smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)[C@H]1CCS(=O)(=O)C1 1319301212 FMYVBPAPXISPNI-NSHDSACASA-N 451.548 -1.106 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1785538721 VFJQNRAFHOGAAX-LJQANCHMSA-N 463.346 -1.330 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830728619 WJFABMRTZPWFLE-IQUTYRLHSA-N 465.931 -1.072 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832484194 YJTRFJBQNLRBRM-WMLDXEAASA-N 453.945 -2.227 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930742 XJCWHSGDBRVKPI-OPAMFIHVSA-N 461.324 -1.259 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933689 AJLMLDUIYGTHNK-OAQYLSRUSA-N 495.363 -2.833 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)C(=O)C(=O)O 1835939698 DYWWSMLNVSMUDX-HXUWFJFHSA-N 463.252 -3.021 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837729707 JUEJIBKTODOZGG-GHTZIAJQSA-N 463.296 -2.413 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1796439455 GEKQZPSQAUCKHT-GWGBFROSSA-N 494.574 -1.560 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797323055 IIISUBUWBOYZDK-IVWMJMPLSA-N 482.501 -1.468 50 20 JAGD O=C1CN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C(=O)N1 1832480678 UDSYKNQTKWPASL-WFASDCNBSA-N 451.249 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832798028 KQJAJBXHLKULNM-HXUWFJFHSA-N 488.461 -1.440 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1)CCO2 1835119106 RZTAJPAUXPHHPI-MOVNLTQESA-N 460.491 -1.145 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838531456 KVOMSUARCSVWFI-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD CN1CCN(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)CC1 725871856 RQQSWHCCQWTKHI-UHFFFAOYSA-N 457.513 -2.140 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031614 BUZNQINIHXTBRM-HNAYVOBHSA-N 450.452 -1.807 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1C[C@H]2C[C@H]2C1 1837284717 YRYLMKVSWWVCPQ-NZQNYPKQSA-N 457.336 -1.223 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1837457431 AVSBMFHRYHKHDR-QFIPXVFZSA-N 470.486 -1.383 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1C(N)=O)C2 1797749821 WUNQBRBPRSHFEW-DRXBFXEBSA-N 453.459 -1.304 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCNC3=O)CCO2 1834564956 MTSYAFPVBYAHLU-NRFANRHFSA-N 477.522 -1.931 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1835939669 DIKICODVOYRCJU-GAJHUEQPSA-N 468.319 -1.035 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840481950 ABBMMYUYGFSDOJ-JOCHJYFZSA-N 455.276 -1.342 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)CC2)CC1 1781110166 YVNHTNPWNYITMB-JOCHJYFZSA-N 471.562 -1.091 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCS(=O)(=O)CC3)[C@H]2C1 1785034364 YNEWASBUENZTSC-WBAXXEDZSA-N 494.574 -1.991 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363839 QQGLAFFJCXNAOM-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1837457536 IPSNWNQYIWUPDH-LAUBAEHRSA-N 489.558 -1.218 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3C(N)=O)C2)C1 1840185616 QDKNGBQNGIKJTB-HXUWFJFHSA-N 463.495 -1.982 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1 1824677477 UBJOHALGDOGFCD-JTQLQIEISA-N 454.509 -1.029 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cn1 1835929174 FHRGNLWUDLZDCM-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccc(O)nn1)CCO2 1839651457 FKOZYBDPEHMCHC-OAQYLSRUSA-N 464.523 -1.056 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1846360754 DPXLOHRFQZFZSB-GFCCVEGCSA-N 452.899 -1.109 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1 920276178 QHUYSENEPAVVTJ-MRXNPFEDSA-N 467.548 -1.121 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031947 HXLLNSONCHRTMP-LAUBAEHRSA-N 477.474 -1.377 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1779032406 QUFDQUYLWDBNCF-FQEVSTJZSA-N 455.431 -1.069 50 20 JAGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783665196 VKECSOVDZVAODP-QFIPXVFZSA-N 464.324 -1.120 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787504321 PRRYXTMSKZZPAK-WDSOQIARSA-N 479.364 -1.615 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-n2c(O)nnc2O)cc1 1798599975 WRRXAIZHIBTTLY-HGKCTWBKSA-N 493.285 -1.125 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1835541330 YQNNXBJKUKCTOO-WCQYABFASA-N 462.209 -1.142 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837379555 BGIHCXRIVGXRMV-QKKBWIMNSA-N 477.522 -1.537 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1779092484 IOXCSPQCEOYTEE-GQNRDTHGSA-N 462.507 -1.399 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(=O)nc1O 1783940681 YVFPGIXAOZXQLE-HXUWFJFHSA-N 450.496 -1.540 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21)c1cccc(B(O)O)c1 1786984450 HQFHZWNTMJSVNP-QOKNQOGYSA-N 467.291 -1.787 50 20 JAGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)c1ccc(B(O)O)cc1 1819881643 XGAWQLYHTGFEDY-IFXJQAMLSA-N 460.321 -1.301 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799353 ZDGQWUUPIHKPLG-UHFFFAOYSA-N 473.383 -1.075 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1835404029 YBGSQKRBXDQGSV-QHCPKHFHSA-N 489.577 -1.607 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1835929387 NGUILKLYJLCZGQ-JOCHJYFZSA-N 483.290 -2.310 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)n(C)c1=O 1796188394 YXFNBYRDEMKRMX-BJWYYQGGSA-N 494.317 -1.935 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807370688 IMVRQOXWXXXFFR-YVWKXTFCSA-N 453.308 -1.326 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1813073120 HKQVJYCZYSFQQH-AVRDEDQJSA-N 464.567 -1.253 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934044 KZVHWARLJYJRQT-YWZLYKJASA-N 483.352 -2.236 50 20 JAGD O=C(CCc1cncnc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836049825 FXXLBUIZUVQKTJ-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1837460337 BUBWJTPYUQVPQV-OAQYLSRUSA-N 471.474 -1.376 50 20 JAGD COC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1839897596 COYNTPAHJSWQBS-FQEVSTJZSA-N 461.475 -1.292 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)CC1 1840184050 PGDXDOSYPIKJRE-JOCHJYFZSA-N 468.599 -1.547 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)N3CCOCC3)C[C@@H]21 1788611255 REDRGYHIGLWUBG-FDRFZEDHSA-N 462.507 -2.071 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832486983 MCFZCJCDRSAPLW-OAQYLSRUSA-N 495.363 -2.833 50 20 JAGD CC(=O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n[nH]1 1833824205 GXTJBQSRDULGMK-NRFANRHFSA-N 471.474 -1.005 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938308 RTZMHQNPUZVVDE-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1840183389 BDGAQKRTDCKWOT-OAQYLSRUSA-N 477.522 -1.931 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1ccccc1=O 1835930592 OPCXSBKFXPQOIN-GAJHUEQPSA-N 469.303 -1.141 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCNC3=O)CCO2 1836781832 ZGZWDZNZCDITIL-JOCHJYFZSA-N 491.549 -1.540 50 20 JAGD O=C1NCc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)ccc21 1837149500 MUSAYJUVMSCNIS-DEOSSOPVSA-N 479.298 -1.006 50 20 JAGD CC(=O)N/C(C)=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459553 JVQUVECSJVYCJJ-PBAKHKOTSA-N 460.491 -1.205 50 20 JAGD O=C1CCCCN1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840104145 HFJYRXNMXIQRPY-QFIPXVFZSA-N 459.308 -1.551 50 20 JAGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783680368 DZNYQTWQSZQYQQ-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1793837828 IZJDQFCACBZROS-XCCSTKFXSA-N 456.334 -1.003 50 20 JAGD O=C(CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)N1CCCC1 1835927072 COZUDLYBNHIIRY-QHCPKHFHSA-N 473.335 -1.161 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1837457672 MLDSVDOFTZKKBP-IBGZPJMESA-N 474.434 -1.300 50 20 JAGD Cn1nc2c(c1C(=O)N1CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C1)CCC2 1839582518 CWUYLUNRAAPRPG-HSZRJFAPSA-N 468.319 -1.028 50 20 JAGD CN(CC(=O)N1CCCC12CN(C(=O)CN(CCO)CCO)C2)NC(=O)NCc1ccccc1 1845039344 GLPMZXDJYYZGNU-UHFFFAOYSA-N 476.578 -1.177 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986445 BJBXHUSDLBHQMR-DVWBAYGPSA-N 483.334 -1.570 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728398 SUPUATCXOOQEON-WMLDXEAASA-N 453.945 -1.532 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837516983 NHSUHXKPLABNPF-TZIWHRDSSA-N 463.296 -2.913 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840915326 QYUWAOFQPFUAAC-YRVVQQKDSA-N 492.957 -1.189 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCS3(=O)=O)[C@H]2C1 1790748174 URDCVZWLBQBZRL-OSMBCOQSSA-N 465.532 -1.144 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCS1(=O)=O)C2 1797754212 YWEHTPBOQMBWHT-NOXHYTERSA-N 451.505 -1.535 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCS1(=O)=O)C2 1797754218 YWEHTPBOQMBWHT-VZAMPYOESA-N 451.505 -1.535 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1810305859 OYZHFOJXVBRWJT-DYESRHJHSA-N 485.545 -1.314 50 20 JAGD O=C(CCN1CCOC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930606 PNAGFQVALBWDOH-NRFANRHFSA-N 461.280 -1.721 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938420 USMRFMIWKPKOQS-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840496120 AUWCUHPGMSIHBS-JOCHJYFZSA-N 455.276 -1.220 50 20 JAGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(C)(C)C 1831088319 XHRIJWYXYVVNQN-WMZHIEFXSA-N 475.351 -1.013 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488059 OSMAVXUYRDOKCQ-YJBOKZPZSA-N 467.972 -1.573 50 20 JAGD O=C(COc1cccnc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832675152 GFGGKIHPDQEXJQ-JOCHJYFZSA-N 455.276 -1.090 50 20 JAGD N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccn1 1835935744 PCYFVHGGKLCWFZ-UGKGYDQZSA-N 454.292 -1.469 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1837274655 OARMGNZNBAJYCA-FQEVSTJZSA-N 473.494 -1.912 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517229 PWHQRFRQCRJISX-QFIPXVFZSA-N 470.291 -1.271 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840151128 VWVDGJMXXJWHIW-MAUKXSAKSA-N 467.972 -1.573 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1840185786 XKLTWLGXSZFSIT-UWJYYQICSA-N 487.554 -1.341 50 20 JAGD CN(C)c1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)o1 1833899182 ITLRTZIFZOGQOO-OAQYLSRUSA-N 458.280 -1.196 50 20 JAGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)no1 1835937396 TYMOCDNORLWFNO-QFIPXVFZSA-N 486.290 -1.238 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807370684 IMVRQOXWXXXFFR-ILZDJORESA-N 453.308 -1.326 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc[n+]([O-])c3)CCO2)C1 1833273876 MCOFSEONVUKHQJ-NRFANRHFSA-N 456.459 -1.298 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1835930225 DAHFPQDFXLUJDK-HSZRJFAPSA-N 497.317 -1.920 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935930 XNTQWGFMTTXULM-GOSISDBHSA-N 471.212 -2.839 50 20 JAGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NCc1ccco1 1835937969 CVJQPOPYDCNBBE-DGQXCUQSSA-N 497.313 -1.098 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cnnn1 1837460514 GYWDGVJQXNMVBX-DJJJIMSYSA-N 459.467 -1.997 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COc1cccnn1)CCO2 1840411305 LFOMHHUZNHMTNX-HXUWFJFHSA-N 450.496 -1.315 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488150 SGZKXPMYACOLLI-YOEHRIQHSA-N 482.397 -1.043 50 20 JAGD O=C(COc1cccnn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933634 DZBJMHDJPQXZSU-OAQYLSRUSA-N 456.264 -1.695 50 20 JAGD O=C(CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)N1CCCC1 1835934315 VJOTUEYHZYQVPS-HSZRJFAPSA-N 473.335 -1.161 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182324 GZJLLDGSHCZWFX-IBGZPJMESA-N 460.553 -1.278 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840361526 NLAIHXNGNKVGPN-GAJHUEQPSA-N 468.319 -1.035 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cccnc1=O)c(=O)n2Cc1ccccc1 32966469 JCOVXFFSIHINJJ-UHFFFAOYSA-N 478.469 -1.168 50 20 JAGD O=C(COC(=O)C1=NC=CN2CCS(=O)(=O)N=C12)NNC(=O)[C@@H]1COc2ccccc2O1 844198642 MBUJWTNKWOEHLH-ZDUSSCGKSA-N 463.428 -1.513 50 20 JAGD Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c2ccccc21 1797171164 LGEKYLXTWSTURW-FAQVEIGNSA-N 478.314 -1.077 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1835936936 KONAWPWJKIXUDQ-JOCHJYFZSA-N 460.340 -2.316 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc21 1836776286 PMODIGDRKBMECE-BEFAXECRSA-N 455.899 -1.314 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1837459181 LJQRMHAEQQSQNT-GOSISDBHSA-N 489.407 -1.139 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838533344 OULKDIIRBJNKRN-JOCHJYFZSA-N 470.486 -1.232 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)CCC(N)=O)NC(=O)NCc1ccccc1 1795534411 VJLSAHXXLWJUIM-NYUBLWNDSA-N 489.577 -1.485 50 20 JAGD Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)no1 1797827616 XFAIUIXMVYKNBD-IVWMJMPLSA-N 471.474 -1.385 50 20 JAGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(C)(C)C 1831088321 XHRIJWYXYVVNQN-XXBNENTESA-N 475.351 -1.013 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927396 NXVOQQQNYZTICL-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934069 LXENWZRMQMGWMG-FQEVSTJZSA-N 466.321 -1.657 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837644933 YSBCYANTUTXQHQ-BTYIYWSLSA-N 472.506 -1.317 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)n1ccccc1=O 1837683399 FLKCJPKJGBNVTO-GAJHUEQPSA-N 469.303 -1.141 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1840185472 MPWYUHYPWWPMRC-FQEVSTJZSA-N 464.479 -1.382 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n(C)c1=O 15737638 IEFJEPOHOIRLMY-UHFFFAOYSA-N 468.518 -1.207 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1779032470 LEBUUYOMICPAFH-AOMKIAJQSA-N 459.551 -1.236 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830568649 HGLWQHPUXBUZOK-NJSLBKSFSA-N 465.931 -1.072 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934992 BDULTPVJSFDICG-HXUWFJFHSA-N 473.251 -1.759 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935298 NKKTUIJVROLPAI-QFIPXVFZSA-N 468.275 -1.756 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839082505 FUAHRHZWVWPXTN-WXVUKLJWSA-N 485.346 -1.163 50 20 JAGD Cc1cn(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(=O)nc1O 1783116124 GZTMUAZJTJLJTP-WZONZLPQSA-N 484.318 -1.235 50 20 JAGD CN1CCCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)cc2C1 1795740482 AFOTUZOQCHSUON-UPHUGPLXSA-N 467.335 -1.085 50 20 JAGD O=C(CN1C(=O)C=CC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826315949 UARIEWOSMLLSHJ-ZDUSSCGKSA-N 454.273 -1.026 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833196772 LOESDTOHXIVUKE-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927160 JFWPWBLMCWJTHL-YWZLYKJASA-N 483.352 -2.236 50 20 JAGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2C1 1839621836 UUTLWLKLRRDSMR-XMMPIXPASA-N 497.361 -1.218 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795582889 CTMHXIJBZPOIAQ-UKBAYJJMSA-N 490.366 -1.188 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799682227 PHWDFZMHGDBHKN-ABXQLRGKSA-N 478.506 -1.269 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)CCO2 1832802955 GWUYWORQCXETPJ-LJQANCHMSA-N 467.483 -1.379 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835997270 IPYVUUKRMNXLSH-QFIPXVFZSA-N 470.486 -1.383 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868904 UKXWNZKFLLHYIF-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCNC(=O)C1)CCO2 1840230441 LASRWRAUECDOEF-QKKBWIMNSA-N 460.491 -1.719 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840549874 PXNMFVYOXHPBRM-IBGZPJMESA-N 469.520 -1.810 50 20 JAGD CN1CCN(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)CC1 1786729453 LRZZWOZMSDJZCB-FHWLQOOXSA-N 452.600 -1.023 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1797750589 MWLSSGOYSSHAHW-CULMDFNYSA-N 467.446 -2.067 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)N1 1800335359 CBAJHLZVHVZSJZ-YNNRSFFJSA-N 474.967 -1.644 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833196774 LOESDTOHXIVUKE-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1835934367 QUOKGMZDVRDYRW-GAJHUEQPSA-N 468.319 -1.035 50 20 JAGD O=C(c1ccc2nncn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937147 QHYQVNJMJHWDNW-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD N=C1NCCN1CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837860519 MEQBSBOMSZWNRC-UHFFFAOYSA-N 457.340 -1.181 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184584 WBUWCFAFQRBEJW-LPHOPBHVSA-N 459.500 -2.120 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCC(=O)NC1)c(=O)n2Cc1ccccc1 916148106 XDFGCNJMMIIISS-INIZCTEOSA-N 497.512 -1.272 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)c1cccc(B(O)O)c1 1795739868 MGUIBTUJSPGONO-GOBLKYCHSA-N 455.320 -1.029 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833613834 QQVFSPBMVHBSNR-UHFFFAOYSA-N 482.346 -1.133 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931251 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JNFJIIIEFILGMD-UHFFFAOYSA-N 477.565 -1.021 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(C)(=O)=O)C2)NC(=O)NCc1ccccc1 1799094995 OTWJLEVYSMUFCP-XEMDLRDOSA-N 481.575 -1.033 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1c[nH]c(=O)cn1 1836138428 DAOZLWRNXFLDOY-UHFFFAOYSA-N 453.308 -1.051 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1840183818 BQCGMLVCVFLIKR-FQEVSTJZSA-N 489.595 -1.759 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)C(=O)O)C[C@@H]21 1787507768 RBOHEHJXOPZNOH-DZYDDEDGSA-N 476.490 -1.357 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800282080 GOWOMXRYYAFBJC-IVWMJMPLSA-N 485.457 -1.342 50 20 JAGD CCOc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1 1835930947 ARGXZCGKKCLZHI-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1 1840184225 DVLBVHRWBUGHQX-JOCHJYFZSA-N 482.582 -2.020 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)n(C)c1=O 1844263605 WCFKSNKNORBTIN-UHFFFAOYSA-N 495.500 -2.051 50 20 JAGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783664232 AOSHREOHKCIQDT-QFIPXVFZSA-N 464.324 -1.120 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835643602 CTDJDUBXQFYJQB-FQEVSTJZSA-N 476.339 -1.384 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1838330888 LVIYNFCKVKLCLG-FQEVSTJZSA-N 463.495 -1.982 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccncc3=O)C2)C1 1840184884 DYGWMUPWFYSKFO-HXUWFJFHSA-N 450.496 -1.927 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724235 WWAZNHKZAQTOSA-GUYCJALGSA-N 462.912 -1.492 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1CC(=O)NC1=O)CCO2 1832482905 SHGIVNFWDVONBO-IBGZPJMESA-N 454.484 -2.632 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1835939738 ZDHVONDZICRONK-QFIPXVFZSA-N 483.265 -1.068 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@H]2C1 1786802078 TVYWWXRSDSRHTN-YZSJLHEHSA-N 461.523 -1.307 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1)c1ccc(B(O)O)cc1 1817470083 HZCGKQIAVKCGGH-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837737445 XFPWEMNHXMHZPF-OXJNMPFZSA-N 457.528 -2.033 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(=O)NC(C)C)c(=O)n2Cc1ccccc1 744446983 RBTAEWAIYIYTOU-UHFFFAOYSA-N 485.501 -1.274 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)n(C)c1=O 1793981217 WLMAVCXNONRDDR-GFQSEFKGSA-N 468.898 -2.377 50 20 JAGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CNC1=O)CC2 1819793556 PSGUNSAFFZGJKE-VIFPVBQESA-N 472.487 -1.081 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938139 NCGMSGXRCOOIIY-JXFKEZNVSA-N 465.268 -2.499 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837250115 JRJDWECHDGNSCM-LJBSOROUSA-N 472.502 -1.410 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460677 JAWZLVFGIBRBSJ-NHCUHLMSSA-N 479.490 -1.629 50 20 JAGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1 1838349782 ZTZDBSLNCSJHAA-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1NC(=O)NC1=O)C2 1779371132 GXBHFQPEKAVOED-PDSXEYIOSA-N 473.490 -1.589 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796440037 CHZIUSZZRSKLMK-WVNFENISSA-N 467.291 -1.296 50 20 JAGD Cn1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1835987102 VJLHEDSCZYDGHJ-QFIPXVFZSA-N 456.308 -1.197 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3O)[C@H]2C1 1785632503 MWZUIJULCVEIHQ-NUTKFTJISA-N 456.459 -1.009 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)C=CC1=O)C2 1796445577 DXHOYOZICJKXJV-GLYXUVKCSA-N 456.459 -1.365 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ncccn3n1)C2 1797750851 SJZOUZSCFARZML-JJLQDPRZSA-N 451.447 -1.360 50 20 JAGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(O)O)CCO2 1830395925 DIINTBNWLJDZNH-IBGZPJMESA-N 453.404 -1.099 50 20 JAGD Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1833037555 DSIXDGIVYAMMEM-QFIPXVFZSA-N 456.308 -1.050 50 20 JAGD CC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n[nH]1 1833821981 ZOPJUFMOQXLNSX-OAQYLSRUSA-N 456.264 -1.324 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457745 PEXNAEWUXNVNRC-QFIPXVFZSA-N 487.517 -1.088 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031700 DPFWTRAVWCQIDS-FPTDNZKUSA-N 482.501 -1.263 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1782960933 WGNAQMQFDRBEGM-HNAYVOBHSA-N 451.505 -1.294 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21)c1cccc(B(O)O)c1 1786983893 DOWYOACSNGFELL-KNBMTAEXSA-N 481.318 -1.397 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c2c1CS(=O)(=O)C2 1787151756 SXCBLZLAARILGC-YEWWUXTCSA-N 488.331 -1.575 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940050 ULXPCSZCCZLKJD-JOCHJYFZSA-N 455.276 -1.220 50 20 JAGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740707 IZHSDNPJXAWVIQ-RMFSNUHRSA-N 464.324 -1.361 50 20 JAGD Cc1cn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(=O)nc1O 1835933536 BBKZBQGAENZDGH-JOCHJYFZSA-N 486.290 -2.293 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831697542 AEQSBHKSJAXZJL-NRFANRHFSA-N 455.556 -1.022 50 20 JAGD CCOc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cn1 1835927831 YQDHWVAVPYSUMD-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1835934985 ATAQUAGGBKVPCN-NRFANRHFSA-N 457.248 -1.851 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937101 OLJQDGVJAUODAT-JOCHJYFZSA-N 472.307 -1.407 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836255868 XYMYZILYEHNVHT-SUMWQHHRSA-N 462.912 -1.492 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837206692 OVVHRHFWVVAHGY-CCLIMJOLSA-N 494.505 -1.359 50 20 JAGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1 1838348833 FBBYDATVEHBSHB-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nccn3)CCO2)C1 1839235604 CSIQQSJVJCBSAG-UDIPQKBFSA-N 458.479 -1.132 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCN(C)S(C)(=O)=O)nc2)CC1 916580361 RKGJDDRSRJBTFN-UHFFFAOYSA-N 463.586 -1.075 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)CCC(N)=O)C2)NC(=O)NCc1ccccc1 1799095117 UPUXHLSHXVZBQJ-NYUBLWNDSA-N 489.577 -1.485 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CC(=O)NC3=O)CCO2)C1 1832476601 WREDFVHCJYUXMM-JHXRPTDYSA-N 489.489 -1.871 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1835931733 ZIBHQVRMFFLOIZ-QFIPXVFZSA-N 498.326 -1.180 50 20 JAGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939564 ALEVJQNSQJRMEP-HSZRJFAPSA-N 494.350 -1.494 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ncccn4n3)CCO2)C1 1779030850 YCQQYFJGAAOKNV-FQEVSTJZSA-N 451.447 -1.120 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CC(=O)NC3=O)[C@H]2C1 1785030175 ZORBJOQGQCHQII-HVEJOWRVSA-N 473.490 -1.348 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369119 AYUPLLIFAPRNEC-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1835925904 NZCSOKAUWGQTPZ-HXUWFJFHSA-N 476.494 -2.139 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1835936881 HHDRHKMIVFUNNJ-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1835938578 ZQQMDDDZHYYFER-NZQNYPKQSA-N 457.336 -1.223 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840186025 WPQQMQYYVYYSRQ-FQEVSTJZSA-N 456.544 -1.811 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1778115083 CBVZMAADTYGRMZ-NRFANRHFSA-N 479.364 -1.519 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417479 WBYJSQZUPNFLCF-NRFANRHFSA-N 457.248 -1.444 50 20 JAGD CN1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1836675767 DRAMCSCVTYQWNU-OAQYLSRUSA-N 454.572 -1.937 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837840248 LDIYJIPJZHNSRO-IBGZPJMESA-N 460.340 -1.429 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CNC(C)=O)c(=O)n2Cc1ccccc1 920472619 DXTPFQNWTHOWFD-UHFFFAOYSA-N 471.474 -1.662 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980073 GCXXHHIJOXWNPG-KCMWZYNZSA-N 452.338 -1.360 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cn3cnnn3)CC2)CC1 1835737045 UEGNXSCNUDSTDD-UHFFFAOYSA-N 456.511 -1.443 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc[nH]c1[N+](=O)[O-])CCO2 1836508296 UNBJZPXLUFKPFN-GOSISDBHSA-N 453.456 -1.239 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1837457124 WHODWRYYSMIXFR-NRFANRHFSA-N 472.458 -1.532 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839654551 VGNQZLCRNZAZTM-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1784115932 OCIXZIPMWFDBFZ-VSIOZEBNSA-N 456.459 -1.125 50 20 JAGD CN[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(=O)O 1835759861 QXPYCOCRPJIGRY-XVZRFPNFSA-N 478.506 -1.361 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1C[C@@H]2C[C@H]2C1 1835930184 AKPUEIINMLLECR-ZQDYSYBYSA-N 457.336 -1.223 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)N1 1843014845 IRWVEQMAMVBJPP-DLBZAZTESA-N 486.359 -1.637 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21)c1ccc(B(O)O)cc1 1786981083 QAMYFGYNRYMFRU-KKXDTOCCSA-N 454.248 -1.238 50 20 JAGD CCOC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1835932058 LNGGWILHZHETIU-OAQYLSRUSA-N 460.292 -1.220 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837643631 UEEACFMSCJKHBL-IIBYNOLFSA-N 457.296 -1.636 50 20 JAGD NC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840646865 ZMKQPUCAJQAKDM-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD Cn1c(=O)c2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n(C)c2n(C)c1=O 728336383 YHCONRUYXKCRFT-OAHLLOKOSA-N 471.426 -1.280 50 20 JAGD CN1CCN(S(=O)(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)CC1 728959297 JROLWBSBLCCVJJ-UHFFFAOYSA-N 495.610 -1.456 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CNC3=O)C[C@@H]21 1788611513 HTMDBEKRLSEXGM-CQDKDKBSSA-N 459.463 -2.170 50 20 JAGD CS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)nc1 1795732569 WSPXIBRFTVGCFK-CCWDJLKJSA-N 473.316 -1.318 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc21 1835934983 AOOFSZIHZHQIRN-JOCHJYFZSA-N 483.290 -2.310 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185531 OOKWLSUIBWAGMQ-AOMKIAJQSA-N 491.549 -1.576 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788471331 UPRQWYSKPZTQGS-HEWDHTHVSA-N 464.479 -1.657 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1797750615 NDUARBCHNLIBGT-ZSBFGKGUSA-N 480.547 -1.686 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1813070533 INZIEGGMRQKXAC-IFXJQAMLSA-N 482.505 -1.100 50 20 JAGD Cc1cc(C)n(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n1 1833037716 JNUVOSQDUPMUQY-JOCHJYFZSA-N 456.308 -1.050 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834733350 JPDOHPALDBBYTR-LJQANCHMSA-N 459.356 -1.856 50 20 JAGD Cc1noc(N)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835625943 IQTZMBBHSBRMBG-FQEVSTJZSA-N 459.463 -1.052 50 20 JAGD CC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054285 RBCKEKKQXVVXOQ-QHCPKHFHSA-N 490.561 -1.075 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651042 IFVAVRUVSSVBCV-JOCHJYFZSA-N 485.501 -1.117 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787495812 OBSWCQXMJLNXNO-NOTNWKISSA-N 474.348 -1.238 50 20 JAGD O=C(c1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930734 WXNXWYPGTCCJSE-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NCc1ccco1 1835930758 YOGSVUIIKFMGJD-PRSVDJLGSA-N 497.313 -1.098 50 20 JAGD O=C1CCCCN1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931983 KFWULZCMDHVYAX-JOCHJYFZSA-N 459.308 -1.551 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1835938082 JFIJWOJYBJFSTH-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD COCCN1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1=O 914458725 KDZASVGCUIIQPL-OAHLLOKOSA-N 454.505 -1.037 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CNC3=O)[C@H]2C1 1784953127 FOLYVIXDUXDWRF-CQDKDKBSSA-N 459.463 -2.170 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291075 KRGMBFFZLBDRAU-XSLAGTTESA-N 470.523 -1.166 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829765244 OMFUEURFBGOREK-KOIKXXGWSA-N 457.292 -1.705 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832795659 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CCn1nc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O 749352838 KBLUNZDPVMVHKJ-UHFFFAOYSA-N 465.536 -1.062 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]nnc4n3)[C@H]2C1 1787269974 RXBVMEVEKVYQCX-OCCUQACQSA-N 496.488 -1.460 50 20 JAGD Cn1cc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1 728328873 YFKVTJWOXDAXKE-CQSZACIVSA-N 453.433 -1.771 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CS(C)(=O)=O)c(=O)n2Cc1ccccc1 919702847 JMYVKSQOQUXIBO-UHFFFAOYSA-N 462.488 -1.380 50 20 JAGD O=C1NCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc21 1835938007 GATYWMXEQQYNPO-DEOSSOPVSA-N 479.298 -1.006 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1837460057 ZYVMQLHVDAHLTO-PZJWPPBQSA-N 478.506 -2.594 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1840184031 OKYAZCKOMSKFHI-OAQYLSRUSA-N 465.507 -1.161 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724226 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CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751727 QLKBZAZQHOYXQB-LTCOOKNTSA-N 477.474 -1.617 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837238822 PCYXKYWNBHDHQQ-PKHCJMHPSA-N 452.338 -1.405 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1837461258 RKRLJKBQHZGWKZ-NRFANRHFSA-N 472.458 -2.320 50 20 JAGD COC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779555964 XFPZNNSFGZVGTO-NNMXDRDESA-N 461.324 -1.355 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980033 AZLOVQSDEMYXBV-WDSOQIARSA-N 479.364 -2.310 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797587011 WKTOROXWRNFWDC-KOZDUTSQSA-N 450.452 -2.047 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804346956 XFKFRIUIBNDIBG-SKDZVZGDSA-N 480.485 -1.002 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829765272 QNVAMXXOBQFFNI-DYRFGFBLSA-N 457.292 -1.705 50 20 JAGD O=C(CCc1cnccn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939779 HPNRZFVSTJUMKT-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651043 IFVAVRUVSSVBCV-QFIPXVFZSA-N 485.501 -1.117 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(=O)n(C)n1)c(=O)n2Cc1ccccc1 813552244 MODNNRYPBVSOHS-UHFFFAOYSA-N 478.469 -1.017 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731190 IQVISRCYGLVBDQ-MPGHIAIKSA-N 450.872 -1.463 50 20 JAGD CCN1CCN(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C(=O)C1=O 916156576 VOVAZUIYPKNMRH-UHFFFAOYSA-N 495.558 -1.522 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)CCC(N)=O)C[C@@H]21 1787509059 YMDAYCUBJVBERI-YZSJLHEHSA-N 461.523 -1.307 50 20 JAGD CN1CCN(C2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)CC2)CC1 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50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)C(=O)O 1810305413 LKIWGKNIYXNTTI-RDTXWAMCSA-N 483.485 -1.057 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3NC(=O)NC3=O)CCO2)C1 1832690998 IYNDMLCPDMETKQ-JLTOFOAXSA-N 475.462 -2.647 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835737088 VQBSDOACRWBMGX-UHFFFAOYSA-N 494.361 -1.136 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930406 IKIODLJAXNHVKC-QVKFZJNVSA-N 462.312 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1837455947 AFCHSPUFFNZXGI-HSZRJFAPSA-N 497.512 -1.420 50 20 JAGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nn1 1838349689 PSINQSWLPVZWOB-OAQYLSRUSA-N 471.474 -1.133 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(=O)nc1O 1840807471 OUAUUTPCQLEXTF-JOCHJYFZSA-N 486.290 -2.293 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734446 OWMLOFYNAZWZTR-UKBAYJJMSA-N 462.264 -1.936 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804089217 HLDHGTFLPHAKFY-IFXJQAMLSA-N 480.485 -1.049 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1807048834 SSERIMGBQSSHQK-UCLAIMLFSA-N 468.518 -1.008 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834733454 OKFUOZMROIKFFV-LJQANCHMSA-N 459.356 -1.856 50 20 JAGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(C1)C2 1835932079 NACUTNFGJSGYJN-VNXZQDSDSA-N 472.303 -1.220 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ncn3)C2)C1 1837456728 QDBIPPLPAUIRSG-FQEVSTJZSA-N 457.447 -1.436 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[C@@H]1SC(=N)NC1=O 1840183852 DSRVYVXCKJXUCE-RISOHXOYSA-N 484.579 -1.382 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784517251 IIRSDGJRPXMWRJ-IKICRFKJSA-N 452.338 -1.360 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927586 UPRHNXNSLKZESB-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939928 PEPAPJCDGNKGAO-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccnc3C(N)=O)C2)C1 1837459459 PSZMLVRGGYSURB-NRFANRHFSA-N 484.473 -2.042 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840361528 NLAIHXNGNKVGPN-HXOBKFHXSA-N 468.319 -1.035 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)N1CCN(C)CC1 1786981714 IIVIGRJHPKHMHI-GIUOSPMZSA-N 458.368 -1.404 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983607 OJPAEZLDAVGOOY-DVWBAYGPSA-N 483.334 -1.570 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccnc1 1793959256 LDIBBEUWCYVKAF-CCWDJLKJSA-N 467.486 -1.287 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2)c1ccc(B(O)O)cc1 1795732783 JHTSEFYNHLGMBP-ZTENYAIWSA-N 482.302 -1.424 50 20 JAGD Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)no1 1796415655 KQFGLUFADDXEAB-YVWYUNDQSA-N 456.264 -1.105 50 20 JAGD O=C1CN(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C(=O)N1 1815350220 KWWJTWADYWCWRN-LBPRGKRZSA-N 457.277 -1.400 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)nc3O)C[C@@H]21 1788610489 VJHDQGUXRPDLHB-LKTVYLICSA-N 457.447 -1.207 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(O)O)CCO2)C1 1830390039 GGMXVSXQZCFOJU-KPZWWZAWSA-N 451.904 -1.114 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1835930237 DUCRAROENITMED-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456345 GTXLKBXQUXJPIM-OAQYLSRUSA-N 471.474 -1.133 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)N1CCN(C)CC1 1789801615 OIFZXMSVKICHPM-VJANTYMQSA-N 452.600 -1.025 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837794724 ZXVYBAJSFROJDC-LJQANCHMSA-N 459.224 -1.619 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199799 VANPAJJDPLAOGY-YPMHNXCESA-N 462.209 -1.142 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)c1cccc(B(O)O)c1 1786984448 HMHVSBORMJKRLW-QIJLZVCCSA-N 496.329 -1.034 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807045309 WAOLROWRRSIVJD-QRFRQXIXSA-N 453.308 -1.326 50 20 JAGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)C(=O)O 1812390996 KOISVVIEYSHHDK-KSSFIOAISA-N 483.485 -1.057 50 20 JAGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)C(=O)C(=O)O 1824673761 JJHXLXVFAUNDBG-SECBINFHSA-N 475.487 -1.090 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837627291 YCIQWWLKAOTRJO-QFIPXVFZSA-N 468.275 -1.530 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797587015 WKTOROXWRNFWDC-UOHMRFDXSA-N 450.452 -2.047 50 20 JAGD Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)no1 1797829271 JKHLQNYNVDJQSN-HBCWATKFSA-N 450.496 -1.325 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720133 TWQZGHBQZXOCPN-CKFHNAJUSA-N 465.931 -1.072 50 20 JAGD O=C(c1ccc2nncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930736 WXUAEQXTXUSRME-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932301 YKNHNEQKXZCUGZ-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(=O)C(=O)O 1839703766 CKYRTLAKVIYACU-ABAIWWIYSA-N 454.249 -1.324 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840183634 QLIVYFXDSHDBHQ-FQEVSTJZSA-N 464.479 -1.382 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846560765 BOOMFIKTRIPPOC-QGZVFWFLSA-N 454.491 -1.027 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1CCc2nc(O)nc(O)c2C1 1794109161 AHBJNOYLCQKOKF-NFWAQSGPSA-N 482.302 -1.424 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779181715 NAKTYENCNYGNAM-YCRPNKLZSA-N 461.523 -1.202 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611039 GYTOBQVAEXFVDS-RUGDWHBFSA-N 462.507 -1.571 50 20 JAGD CN1CCN(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)CC2)CC1 1799192174 RANNAURTPTZCDB-OPVJXMOQSA-N 456.352 -1.650 50 20 JAGD CNC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831276520 PGGKUVVMUQZUOL-QHCPKHFHSA-N 490.561 -1.075 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ncccn3)CCO2)C1 1833167298 QROQVDAHSSDYSA-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)C=CC3=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786980157 PBFLUGQLCMLIEW-SZMVWBNQSA-N 455.276 -1.725 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833197039 PBBRVCMGEASNBL-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935943 XZVCFBXJTOXEMA-QFIPXVFZSA-N 468.080 -2.570 50 20 JAGD Cc1cnn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457940 XMXWJBMQNUAGJY-NRFANRHFSA-N 457.491 -1.040 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1840032038 MCAQBECTFFTXQV-MGPLVRAMSA-N 470.284 -1.334 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)C=CC1=O)C2 1797748608 MCZPLXSTKHNKMC-DBWKPXFBSA-N 456.459 -1.797 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828522984 LZIUCLWPXHMZMP-XMMPIXPASA-N 497.313 -1.257 50 20 JAGD N=C(N)SCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835511923 CUPJBEOTOOCUCT-SFHVURJKSA-N 451.509 -1.618 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938156 NNHYQQIBWYYUMI-NQIIRXRSSA-N 463.296 -2.413 50 20 JAGD O=C1NCc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)ccc21 1837149533 NIQPATZOKYKHIY-DEOSSOPVSA-N 479.298 -1.006 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837495753 ATSRJQDNHKWYRA-RLFYNMQTSA-N 450.872 -1.463 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1837921165 HRNBSGREEMBANF-QHCPKHFHSA-N 475.351 -1.371 50 20 JAGD NC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840646459 IOVKFPYNQIZDQD-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)S(C)(=O)=O 916580325 MZVLSWNDFFGQQK-UHFFFAOYSA-N 477.565 -1.067 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2)c1cccc(B(O)O)c1 1795738955 JOWDXRHXYMNGIO-CCWDJLKJSA-N 467.291 -1.787 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc21 1834562465 WMNBYIBSYSXJKM-QFIPXVFZSA-N 483.290 -2.310 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(CCO)CCO)[C@H]2C1 1790910114 DLRAXLCOTOFKEO-MPKALDKKSA-N 478.550 -1.613 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2)c1ccc(B(O)O)cc1 1795734671 YVDUMCTUQFEPDQ-HGKCTWBKSA-N 465.337 -2.005 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1CCSCC1)CCO2 1829716000 IFYHCOPBBRDWAC-HXUWFJFHSA-N 457.597 -1.135 50 20 JAGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn2[nH]cnc(=O)c12 1838472671 WNTTXQGEAXXAJO-QFIPXVFZSA-N 489.533 -1.226 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2 1839531498 AHCRUWZYKGZVKV-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1OC 754809945 WEFBDOXPIJMWPJ-UHFFFAOYSA-N 474.430 -1.545 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)n2[nH]cnc2n1 1795730014 QLFQIJAYLKDLDU-CULMDFNYSA-N 467.446 -2.067 50 20 JAGD CC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)CC1 1797750756 PHCXRORWYCUDGE-CWPLJXCYSA-N 473.534 -1.948 50 20 JAGD 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)C(=O)O 1800260401 WJUBKJNANKCIPY-UOEJNGGWSA-N 462.463 -1.747 50 20 JAGD Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1C 1830949195 JNARLLOILYMWJC-QFIPXVFZSA-N 456.308 -1.279 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3NC(=O)NC3=O)CCO2)C1 1832692269 XCGBWRQJJPSYRI-ZROFWDEVSA-N 489.489 -1.825 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837466047 XRBHBDXGRBEOIQ-FQEVSTJZSA-N 479.563 -1.761 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839174466 FCZXVFNQBMWVOP-JOCHJYFZSA-N 460.292 -1.054 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc21 1778378565 CCYASKZBWPGRHX-JOCHJYFZSA-N 467.291 -1.546 50 20 JAGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c(C)n2n1 1795739254 XJAPNJBUJHPMGF-CWPLJXCYSA-N 464.291 -1.062 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cncn3)CCO2)C1 1836134712 USZJNMSMDJRQKS-FBTHGLLTSA-N 458.479 -1.132 50 20 JAGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919716 XVTAVNLGQFYUMK-YJBOKZPZSA-N 466.373 -1.097 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)n(C)c1=O 1848150353 NUONZKMHHULNIK-GJZGRUSLSA-N 495.500 -2.052 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779076544 NTSQBXWIRBCVEB-UZLBHIALSA-N 456.496 -1.316 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779180930 WFNAPTQFUGIULZ-FPTDNZKUSA-N 482.501 -1.263 50 20 JAGD Nc1n[nH]c(CCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n1 1779240425 GDUNKCPBTVZRHJ-IIBYNOLFSA-N 456.312 -1.173 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3c(O)nnc13)C2 1797750423 BROQHJCTYJCSMR-DRXBFXEBSA-N 466.458 -1.050 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750546 GYACPHYSLILECQ-RMHZUWNSSA-N 492.533 -1.226 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)o1 1836024531 DANYIITWGMAIGQ-FQEVSTJZSA-N 459.463 -1.311 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840360869 DHCDLVGQWOPUKG-GAJHUEQPSA-N 468.319 -1.035 50 20 JAGD O=C(CNC(=O)c1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785167713 JSKLSTPHTGHTTP-IHPCNDPISA-N 466.303 -1.215 50 20 JAGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)C(=O)C(=O)O 1824673763 JJHXLXVFAUNDBG-VIFPVBQESA-N 475.487 -1.090 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H](O)N1CCOCC1 1835764953 VLPIMQCSFNQILY-QHCPKHFHSA-N 474.367 -1.798 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1835937089 NZHPJXVXPWSWHX-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[C@H]1SC(=N)NC1=O 1835937134 QBWHIRMDEBMKRP-QSZISKGPSA-N 490.347 -1.761 50 20 JAGD CCOc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1 1835937977 DCQMETVGUKHNSD-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787397044 MSKVNMTVAHCOFU-QZHFEQFPSA-N 458.349 -1.014 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3nc(N)n[nH]3)C[C@@H]21 1788610965 CNHGMEQZZNTXTA-CQDKDKBSSA-N 457.495 -1.389 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1835939273 JPTKLSPQOVUXFT-WXVUKLJWSA-N 485.346 -1.163 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840180068 GZSREVJZUOABRP-SFTDATJTSA-N 479.490 -1.629 50 20 JAGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cn2[nH]cnc(=O)c12 1786981087 QLLGUCFKFRJPJU-SNRMKQJTSA-N 479.302 -1.082 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1801009608 RPRURIRQNPUAAP-PJHJGJPPSA-N 476.534 -1.045 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930534 LJIGEPXTXLMHEW-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(C)(C)C 1835933904 GHPAHVXDFLCWJD-XXBNENTESA-N 475.351 -1.013 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n(C)c1=O 1793980234 JFSYZUHNIMZCPC-JJLQDPRZSA-N 497.350 -1.192 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1837460373 DUEYDIYAFVUVBE-NRFANRHFSA-N 480.522 -2.958 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839649997 XIHNFNVBDLUOMI-QFIPXVFZSA-N 470.291 -1.435 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364543 QQHPDUOWJJIJFZ-PXNSSMCTSA-N 450.308 -1.079 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486881 QLVSLFWGMPIHET-OAQYLSRUSA-N 461.368 -1.114 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807946610 AWLUNOADRLOKCN-KXBFYZLASA-N 488.273 -1.479 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833861314 BSZZYGYYQVSKNS-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCCNC3=O)CCO2 1836781835 ZGZWDZNZCDITIL-QFIPXVFZSA-N 491.549 -1.540 50 20 JAGD Cn1nc(SCC(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)c(=O)n(C)c1=O 915958835 YXGOFEOUXMADHL-UHFFFAOYSA-N 459.488 -1.120 50 20 JAGD O=C(CN1CCN(S(=O)(=O)[C@H]2CCS(=O)(=O)C2)CC1)NNC(=O)c1ccc(F)cc1 1117993837 DNBHOVSOYUXRLL-HNNXBMFYSA-N 462.525 -1.279 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831444176 KZJFYXLOYKWJGO-FQEVSTJZSA-N 481.531 -1.339 50 20 JAGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1832755126 FRXNUQHYIURURI-LHSJRXKWSA-N 496.952 -1.093 50 20 JAGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1833431816 LIMXHDMVYKLQJH-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1835938581 ZUISCCIKFPVLCA-IBGZPJMESA-N 459.224 -1.619 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939934 PMIKWVFXTTVJJF-LEWJYISDSA-N 464.280 -1.948 50 20 JAGD C=CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459384 NNJKXLMSXPUYHS-SZNDQCEHSA-N 460.491 -1.554 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837835688 HDELTYXCXLWQBF-UHFFFAOYSA-N 483.267 -1.297 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)CC2)CC1 1839107630 GWKLYIYYXSGABZ-HSZRJFAPSA-N 486.378 -1.784 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)N1CCN(C)CC1 1789797772 BIKZORNLENVVFF-LGYWMIHWSA-N 458.368 -1.404 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1797138595 OVDICPVBTXYSSP-IZZQQSIFSA-N 479.364 -1.759 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807950178 TYVZIAGQTDMNFN-LIRRHRJNSA-N 482.505 -1.100 50 20 JAGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)C(=O)O 1812389624 IYIOLHBPUQMCEY-LPHOPBHVSA-N 468.275 -1.376 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn1 1835935039 CPSBVJLUHFNSQB-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184583 WBUWCFAFQRBEJW-APWZRJJASA-N 459.500 -2.120 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810350151 PXHYYMPBYMUZTD-LEDOBFOHSA-N 468.319 -1.268 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938556 YFXPPRFIRZKGGY-UGKGYDQZSA-N 492.290 -2.069 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837519013 SARRPXNBABGIRL-PZJWPPBQSA-N 478.506 -2.594 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840151899 QOUWRODJWXLRIR-KPZWWZAWSA-N 454.871 -1.259 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1840184545 UFRYHQJRKLTGGR-JEUZPXFCSA-N 451.524 -1.349 50 20 JAGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1 915635246 BPKCLACXIONMNA-UHFFFAOYSA-N 470.533 -1.056 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)CC2)CC1 1779032877 ZPZOROOGNVVZIB-QFIPXVFZSA-N 471.562 -1.091 50 20 JAGD NC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785513697 DELVMUFKJNXRJH-WBAXXEDZSA-N 452.276 -1.233 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979776 POXVXQPHPMVXTP-FRYIKTPZSA-N 476.291 -1.546 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737152 BJKSNGJABXVWAS-ZBEGNZNMSA-N 451.954 -1.097 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CNC(=N)N)CCO2)C1)NC(=O)NCc1ccccc1 1835574580 ODJJZCAWAYBWSV-QFIPXVFZSA-N 490.565 -1.728 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837643251 MEXWHAGUMYJCLD-HRAATJIYSA-N 457.296 -1.636 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1840155524 ADBLSOPRUOTXBW-AUUYWEPGSA-N 458.899 -1.032 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980168 QSHLLCXFZXCESM-WBAXXEDZSA-N 457.252 -1.235 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1SC(=N)NC1=O 1796425824 PCKBAHFBDACDGD-LLKOPVJYSA-N 460.321 -1.628 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1801011784 CJVQQSLRAQPIPB-VTEUUUEMSA-N 457.491 -1.334 50 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COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1840151240 YHKPDMYOOLXIMF-DJJJIMSYSA-N 455.899 -1.050 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)N1 1843012160 KPRGPWMMYIMPOO-DLBZAZTESA-N 486.359 -1.637 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c1 914163816 AGBJVLAVNGWQSY-UHFFFAOYSA-N 460.472 -1.043 50 20 JAGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)C2=O)cc1 919883831 FXTXUAMLXKDWSH-KPZWWZAWSA-N 453.477 -1.020 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1782215192 XLPABPJPOLJNGQ-OZOXKJRCSA-N 455.556 -1.476 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1786983490 VWDLGICZFXFLGV-DIMBHLCBSA-N 474.348 -1.238 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)nn1 1800207142 BNGPLBNDZWLBES-KSPBDQMDSA-N 457.447 -1.537 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCN3C(=O)C=CC3=O)CCO2)C1 1832022925 VGNBIOURMIJZMP-QFIPXVFZSA-N 486.485 -1.930 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1835403170 CXFKQHMSVBPGAO-QHCPKHFHSA-N 474.367 -1.926 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927157 JFWPWBLMCWJTHL-FOIQADDNSA-N 483.352 -2.236 50 20 JAGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccco1 1835928545 QZMDOZFVKJDEMK-QFIPXVFZSA-N 471.275 -1.541 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1835938077 IKPJYZCJXJFHOF-GOSISDBHSA-N 483.212 -1.113 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CC(=O)NC3=O)C2)C1 1837456097 IQQTZWSIGIUTOM-FQEVSTJZSA-N 475.462 -2.693 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CNC3=O)C[C@@H]21 1787507140 ZHORFXKPDMZRHR-HVEJOWRVSA-N 473.490 -1.348 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833570885 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COCCn1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937102 OLJQDGVJAUODAT-QFIPXVFZSA-N 472.307 -1.407 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938140 NCGMSGXRCOOIIY-OXJNMPFZSA-N 465.268 -2.499 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840895240 LYRAQURDKVKWAC-BZNIZROVSA-N 451.954 -1.097 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(CCO)CCO)C2 1782213270 JZYOASLZWDZOEI-DYESRHJHSA-N 457.572 -1.840 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCCS1(=O)=O 1790747519 LKUABUBNPVSGFO-LEUOFYLZSA-N 450.322 -1.463 50 20 JAGD CC(=O)N(C)[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457668 MJQRZMWCPRXAHI-SPLOXXLWSA-N 462.507 -1.378 50 20 JAGD COC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837460615 HTAFVAUDPRUZNF-FQEVSTJZSA-N 461.475 -1.292 50 20 JAGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)NCc1ccco1 1837637458 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N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccn1 1835928031 BMWBHPKSRBSCSR-KNQAVFIVSA-N 454.292 -1.469 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1835938533 XMTXHSWISBQZDR-PZJWPPBQSA-N 463.296 -2.913 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1837459182 LJQRMHAEQQSQNT-SFHVURJKSA-N 489.407 -1.139 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833765548 ZNGXTPDBHRLVAL-INIZCTEOSA-N 465.555 -1.471 50 20 JAGD COCCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1836551221 MVJWQDCDXZOPAA-JOCHJYFZSA-N 487.517 -1.088 50 20 JAGD CC[S@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837238820 PCYXKYWNBHDHQQ-GEFUHLBYSA-N 452.338 -1.405 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837457830 STAYOQDXSYNWMF-QFIPXVFZSA-N 483.290 -2.251 50 20 JAGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840030610 QDGAEZUAHDYUSH-RHSMWYFYSA-N 482.397 -1.043 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1779037322 VXONTWTTWJQQGI-FQEVSTJZSA-N 457.447 -1.297 50 20 JAGD CS(=O)(=O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371174 NMFTUTVTVZCGQS-DNVCBOLYSA-N 453.521 -1.143 50 20 JAGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cn2[nH]cnc(=O)c12 1798466736 QYOIVLXBUNTZHV-ZSBFGKGUSA-N 459.507 -1.093 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807193317 VHLKKQBORVDFFJ-ILZDJORESA-N 453.308 -1.326 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1835927494 PZUCKXODJZEYBA-OAQYLSRUSA-N 474.254 -1.154 50 20 JAGD Cn1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cn1 1835928447 QRWFSBRCGLTSDQ-JOCHJYFZSA-N 456.308 -1.197 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(=O)[nH]c1C 1837456697 LUOCDWAUXVDJRH-QFIPXVFZSA-N 485.501 -1.231 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1CCc2nc(O)nc(O)c2C1 1794109159 AHBJNOYLCQKOKF-FIIQBIKZSA-N 482.302 -1.424 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931332 MUCAKBCXFBWMPJ-QHCPKHFHSA-N 479.302 -1.278 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836472559 LZTLHUHIFIBALK-KSMMKXTCSA-N 465.931 -1.072 50 20 JAGD CCC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455657 CEFHMQGKBNCHNB-LHSJRXKWSA-N 462.507 -1.330 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184304 ZCQJFNVCLXSJQT-ZHNJOBQTSA-N 491.549 -1.050 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN1CCCC1=O)c(=O)n2Cc1ccccc1 849208803 ZEMJMEACEBXMGO-UHFFFAOYSA-N 497.512 -1.176 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738887 JGYDYRMKSQIAQP-UKBAYJJMSA-N 462.264 -1.936 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1801009290 YTKOXZMJLHMAMB-BASYENTBSA-N 471.555 -1.165 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc[n+]([O-])c3)CCO2)C1 1833273881 MCOFSEONVUKHQJ-OAQYLSRUSA-N 456.459 -1.298 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928436 PWIWTRJDYFJFDO-QFIPXVFZSA-N 468.080 -2.570 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935478 HABCOXFKLNQZSK-RXVVDRJESA-N 474.348 -1.537 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1835936886 HYKKUXIUFCPQNK-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ncccn4n3)C2)C1 1777830064 YSVXTFCPOBJGKP-HXUWFJFHSA-N 451.447 -1.120 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2n(n1)CCNC2=O 1794972937 PZYAVJVYKQCRKJ-ZSBFGKGUSA-N 453.264 -2.177 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361701 NOHPLUMVHKRDRO-CYBMUJFWSA-N 454.273 -1.026 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832332482 QVMBOMDJSGLKBV-SWLSCSKDSA-N 451.249 -1.315 50 20 JAGD Cn1nc2c(c1C(=O)N1CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CCC2 1835932330 ZSFSTDAAVQAHHI-HSZRJFAPSA-N 468.319 -1.028 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1 1835937911 AYWPNSZYUSRRNH-HXUWFJFHSA-N 458.236 -1.014 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839918178 MKDBXHOUZNQNCW-OAQYLSRUSA-N 465.312 -3.277 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCn3cncn3)CCO2)C1 1840358030 RJAUYSJDFITNAF-FQEVSTJZSA-N 458.479 -1.563 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840410608 IHIWBDRHOXKQTB-OAQYLSRUSA-N 471.474 -1.376 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccc(O)nn3)C2)C1 1782676969 OUQYJWGCSRZDCZ-FQEVSTJZSA-N 457.447 -1.297 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCS(=O)(=O)CC1 1793838952 WHYJDGJGKCGVNS-CCWDJLKJSA-N 459.569 -2.321 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC(=O)C(F)(F)F)C2 1797751502 AZJKYIBLKXEWKC-WDAIWFPHSA-N 459.381 -1.006 50 20 JAGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939985 RNZPLFDBZKCJNC-VWLOTQADSA-N 494.357 -1.167 50 20 JAGD COCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835242376 XKMACDILCKKPDD-HXUWFJFHSA-N 451.480 -1.582 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)CC2)CC1 1835931422 RYSFGYQBUNCHAQ-HSZRJFAPSA-N 486.378 -1.784 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940131 VKQJXHVUBYTNLM-LJQANCHMSA-N 461.309 -1.653 50 20 JAGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839916428 OYFQTIOPJRUYEF-CRAIPNDOSA-N 466.373 -1.240 50 20 JAGD O=C1CCCCN1CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840104651 RVAUXXJQLNPLSB-JOCHJYFZSA-N 459.308 -1.551 50 20 JAGD CN1CCN(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)CC1 1786984514 NXLOEMDLFZZEEC-JBACZVJFSA-N 458.368 -1.403 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3O)C[C@@H]21 1788611740 XTSSDSMHQBQGSM-NUTKFTJISA-N 456.459 -1.009 50 20 JAGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)C(=O)O 1807366704 NVNIWXJUNYKSSI-QFBILLFUSA-N 468.275 -1.376 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930706 VRARCDJVUPZQKP-JOCHJYFZSA-N 483.290 -2.251 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839047910 CVSXNJRVHAPICF-QHCPKHFHSA-N 479.302 -1.278 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1844263553 PPHNKJIDVYIJQM-UHFFFAOYSA-N 450.521 -1.768 50 20 JAGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(=O)C(=O)O 1821715328 WUCJPBDUFAIRFK-OAHLLOKOSA-N 457.252 -1.062 50 20 JAGD O=C(CCN1CCOCC1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835443680 KIZQJEMIJNRVDZ-JOCHJYFZSA-N 461.324 -1.841 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928330 KXFUWUKIBJWORQ-OAQYLSRUSA-N 495.363 -2.138 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CNC3=O)C2)C1 1837457204 ZRHXJPLEFDCVCQ-HXUWFJFHSA-N 475.462 -2.693 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371032 OIJTYIYDMCXROE-YLJYHZDGSA-N 450.308 -1.079 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348283 KJJZRZXDVSFBDG-ZDUSSCGKSA-N 454.273 -1.026 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1835939272 JPTKLSPQOVUXFT-WWEVIYMKSA-N 485.346 -1.163 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3C(=O)C=CC3=O)CCO2)C1 1832022924 VGNBIOURMIJZMP-JOCHJYFZSA-N 486.485 -1.930 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1835740031 WIYAHQDRASXIPQ-SFJVMYTDSA-N 477.522 -1.830 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456170 KCQFQGIZTXRFTC-JLTOFOAXSA-N 483.547 -1.564 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)C1 1843234856 XLFFJMNKIOAWNT-SSDVNMTOSA-N 452.435 -1.236 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(=O)NC1CC1)c(=O)n2Cc1ccccc1 10432559 UVZFYPULVSDCOH-UHFFFAOYSA-N 483.485 -1.520 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784370082 KFMPUYBBJUNUNM-GCJKJVERSA-N 484.517 -1.401 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2)c1ccc(B(O)O)cc1 1795735311 YLOAAXXYYFTJBE-YVWYUNDQSA-N 463.259 -1.714 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1807048833 SSERIMGBQSSHQK-LJHODMEESA-N 468.518 -1.008 50 20 JAGD CN1N=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CCC1=O 1832375555 RPIBCRMQDKNFNA-OAQYLSRUSA-N 458.280 -1.955 50 20 JAGD CN[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(=O)O 1834797891 ISAYDNDVLMEROJ-IBGZPJMESA-N 460.340 -1.386 50 20 JAGD N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccn1 1835699871 GXUJLQAKIFQWSK-SIKLNZKXSA-N 454.292 -1.469 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COC(=O)C(F)(F)F)CCO2 1837319754 GMNHCBCGNHNMOX-QGZVFWFLSA-N 468.429 -1.079 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785538463 QIGMICGBGHXQQY-LJQANCHMSA-N 463.346 -1.330 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1)c1cccc(B(O)O)c1 1817473919 GXQNGUCBEZGVJL-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(O)O)CCO2 1830395928 DIINTBNWLJDZNH-LJQANCHMSA-N 453.404 -1.099 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2n(n1)CCNC2=O 1834327134 CGYDVDPHWBZKQS-UHFFFAOYSA-N 494.361 -1.195 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935297 NKKTUIJVROLPAI-JOCHJYFZSA-N 468.275 -1.756 50 20 JAGD O=C1NCc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)ccc21 1837149535 NIQPATZOKYKHIY-XMMPIXPASA-N 479.298 -1.006 50 20 JAGD Cn1cc(C=NNC(=O)c2cccc(NN=Cc3cn(C)c(=O)n(C)c3=O)c2)c(=O)n(C)c1=O 839386535 RKWKEBLEHMJVCM-UHFFFAOYSA-N 466.458 -1.309 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1792887631 LDFIXTCMXPQXJS-DLTLXFJOSA-N 492.533 -1.226 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(=O)N(C)C)CCO2)NC(=O)NCc1ccccc1 1835433606 XMMTVMSOQCIGJH-QHCPKHFHSA-N 490.561 -1.123 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1835927465 OYTVVKGOJWZYJI-QGZVFWFLSA-N 492.187 -1.208 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077006 QSNUSIGHZCHQSY-UHFFFAOYSA-N 487.517 -1.151 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1837272127 OEMQXEWDJMQACE-NFCNUSAFSA-N 487.521 -1.090 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839043808 UURASTBQMGPHRP-AUUYWEPGSA-N 472.951 -1.052 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031964 IGDYOMGEYKBSPD-NRFANRHFSA-N 468.474 -1.559 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787496838 WVBWVEUPZQKZED-NOTNWKISSA-N 474.348 -1.238 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CC(=O)NC3=O)C[C@@H]21 1788611465 CRJNKIYISACEPF-CQDKDKBSSA-N 459.463 -2.170 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCS(=O)(=O)CC1 1793837492 SSHCYOFGFLILKD-ZSBFGKGUSA-N 480.547 -2.381 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804344785 SFALXXWLSFQYFI-IEZWGBDMSA-N 465.275 -1.321 50 20 JAGD C[C@@](O)(C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(F)(F)F 1832156053 LSXFURULEAPEQL-QZTJIDSGSA-N 460.214 -1.250 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1835737075 KGRHSRFMYIAMTN-QGZVFWFLSA-N 486.533 -1.532 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835738092 SRACMJRZOHVRQM-HSZRJFAPSA-N 489.577 -1.479 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H](O)N1CCOCC1 1835764932 TUDTWIWWOAFPMH-HSZRJFAPSA-N 474.367 -1.798 50 20 JAGD O=C1NCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc21 1835930582 NUNRFDSNJDMZAZ-DEOSSOPVSA-N 479.298 -1.006 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938215 QNKHCXIDXIKHKO-PLTNMMHCSA-N 452.338 -1.405 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1835939829 JXVZNDOUJDNICX-FXAWDEMLSA-N 466.321 -1.986 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1837457421 AILCRAABMQXYMJ-QFIPXVFZSA-N 496.484 -1.183 50 20 JAGD NC(=O)[C@@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837880141 KYIFEMQFVSCUKR-IBGZPJMESA-N 460.340 -1.429 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839781809 FKEPWEKBZOCHAV-YLJYHZDGSA-N 466.321 -1.986 50 20 JAGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2)c1cccc(B(O)O)c1 1815354822 SHHOBUHUBQSUDT-NSHDSACASA-N 480.275 -1.512 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)N(C)C)CCO2)C1 1830043186 YFHOWWUCVLYJBG-MNQDVBFDSA-N 477.522 -1.152 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831330971 ZEETWUYSMCGRCO-HNAYVOBHSA-N 477.584 -1.856 50 20 JAGD CN1C(=O)CC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459766 NAGCVYBKIDDIMC-HRAATJIYSA-N 460.491 -1.624 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922085 JQARGDZNBNIMPX-UHFFFAOYSA-N 469.303 -1.096 50 20 JAGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)C(=O)N1CCCC1 748454430 UFJOAAKWKASLHC-UHFFFAOYSA-N 453.525 -1.514 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031935 HXLLNSONCHRTMP-DYESRHJHSA-N 477.474 -1.377 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1840155528 ADBLSOPRUOTXBW-LIRRHRJNSA-N 458.899 -1.032 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839083003 MEIFLGXCUHNTEF-NRYAXDJKSA-N 485.346 -1.163 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840183837 COUZPDPPVBMJJY-OAQYLSRUSA-N 462.312 -2.191 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cnnn1)c(=O)n2Cc1ccccc1 789857548 XCCJOMMMADOCMJ-UHFFFAOYSA-N 482.461 -2.112 50 20 JAGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)CC1 789857812 KLCKRDVGJDOFPA-UHFFFAOYSA-N 451.505 -1.077 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037319 VSQXBMZFKUPTEB-IERDGZPVSA-N 478.506 -1.028 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(CCO)CCO)C1 1781840641 HBTDNDKHLRRHAB-DYESRHJHSA-N 457.572 -1.840 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN 1795525141 CBUYSUQNZIPQAT-WQDJSCAQSA-N 490.366 -1.650 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933984 KKDVIQXOVBNEJY-IBGZPJMESA-N 461.309 -1.653 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836516794 KZAHZWNCNDZOPZ-OAQYLSRUSA-N 495.363 -2.138 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839717631 KHDBKRDSJNDPKQ-KBXCAEBGSA-N 458.855 -1.187 50 20 JAGD CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1839760640 KVPYIKGZWNXNFP-NRFANRHFSA-N 460.292 -1.220 50 20 JAGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cn2[nH]cnc(=O)c12 1840185609 PZRKXDHFVNCTLJ-JOCHJYFZSA-N 489.533 -1.226 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1779028052 AFLNXXOTJMKHMU-FQEVSTJZSA-N 455.431 -1.069 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795737149 XPUXOVURCLKCNV-REGYPHIPSA-N 466.303 -1.217 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832880061 XOURJDQNIKFJMB-QHCPKHFHSA-N 499.528 -1.097 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)o1 1836024534 DANYIITWGMAIGQ-HXUWFJFHSA-N 459.463 -1.311 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc21 1836779158 CAPISGUHFLNTGF-QHCPKHFHSA-N 497.317 -1.920 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784519065 RIMSYNRGGQTJRZ-PYTWLRIVSA-N 467.548 -1.041 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738477 PDYDQAHXCDBPTE-GPMSIDNRSA-N 457.915 -1.487 50 20 JAGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837526399 DILNEYNUSONMSY-VJIOCRDPSA-N 475.307 -1.035 50 20 JAGD O=C(Cn1ccncc1=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839663111 AMJTYNBRVGGHPO-NRFANRHFSA-N 456.264 -2.307 50 20 JAGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn2[nH]cnc(=O)c12 1780019911 QYZWWNSOYZWBKT-JOCHJYFZSA-N 465.275 -1.232 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)[C@@H]1SC(=N)NC1=O 1796425182 FAWACCUEYHMKTP-VHKOSHJNSA-N 475.531 -1.309 50 20 JAGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799355416 NIBCJYJWFYCGFM-NBMJBFSESA-N 491.350 -1.155 50 20 JAGD CC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC1 1801011708 WCYIMXUUNHNAGI-UPHUGPLXSA-N 452.556 -1.887 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376064 TVLUPDJXBIVIGX-CZTZKLFOSA-N 468.319 -1.268 50 20 JAGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccs1 1835935186 FQXHABMYVTYXGY-QFIPXVFZSA-N 487.343 -1.072 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183453 FLQBRCBTFKDSHF-HXUWFJFHSA-N 450.496 -1.072 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1779036795 FBUYNCZDBWHWSR-DNVCBOLYSA-N 451.505 -1.294 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1781853161 AAHRGBOKDGHLII-IIBYNOLFSA-N 463.296 -1.347 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)N3CCOCC3)C[C@@H]21 1787508244 BPPXCFVKIBENCE-GZNBKPNSSA-N 476.534 -1.249 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1 1809966769 LYCGABBEQRNJBT-UHFFFAOYSA-N 465.279 -1.349 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CC(=O)NC3=O)CCO2)C1 1832476599 WREDFVHCJYUXMM-GQBLCDNYSA-N 489.489 -1.871 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nn3)CCO2)C1 1833834246 BFNXWTIIHVMCBM-HXUWFJFHSA-N 457.447 -1.436 50 20 JAGD CCNC(=S)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939242 INRVUSIFJHHSQL-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459120 IYEJMCIUCGOCKT-MQFAKOPTSA-N 467.548 -1.086 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)C(=O)N1 1839198693 MUAMVBVIVPQIAA-IUODEOHRSA-N 451.249 -1.315 50 20 JAGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)(C1)C2 1840005174 KBLBBKAYLRRVRO-VNXZQDSDSA-N 472.303 -1.220 50 20 JAGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNS(=O)(=O)c2cn(C)c(C)n2)cc1 725879627 KJCIJSZMJJPRTB-UHFFFAOYSA-N 472.549 -1.217 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788706352 YXFSESCTGIIZAS-IPQUUHLSSA-N 496.528 -1.113 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(S(C)(=O)=O)c1)CCO2 1833401422 OJFGDZDKZDQJOU-OAQYLSRUSA-N 497.574 -1.072 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1837461506 WQUKTCXAPLTIBZ-GOSISDBHSA-N 488.423 -1.566 50 20 JAGD O=C(CNC(=O)C(F)(F)F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791311249 YDFHLSDNZUOBKG-QEJZJMRPSA-N 457.214 -1.362 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1NC(=O)NC1=O 1793941080 FYBKTZSKHPKGOV-OQVYJZQFSA-N 459.463 -1.692 50 20 JAGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735846 GKNSHTNQAMEVAC-NBMJBFSESA-N 491.350 -1.155 50 20 JAGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736649 BPIAPKLYDLKVDT-RMFSNUHRSA-N 464.324 -1.361 50 20 JAGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CNC1=O)CC2 1819793555 PSGUNSAFFZGJKE-SECBINFHSA-N 472.487 -1.081 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CC(=O)NC1=O)CC2 1826083089 JWPYLGCUKAGXBU-SNVBAGLBSA-N 451.509 -1.020 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459618 SXEBOBPZPCWUGA-SZNDQCEHSA-N 477.522 -1.537 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1786979852 LZYGCRQWTOENCF-DIMBHLCBSA-N 474.348 -1.238 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371762 ZOVNBJALUZPMOT-QRFRQXIXSA-N 453.308 -1.326 50 20 JAGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(=O)[nH]c1C 1833390821 GTDKFFLLXVVFLE-OAQYLSRUSA-N 464.523 -1.170 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1835928619 SQEOGKSQWBRQPG-HSZRJFAPSA-N 483.286 -1.084 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1837271721 CJMJGIGBNCFXFR-FQEVSTJZSA-N 458.284 -2.231 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1837949122 KEONLJCZSXHZPX-FQEVSTJZSA-N 464.479 -1.382 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1)C2)NC(=O)NCc1ccccc1 1799097115 CGCCGVHRYQJEKN-RVDAZCDBSA-N 474.562 -1.355 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833478031 BOYWPWZRPKZOST-FQEVSTJZSA-N 451.480 -1.471 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801119 PZPSAQXGKDLHSS-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CNCP(=O)(O)O)CCO2 1835535464 OJZNSPMFJUGUSX-CQSZACIVSA-N 458.246 -1.047 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1835928659 UOYVSXYRXXHLAF-NRFANRHFSA-N 482.262 -2.519 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930410 IKIODLJAXNHVKC-YCRPNKLZSA-N 462.312 -1.856 50 20 JAGD Cc1nnc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)s1 1835935752 PKGGLXLXLNGZAC-HXUWFJFHSA-N 460.321 -1.161 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1835936901 IMYUOIGZSDFWRL-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938311 RTZMHQNPUZVVDE-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837209322 UFOXNDIYTHPGQO-OXJNMPFZSA-N 480.478 -2.180 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791543051 RUAUMMHQRQNACI-GAZPGATBSA-N 498.544 -1.251 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2)c1cccc(B(O)O)c1 1795741290 SBJORBLJTIZFOL-CCWDJLKJSA-N 470.247 -1.660 50 20 JAGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)NCc1ccco1 1837637451 OGPNGHYZBGSUNA-DGQXCUQSSA-N 497.313 -1.098 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839386847 QAXQDYBDTUDLIM-VGSWGCGISA-N 493.322 -1.721 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 729274909 HCYZWVBQAGEZBP-CQSZACIVSA-N 489.576 -1.615 50 20 JAGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccc[nH]1 1832875746 MSNLVJXHAQLMRS-HSZRJFAPSA-N 484.318 -1.415 50 20 JAGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)O 1834740325 UULQCNUYMSMWSM-SFHVURJKSA-N 475.550 -1.067 50 20 JAGD O=C(Cn1ccccc1=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928370 MTXZPYCWMFATOP-QFIPXVFZSA-N 455.276 -1.702 50 20 JAGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)C(=O)O 1836512942 UTGKSTKKUZFHGW-UHFFFAOYSA-N 489.533 -1.587 50 20 JAGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1csc(N2CCOCC2)n1 1317799142 OJSXTIFHDUZQEQ-NEPJUHHUSA-N 457.534 -1.224 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028646 GNHDXDBUYJGINU-YJYMSZOUSA-N 453.521 -1.191 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccnc1C(N)=O 1798355066 CYAXUVRCTURZFD-DVMGPBRKSA-N 468.474 -1.087 50 20 JAGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(=O)O 1834737101 AQHKEKNJKNXIAU-IBGZPJMESA-N 460.340 -1.386 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n1 1835937114 PCLLRGKPNZBUCT-JOCHJYFZSA-N 472.307 -1.407 50 20 JAGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)c(=O)n2C 15737591 JZJVIOQPMMPMAR-UHFFFAOYSA-N 468.518 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3(=O)=O)C[C@@H]21 1788609711 CGLYLUDKFFYMQI-OSMBCOQSSA-N 465.532 -1.144 50 20 JAGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cn2[nH]cnc(=O)c12 1789176396 FDECKTHLLQNOGI-SNRMKQJTSA-N 479.302 -1.082 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807947907 LODAQULRNJZZDA-KXBFYZLASA-N 488.273 -1.479 50 20 JAGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(=O)C(=O)O 1821715072 SEFQVXGMOWWQGM-OAHLLOKOSA-N 457.252 -1.062 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833861260 AEZUABICNVOPQC-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835446164 ZAEBDLAOYIINBI-JOCHJYFZSA-N 476.534 -1.523 50 20 JAGD O=C(CCc1cncnc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928361 MNBZXPUKTLJXCG-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1C 1835931307 MLMRRXZCXRWGSW-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940186 YJJIQTLVYJXLFQ-NFBKMPQASA-N 499.333 -2.093 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837384971 MYRJJMTYHGMYNH-FOIQADDNSA-N 456.544 -1.477 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837730699 AGWKESZIQKSDRB-BZMRFGKZSA-N 492.533 -1.272 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840183836 COUZPDPPVBMJJY-NRFANRHFSA-N 462.312 -2.191 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789708476 YQBRIUNCQHPMND-SNRMKQJTSA-N 498.370 -1.135 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2)c1ccc(B(O)O)cc1 1795735036 LBZMTGLWOOVNHP-ZSBFGKGUSA-N 468.300 -1.047 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1835927458 OYTVVKGOJWZYJI-KRWDZBQOSA-N 492.187 -1.208 50 20 JAGD NC(=O)c1nccnc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836048241 MGNNUDGDWAYQHI-UHFFFAOYSA-N 480.334 -1.246 50 20 JAGD N=C(N)SCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457517 HSZZXSCLKZFMTG-SFHVURJKSA-N 451.509 -1.618 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837794723 ZXVYBAJSFROJDC-IBGZPJMESA-N 459.224 -1.619 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1778354724 TYDYBSCVSRHJFE-JOCHJYFZSA-N 458.324 -2.026 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CNC1=O)C2 1779371307 NDWBVHOMDTZHSE-QVKFZJNVSA-N 473.490 -1.636 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)no1 1783936043 QLVQBXBGSHQQOD-FQEVSTJZSA-N 450.496 -1.084 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1807190734 LIHQLNCVCUOYPS-DKSSEZFCSA-N 468.518 -1.008 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1835744621 ZXUDATYMYMEWNJ-QRWLVFNGSA-N 463.495 -2.652 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(=O)C(=O)O 1839702939 LRSBBNMHNAUXFZ-MRXNPFEDSA-N 450.286 -1.229 50 20 JAGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)CC1 729274950 HZCSDBJZWPHOOW-GFCCVEGCSA-N 475.549 -1.762 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CC(=O)NC1=O 1793834226 ZMIIYRUZDFGINB-CNKKGNCFSA-N 459.463 -1.738 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804186671 LHFIWQHLOLGMFG-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840431215 ZJIOAZLWLHISOR-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037318 VSQXBMZFKUPTEB-HRAATJIYSA-N 478.506 -1.028 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784444518 MFGDDKFVDQRBGE-UGUYLWEFSA-N 461.585 -1.333 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)cn1)CCO2 1833599597 OKXUIGNMRJRUGS-NRFANRHFSA-N 497.574 -1.072 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833762570 DTNBIQIUTWEAOD-QGZVFWFLSA-N 486.533 -1.532 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835645334 FEZKWGJFWRAYCK-HXUWFJFHSA-N 470.571 -1.005 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934432 ZQKFHJJVFGICKB-MGPUTAFESA-N 468.337 -1.883 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838327809 KDFQAPUKTCNDIZ-NRFANRHFSA-N 469.263 -2.361 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1840183995 MXRSGXXWPLEUPM-QGZVFWFLSA-N 450.439 -1.074 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2)c1cccc(B(O)O)c1 1795739870 MGUIBTUJSPGONO-JHLLAZCVSA-N 455.320 -1.029 50 20 JAGD COCc1oncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928440 QAISLRKEZXVDHN-OAQYLSRUSA-N 459.264 -1.115 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934534 XESMVJDPXINRST-SIKLNZKXSA-N 461.324 -1.259 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748577 JULDDFPFYBUMAM-JFILPPLUSA-N 453.521 -1.431 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(N)=O)C2)NC(=O)NCc1ccccc1 1799098240 FCQRIJDTAOFAPY-HGKCTWBKSA-N 461.523 -1.410 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804343400 DPIPZPJQIKCKEC-AYBZRNKSSA-N 465.275 -1.321 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367251 KBLQLKBKXWFSRN-SIKLNZKXSA-N 470.335 -1.632 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810350152 PXHYYMPBYMUZTD-NOXFTYBFSA-N 468.319 -1.268 50 20 JAGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(=O)C(=O)O 1815348603 RQKQHYCIGLADLX-GFCCVEGCSA-N 460.277 -1.408 50 20 JAGD O=C(/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)NC1CC1 1837250895 SNNCJQZJKMYORB-RHVSLNNASA-N 457.292 -1.729 50 20 JAGD Cn1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1=O 1837455655 CAXZOWOWDHPJHD-JOCHJYFZSA-N 470.486 -1.232 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1837460374 DUEYDIYAFVUVBE-OAQYLSRUSA-N 480.522 -2.958 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837464338 SORRYGDJVJKUCP-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837798834 FBJVJKUMHKDFGC-GOSISDBHSA-N 453.456 -1.239 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)CC1 1840184051 PGDXDOSYPIKJRE-QFIPXVFZSA-N 468.599 -1.547 50 20 JAGD N=C1NCCN1CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837860458 ITWNGBNWAVEHPT-UHFFFAOYSA-N 457.340 -1.181 50 20 JAGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 16785894 CRMJGLHQSMICOM-OAHLLOKOSA-N 486.572 -1.118 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3c(O)nnc13)C2)c1cccc(B(O)O)c1 1795739132 XAOCCPKBEPJHIT-XOIINTDNSA-N 451.248 -1.368 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(CCO)CCO 1800582323 ARBLOGGBGRDXFN-GWGBFROSSA-N 464.523 -2.003 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)CC2)CC1 1783935567 VTDNCLGVELVOEW-OAQYLSRUSA-N 450.584 -1.031 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751568 HVSGTGXJXSKBBS-UOHMRFDXSA-N 450.452 -2.047 50 20 JAGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(C)(C)C 1831086917 ICBOOGYHYBBEFT-WMZHIEFXSA-N 475.351 -1.013 50 20 JAGD CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800195 YGLMVPKDVSRKFZ-LJQANCHMSA-N 459.356 -1.002 50 20 JAGD CC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456923 SUKOSINSSSSTSV-DYESRHJHSA-N 462.507 -1.330 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840180067 GZSREVJZUOABRP-RTWAWAEBSA-N 479.490 -1.629 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804185154 BZLPVIPIKRVJOY-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)n(C)c1=O 1830726845 UIMYIXVRDPRHOE-XCLFUZPHSA-N 498.924 -2.510 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)n(C)c1=O 1830726846 UIMYIXVRDPRHOE-ZUOKHONESA-N 498.924 -2.510 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837626105 BKVJQIMCNOYGKG-QFIPXVFZSA-N 468.275 -1.530 50 20 JAGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1783873906 WHFCYQRWGWZGIJ-ZUOKHONESA-N 482.925 -1.483 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793085332 DWFXUWCYMCDEPU-NBMJBFSESA-N 491.350 -1.155 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2c(O)nnc12 1796287959 IFRXHHPQNCTHPT-DRXBFXEBSA-N 466.458 -1.050 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797745 AXISZFAPWWXJFI-UHFFFAOYSA-N 465.381 -1.014 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839350280 UGGMHASVIHPUKM-HSZRJFAPSA-N 467.287 -1.151 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839717634 KHDBKRDSJNDPKQ-KDOFPFPSSA-N 458.855 -1.187 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797750506 INJNKRAMYZWZST-ZSBFGKGUSA-N 453.264 -2.118 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800282545 FJVKGSDQZJYGCM-CCWDJLKJSA-N 470.247 -1.660 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804091526 QEVVNDYVRBZJOQ-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)N1 1832694496 QUNXJEUMGMDQJO-MGPUTAFESA-N 460.252 -2.966 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]nnc3n1)CCO2 1836402750 DBWHQKLPMBSEEU-MRXNPFEDSA-N 470.284 -1.332 50 20 JAGD Cc1noc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457768 QOULQBMKHDSJJO-FQEVSTJZSA-N 459.463 -1.311 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737704 LENCQHMEHFRUQM-NBMJBFSESA-N 491.350 -1.155 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1809659361 MQGLGLBDGZGFMN-UHFFFAOYSA-N 453.241 -1.064 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460943 LXDSRMMGICCELZ-NRFANRHFSA-N 477.522 -1.872 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCO)CCO2)C1 1839194020 MWMKMUOSPCLCHE-INKLHFNDSA-N 451.480 -1.414 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839785619 WRFITIYEWUXNMO-DNVCBOLYSA-N 460.553 -1.607 50 20 JAGD O=C(CCc1cnccn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840457194 JZSRWADFWVRZNO-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)cc1OC 825370592 VQHFRRPXIOVETJ-UHFFFAOYSA-N 474.430 -1.545 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028642 GNHDXDBUYJGINU-DJJJIMSYSA-N 453.521 -1.191 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)N1 1782871593 JSDXSJFWKXJECV-SSHHRWTQSA-N 474.967 -1.404 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787152483 SXONXORGHBCSPK-XEZPLFJOSA-N 482.563 -1.196 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnncc1C(=O)O)C2 1797751583 JOQHBOVPYVUNHU-CULMDFNYSA-N 455.431 -1.310 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726639 SBWOYEWOTIICOI-YOEHRIQHSA-N 453.945 -2.227 50 20 JAGD C[C@](O)(C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(F)(F)F 1832156033 LQSOLFJYEWTVNR-ZWKOTPCHSA-N 460.214 -1.250 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1CC(=O)NC1=O)CCO2 1832482906 SHGIVNFWDVONBO-LJQANCHMSA-N 454.484 -2.632 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1835927493 PZUCKXODJZEYBA-NRFANRHFSA-N 474.254 -1.154 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1835930166 AIETYQOPSPTVOR-QHCPKHFHSA-N 484.318 -1.011 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)N1 1835935073 FHNGWOQVDBIXKY-QRWLVFNGSA-N 460.252 -2.966 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793370252 GECSHLJNBXFSHJ-NFFDBFGFSA-N 453.521 -1.431 50 20 JAGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)nc1 1794426436 CHFHYKOLFKNGGK-CCWDJLKJSA-N 473.316 -1.318 50 20 JAGD CSCC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934229 PYTIZWYWMSJKSI-FXAWDEMLSA-N 452.338 -1.450 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NNC(=O)C3)CCO2)C1 1837361368 RKBRISINEPCRIX-CCULFSDZSA-N 459.463 -1.547 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(=O)[nH]c1C 1840183565 MGZVOVDHEQYMKT-OAQYLSRUSA-N 464.523 -1.170 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185341 LPSJTQCRRPDQHH-UZLBHIALSA-N 451.528 -1.256 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnncc1C(=O)O 1798099757 ORPBUCNZOFMBTN-CULMDFNYSA-N 455.431 -1.310 50 20 JAGD CN(C)C(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830044689 LYWFNEKNXCKLIT-HXUWFJFHSA-N 463.495 -1.974 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc21 1834562464 WMNBYIBSYSXJKM-JOCHJYFZSA-N 483.290 -2.310 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927158 JFWPWBLMCWJTHL-MGPUTAFESA-N 483.352 -2.236 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](N)c3ccccn3)C2)C1 1837457943 XORKTJPQDPPXPY-GCJKJVERSA-N 469.502 -1.150 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458763 AZYGOHFYTFATAY-UTKZUKDTSA-N 478.506 -2.094 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738842 HVGXKPJRHIESMI-ZSBFGKGUSA-N 453.264 -2.118 50 20 JAGD CNC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831276505 PGGKUVVMUQZUOL-HSZRJFAPSA-N 490.561 -1.075 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832201398 DPAPATXBORCHOC-HSZRJFAPSA-N 479.302 -1.119 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1835930386 IFTIDRFWNKXDDK-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456178 KCQFQGIZTXRFTC-VLIAUNLRSA-N 483.547 -1.564 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837517683 ZCYXBAFPUKNPPD-CTNGQTDRSA-N 463.296 -2.913 50 20 JAGD CN1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1778847411 ALASICUTUZWVKJ-NFBKMPQASA-N 458.368 -1.259 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937927 BJNYJUHLZDUIOQ-OPAMFIHVSA-N 461.324 -1.259 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1835939209 HKIATJFZYHOXPU-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840183906 HMGLQOCUQDHBPV-AVRDEDQJSA-N 462.551 -1.219 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187054 UABWYMRTKJIJFC-INIZCTEOSA-N 458.364 -1.023 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840360881 DHCDLVGQWOPUKG-UZUQRXQVSA-N 468.319 -1.035 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784441665 QPJSWOGHEDURDE-IKICRFKJSA-N 467.353 -1.713 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985028 LLSDLESVXWLZNJ-XPYUAMARSA-N 477.323 -1.197 50 20 JAGD Cc1nn(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1835929633 ZNGOYTQRWDGBHL-OAQYLSRUSA-N 460.271 -1.069 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1835931091 FVIXFXMLXOSZJH-QHCPKHFHSA-N 493.285 -1.847 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1835939737 ZDHVONDZICRONK-JOCHJYFZSA-N 483.265 -1.068 50 20 JAGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn2[nH]cnc(=O)c12 1838469769 UTWBSLNGIVOWLW-HSZRJFAPSA-N 495.301 -1.605 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1ccc(=O)[nH]c1=O)c(=O)n2Cc1ccccc1 10161461 ZQGSQAFXOSTQQD-UHFFFAOYSA-N 494.468 -1.875 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785035671 UYUDXFSAYGZJAZ-WDSOQIARSA-N 479.364 -2.310 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)C=CC1=O)C2)NC(=O)NCc1ccccc1 1799097206 IPGQJXKZDNQHBT-FEJSZKPUSA-N 498.540 -1.153 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930494 JKVGUUSEYMUNLU-KNQAVFIVSA-N 492.290 -2.069 50 20 JAGD O=C(CCc1cncnc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935884 VXSRRSBZLRBSPU-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD Cn1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1=O 1835934182 OSGWTWAMCCWIFJ-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837757784 DOIDWVBMMBFKRF-QHCPKHFHSA-N 484.318 -1.011 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838477811 ZIWKQISJDLZIDH-JOCHJYFZSA-N 469.259 -1.126 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840482296 VKUBOINPLBBZBP-JOCHJYFZSA-N 455.276 -1.342 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c(=O)n2Cc1ccccc1 901413400 IWYAZWBTYJZBTQ-HNNXBMFYSA-N 483.485 -1.520 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1779092487 IOXCSPQCEOYTEE-WXWJXLOASA-N 462.507 -1.399 50 20 JAGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccco1 1835935497 HSRWOHGRSVSHQO-JOCHJYFZSA-N 471.275 -1.541 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837526396 DILNEYNUSONMSY-ROZQTZPBSA-N 475.307 -1.035 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788611220 PDNRQMBZTIQFQA-VDGAXYAQSA-N 487.561 -1.558 50 20 JAGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800849662 XQVDOTORAHJYPO-HATOLVCRSA-N 494.350 -1.734 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720135 TWQZGHBQZXOCPN-NJSLBKSFSA-N 465.931 -1.072 50 20 JAGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1834823469 WJNJXBYNPRGBFV-DOTOQJQBSA-N 450.330 -1.122 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835396844 OHYJDZRAVOJEKM-OAQYLSRUSA-N 462.507 -1.913 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[C@@H]1SC(=N)NC1=O 1835928761 YHAWATPNAOAMRI-UYTHQXMGSA-N 490.347 -1.761 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837238825 PCYXKYWNBHDHQQ-PLTNMMHCSA-N 452.338 -1.405 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183452 FLQBRCBTFKDSHF-FQEVSTJZSA-N 450.496 -1.072 50 20 JAGD CSCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840195936 LXDXRQCKKZIHBJ-PXNSSMCTSA-N 452.338 -1.450 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cncn1)c(=O)n2Cc1ccccc1 849208808 ZWCDFXJXIWYYBY-UHFFFAOYSA-N 481.473 -1.507 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3NC(=O)NC3=O)[C@H]2C1 1785150662 JTXWVKWLOPSJDG-HJPIBITLSA-N 459.463 -2.124 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)[C@H]1SC(=N)NC1=O 1795734259 LWZLHULSDVYVNP-LLKOPVJYSA-N 460.321 -1.628 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831449104 HXAQNTPPQZXUNN-IBGZPJMESA-N 460.553 -1.278 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835764777 QIYCFKWBYPQPDE-HSZRJFAPSA-N 489.577 -1.479 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)C=CC1=O)CCO2 1840264228 OKGSMZCANJWHNV-HXUWFJFHSA-N 451.480 -2.259 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980199 UYKCHLOOFITQKV-WBAXXEDZSA-N 452.276 -1.233 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1801012744 IEXDCKRVPARHFN-HBCWATKFSA-N 464.479 -1.281 50 20 JAGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccc[nH]1 1835927207 MAWXTMPCFIGBDT-HSZRJFAPSA-N 484.318 -1.415 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837204304 FQNJAPKKZHUZSU-UZLBHIALSA-N 465.268 -2.499 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837479855 CIAKJOAOUZNKCG-KSFYIVLOSA-N 469.307 -1.273 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2)c1ccc(B(O)O)cc1 1795734309 MALVYKJTWCWMAZ-CCWDJLKJSA-N 467.291 -1.787 50 20 JAGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740602 CNNKGXGUELXINX-HATOLVCRSA-N 494.350 -1.734 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804346941 XFKFRIUIBNDIBG-MZMPZRCHSA-N 480.485 -1.002 50 20 JAGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(=O)C(=O)O 1815348604 RQKQHYCIGLADLX-LBPRGKRZSA-N 460.277 -1.408 50 20 JAGD O=C(C[C@H]1NC(=O)NC1=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833760738 FARYTQHJRHWLPQ-GOSISDBHSA-N 471.323 -1.850 50 20 JAGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)no1 1835928297 IXHVEZZYOQTLDW-JOCHJYFZSA-N 486.290 -1.238 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037321 VSQXBMZFKUPTEB-KKSFZXQISA-N 478.506 -1.028 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1784373526 AICNWXLYTIVIIV-UTKZUKDTSA-N 463.539 -1.340 50 20 JAGD N=C1NCCN1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807113913 WUUZJXXZLMCNIP-XLIONFOSSA-N 450.308 -1.079 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(=O)O)ncn1)CCO2 1833496567 PFDPNLIWLSAYMZ-HXUWFJFHSA-N 464.479 -1.382 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1835541643 BFDXNFNJHNXNGQ-SMDDNHRTSA-N 458.246 -1.049 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934018 LCQCPVAKBHWULS-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940122 VBNLZLYPZCCHNX-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837206696 OVVHRHFWVVAHGY-XGHYCODVSA-N 494.505 -1.359 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837497708 KWHCZGSEQBSWAO-SIKLNZKXSA-N 492.290 -2.069 50 20 JAGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1 1838348836 FBBYDATVEHBSHB-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182269 BTCVDYJMLJMJNW-KXBFYZLASA-N 477.584 -1.856 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784440687 DIJMIMKZWADBSF-KCMWZYNZSA-N 467.353 -1.713 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CO)on3)C2)C1 1837459281 BBXFIXIPJBJKLV-FQEVSTJZSA-N 460.447 -1.451 50 20 JAGD CSCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840196753 XSPGCHUMBHILDQ-PXNSSMCTSA-N 452.338 -1.450 50 20 JAGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 920212628 RUWXNCLUJYWICL-NSHDSACASA-N 464.522 -1.110 50 20 JAGD O=C(NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccc[nH]1 1832875419 FGOCUMQNCCMWFY-QHCPKHFHSA-N 484.318 -1.415 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928329 KXFUWUKIBJWORQ-NRFANRHFSA-N 495.363 -2.138 50 20 JAGD CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939955 QBYUJEVVNKJWRT-YCRPNKLZSA-N 464.280 -1.002 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)C1 1837457074 WPVYRGHSGHGBET-SZNDQCEHSA-N 460.491 -1.719 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840809465 ZCFIDBKNWYAVBV-LIRRHRJNSA-N 458.899 -1.032 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028644 GNHDXDBUYJGINU-ORAYPTAESA-N 453.521 -1.191 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798334 JDVYKUJOZKNSOS-NRFANRHFSA-N 474.367 -1.297 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)Cn3cnnn3)CC2)CC1 1834875723 DGMNBPQIHCDASL-UHFFFAOYSA-N 456.511 -1.443 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1837457674 MLDSVDOFTZKKBP-LJQANCHMSA-N 474.434 -1.300 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837644936 YSBCYANTUTXQHQ-YCRPNKLZSA-N 472.506 -1.317 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1778115085 CBVZMAADTYGRMZ-OAQYLSRUSA-N 479.364 -1.519 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCS(=O)(=O)CC1 1794091313 AMNRUGYEVVJQCO-QDMKHBRRSA-N 464.548 -1.333 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCNC2=O 1794974144 CTRHZFSEXKENCE-DPIQGUFMSA-N 468.474 -1.858 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930635 QYYLHUBWCJGAQL-NQIIRXRSSA-N 463.296 -2.413 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1 1835939683 XWFBYPZYDYRGTJ-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1839200164 GVDIHJJRUSRUKO-JGGQBBKZSA-N 454.293 -1.216 50 20 JAGD CCc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1CCOCC1 729277352 ZWCXQXKLKPOGOE-LBPRGKRZSA-N 462.550 -1.031 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796300181 MLFNBUDEIFRNKD-KRXQYRFLSA-N 471.555 -1.165 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1)NC(=O)NCc1ccccc1 1799141355 USDRTHWKPUPVAR-RVDAZCDBSA-N 474.562 -1.355 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1NC(=O)NC1=O)CCO2 1832698424 YQHMBCHRBQEMCQ-DJJJIMSYSA-N 454.484 -2.586 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798526 HJQDFEOYLXQPAZ-UHFFFAOYSA-N 494.361 -1.136 50 20 JAGD Cn1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1836061806 BJHZZYLTPNQDAW-NRFANRHFSA-N 457.491 -1.269 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831690419 IPAZTZQPIIOCQS-QFIPXVFZSA-N 461.324 -1.401 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C(=O)Nc1cccnc1 1788716269 ABGZKONKZKDZEX-SNRMKQJTSA-N 452.276 -1.007 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21 1791287972 IYESMTSVHPDQSX-ULQDDVLXSA-N 473.596 -1.931 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)N1 1832697797 QSAZPWNDXWKJEU-ZVWUFJHRSA-N 451.249 -1.269 50 20 JAGD N=C(N)SCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835651617 AHVHBODGGJOXNC-LJQANCHMSA-N 465.536 -1.228 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837377930 WLAQJIKONPTTBL-VFNWGFHPSA-N 462.312 -1.856 50 20 JAGD CC(=O)N(C)[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457670 MJQRZMWCPRXAHI-SZNDQCEHSA-N 462.507 -1.378 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2 1838826712 WNUOZZGEEURKKT-HXUWFJFHSA-N 458.236 -1.014 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CNC(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1840920396 OPDGXXALCZRPPF-QFIPXVFZSA-N 491.549 -1.543 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786261343 HIKDHFPNSDYVDZ-QITLCBANSA-N 482.501 -1.468 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834797577 METSQMJXXOARTB-UHFFFAOYSA-N 487.565 -1.024 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939641 CMCFWRXFLNZZAC-QFIPXVFZSA-N 477.323 -1.039 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(=O)C(=O)O 1839702934 LQFKAJBRNJBDIA-FQEVSTJZSA-N 463.252 -3.021 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)N1CCOCC1)C2 1782215188 XLPABPJPOLJNGQ-LKUPVBHCSA-N 455.556 -1.476 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nn1 1837459659 VIHSKKXIBVVHEB-NRFANRHFSA-N 471.474 -1.133 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1840185649 RRQHJAUIWUNGAI-JOCHJYFZSA-N 487.517 -1.468 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(=O)nc1O 1779036017 TVPMAHCLJYUKKX-OAQYLSRUSA-N 471.474 -1.600 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810487693 GCJDXHAYHVPLSU-UHFFFAOYSA-N 480.489 -1.030 50 20 JAGD N[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccnc1 1835828893 NBHFTFVAQUGTNI-OFNKIYASSA-N 468.319 -1.079 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccncc3=O)C2)C1 1837459520 HIXAXELKJUDRIR-OAQYLSRUSA-N 471.474 -1.988 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CC(=O)NC1=O)C2 1779371128 GRJJLBWAHSFYPG-QVKFZJNVSA-N 473.490 -1.636 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829714185 YRUAEUQVBPCIGK-OAQYLSRUSA-N 478.575 -1.196 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185334 LPSJTQCRRPDQHH-JXFKEZNVSA-N 451.528 -1.256 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1797752774 GPHUIHLOIOQKIS-ZSBFGKGUSA-N 499.553 -1.207 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336795 FFBGISFEXQTLJR-HNNXBMFYSA-N 492.388 -1.221 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817814153 BZXYNBYJMOVUNM-HNNXBMFYSA-N 477.250 -1.165 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817814912 ZFCAEOAKSNHCGW-HNNXBMFYSA-N 477.250 -1.165 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCC3=O)C2)C1 1837457504 GENSQVAENSCJIE-NRFANRHFSA-N 460.491 -1.623 50 20 JAGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1840035436 RIBCSDUQOMTSSI-RHSMWYFYSA-N 452.346 -1.487 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214252 JBOLKPPFEIKWBX-CFLQYTFWSA-N 457.528 -1.062 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791283595 UMSWIGNZVVMDPU-LEYVPELOSA-N 463.491 -1.106 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831325414 XYZUFPRRYASXCZ-JLTOFOAXSA-N 498.562 -1.917 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456825 QKHGZCPCIORAGD-VBKZILBWSA-N 498.562 -1.917 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)CN)C2 1843428575 BQYVWXRKEVVLFE-KRWDZBQOSA-N 460.340 -1.036 50 20 JAGD Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNC(=O)CN2CCCC2=O)cc1C 920826598 PNOYFAPAGHSGBR-HNNXBMFYSA-N 453.521 -1.014 50 20 JAGD O=C(CN(CCO)CCO)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781837119 UJYXKZGLSYGMAB-DENIHFKCSA-N 463.340 -2.220 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1n[nH]c2c1CS(=O)(=O)C2 1795931874 PPQUHHLZQGAJGC-FVCICTRLSA-N 474.304 -1.965 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840897148 NZTJQPNOAIOCMA-IBGZPJMESA-N 487.604 -1.324 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837730701 AGWKESZIQKSDRB-UYVYXKLWSA-N 492.533 -1.272 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)n3[nH]nnc3n2)C1 1777823745 ZSMXVVOIWBOOOV-JLTOFOAXSA-N 475.510 -1.687 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833712955 RPJDELFNVQPUCA-UHFFFAOYSA-N 465.555 -1.517 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1)c1cccc(B(O)O)c1 1834800209 ZVTNDDSVJIONPW-UHFFFAOYSA-N 482.346 -1.133 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1835932232 VEKWXDKLURJPLF-JOCHJYFZSA-N 483.265 -1.068 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nncn3c1)CCO2 1837015321 SHJHICZFDDPUTN-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838501007 BHOICYMFGHCGGT-HSZRJFAPSA-N 493.285 -1.847 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840203120 SIZKDFZWULWCPX-GOSISDBHSA-N 473.213 -1.885 50 20 JAGD O=C(CN1CCN(S(=O)(=O)[C@@H]2CCS(=O)(=O)C2)CC1)NNC(=O)c1ccc(F)cc1 1117993838 DNBHOVSOYUXRLL-OAHLLOKOSA-N 462.525 -1.279 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CC2)CC1 1781107481 QOVMHFOSYGAHNT-QFIPXVFZSA-N 456.352 -1.410 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336799 FFBGISFEXQTLJR-OAHLLOKOSA-N 492.388 -1.221 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1830730583 BPKPWHZFFJMPSK-QAPCUYQASA-N 467.972 -1.286 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1835928300 JALNDXDLDJPLJY-HXUWFJFHSA-N 458.236 -2.049 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934430 ZQKFHJJVFGICKB-FOIQADDNSA-N 468.337 -1.883 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)C(=O)O)CCO2)C1 1839704498 RKYUOOOQVOHJIY-MEDUHNTESA-N 450.286 -1.231 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840183804 BFWANKSEQJYYDR-NRFANRHFSA-N 462.312 -2.191 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1840185406 QGEHMUAZVWNWQB-NRFANRHFSA-N 464.523 -1.056 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1779030766 HSWBQPWAGFNJJW-FQEVSTJZSA-N 467.446 -1.827 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797789638 WAHFXHQOLMXGNS-LTCOOKNTSA-N 477.474 -1.617 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807190388 FLMJMLWBDYGVOQ-YVWKXTFCSA-N 453.308 -1.326 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1835931075 FFECOIASAYTGGA-SFHVURJKSA-N 483.212 -1.113 50 20 JAGD CC(C)n1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n1 1835936809 FCPVRWVYHMDELQ-NRFANRHFSA-N 457.296 -1.077 50 20 JAGD COC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461020 MQAVDDTZZLPGOF-LJQANCHMSA-N 450.452 -1.889 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837673548 GAIIETDHZZGGMQ-ZHRRBRCNSA-N 461.324 -1.259 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840370992 IFWHWCKECFJJAX-NFBKMPQASA-N 499.333 -2.093 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840548958 MDPOIVKVSIVGLE-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)C(=O)C(=O)O)C1 1781542855 YUGDRDDRQOIFLI-JLTOFOAXSA-N 455.512 -1.584 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)C=CC1=O 1793613821 YGVKPMKLQMWYLT-DBWKPXFBSA-N 456.459 -1.797 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)CN)C2)C1 1832549555 UXMLHNPNQNVKFI-CKFHNAJUSA-N 463.963 -1.139 50 20 JAGD O=C(NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccc[nH]1 1832875747 MSNLVJXHAQLMRS-QHCPKHFHSA-N 484.318 -1.415 50 20 JAGD N=C(N)SCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835651616 AHVHBODGGJOXNC-IBGZPJMESA-N 465.536 -1.228 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077799 VQNVKTMWMUGZSG-UHFFFAOYSA-N 466.539 -1.090 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460674 JAWZLVFGIBRBSJ-LEWJYISDSA-N 479.490 -1.629 50 20 JAGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840077977 WUCLXOMIAQCPKV-QFIPXVFZSA-N 488.582 -1.115 50 20 JAGD N=C1NCCN1CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800919 ATUXFKJMYLMZNP-UHFFFAOYSA-N 456.356 -1.608 50 20 JAGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cnnn1 1834801484 ODUJBNYHKJHSSN-OAHLLOKOSA-N 455.328 -1.201 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCC(=O)O)C2)C1 1837460635 IFUIGMBONWFXDQ-LJQANCHMSA-N 467.504 -1.427 50 20 JAGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198810 BSKNKJGNZJLBMF-IAQYHMDHSA-N 474.247 -1.427 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787503835 HJAGZCJRJXTAAA-WDSOQIARSA-N 479.364 -1.615 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737415 FKKGCMVKDOTAIL-UKBAYJJMSA-N 490.366 -1.188 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832486888 AJMGERNFFMTUCW-HOCLYGCPSA-N 486.360 -1.136 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1835938081 JFIJWOJYBJFSTH-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836768279 ATJVWHIIBVKTSF-YLJYHZDGSA-N 460.959 -1.139 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COc1ccc(O)nn1)CCO2 1839670369 FFZJWPAPEXPTPG-FQEVSTJZSA-N 466.495 -1.610 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 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CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934442 SMMYWWACFZHGCD-NFBKMPQASA-N 499.333 -2.093 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837644935 YSBCYANTUTXQHQ-VFNWGFHPSA-N 472.506 -1.317 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)N1 1839198930 OZCPFORJASWCQZ-ZSGNIPIJSA-N 451.249 -1.269 50 20 JAGD Cc1cn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(=O)nc1O 1795741169 MIMWLIBLUZIDMN-JLVBRIDZSA-N 456.264 -2.159 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1806699928 XFTDEGCTYIDRPB-UHFFFAOYSA-N 477.392 -1.058 50 20 JAGD CN1N=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CCC1=O 1835927871 ZEIQSUFXYSWWDP-NRFANRHFSA-N 458.280 -1.955 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837498014 OYLGVWGUWYOQDI-DENIHFKCSA-N 492.290 -2.069 50 20 JAGD CNC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054176 KGYGROJHJADKRO-HSZRJFAPSA-N 490.561 -1.075 50 20 JAGD O=C(COc1cccnn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840409324 XCXBFVPABGGJIF-NRFANRHFSA-N 456.264 -1.695 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800282745 QZBJYJWJEFBIPB-CCWDJLKJSA-N 470.247 -1.660 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1810304014 ZWJWYNWFBUFNEO-FNHZYXHNSA-N 468.518 -1.008 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCNC3=N)CCO2)C1 1835634939 WKZODNRNPAODET-JAMLUQCHSA-N 474.522 -1.583 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1835738247 OZUSAZNNBZWWIX-UHFFFAOYSA-N 491.593 -1.843 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934053 LLVQMHMNPCULHT-DYRFGFBLSA-N 457.292 -1.705 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836396427 RGNHNGRQZJJYLU-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD Cc1nc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1C 728344760 OGSMZJQAJVFAQW-AWEZNQCLSA-N 467.460 -1.463 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979925 PSZOXJMEEFWQNK-VDGAXYAQSA-N 452.081 -2.047 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786983675 PJAXQSJMWMAPBW-DKIMLUQUSA-N 450.322 -1.463 50 20 JAGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(=O)nc1O 1792132420 QVKJDOSUMYEBDV-JYJNAYRXSA-N 464.523 -1.390 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1840186066 YSFQRRUUKMEOFT-HXUWFJFHSA-N 451.480 -2.259 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495815 OBSWCQXMJLNXNO-VCQFHVMDSA-N 474.348 -1.238 50 20 JAGD O=C1CN(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C(=O)N1 1815337287 QWUWBDUNNBUGBU-LBPRGKRZSA-N 457.277 -1.400 50 20 JAGD O=C1CN(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C(=O)N1 1833711131 AIYYEBOVGNREOC-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919400 MSQBZCYBTWXFSK-UHFFFAOYSA-N 480.135 -1.028 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832201855 MPKGUDYNCRKWGX-QHCPKHFHSA-N 479.302 -1.119 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)N1 1832693722 LDCUXALKZIVRFV-QRWLVFNGSA-N 460.252 -2.966 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832795642 BCZSHHGYTUTQOK-HXUWFJFHSA-N 473.251 -1.759 50 20 JAGD CN(C)c1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)o1 1835929279 IUFCEOIDVLDYQQ-OAQYLSRUSA-N 458.280 -1.196 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1835930229 DEHIMOXLMRQOPY-JOCHJYFZSA-N 460.340 -2.316 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985027 LLSDLESVXWLZNJ-PCODUJHASA-N 477.323 -1.197 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1797749775 RIGYBHRTDREPSM-DPIQGUFMSA-N 468.474 -1.858 50 20 JAGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1833432048 NMNDYKXAZVWQRN-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839918224 NXRSZFJIOFMKGR-ZRZWOPFXSA-N 494.549 -2.137 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840431090 VRWUOQYILBUMOK-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(=O)nc1O 1840808551 CYTZHJFSMDEOLQ-OAQYLSRUSA-N 480.522 -1.913 50 20 JAGD Cn1nc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O 749354989 ZJPJOCLYOPLIMJ-UHFFFAOYSA-N 451.509 -1.545 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)n(C)c1=O 1794250314 VLCAKJMHNDBTOK-BJWYYQGGSA-N 494.317 -1.935 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796440906 XVAZLWYNYRILPU-CCWDJLKJSA-N 459.569 -1.625 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ncn3)CCO2)C1 1831737323 YULCJNDDHHDINP-FQEVSTJZSA-N 457.447 -1.436 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837211170 JCTOTZUBZNTBKC-APWZRJJASA-N 459.500 -2.120 50 20 JAGD CN1CCN(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)CC1 725874060 VNDYOSNSOWCREL-UHFFFAOYSA-N 473.581 -1.672 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccncc3=O)[C@H]2C1 1790581449 JJXJZZBGJYWRKO-JQFCIGGWSA-N 455.475 -1.465 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829757057 COQMIKINHMEWGS-IBGZPJMESA-N 476.519 -1.038 50 20 JAGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)O 1834801124 QLTZNHUTKMSKRV-LJQANCHMSA-N 460.340 -1.386 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031610 BUZNQINIHXTBRM-BEFAXECRSA-N 450.452 -1.807 50 20 JAGD Cn1nc2c(c1C(=O)N1CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CCC2 1835932331 ZSFSTDAAVQAHHI-QHCPKHFHSA-N 468.319 -1.028 50 20 JAGD Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)nn1C 1835934272 SCQMBRIICZANEY-QFIPXVFZSA-N 456.308 -1.279 50 20 JAGD O=C(CCN1CCOC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937169 QSCHAPNUSJVMFD-OAQYLSRUSA-N 461.280 -1.721 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837498016 OYLGVWGUWYOQDI-SIKLNZKXSA-N 492.290 -2.069 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837797206 XXNFCHXRZLSQJF-LJQANCHMSA-N 474.434 -1.300 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21)c1cccc(B(O)O)c1 1786984573 OZQRLXBNPZNRJT-WBAXXEDZSA-N 457.252 -1.235 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nn1C 1840185875 URAWMKAEEOKHNP-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)CC1 920827877 YYYXCFPOINMENU-UHFFFAOYSA-N 451.505 -1.077 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1782209094 KPWNAAOBXVYZOP-DYESRHJHSA-N 487.623 -1.396 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783992032 MSQJOIIPHWYFQC-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD CNc1nsnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456958 UHXQMEURYQXUOU-LJQANCHMSA-N 476.519 -1.038 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837205415 ZAIHCNLHUITKJK-UZLBHIALSA-N 465.268 -2.499 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458944 GBQCYXLPXVSZMS-OXQOHEQNSA-N 480.478 -2.180 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837501989 GGUASEVCKSOTNR-DYESRHJHSA-N 486.522 -1.689 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1CCN(C)CC1 1839101970 VDEOGCZUUHYFIJ-JPYJTQIMSA-N 474.367 -1.928 50 20 JAGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)C(=O)O)C2)C1 1840035159 IDYSGCAZYYEMGP-BDJLRTHQSA-N 450.286 -1.231 50 20 JAGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840184725 CHXSJGHSGOACEL-JOCHJYFZSA-N 488.582 -1.115 50 20 JAGD NC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840646458 IOVKFPYNQIZDQD-HSZRJFAPSA-N 467.287 -1.151 50 20 JAGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)CCN1 906496705 CUIFZRPBUGDYHP-UHFFFAOYSA-N 470.471 -1.142 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2n(n1)CCCNC2=O 1788257304 NALLBBZXPGTNAR-KNBMTAEXSA-N 481.318 -1.397 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)CC1 1797750758 PIVZSLVCFHLNRH-JLVBRIDZSA-N 494.574 -1.440 50 20 JAGD O=C1CN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)C(=O)N1 1815665921 KRXHOCBVLVLAHO-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831458972 VIXPHSREOHWRSW-VLIAUNLRSA-N 483.547 -1.564 50 20 JAGD O=C1CN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C(=O)N1 1832480677 UDSYKNQTKWPASL-SWLSCSKDSA-N 451.249 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834734971 MECWHYIEAONPAX-GOSISDBHSA-N 474.566 -1.537 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836968084 AFPOOMOHHSLAJX-QFIPXVFZSA-N 470.291 -1.271 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCNC(=O)C1)CCO2 1840230442 LASRWRAUECDOEF-SPLOXXLWSA-N 460.491 -1.719 50 20 JAGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1 1788247420 YDDKYAFZPVLFKN-VDGAXYAQSA-N 487.561 -1.558 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)N1CCN(C)CC1 1789801616 OIFZXMSVKICHPM-XWSJACJDSA-N 452.600 -1.025 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831692009 AWODSRSVAXWYFV-JOCHJYFZSA-N 476.534 -1.083 50 20 JAGD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1CCCC1 1832420164 OCMLMGJIFXAQCS-HSZRJFAPSA-N 473.335 -1.161 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934417 RULCBTSDBYAHAW-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccc[nH]1 1835935301 NMHBUBMIGCQVDB-HSZRJFAPSA-N 484.318 -1.415 50 20 JAGD O=C(Cn1ccccc1=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835996029 YFTCOUPKWVRHAQ-QFIPXVFZSA-N 455.276 -1.702 50 20 JAGD CC(=O)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n[nH]1 1837456464 IGJRZQYBSVFHEN-OAQYLSRUSA-N 471.474 -1.005 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460281 ZHYICSFFMKTFPZ-JOCHJYFZSA-N 470.486 -1.232 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839174467 FCZXVFNQBMWVOP-QFIPXVFZSA-N 460.292 -1.054 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199797 VANPAJJDPLAOGY-DGCLKSJQSA-N 462.209 -1.142 50 20 JAGD O=C(NNC(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1)c1ccc(-n2cnnn2)cc1 913462906 HEPUDKRXPWYFHX-UHFFFAOYSA-N 465.496 -1.789 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ncccn2n1 1796957131 ZCJNMHLLYKAJLX-JJLQDPRZSA-N 451.447 -1.360 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360525 BECOGZCGPGRXQN-DNVCBOLYSA-N 488.273 -1.479 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807946608 AWLUNOADRLOKCN-DNVCBOLYSA-N 488.273 -1.479 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460320 BESKVHFWMUUACF-OXQOHEQNSA-N 467.548 -1.131 50 20 JAGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1837711820 RMMOGOPHBYEUPT-SFHVURJKSA-N 465.543 -1.266 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840182501 KCTBZYMBVLPDAB-QFIPXVFZSA-N 478.550 -1.036 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840192765 BKBUPPHNYVJNAO-IBGZPJMESA-N 467.504 -1.427 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978736 OYMDJPMPBWACOE-IKICRFKJSA-N 467.353 -1.713 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797786553 UGOIMTKLFFJSEE-UKBAYJJMSA-N 462.264 -1.936 50 20 JAGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800848226 YUFVWMXPXCPAQT-DFGXFYAUSA-N 452.932 -1.128 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CC(=O)NC3=O)C2)C1 1840182652 PDGDSSULLKSRQQ-IBGZPJMESA-N 454.484 -2.632 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCNC(=O)C1)CCO2 1840230440 LASRWRAUECDOEF-LHSJRXKWSA-N 460.491 -1.719 50 20 JAGD NC(=O)c1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789091160 PKFJJTBJYPPDHD-BPUTZDHNSA-N 453.264 -1.838 50 20 JAGD 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](O)CCl)C2 1802148066 PIIMBXJXHZJCQE-KBRXKUPHSA-N 462.931 -1.056 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737150 BJKSNGJABXVWAS-MEDUHNTESA-N 451.954 -1.097 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1=NN(C)C(=O)CC1)CCO2 1832380923 SMTMFGHZMXMGCT-FQEVSTJZSA-N 452.512 -1.576 50 20 JAGD Cc1nn(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1F 1835935002 BRFQYDZNPRFRKI-OAQYLSRUSA-N 460.271 -1.069 50 20 JAGD CCOc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn1 1835935435 STECZELXXANTSP-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1839077495 GMPRUEYNIPTWDT-AAXZGAIASA-N 462.507 -1.700 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1848150115 HJGABYLPJBIQIS-KBPBESRZSA-N 474.522 -1.992 50 20 JAGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)nc1 1794426467 DKTTXPUVHVKZHP-CCWDJLKJSA-N 473.316 -1.318 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831458964 VIXPHSREOHWRSW-JLTOFOAXSA-N 483.547 -1.564 50 20 JAGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cnnn1 1834800272 BZRUYLONBAMOFK-OAHLLOKOSA-N 455.328 -1.201 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1835925457 DXCDNNXXTUGDMH-SGTLLEGYSA-N 454.871 -1.259 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183640 QVXDKGJTICXFHX-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788639235 ZFRMVZJCCSIUEY-LEAZDLGRSA-N 476.291 -1.546 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2 1835560673 QEZMSYZLKKUASR-YWZLYKJASA-N 463.495 -2.652 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927679 WQGZJFGGHKBYLT-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939639 CMCFWRXFLNZZAC-JOCHJYFZSA-N 477.323 -1.039 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783992919 XAZLXOAUZKFFMC-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD COC(=O)CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784513332 CXFSBZDSZDPCED-XIRDDKMYSA-N 450.322 -1.134 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1792887635 LDFIXTCMXPQXJS-RMHZUWNSSA-N 492.533 -1.226 50 20 JAGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cn2[nH]cnc(=O)c12 1795734962 BLVZFMSYUBBTEQ-JLVBRIDZSA-N 465.275 -1.472 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(=O)n2[nH]cnc2n1 1834795118 CGVIIOKSCYPUAJ-UHFFFAOYSA-N 493.333 -1.404 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839682670 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CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012373 WJMACOSNKFCKPF-DOHHPOSVSA-N 463.539 -1.581 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833762566 DTNBIQIUTWEAOD-KRWDZBQOSA-N 486.533 -1.532 50 20 JAGD N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccn1 1835700962 XLFGDQWMGXCXSP-KNQAVFIVSA-N 454.292 -1.469 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927159 JFWPWBLMCWJTHL-QRWLVFNGSA-N 483.352 -2.236 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939954 QBYUJEVVNKJWRT-VFNWGFHPSA-N 464.280 -1.002 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1840033586 KGMOOHZDRRQLLK-YSVLISHTSA-N 450.330 -1.123 50 20 JAGD O=C(CCc1cnccn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934518 WTUYUNCNLSBAJJ-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)s1 1835935751 PKGGLXLXLNGZAC-FQEVSTJZSA-N 460.321 -1.161 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837731967 PCNHOKJDLSDCSW-DYESRHJHSA-N 478.506 -2.094 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837794195 JVYGMXBLHCVBML-LJQANCHMSA-N 459.224 -1.619 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1nc2ncccn2n1 1787936773 HUFCDBBAXPWFCY-XIRDDKMYSA-N 450.264 -1.289 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(=O)n2[nH]cnc2n1 1795728727 ZUMDNEPNQAKIIH-FVCICTRLSA-N 452.236 -2.386 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2 1835560672 QEZMSYZLKKUASR-MGPUTAFESA-N 463.495 -2.652 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935362 CAQYUFDUEAETKM-HXUWFJFHSA-N 462.699 -1.014 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836472557 LZTLHUHIFIBALK-CKFHNAJUSA-N 465.931 -1.072 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1837455964 AFCHSPUFFNZXGI-QHCPKHFHSA-N 497.512 -1.420 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)no1 1837549915 CYBDVJLQHIHXAZ-NRFANRHFSA-N 480.522 -1.458 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(=O)n2[nH]nnc2n1 1834972835 CXOIUSNDWGMUAY-UHFFFAOYSA-N 494.321 -2.009 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1835928299 JALNDXDLDJPLJY-FQEVSTJZSA-N 458.236 -2.049 50 20 JAGD O=C(CCN1CCOC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930607 PNAGFQVALBWDOH-OAQYLSRUSA-N 461.280 -1.721 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932157 QQILMTUQMSGDJI-VGSWGCGISA-N 493.322 -1.721 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1835938194 PRHOKOVTSICVEL-QHCPKHFHSA-N 484.318 -1.011 50 20 JAGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)CN)CCO2 1836491038 ZDOKIAJRMFGVTE-OXJNMPFZSA-N 465.463 -1.124 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCNC(=O)C3)C2)C1 1837461256 RKFAAYPANLZUNC-SZNDQCEHSA-N 460.491 -1.719 50 20 JAGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H](O)N1CCOCC1 1779413568 QIBBQAMDRJBCCC-STZQEDGTSA-N 461.324 -1.856 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1791289025 CBWNDRRCECIZCW-YDHLFZDLSA-N 460.495 -1.616 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)no1 1837547117 PVDFRMCTLXTIOW-JOCHJYFZSA-N 486.290 -1.837 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726637 SBWOYEWOTIICOI-RHSMWYFYSA-N 453.945 -2.227 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)n(C)c1=O 1832755310 JZRJWOPDCOXCNL-XCLFUZPHSA-N 498.924 -2.510 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1835938582 ZUISCCIKFPVLCA-LJQANCHMSA-N 459.224 -1.619 50 20 JAGD COCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457952 YFCYROKFAIPANX-FQEVSTJZSA-N 451.480 -1.582 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1837459561 KDHIPNBJDPYCLU-GAJHUEQPSA-N 489.577 -1.609 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840183276 WXLBJMLZDVVQTC-JEUZPXFCSA-N 451.524 -1.326 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785541723 ZWVBYHPPANXEAJ-IBGZPJMESA-N 478.556 -1.011 50 20 JAGD CCC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831185758 UFIFBSKARHATOD-QKKBWIMNSA-N 462.507 -1.330 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930320 GMUWCINOZXNWKR-PKHCJMHPSA-N 452.338 -1.405 50 20 JAGD Cc1nnc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)o1 1837457949 XWLBZCHXEPCGBI-HXUWFJFHSA-N 459.463 -1.311 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CC1 1837460001 YKFJFYBJSOTBEX-QFIPXVFZSA-N 475.550 -1.998 50 20 JAGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)(C1)C2 1840005175 KBLBBKAYLRRVRO-XPPIMPSXSA-N 472.303 -1.220 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840548824 CPXTUGWPMZBWGB-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1835541637 BFDXNFNJHNXNGQ-FZMZJTMJSA-N 458.246 -1.049 50 20 JAGD C=CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837698261 AXGVMXBVWAPABL-SPLOXXLWSA-N 460.491 -1.554 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)C(=O)O)C2)C1 1840185928 UDXCHQBLYNXRJU-IBGZPJMESA-N 457.484 -2.641 50 20 JAGD COC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840320145 CIAPKDUXPSWQRZ-LJQANCHMSA-N 450.452 -1.889 50 20 JAGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c(C)n2n1 1795734665 XTAIUPAFNPOZHG-CWPLJXCYSA-N 464.291 -1.062 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(=O)cn3)C2)C1 1837459499 GEFFNHUIGVVBIB-FQEVSTJZSA-N 457.447 -1.848 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739989 ZMTQIITXDUCNDK-YNVMFWSZSA-N 491.350 -1.155 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1810302103 FUGIOOJVNLKNLP-UCLAIMLFSA-N 468.518 -1.008 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833196766 LOESDTOHXIVUKE-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)C(=O)N1 1835927562 STIVLDXEQBKMLB-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1836888443 OHILIKHVLZGTQP-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CNC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054177 KGYGROJHJADKRO-QHCPKHFHSA-N 490.561 -1.075 50 20 JAGD Cc1cn(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(=O)nc1O 1785351251 VALMYMVJQMIAQL-NRFANRHFSA-N 471.474 -1.600 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787496832 WVBWVEUPZQKZED-DIMBHLCBSA-N 474.348 -1.238 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)N1 1792984214 WGJRKRLTCXJDBU-GNIPQWQFSA-N 474.967 -1.644 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n(C)n1 1833448152 DMATUXXHIJLKDX-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1834822464 OTDINJZFULOUNN-MRXNPFEDSA-N 470.284 -1.332 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1835932189 SKIJKYLSQVZMLI-QFIPXVFZSA-N 470.291 -1.271 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)CC2)CC1 1840184821 CPYGQMYPIAYARD-JOCHJYFZSA-N 480.610 -1.404 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840199413 ZLRONGIXKVGDHS-OXQOHEQNSA-N 467.548 -1.131 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371760 ZOVNBJALUZPMOT-KPFFTGBYSA-N 453.308 -1.326 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731179 HNKCSRAXCOFSBQ-IFXJQAMLSA-N 451.867 -1.241 50 20 JAGD CS(=O)(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835256237 CZLFJRBCSGSQPO-GOSISDBHSA-N 455.493 -2.200 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1835935506 IBROYSHWNOSVRD-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938212 QKHAIKPCMOCAGC-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cnnn1 1837460519 GYWDGVJQXNMVBX-YJYMSZOUSA-N 459.467 -1.997 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838503540 ZKPQFCXVKPJGML-JOCHJYFZSA-N 487.517 -1.468 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839350281 UGGMHASVIHPUKM-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21)c1cccc(B(O)O)c1 1786984910 XUFNDQNTLUPUTL-IEZWGBDMSA-N 477.286 -1.324 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1810294414 KIHLBOYTWCOQNJ-KUHUBIRLSA-N 480.485 -1.049 50 20 JAGD CCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831185760 UFIFBSKARHATOD-SPLOXXLWSA-N 462.507 -1.330 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834673645 GHQGXQHETPSJRV-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1835922755 HELINCPNYHQMCL-NRFANRHFSA-N 482.262 -2.519 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1835922778 HYIYKDQJPFNCTH-OAQYLSRUSA-N 482.262 -2.519 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930743 XJCWHSGDBRVKPI-ZHRRBRCNSA-N 461.324 -1.259 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939245 IOMHXAAOAMJJHY-JOCHJYFZSA-N 470.291 -1.435 50 20 JAGD COC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779553150 AEYYLTURYUPSEU-NJNPRVFISA-N 476.534 -1.036 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751567 HVSGTGXJXSKBBS-KOZDUTSQSA-N 450.452 -2.047 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367255 KBLQLKBKXWFSRN-UGKGYDQZSA-N 470.335 -1.632 50 20 JAGD CCC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455658 CEFHMQGKBNCHNB-QKKBWIMNSA-N 462.507 -1.330 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838531525 OXYYBVXELBBOKN-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD COC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1840320276 CFDDTXGFMBYZEJ-BTVXTAIASA-N 464.479 -1.067 50 20 JAGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835936896 IHEQDGGRTOFXKQ-HSZRJFAPSA-N 483.286 -1.068 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1C 1835938541 XRHXLKXULSEMKS-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837205412 ZAIHCNLHUITKJK-JXFKEZNVSA-N 465.268 -2.499 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837206695 OVVHRHFWVVAHGY-NXUSNIPQSA-N 494.505 -1.359 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1778353703 FHZTYZSKPNMYLY-QFIPXVFZSA-N 458.324 -2.026 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801154 NWRLDUSLDIIABE-UHFFFAOYSA-N 494.361 -1.136 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932177 ROGQWOXZRUXBSH-OAQYLSRUSA-N 465.312 -3.277 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CC2)CC1 1835939140 GKVPXHNGJIZVEH-QHCPKHFHSA-N 486.378 -1.784 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1836765070 OWWCOOPSNIGYLB-HSZRJFAPSA-N 488.350 -2.400 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)no1 1837546880 CPJMDZHKNRHJGW-QFIPXVFZSA-N 486.290 -1.837 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)C2 1779373434 RISPWXGYOXBEKV-GCKMJXCFSA-N 461.523 -1.595 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979958 UFBUSMLUFMLBTQ-QRTARXTBSA-N 466.263 -1.996 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(CCO)CCO)C[C@@H]21 1788609842 MQHCBEIWQZKAJO-WBAXXEDZSA-N 464.523 -2.435 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793086325 ZZPITQIKKOKRSN-UKBAYJJMSA-N 491.350 -1.155 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456867 RDOARHXDVSGHKH-LJBSOROUSA-N 472.502 -1.387 50 20 JAGD CC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054284 RBCKEKKQXVVXOQ-HSZRJFAPSA-N 490.561 -1.075 50 20 JAGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783664227 AOSHREOHKCIQDT-JOCHJYFZSA-N 464.324 -1.120 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364261 PNOBFSAYQCETTC-XKGZKEIXSA-N 453.308 -1.326 50 20 JAGD CNc1nsnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926558 RVBPDGXNNRTJCZ-IBGZPJMESA-N 461.309 -1.357 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940130 VKQJXHVUBYTNLM-IBGZPJMESA-N 461.309 -1.653 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H](N)C(N)=O)C[C@@H]21 1787508572 BJEPUHUKGLDCSQ-CGEVSQDCSA-N 461.523 -1.307 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1810305863 OYZHFOJXVBRWJT-UTKZUKDTSA-N 485.545 -1.314 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839372358 VSCRQQHJXGTGGV-JOCHJYFZSA-N 472.259 -1.133 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)[C@H]1SC(=N)NC1=O 1783934259 CXKRYGPPYKWGQL-IOHHAYIISA-N 454.553 -1.008 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738886 JGYDYRMKSQIAQP-NBMJBFSESA-N 462.264 -1.936 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728395 SUPUATCXOOQEON-RHSMWYFYSA-N 453.945 -1.532 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833197038 PBBRVCMGEASNBL-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2 1835701684 NHSKHBDBULGKIR-PGRDOPGGSA-N 469.502 -1.150 50 20 JAGD CN1CCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2C1 1835932178 SBWGYOQPJGLKCT-DEOSSOPVSA-N 497.361 -1.218 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1835939270 JPTKLSPQOVUXFT-FPGHNAPASA-N 485.346 -1.163 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837480157 GVLCZQFTZXDTLS-KSFYIVLOSA-N 469.307 -1.273 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779404489 SHCUWGXCXXQKCK-TXTKFYIRSA-N 490.318 -1.011 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)n(C)c1=O 1792974732 AERBOLJLMKYYSM-OPDFLTKYSA-N 468.898 -2.377 50 20 JAGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1802333631 YRXCPMKBLRIWPW-QDMKHBRRSA-N 488.549 -1.555 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837673899 QOENVFYKZISJBU-OPAMFIHVSA-N 461.324 -1.259 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779032366 OPYZNNSFNRKWGN-JOCHJYFZSA-N 473.534 -1.707 50 20 JAGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)C(=O)O 1812390198 RXRIYYVCXZLGKA-APWZRJJASA-N 468.275 -1.376 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839987742 UCOXMHQOEOJLDB-QFIPXVFZSA-N 477.323 -1.039 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)n(C)c1=O 1793981218 WLMAVCXNONRDDR-OPDFLTKYSA-N 468.898 -2.377 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)no1 1795734104 CPKKSNHIAXWVJJ-CCWDJLKJSA-N 456.264 -1.704 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1801285505 FDOOGGCXJZAVJA-WOUAJJJCSA-N 469.307 -1.960 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831330967 ZEETWUYSMCGRCO-DNVCBOLYSA-N 477.584 -1.856 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1=O 1831888009 OELZJBOMUZWBFS-JOCHJYFZSA-N 470.486 -1.232 50 20 JAGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(=O)O 1834737102 AQHKEKNJKNXIAU-LJQANCHMSA-N 460.340 -1.386 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939799 IQOCFBIVZMMMCM-NRFANRHFSA-N 465.312 -3.277 50 20 JAGD Cc1cn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(=O)nc1O 1835941825 QRNXTPJXLAZFMJ-QFIPXVFZSA-N 486.290 -2.293 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN(CCO)CCO)CC2)CC1 1836535810 KKSDQCRADKUZPZ-UHFFFAOYSA-N 470.615 -1.782 50 20 JAGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198812 BSKNKJGNZJLBMF-XHDPSFHLSA-N 474.247 -1.427 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839624082 RFMGKSXAYRHOQV-JOCHJYFZSA-N 483.265 -1.068 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692581 GOVUQXNDMDRVOC-RUZDIDTESA-N 494.357 -1.167 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1779028058 BEXAFRQCWPZTEL-NRFANRHFSA-N 453.459 -1.064 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779416912 DTDQLZMZNKHWCZ-TYCQWZJGSA-N 455.556 -1.476 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1797753954 LXTMXQSEEZNPRK-IVWMJMPLSA-N 485.457 -1.342 50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)C(=O)O 1807366707 NVNIWXJUNYKSSI-VQIMIIECSA-N 468.275 -1.376 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)CN)C2)C1)NC(=O)NCc1ccccc1 1839054338 UTTYSHQIRCRFAH-AVRDEDQJSA-N 477.566 -1.925 50 20 JAGD O=C1CCCCN1CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840104142 HFJYRXNMXIQRPY-JOCHJYFZSA-N 459.308 -1.551 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NCC(N)=O)c(=O)n2Cc1ccccc1 727067917 UPVBDFVUAMMHCN-UHFFFAOYSA-N 488.530 -1.965 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779198785 JIQXQXAJDGJXOP-HGHGUNKESA-N 463.296 -1.442 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)N1 1807362560 LEEGRRMEWHKDKT-IEZWGBDMSA-N 465.275 -1.321 50 20 JAGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(C)(C)C 1835933900 GHPAHVXDFLCWJD-CVDCTZTESA-N 475.351 -1.013 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456890 RUXFRRQTROZGTG-IBGZPJMESA-N 469.520 -1.810 50 20 JAGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNCP(=O)(O)O)C2)C1 1840032369 WSASREOYBWQVNY-BXUZGUMPSA-N 458.246 -1.049 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CCc2nc(O)nc(O)c2C1 1794110470 ZDBUAEWXCRMLJW-BKEDOTJMSA-N 482.302 -1.424 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798266 AJIFDHVOEUHFAG-UHFFFAOYSA-N 453.308 -1.051 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1835541640 BFDXNFNJHNXNGQ-RISCZKNCSA-N 458.246 -1.049 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930681 UHUOHBPNTZYDIE-IERDGZPVSA-N 457.296 -1.636 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc21 1836779833 ZGQUJQFYRQURHC-HSZRJFAPSA-N 497.317 -1.920 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1CCCCC1=O)CCO2 1840107702 ZDNUMLBCQVHSAA-NRFANRHFSA-N 453.540 -1.172 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1779031653 CPDCUWWCLCVBNF-NRFANRHFSA-N 471.474 -1.145 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1810302099 FUGIOOJVNLKNLP-FNHZYXHNSA-N 468.518 -1.008 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CNC1=O)CC2 1826082704 BDBHDAVYRYWNLX-JTQLQIEISA-N 451.509 -1.020 50 20 JAGD Cn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1833407439 LJNFNAHGGDPPMQ-HXUWFJFHSA-N 459.463 -1.492 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938544 XRQXWWWJKRRVTP-KSFYIVLOSA-N 469.307 -1.273 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1779028053 AFLNXXOTJMKHMU-HXUWFJFHSA-N 455.431 -1.069 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1833311288 OCYPXDOMZZZSLD-JOCHJYFZSA-N 483.485 -1.437 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1835931306 MLJPPMFZJJPODD-WXVUKLJWSA-N 485.346 -1.163 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933768 CLOIYBQHTNXRTA-HSZRJFAPSA-N 479.302 -1.119 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198636 LYJGNTIWXJQAFV-GDBMZVCRSA-N 486.360 -1.136 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1779028686 NTNQXXPLPJOPAS-HXUWFJFHSA-N 480.547 -2.141 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980072 GCXXHHIJOXWNPG-IKICRFKJSA-N 452.338 -1.360 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)C2 1798439112 DGPBLERWSGSFNI-ZSBIGDGJSA-N 451.447 -1.018 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)c1cccc(B(O)O)c1 1817475462 RPAYUUPTXYKUQA-HNNXBMFYSA-N 477.250 -1.165 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1C 1835931308 MLMRRXZCXRWGSW-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939803 IYQCACHRPVWSBC-JOCHJYFZSA-N 455.276 -1.342 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)N1 1837115049 BREXRIVCWGONOQ-GOSISDBHSA-N 472.307 -1.423 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=NNC(=O)C3)CCO2)C1 1837361367 RKBRISINEPCRIX-BOURKTIISA-N 459.463 -1.547 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1C 1838833511 YWVIXMHKTZRZDY-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD C[C@H](NC=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839163999 UDYYPONOHCLZEQ-MBSDFSHPSA-N 490.561 -1.077 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1840183430 DZNYMVOGATXBRX-FQEVSTJZSA-N 451.480 -1.471 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CC1 1778355196 VDWWUPTZVSPRNT-JOCHJYFZSA-N 473.534 -1.707 50 20 JAGD CN1CCN(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)CC1 1791289024 BYFAOGRLJKKZAG-FHWLQOOXSA-N 452.600 -1.023 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798500221 KAEDKOXBDKZFGP-VTEUUUEMSA-N 457.491 -1.334 50 20 JAGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)n3[nH]nnc3n1)CCO2 1836402749 DBWHQKLPMBSEEU-INIZCTEOSA-N 470.284 -1.332 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183076 ZYYQWCHQUKPYIK-BEFAXECRSA-N 462.569 -1.504 50 20 JAGD Cc1cn(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(=O)nc1O 1840187229 OBQSHCAQZVAYNH-NRFANRHFSA-N 480.522 -1.913 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCNC3=O)C2)c1ccc(B(O)O)cc1 1795732445 GSIFLSBGEGFSKN-ZSBFGKGUSA-N 453.264 -2.177 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2)c1cccc(B(O)O)c1 1795739786 MGUIBTUJSPGONO-DNMVWIPKSA-N 455.320 -1.029 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1807190738 LIHQLNCVCUOYPS-LJHODMEESA-N 468.518 -1.008 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830737148 BJKSNGJABXVWAS-BZNIZROVSA-N 451.954 -1.097 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1 1835737083 LHIMEENPHGXJRD-KRWDZBQOSA-N 459.507 -1.021 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840895242 LYRAQURDKVKWAC-ZBEGNZNMSA-N 451.954 -1.097 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(CCO)CCO)C2 1778095052 RBVPAIUTWJMIJR-RCBCJABQSA-N 492.577 -1.079 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1)c1ccc(B(O)O)cc1 1834797549 XRXRCLBHZCHLGA-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935932 XNTQWGFMTTXULM-SFHVURJKSA-N 471.212 -2.839 50 20 JAGD COCc1oncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835936814 FHEWGUFILOWDCH-NRFANRHFSA-N 459.264 -1.115 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837794191 JVYGMXBLHCVBML-IBGZPJMESA-N 459.224 -1.619 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779032199 LPGUWCHRQCILJN-NRFANRHFSA-N 494.574 -1.200 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)N1CCN(C)CC1 1789797770 BIKZORNLENVVFF-GIUOSPMZSA-N 458.368 -1.404 50 20 JAGD N=C1NCCN1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807113908 WUUZJXXZLMCNIP-FXAWDEMLSA-N 450.308 -1.079 50 20 JAGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)c1cccc(B(O)O)c1 1819879942 HCCHHZXYDABUIL-AUUYWEPGSA-N 460.321 -1.301 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)C(=O)C(=O)O 1834824541 AVRNKWJKHBIGAR-INIZCTEOSA-N 450.286 -1.229 50 20 JAGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1835512466 KSWFKWJGSPVZEG-UHFFFAOYSA-N 499.421 -1.284 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1835930542 LXTJHLXSZFYETD-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933869 HTVXPHXMUMJZEJ-SFTDATJTSA-N 464.280 -1.948 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1838330889 LVIYNFCKVKLCLG-HXUWFJFHSA-N 463.495 -1.982 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1781853150 AAHRGBOKDGHLII-HRAATJIYSA-N 463.296 -1.347 50 20 JAGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)CC1 1788246135 ZCTNQDSIHUGXLP-JBACZVJFSA-N 472.351 -1.876 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840199414 ZLRONGIXKVGDHS-UZLBHIALSA-N 467.548 -1.131 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cncn1 1840419025 RNPWEBILLJRGJC-JLTOFOAXSA-N 458.479 -1.392 50 20 JAGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931955 IWHOKRDNTJCJOP-VWLOTQADSA-N 494.357 -1.167 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837377927 WLAQJIKONPTTBL-QVKFZJNVSA-N 462.312 -1.856 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cn1 1835929173 FHRGNLWUDLZDCM-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794112868 IBIUGUHZPBMRSL-JWXAPSBJSA-N 497.512 -1.105 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(=O)nc2sccn12 1798413490 HWMFTHVEMGMDAH-ZSBFGKGUSA-N 468.300 -1.047 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(=O)nc2cccnn12 1798497695 OVLMJRYLXMJOIC-YVWYUNDQSA-N 463.259 -1.714 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1836208110 RNMNCNASKTWNRG-KMUCBOENSA-N 458.479 -1.132 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840183968 LNKQXHORHBRZMR-FQEVSTJZSA-N 476.494 -2.139 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[C@H]1SC(=N)NC1=O 1796427884 HGQXBFWGWMSCDL-ZTJZGAFRSA-N 454.553 -1.249 50 20 JAGD O=C1CN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)C(=O)N1 1832480676 UDSYKNQTKWPASL-IUODEOHRSA-N 451.249 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1838327509 SNVCTWGNQLLPCO-OAQYLSRUSA-N 484.473 -2.042 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829000342 HFGHOQDICVQFFZ-XMMPIXPASA-N 497.313 -1.257 50 20 JAGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1cccs1 1835927095 FBGWFVSNXKDIBK-JOCHJYFZSA-N 487.343 -1.072 50 20 JAGD O=C(Cn1ccccc1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928369 MTXZPYCWMFATOP-JOCHJYFZSA-N 455.276 -1.702 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836255864 XYMYZILYEHNVHT-DYVFJYSZSA-N 462.912 -1.492 50 20 JAGD CC(=O)N(C)[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457650 MJQRZMWCPRXAHI-LHSJRXKWSA-N 462.507 -1.378 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)CN)C2)C1)NC(=O)NCc1ccccc1 1839054339 UTTYSHQIRCRFAH-PGRDOPGGSA-N 477.566 -1.925 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830568647 HGLWQHPUXBUZOK-BIENJYKASA-N 465.931 -1.072 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833676798 IOIBNZBJZXPGJO-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836516681 IAKHWCZEHSJCHP-NRFANRHFSA-N 495.363 -2.138 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1837167105 PEXZHADSGNPAGF-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456180 KCQFQGIZTXRFTC-XOBRGWDASA-N 483.547 -1.564 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517209 ORQXFGKVFWZAPE-QFIPXVFZSA-N 470.291 -1.271 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)C(=O)C(=O)O)C2)C1 1782746310 GRFUCZBCDSYNMB-CCULFSDZSA-N 462.463 -1.507 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784440683 DIJMIMKZWADBSF-IKICRFKJSA-N 467.353 -1.713 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCNC(=O)c1ccc[nH]1)CCO2 1832881790 SPDLTUBLGMMJRW-JOCHJYFZSA-N 478.550 -1.036 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2c1CCC2 1835930260 FVMJXLAODLFTQZ-QHCPKHFHSA-N 468.319 -1.028 50 20 JAGD O=C(O)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ncn1 1835935639 WXWUDHXMHCOCLW-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839918830 HYQHYMMNJSUQQB-ZBFHGGJFSA-N 456.309 -1.580 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834800156 UQIPNBFVIUVYKM-UHFFFAOYSA-N 494.321 -2.009 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931380 PPNSYMOMRCABDM-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932082 NCSHGHIMHOQHHF-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)n2[nH]nnc2n1 1796110142 PVGOGXMAKMUHSN-RHWYEIDDSA-N 482.461 -1.850 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796441990 MEQZQCAZGZFTLD-XODPUGQPSA-N 464.479 -1.226 50 20 JAGD CN1N=C(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CCC1=O 1832374918 CULHANLXNZHLGS-NRFANRHFSA-N 458.280 -1.955 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1837919115 GGBKEKICMNRTLQ-HSZRJFAPSA-N 475.351 -1.371 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1840183838 CTVHLFFBYJKKRH-GOSISDBHSA-N 453.456 -1.239 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611621 MUTJNKXJVPYAFN-OQUILHJVSA-N 467.548 -1.041 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1835930181 AKPUEIINMLLECR-NZQNYPKQSA-N 457.336 -1.223 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1837460055 ZYVMQLHVDAHLTO-CTNGQTDRSA-N 478.506 -2.594 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837627289 YCIQWWLKAOTRJO-JOCHJYFZSA-N 468.275 -1.530 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791545251 PHBRZXPWKIQCPH-DVWBAYGPSA-N 483.334 -1.570 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793312563 SUQHEUWBWYCUBD-JJAZEVLHSA-N 453.326 -2.103 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829770574 YXDRTLUCEMQMHY-BNOLWBGWSA-N 472.502 -1.387 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n(C)c1=O 1832755966 UZPUZESRFDXDSC-LIRRHRJNSA-N 486.888 -1.576 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837606486 VHXNWILJNHQGHH-OHNRDTAOSA-N 455.899 -1.349 50 20 JAGD Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1832928249 URZXKYQJELDUIW-HXUWFJFHSA-N 459.463 -1.311 50 20 JAGD N[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccnc1 1835828892 NBHFTFVAQUGTNI-NZQKXSOJSA-N 468.319 -1.079 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835972508 XOINGGWAWCGPFT-FQEVSTJZSA-N 462.699 -1.014 50 20 JAGD Cn1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837461301 TXZLVZLTHUOWLF-OAQYLSRUSA-N 457.491 -1.269 50 20 JAGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837527110 JWBNTOFWQMIWAY-VJIOCRDPSA-N 475.307 -1.035 50 20 JAGD O=C(COc1cccnn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840409099 OXIGPWKKJGCNJI-OAQYLSRUSA-N 456.264 -1.695 50 20 JAGD CN1CCN(C(=O)CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 916433362 LQLNIILOMIWDQF-UHFFFAOYSA-N 482.563 -1.184 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982718 FMBJCICCACGANK-KCMWZYNZSA-N 452.338 -1.360 50 20 JAGD CC(=O)N(C)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1832296327 WMJCKJSOABGKPF-OAQYLSRUSA-N 462.507 -1.377 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CNC3=O)CCO2)C1 1832326395 SYUWPJGMFXLTKB-GQBLCDNYSA-N 489.489 -1.871 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[C@@H]1SC(=N)NC1=O 1835928759 YHAWATPNAOAMRI-PCMMCCAGSA-N 490.347 -1.761 50 20 JAGD CN1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1836672617 RVTPIIAHEGXXOJ-QFIPXVFZSA-N 475.550 -1.998 50 20 JAGD O=C(COC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 753636960 XYADIVRXQVBMIT-WBMJQRKESA-N 494.482 -1.318 50 20 JAGD CN(C)NC(=O)CCC(=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 1801014303 LGZAWKOICXGCJP-YGTYGHESSA-N 498.581 -1.282 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1 1824677478 UBJOHALGDOGFCD-SNVBAGLBSA-N 454.509 -1.029 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833471341 DXTXZJQOFCRCMJ-NRFANRHFSA-N 457.248 -1.851 50 20 JAGD NC(=O)c1nccnc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836048218 KJOUFZCKRZMINP-UHFFFAOYSA-N 480.334 -1.246 50 20 JAGD Cc1nc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1C 728344761 OGSMZJQAJVFAQW-CQSZACIVSA-N 467.460 -1.463 50 20 JAGD CN1CCCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)cc2C1 1795735941 KSXLKLFVGNXPDX-UPHUGPLXSA-N 467.335 -1.085 50 20 JAGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)C(=O)O 1812389617 IYIOLHBPUQMCEY-APWZRJJASA-N 468.275 -1.376 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n1 1835938206 QCAJBVGMMQABTB-XMMPIXPASA-N 498.345 -1.263 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836847107 SDRUHFRRIBJOOM-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1ccnn1 1837459939 OZDVGQPIBMLZQF-XOBRGWDASA-N 458.479 -1.392 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919666 VQWSKLADNMMLOP-RHSMWYFYSA-N 452.346 -1.487 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840184113 SVCKEPYFKVVUOC-JXFKEZNVSA-N 468.580 -1.158 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832201854 MPKGUDYNCRKWGX-HSZRJFAPSA-N 479.302 -1.119 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1835922777 HYIYKDQJPFNCTH-NRFANRHFSA-N 482.262 -2.519 50 20 JAGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930532 LITWGWYGUWRRHK-OPAMFIHVSA-N 469.307 -1.273 50 20 JAGD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935520 IOCIDXQSXVSXPN-OAQYLSRUSA-N 457.248 -1.444 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938158 NNHYQQIBWYYUMI-WIYYLYMNSA-N 463.296 -2.413 50 20 JAGD Cc1noc(N)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457507 GOPCDULVHNWXDZ-HXUWFJFHSA-N 459.463 -1.052 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1837457781 QTIHUKGGJOOYEG-HXUWFJFHSA-N 473.446 -1.730 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)COCCO)C2)C1)NC(=O)NCc1ccccc1 1839054336 UQXIPUJISGUGLL-HSZRJFAPSA-N 493.561 -1.202 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185912 VOIHONWMAXAQEW-OXQOHEQNSA-N 457.528 -2.033 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779525161 HWDHVZRDXFEYJE-FQEVSTJZSA-N 455.431 -1.069 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1781854634 NYCZUWNGTBKGQO-HRAATJIYSA-N 463.296 -1.347 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837385019 MYRJJMTYHGMYNH-YWZLYKJASA-N 456.544 -1.477 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837516982 NHSUHXKPLABNPF-PZJWPPBQSA-N 463.296 -2.913 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(O)O)C2)C1)NC(=O)NCc1ccccc1 1839054329 ULKQCINCRAGUEP-OAQYLSRUSA-N 465.507 -1.900 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840370993 IFWHWCKECFJJAX-OFNKIYASSA-N 499.333 -2.093 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1 1778357776 CTLOIXPBNIPFEU-NRFANRHFSA-N 452.556 -1.647 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796299122 NBJMYFAFTQKEQB-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD COC(=O)CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748519 GDNCHBXBVNXEST-DPIQGUFMSA-N 451.505 -1.206 50 20 JAGD 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QQZIMOPOPFKEOK-PGRDOPGGSA-N 468.599 -1.548 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184977 CXQUXRYZPGKHSM-LAUBAEHRSA-N 486.522 -1.689 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1837461038 MUUJWSFTAQUMOV-LJQANCHMSA-N 476.519 -1.335 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837797205 XXNFCHXRZLSQJF-IBGZPJMESA-N 474.434 -1.300 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839782181 PABQKAZSKYSEDY-YLJYHZDGSA-N 466.321 -1.986 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919668 VQWSKLADNMMLOP-YOEHRIQHSA-N 452.346 -1.487 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1840183958 KBFCVZZQGQWOCX-FQEVSTJZSA-N 451.480 -1.064 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798561 LCFJAHGPFZHVLR-FQEVSTJZSA-N 476.339 -1.384 50 20 JAGD Cn1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835935691 MJCYNYOFKLERLI-JOCHJYFZSA-N 456.308 -1.197 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837385017 MYRJJMTYHGMYNH-MGPUTAFESA-N 456.544 -1.477 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H](N)C(N)=O)C2)C1 1837457890 UWAPFWHVFDDCGF-QRWLVFNGSA-N 463.495 -2.652 50 20 JAGD O=C(O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840191899 AHLVFANOAKZLJI-IBGZPJMESA-N 452.294 -1.746 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840915323 QYUWAOFQPFUAAC-LRDNONRASA-N 492.957 -1.189 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804344788 SFALXXWLSFQYFI-VDZJLULYSA-N 465.275 -1.321 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1837457130 WHODWRYYSMIXFR-OAQYLSRUSA-N 472.458 -1.532 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831322995 HXTYKMVXCQZBBT-MGPUTAFESA-N 483.352 -2.236 50 20 JAGD CC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839860307 NSUNZIMNIAGBBU-QHCPKHFHSA-N 490.561 -1.075 50 20 JAGD O=C(CN(CCO)CCO)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781837015 MUQHHJVVANKJMB-DENIHFKCSA-N 463.340 -2.220 50 20 JAGD Cc1cn(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(=O)nc1O 1785354213 ZAVGSWINKPESLX-NRFANRHFSA-N 456.264 -1.919 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799366144 UZFYMYVXDPBLCY-YNVMFWSZSA-N 491.350 -1.155 50 20 JAGD O=C1CN(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C(=O)N1 1807360473 BUGMPNZXJZUSST-OXJNMPFZSA-N 465.275 -1.367 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1810295985 ZESPXQHHOWSAFE-OWQGQXMQSA-N 480.485 -1.002 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838499079 OYJBDKLASKMJJN-KUHUBIRLSA-N 451.867 -1.241 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 728450234 UFEDOPUJPYGNGV-LLVKDONJSA-N 465.579 -1.037 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1779034064 KXEFHWQWFKSOOF-QGZVFWFLSA-N 458.397 -1.193 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1810295401 SJBRNBIQZRULTA-KUHUBIRLSA-N 480.485 -1.049 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934467 UJFASFRWZSAKMD-QFIPXVFZSA-N 455.276 -1.220 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3NC(=O)NC3=O)C2)C1 1837456520 JOJMUFXXKCCKJD-VLIAUNLRSA-N 475.462 -2.647 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc[n+]([O-])cc3)CCO2)C1 1838336617 JHUDHCAOVOJBNL-OAQYLSRUSA-N 456.459 -1.298 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1840153212 HNYKWNMGPZRGFC-YLJYHZDGSA-N 460.959 -1.139 50 20 JAGD CN1CCN(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)CC1 1786728697 RDBWFQVEAYBJKB-JBACZVJFSA-N 458.368 -1.403 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488057 OSMAVXUYRDOKCQ-MAUKXSAKSA-N 467.972 -1.573 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc21 1834562085 NSFZPKKBGMUCLB-JOCHJYFZSA-N 483.290 -2.310 50 20 JAGD CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1835481326 OUXACEGEXGDUED-UHFFFAOYSA-N 471.411 -1.201 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1835932147 QIRYMDGAMRFMMQ-QFIPXVFZSA-N 472.259 -1.133 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939953 QBYUJEVVNKJWRT-QVKFZJNVSA-N 464.280 -1.002 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839682840 IKXUJGGMBXJRGK-VFNWGFHPSA-N 464.280 -1.002 50 20 JAGD O=C(COCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NNC(=O)[C@H]1COc2ccccc2O1 820100622 OEFJPBFLCIVKBF-QZTJIDSGSA-N 486.437 -1.022 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779404591 UVFMESRREHJDTF-TXTKFYIRSA-N 490.318 -1.011 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793312561 SUQHEUWBWYCUBD-FAYQHZLMSA-N 453.326 -2.103 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1 1795739097 OEIIVNFQZBXYOB-IZZQQSIFSA-N 479.364 -1.759 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1810304012 ZWJWYNWFBUFNEO-DKSSEZFCSA-N 468.518 -1.008 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)NC1)CCO2 1829953083 BOKNRHKNBQXGLZ-SZNDQCEHSA-N 460.491 -1.719 50 20 JAGD Cc1ccn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1833086991 JHPZTSRBRFKYBB-NRFANRHFSA-N 457.491 -1.040 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839384318 AORGSSFLCXDBHU-VEVIJQCQSA-N 451.904 -1.114 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCC(=O)N1)c(=O)n2Cc1ccccc1 9647181 IEINJGCMMDIYDS-CQSZACIVSA-N 453.459 -1.146 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CNC(=O)OC)c(=O)n2Cc1ccccc1 919703672 YPMOVVWTFMKCEE-UHFFFAOYSA-N 457.447 -1.069 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1779030560 CHQGAYFUZUGRJA-KRWDZBQOSA-N 456.396 -2.147 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)CC2)CC1 1781107471 PWCWMQMXGFPXGQ-QFIPXVFZSA-N 456.352 -1.410 50 20 JAGD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1CCCC1 1832420054 GPGPAGPYLOKXMS-HSZRJFAPSA-N 473.335 -1.161 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457548 JBUCDOFEYVCURG-JOCHJYFZSA-N 487.517 -1.088 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837513114 ATAXMFVBDVNSGW-NVXWUHKLSA-N 450.330 -1.122 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837643254 MEXWHAGUMYJCLD-KKSFZXQISA-N 457.296 -1.636 50 20 JAGD C[C@@]1(NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)CCS(=O)(=O)C1 916516095 DDCKWNIGNCBNBE-QGZVFWFLSA-N 460.582 -1.086 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779198812 JIQXQXAJDGJXOP-PLMTUMEDSA-N 463.296 -1.442 50 20 JAGD 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](O)CCl)C2 1802148063 PIIMBXJXHZJCQE-ARUSPNSKSA-N 462.931 -1.056 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1834675866 HCQWERHCYXTBNW-KRWDZBQOSA-N 453.588 -1.476 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840915324 QYUWAOFQPFUAAC-MNVSYLFESA-N 492.957 -1.189 50 20 JAGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1 728510718 RGCDKYAOMQNQRN-NSHDSACASA-N 457.552 -1.253 50 20 JAGD O=C(NNC(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CCN(c2ncccn2)CC1 728958613 BQXVMDZWBMRFOO-UHFFFAOYSA-N 482.567 -1.372 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1784371150 OMGMUQQWEOWNOD-DENIHFKCSA-N 469.307 -1.720 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726638 SBWOYEWOTIICOI-WMLDXEAASA-N 453.945 -2.227 50 20 JAGD CC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831475123 GAMMWXARCMIORH-OAQYLSRUSA-N 462.507 -1.330 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1835928400 NWFURAXAUQUAOV-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1835931054 DVNDCLRNZUBGDA-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837946170 WGJLNOPREJPFNK-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD O=C(CN1CCSCC1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829710621 FJTYYACGGWWSNB-OAQYLSRUSA-N 463.365 -1.515 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc21 1830732201 WDWJUYIUCCVXCS-DNVCBOLYSA-N 455.899 -1.314 50 20 JAGD N=C(N)SCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835648048 UDELLIBKVXDCOQ-IBGZPJMESA-N 450.326 -1.547 50 20 JAGD O=C(c1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930735 WXNXWYPGTCCJSE-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1835937099 OGKGFFXLKNDYDI-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1837457780 QTIHUKGGJOOYEG-FQEVSTJZSA-N 473.446 -1.730 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184429 LPKUZALCXGABRW-NRFANRHFSA-N 466.539 -1.028 50 20 JAGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 16203015 JYFLJHFJHIHKCG-UHFFFAOYSA-N 476.519 -1.113 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984021 KDASNWDGGMADLB-LEAZDLGRSA-N 476.291 -1.546 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788774203 UAMPVZAQFBNNKP-RUGDWHBFSA-N 462.507 -1.571 50 20 JAGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)c1cccc(B(O)O)c1 1815356755 PKRFRHLFEUOMBZ-AUUYWEPGSA-N 460.321 -1.301 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829773711 REEZGHPBXKJJHO-JEUZPXFCSA-N 451.524 -1.326 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934537 XITHNGFRNMBFTI-OAQYLSRUSA-N 462.312 -2.191 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1 1835937920 BEXFDQLWHRNTGR-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1837167101 PEXZHADSGNPAGF-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460593 HMBOYQKIHNXIOW-QFIPXVFZSA-N 470.486 -1.024 50 20 JAGD COC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461010 MQAVDDTZZLPGOF-IBGZPJMESA-N 450.452 -1.889 50 20 JAGD C[C@@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839164001 UDYYPONOHCLZEQ-WZONZLPQSA-N 490.561 -1.077 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928788 ZORLHUVOENZNHF-LRULAXNGSA-N 497.317 -1.430 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1nc(N)n[nH]1)CCO2 1837277211 GPXZHSIAVZLHLE-IBGZPJMESA-N 452.516 -1.851 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840182462 JPODGJHARJLEAN-FQEVSTJZSA-N 489.595 -2.454 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840379711 ISPSMILIPCDWCJ-IBGZPJMESA-N 461.309 -1.653 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCS(=O)(=O)N3CCOCC3)nc2)CC1 748111858 OGWAIDXJJDRSQI-UHFFFAOYSA-N 491.596 -1.694 50 20 JAGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1)c1ccc(B(O)O)cc1 1816670863 BIAAGFOSDNBIAG-NSHDSACASA-N 480.275 -1.512 50 20 JAGD CN1N=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CCC1=O 1832374919 CULHANLXNZHLGS-OAQYLSRUSA-N 458.280 -1.955 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933762 CKFHOXXWCUCJRY-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cccnn3n1)CCO2 1838425751 QUYSKTRSALSBLC-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1CCN(C)CC1 1839105129 QQZIMOPOPFKEOK-GCJKJVERSA-N 468.599 -1.548 50 20 JAGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1CCN(S(C)(=O)=O)CC1 746512474 NOMVLUBZDOXALA-UHFFFAOYSA-N 475.597 -1.191 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831325376 YXSKDOKJVUEYMN-QRWLVFNGSA-N 483.352 -2.236 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)C(=O)C(=O)O 1835932029 LAIRAVGEBVTUPC-HXUWFJFHSA-N 463.252 -3.021 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934227 PXTMIZZSBPFNBA-SFHVURJKSA-N 473.213 -1.885 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837842087 TXGCMOSEUAFRQI-SFHVURJKSA-N 475.550 -1.110 50 20 JAGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1839966428 DFUQOJDSGHEAFL-YJBOKZPZSA-N 466.373 -1.097 50 20 JAGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812389628 IYIOLHBPUQMCEY-VQIMIIECSA-N 468.275 -1.376 50 20 JAGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1830538908 UZIZMFFBRWOVKN-DIFFPNOSSA-N 484.311 -1.086 50 20 JAGD O=C(COC(=O)C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937976 CZPQLVKMPJNRFX-SFHVURJKSA-N 474.197 -1.458 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840380108 UCDDQAJWMBLGGX-IBGZPJMESA-N 461.309 -1.653 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788611167 NGRXAOWBZSNBDR-IGNZVWTISA-N 482.501 -1.409 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)N1CCN(C)CC1 1797753098 SHYJDAABAYZDAI-OAFZBRQQSA-N 459.551 -1.476 50 20 JAGD CS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834569751 PNKJLVUPYIDEPK-UHFFFAOYSA-N 451.354 -1.404 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)N1 1834800091 VKHSRELFBLQWIU-GOSISDBHSA-N 471.323 -1.850 50 20 JAGD CN[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)C(=O)O 1835760653 DTZBWQIRWMNQPI-QRWLVFNGSA-N 464.479 -2.182 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1837459517 HIUGCIDYRVLSQK-JOCHJYFZSA-N 485.501 -1.117 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837523300 SINNZXZJTJNIMK-AZUAARDMSA-N 457.528 -2.534 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)n(C)c1=O 1794249498 DNCJYXBSJPLWJH-YVECIDJPSA-N 452.899 -1.328 50 20 JAGD O=C(NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1cccnc1 1795737173 ADPFOLKHMWGFCY-XEMDLRDOSA-N 452.276 -1.605 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795929913 DMAWQZBGRWVZKU-CULMDFNYSA-N 489.514 -1.646 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930531 LITWGWYGUWRRHK-KSFYIVLOSA-N 469.307 -1.273 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930676 UGJAPGABVXZGCP-PIVQEWKSSA-N 475.307 -1.035 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459231 MXZYJZAHUXSXGG-QFIPXVFZSA-N 498.500 -1.933 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837495744 ATSRJQDNHKWYRA-MPGHIAIKSA-N 450.872 -1.463 50 20 JAGD C=CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837698262 AXGVMXBVWAPABL-SZNDQCEHSA-N 460.491 -1.554 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183641 QVXDKGJTICXFHX-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD COCCOCCOCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738130 MNFYUPDTBSMPSB-PXNSSMCTSA-N 482.958 -1.261 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934041 KZVHWARLJYJRQT-FOIQADDNSA-N 483.352 -2.236 50 20 JAGD CN(C)C(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837455705 FBEAPOYZVWGNEK-FQEVSTJZSA-N 463.495 -1.974 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1778115190 HMQJCMIJIONQLQ-NRFANRHFSA-N 479.364 -1.519 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782467427 ISJLSWDFNLIKIW-PQNGQFLHSA-N 497.361 -1.036 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795932231 SMPQTBVZXAVFMT-DPIQGUFMSA-N 468.536 -1.586 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1801012413 FAVYMNLVFQUDBK-CCWDJLKJSA-N 478.575 -1.146 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838499077 OYJBDKLASKMJJN-AUUYWEPGSA-N 451.867 -1.241 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)C[C@@H]21 1787506774 LVUKSHRXHNGCOF-ZVFIJVIPSA-N 473.490 -1.302 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3C(=O)C=CC3=O)C2)C1 1837457116 XUQYBKMWBZGUAK-QFIPXVFZSA-N 486.485 -1.930 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692582 GOVUQXNDMDRVOC-VWLOTQADSA-N 494.357 -1.167 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184980 CXQUXRYZPGKHSM-UTKZUKDTSA-N 486.522 -1.689 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CSc1nc[nH]n1)CCO2 1840381831 WGHVNLQOILUUQT-GOSISDBHSA-N 455.541 -1.274 50 20 JAGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=S)NCC(N)=O)N(S(C)(=O)=O)CC2 727066142 GWFPVVAPMRICIK-LBPRGKRZSA-N 459.550 -1.067 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCS(=O)(=O)CC1)C2)[C@@H](F)Br 1799344543 NMESVMSAYNIBNL-ZMJPVWNMSA-N 456.334 -1.003 50 20 JAGD Cn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1833407438 LJNFNAHGGDPPMQ-FQEVSTJZSA-N 459.463 -1.492 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930740 XJCWHSGDBRVKPI-AOMKIAJQSA-N 461.324 -1.259 50 20 JAGD Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)nn1C 1835934271 SCQMBRIICZANEY-JOCHJYFZSA-N 456.308 -1.279 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788639233 ZFRMVZJCCSIUEY-FRYIKTPZSA-N 476.291 -1.546 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)n(C)c1=O 1792974731 AERBOLJLMKYYSM-GFQSEFKGSA-N 468.898 -2.377 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939936 PMIKWVFXTTVJJF-RTWAWAEBSA-N 464.280 -1.948 50 20 JAGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)c1ccc(B(O)O)cc1 1815344271 QQEHDSVFZZNGPY-IFXJQAMLSA-N 460.321 -1.301 50 20 JAGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(=O)C(=O)O 1817474231 AXXFCTVLSHSHGL-HNNXBMFYSA-N 457.252 -1.062 50 20 JAGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831196774 JMZLSPZUKAWHOY-JOCHJYFZSA-N 461.324 -1.257 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836396489 WMOHWKAMTNLRNA-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868901 UKAFBXLKYLANPP-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837241705 PXZCHQAXJRXQCV-MQFAKOPTSA-N 467.548 -1.086 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840896417 YRSDQTBLTNDSEP-FQEVSTJZSA-N 493.372 -1.703 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)n1 1797908982 PNSYWZZVJDFEDE-XEMDLRDOSA-N 468.319 -1.130 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360989 NIMGAMLZZDZIDV-VCOUNFBDSA-N 468.319 -1.268 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832795655 BZDJRXWBIICMER-FQEVSTJZSA-N 473.251 -1.759 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837467439 LHYRALMQSDZWSX-LJQANCHMSA-N 458.585 -1.700 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034717 SWCPYTWLPIXLDW-GCJKJVERSA-N 484.517 -1.401 50 20 JAGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cn1 1795739095 VQBRDMHUYRZTFR-XEMDLRDOSA-N 487.343 -1.177 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)CCO2 1832802950 GWUYWORQCXETPJ-IBGZPJMESA-N 467.483 -1.379 50 20 JAGD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928379 NGKGUTBFHXLIHB-NRFANRHFSA-N 457.248 -1.444 50 20 JAGD Cc1nn(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1835929632 ZNGOYTQRWDGBHL-NRFANRHFSA-N 460.271 -1.069 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1835930215 CUEURMCNDYTOMB-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD NC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840646864 ZMKQPUCAJQAKDM-HSZRJFAPSA-N 467.287 -1.151 50 20 JAGD CN(C)C(=O)NCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833143719 HKPWNRBSYWNOMC-UHFFFAOYSA-N 459.356 -1.177 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839918177 MKDBXHOUZNQNCW-NRFANRHFSA-N 465.312 -3.277 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2)CC1 728213304 JQXKHOJSPXLHFI-UHFFFAOYSA-N 490.546 -1.487 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1778116772 GZDDSLWQGWHNAA-NRFANRHFSA-N 494.574 -1.200 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CNC(=O)OC(C)(C)C 1792889350 OADANARVTXIDIS-BASYENTBSA-N 471.555 -1.165 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[C@H]1SC(=N)NC1=O 1801011183 LOEDGZHMXZHIBG-ZTJZGAFRSA-N 454.553 -1.249 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363845 QQGLAFFJCXNAOM-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1835939831 JXVZNDOUJDNICX-XLIONFOSSA-N 466.321 -1.986 50 20 JAGD O=C([C@H](O)N1CCOCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200166 GVDIHJJRUSRUKO-NOLJZWGESA-N 454.293 -1.216 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1840185783 XKLTWLGXSZFSIT-UTKZUKDTSA-N 487.554 -1.341 50 20 JAGD O=C(CCc1cnccn1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934519 WTUYUNCNLSBAJJ-QFIPXVFZSA-N 454.292 -1.141 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836475357 PDEQLABSWUXKDF-RXVVDRJESA-N 474.348 -1.537 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735002 BRJQFXDAJWYRPC-RDTXWAMCSA-N 458.855 -1.187 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CC[C@H](N)C(N)=O)CC2)CC1 1834734972 MECWHYIEAONPAX-SFHVURJKSA-N 474.566 -1.537 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930622 QFABLCMSQIYLME-SGCYSOCQSA-N 458.324 -1.092 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1784115931 OCIXZIPMWFDBFZ-KURUZVKSSA-N 456.459 -1.125 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1797584900 JIVFLSZGWKSGPV-XODPUGQPSA-N 464.479 -1.226 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H](N)C(N)=O)C2)NC(=O)NCc1ccccc1 1799095199 YZZGOALBLSIZDG-NYUBLWNDSA-N 489.577 -1.485 50 20 JAGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(=O)C(=O)O 1815360057 KMGNPVNYSTXDFC-LBPRGKRZSA-N 460.277 -1.408 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1835930226 DAHFPQDFXLUJDK-QHCPKHFHSA-N 497.317 -1.920 50 20 JAGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835936897 IHEQDGGRTOFXKQ-QHCPKHFHSA-N 483.286 -1.068 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837498015 OYLGVWGUWYOQDI-KNQAVFIVSA-N 492.290 -2.069 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779067931 HPIUGWRRNFGOQD-RXVVDRJESA-N 462.264 -1.695 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]nnc4n3)[C@H]2C1 1787270666 AMYJJQLXKAZTJE-OBJOEFQTSA-N 461.483 -2.221 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930535 LJIGEPXTXLMHEW-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939328 MKSCAVBACJXVTI-HTAPYJJXSA-N 493.322 -1.721 50 20 JAGD O=C(O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940008 SNBLRCDBXLMDBW-IBGZPJMESA-N 452.294 -1.746 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692626 HZSDOXFYQQGWLK-VWLOTQADSA-N 494.357 -1.167 50 20 JAGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC 920212594 RUWXNCLUJYWICL-LLVKDONJSA-N 464.522 -1.110 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779073241 IKQXPHBAXDPJMD-UWJYYQICSA-N 477.474 -1.377 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376074 TVLUPDJXBIVIGX-VCOUNFBDSA-N 468.319 -1.268 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734999 BRJQFXDAJWYRPC-KDOFPFPSSA-N 458.855 -1.187 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928718 WSJZPOWXHTXNNJ-JOCHJYFZSA-N 458.324 -1.282 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364258 PNOBFSAYQCETTC-QRFRQXIXSA-N 453.308 -1.326 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2 1835563080 WKEAPGYXBDJAAN-DEMPXQDTSA-N 477.522 -1.830 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1837457919 WBMVGOPNXJJEMS-WMZHIEFXSA-N 483.529 -1.280 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)n3)C[C@@H]21 1788610525 XRIBQRFRWTYKQZ-XEGUGMAKSA-N 457.447 -1.207 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1ccnn1 1837459936 OZDVGQPIBMLZQF-VLIAUNLRSA-N 458.479 -1.392 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3ccnn3)C2)C1 1837461315 UEYAMQHATVIPHS-FQEVSTJZSA-N 458.479 -1.563 50 20 JAGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1780968861 GIIRKGYZKMLANL-FDDCHVKYSA-N 489.577 -1.245 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784371179 PHDCCQLEBVETBG-KNQAVFIVSA-N 469.307 -1.720 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790175587 PJHBCKJKSAUSOW-XPYUAMARSA-N 477.323 -1.197 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(C)c1=O 1832755965 UZPUZESRFDXDSC-KUHUBIRLSA-N 486.888 -1.576 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[C@@H]1SC(=N)NC1=O 1835937133 QBWHIRMDEBMKRP-PCMMCCAGSA-N 490.347 -1.761 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938467 WBASUMGKODIPIL-QMHKHESXSA-N 497.317 -1.955 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838533345 OULKDIIRBJNKRN-QFIPXVFZSA-N 470.486 -1.232 50 20 JAGD N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccn1 1835928033 BMWBHPKSRBSCSR-UGKGYDQZSA-N 454.292 -1.469 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930487 JKVGUUSEYMUNLU-DENIHFKCSA-N 492.290 -2.069 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938554 YFXPPRFIRZKGGY-KNQAVFIVSA-N 492.290 -2.069 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(=O)[nH]c1C 1835927124 GRPOPMPBTOCAHS-QFIPXVFZSA-N 470.291 -1.550 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839043809 UURASTBQMGPHRP-IFXJQAMLSA-N 472.951 -1.052 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1781853164 AAHRGBOKDGHLII-KKSFZXQISA-N 463.296 -1.347 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CNC1=O)C2 1782209476 SDXZYPAWPUMCLN-JLTOFOAXSA-N 452.512 -1.575 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)no1 1835930729 WUPVPNMSJWLPQC-QFIPXVFZSA-N 486.290 -1.837 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836847018 PWJQAQGMOVLUHZ-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732906 QFMRNDHQVPWYEI-UKBAYJJMSA-N 491.350 -1.155 50 20 JAGD O=C1CN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)C(=O)N1 1832475937 GPRLQTOEQJZBMD-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccc[nH]1 1832875418 FGOCUMQNCCMWFY-HSZRJFAPSA-N 484.318 -1.415 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1833311290 OCYPXDOMZZZSLD-QFIPXVFZSA-N 483.485 -1.437 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835674786 NPLYFBVUKCNYNO-QFIPXVFZSA-N 458.324 -1.282 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1835929157 CLGLPIXDUNOLAQ-HSZRJFAPSA-N 474.367 -1.926 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940016 STGRDMOGPMLXSZ-TWKPZUECSA-N 452.276 -1.060 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837673900 QOENVFYKZISJBU-ZHRRBRCNSA-N 461.324 -1.259 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840178283 BXFXRZYDTMVLGY-LEWJYISDSA-N 464.280 -1.948 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CC(=O)N(C)C1)c(=O)n2Cc1ccccc1 914755925 ALXCRULBAMGMNL-MRXNPFEDSA-N 497.512 -1.320 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnnc3O)C2)C1 1837459291 BHJOOSCEDPFDSL-FQEVSTJZSA-N 457.447 -1.436 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840895241 LYRAQURDKVKWAC-MEDUHNTESA-N 451.954 -1.097 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840897149 NZTJQPNOAIOCMA-LJQANCHMSA-N 487.604 -1.324 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031617 BUZNQINIHXTBRM-KXBFYZLASA-N 450.452 -1.807 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930931 ALXFOVUCLFXXGS-NRFANRHFSA-N 469.263 -2.361 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837241706 PXZCHQAXJRXQCV-QTYPKTMWSA-N 467.548 -1.086 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)[C@@H]1SC(=N)NC1=O 1795734257 LWZLHULSDVYVNP-APDPGRRMSA-N 460.321 -1.628 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360530 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O=C(Nc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938567 ZAGORQIQYDMMIO-JOCHJYFZSA-N 468.275 -1.530 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc[n+]([O-])c3)C2)C1 1837456232 GAEMKHITRRKQSC-NRFANRHFSA-N 456.459 -1.298 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840182500 KCTBZYMBVLPDAB-JOCHJYFZSA-N 478.550 -1.036 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCC(=O)N3CCOCC3)nc2)CC1 916251265 BDVUXQZVTJPAJD-UHFFFAOYSA-N 455.541 -1.107 50 20 JAGD O=C(CN1C(=O)C=CC1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782314060 IXOJKQSTQCWUHA-VGOFRKELSA-N 455.276 -1.581 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786983332 NGZRRSOTEUVBCW-WDSOQIARSA-N 479.364 -2.310 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812713852 CHLQYWHVPPFIDB-UTKZUKDTSA-N 485.545 -1.314 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3NC(=O)NC3=O)CCO2)C1 1832692262 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C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488149 SGZKXPMYACOLLI-WMLDXEAASA-N 482.397 -1.043 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1835541328 YQNNXBJKUKCTOO-AAEUAGOBSA-N 462.209 -1.142 50 20 JAGD N=C1NCCN1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835637272 WSGBOYQWLARIMR-FQEVSTJZSA-N 460.495 -2.405 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940113 ULXPCSZCCZLKJD-QFIPXVFZSA-N 455.276 -1.220 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21)c1cccc(B(O)O)c1 1786984248 UYWUTNCGHXUXPF-KKXDTOCCSA-N 454.248 -1.238 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)c1ccc(B(O)O)cc1 1795735286 VWGSNMQYXXOAST-VAVQPMOSSA-N 455.320 -1.029 50 20 JAGD O=C(CN1C(=O)C=CC1=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826315941 UARIEWOSMLLSHJ-CYBMUJFWSA-N 454.273 -1.026 50 20 JAGD CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798668 WKERPWZVRWPAHJ-LJQANCHMSA-N 459.356 -1.002 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1840183679 TUVVSXCMSCVBAN-OAQYLSRUSA-N 497.574 -1.072 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779073231 IKQXPHBAXDPJMD-LAUBAEHRSA-N 477.474 -1.377 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783992027 MSQJOIIPHWYFQC-KANFNMMFSA-N 491.350 -1.155 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786983807 SYFQDCAUTSNYAT-IEZWGBDMSA-N 484.274 -1.270 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611093 KYZMRIWQVLJENJ-UDTPNQRGSA-N 491.501 -1.227 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739988 ZMTQIITXDUCNDK-WQDJSCAQSA-N 491.350 -1.155 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1)c1ccc(B(O)O)cc1 1834797925 MPPLAXTXKCWFCZ-UHFFFAOYSA-N 494.361 -1.195 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)N1 1835927144 IXIRQWAOSOLHPI-YWZLYKJASA-N 460.252 -2.966 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837517688 ZCYXBAFPUKNPPD-PZJWPPBQSA-N 463.296 -2.913 50 20 JAGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cn2[nH]cnc(=O)c12 1801011827 IRZLAHYOXVWUAF-ZSBFGKGUSA-N 459.507 -1.093 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN1CCCNC1=O)c(=O)n2Cc1ccccc1 920444853 MYERROVXXQJKGY-UHFFFAOYSA-N 482.501 -1.009 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807947904 LODAQULRNJZZDA-BEFAXECRSA-N 488.273 -1.479 50 20 JAGD O=C(COc1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927206 LZTFBRJQLUJDRJ-QFIPXVFZSA-N 455.276 -1.090 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1C[C@H]2C[C@@H]2C1 1837283431 KLDMBKATLYGLCL-DYVMYPEFSA-N 457.336 -1.223 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)C(=O)C(=O)O)C2)C1 1782746307 GRFUCZBCDSYNMB-BOURKTIISA-N 462.463 -1.507 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782786212 BSUZAUSUBUJTRG-HXUWFJFHSA-N 464.479 -1.041 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1 1795734103 CLFDOQCPCXENHA-IZZQQSIFSA-N 479.364 -1.759 50 20 JAGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1834528310 PHIUISOXONRPOA-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD CCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455659 CEFHMQGKBNCHNB-SPLOXXLWSA-N 462.507 -1.330 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1840033584 KGMOOHZDRRQLLK-LXZKKBNFSA-N 450.330 -1.123 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785328950 LELBBWLBVNIHML-OFVDUGFESA-N 496.329 -1.034 50 20 JAGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)(C1)C2 1840005403 ZGGQASCBLQOLDX-XPPIMPSXSA-N 472.303 -1.220 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)CC2)CC1 1786984810 LXBNHIPRMDLBQQ-JBACZVJFSA-N 470.379 -1.260 50 20 JAGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cn2[nH]cnc(=O)c12 1798463889 JEIULCWPIIWUBR-JLVBRIDZSA-N 465.275 -1.472 50 20 JAGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)c1ccc(B(O)O)cc1 1815344270 QQEHDSVFZZNGPY-AUUYWEPGSA-N 460.321 -1.301 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799842 HGYKEAMFIAQYNA-UHFFFAOYSA-N 465.381 -1.014 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840178285 BXFXRZYDTMVLGY-RTWAWAEBSA-N 464.280 -1.948 50 20 JAGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cn2[nH]cnc(=O)c12 1840185614 PZRKXDHFVNCTLJ-QFIPXVFZSA-N 489.533 -1.226 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1843130258 DHKIQCLPUVUWMQ-UHFFFAOYSA-N 459.488 -1.033 50 20 JAGD N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccn1 1835928032 BMWBHPKSRBSCSR-SIKLNZKXSA-N 454.292 -1.469 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1837459489 RUMHKFPMRRRHIS-JOCHJYFZSA-N 483.485 -1.211 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182297 FSMQMJWPBAOXBL-OAQYLSRUSA-N 455.556 -1.022 50 20 JAGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn2[nH]cnc(=O)c12 1780019913 QYZWWNSOYZWBKT-QFIPXVFZSA-N 465.275 -1.232 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936084 QSKPKVZIRLLANK-OXJNMPFZSA-N 456.496 -1.316 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CCc2nc(O)nc(O)c2C1 1785328856 JOYPQJMTTOVQPH-VQUGOPFGSA-N 496.329 -1.034 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833760739 FARYTQHJRHWLPQ-SFHVURJKSA-N 471.323 -1.850 50 20 JAGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CNC(N)=O)C2)C1)NC(=O)NCc1ccccc1 1785629807 ZWZSBWULYNHRHK-NRFANRHFSA-N 461.523 -1.169 50 20 JAGD N[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1835828825 KUDYNNCMBWZOKE-OFNKIYASSA-N 468.319 -1.079 50 20 JAGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934093 NHLJEZMTXNJYFD-JOCHJYFZSA-N 461.324 -1.257 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836475650 SUDLSEGTNSLDPK-RXVVDRJESA-N 474.348 -1.537 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1C[C@H]2C[C@H]2C1 1837283436 KLDMBKATLYGLCL-YQYRJILISA-N 457.336 -1.223 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(C)c1=O 754809159 BUXGLCBGFFHAEA-ZDUSSCGKSA-N 472.414 -2.036 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1797138752 SRUPHDRSFAFBNT-IZZQQSIFSA-N 479.364 -1.759 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833307306 BUDSJJJDMBYJIL-QFIPXVFZSA-N 468.275 -1.756 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1835928597 SBLSNRBPBQEZRQ-LJQANCHMSA-N 459.224 -1.619 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837945671 LZWRHDZOXUKLKT-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1810304016 ZWJWYNWFBUFNEO-LJHODMEESA-N 468.518 -1.008 50 20 JAGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cccc1=O 1835929523 TWCAIQDZFQGXRY-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1779030555 SKFSEWGUPDZVGY-HXUWFJFHSA-N 480.547 -1.446 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983529 RPDIYPXQKGWIMQ-KANFNMMFSA-N 491.350 -1.155 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729177 ZNVAAGVAGILRJC-QHCPKHFHSA-N 497.512 -1.420 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801554 WUOAMKAIKYWYJV-UHFFFAOYSA-N 465.381 -1.014 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1835930245 FHNFCWQEXYGYSR-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837377923 WLAQJIKONPTTBL-BTYIYWSLSA-N 462.312 -1.856 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[C@H]1SC(=N)NC1=O 1840183850 DSRVYVXCKJXUCE-GQWAEJPESA-N 484.579 -1.382 50 20 JAGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C[C@H](C)O1 918779156 CPWHNUOZPMCTID-GJZGRUSLSA-N 493.550 -1.012 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)C(F)(F)F 1801033477 CELRAJZAGKNWOV-WDAIWFPHSA-N 458.397 -1.433 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1 1835740028 WIYAHQDRASXIPQ-DEMPXQDTSA-N 477.522 -1.830 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837457826 STAYOQDXSYNWMF-JOCHJYFZSA-N 483.290 -2.251 50 20 JAGD CCS(=O)(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607737 CNQYDOXLQPKZLM-RCBQFDQVSA-N 453.521 -1.287 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791288041 PFONYEUHSSKRDI-VGWMRTNUSA-N 461.585 -1.333 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1837272128 OEMQXEWDJMQACE-PFRKPPGBSA-N 487.521 -1.090 50 20 JAGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1839966425 DFUQOJDSGHEAFL-CRAIPNDOSA-N 466.373 -1.097 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1835930654 SCSSZXCOGGSZCS-IBGZPJMESA-N 459.224 -1.619 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1779031228 OCCJUGHEJHEVCD-OAQYLSRUSA-N 468.474 -1.618 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797786346 JYPNXESAYYNUQJ-NBMJBFSESA-N 462.264 -1.936 50 20 JAGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927642 VZBJQMLRXDGZIE-JOCHJYFZSA-N 461.324 -1.257 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c2c1CCC2 1835937457 XWLUXECORSHNBS-HSZRJFAPSA-N 468.319 -1.028 50 20 JAGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837513115 ATAXMFVBDVNSGW-RDJZCZTQSA-N 450.330 -1.122 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)n1ccccc1=O 1837684481 TXTPLXGDVXAMIL-SBUREZEXSA-N 469.303 -1.141 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804186669 LHFIWQHLOLGMFG-OXJNMPFZSA-N 465.275 -1.367 50 20 JAGD O=C(CN(CCO)CCO)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812712987 GRDWAHPKNWZHBX-KNQAVFIVSA-N 470.335 -1.632 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830732511 ZPRYATVTGBUONM-OHNRDTAOSA-N 455.899 -1.349 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1835930655 SCSSZXCOGGSZCS-LJQANCHMSA-N 459.224 -1.619 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)s1 1836078778 ZWOWRUBOKJFSSE-FQEVSTJZSA-N 460.321 -1.161 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1779036797 FBUYNCZDBWHWSR-KXBFYZLASA-N 451.505 -1.294 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(O)O)CCO2)C1 1830390043 GGMXVSXQZCFOJU-SGTLLEGYSA-N 451.904 -1.114 50 20 JAGD N[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1cccnc1 1835928257 HHGUVVLORDOWLK-NFBKMPQASA-N 468.319 -1.079 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930774 ZBNPLWKEERWBJL-JOCHJYFZSA-N 468.275 -1.530 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1839104123 LIOXHCGVWCFEAM-SBUREZEXSA-N 489.577 -1.609 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)C1 1840182865 WRUKYYZRUUIQJM-DJJJIMSYSA-N 454.484 -2.586 50 20 JAGD CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916516982 UYWLIAWXXVIZBS-UHFFFAOYSA-N 463.538 -1.409 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(=O)nc1O 1783940679 YVFPGIXAOZXQLE-FQEVSTJZSA-N 450.496 -1.540 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1834799983 LCBNTBWOFTYVMJ-UHFFFAOYSA-N 499.421 -1.284 50 20 JAGD N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccn1 1835700959 XLFGDQWMGXCXSP-DENIHFKCSA-N 454.292 -1.469 50 20 JAGD CSCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840199411 ZLRONGIXKVGDHS-JXFKEZNVSA-N 467.548 -1.131 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)N3CCOCC3)C[C@@H]21 1787508242 BPPXCFVKIBENCE-BXIXKNFKSA-N 476.534 -1.249 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)ncn1 1794369943 VDUMHGZPJYZONX-CULMDFNYSA-N 455.431 -1.310 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)C=CC1=O 1801118133 HTIHBUOSENSVGD-GLYXUVKCSA-N 456.459 -1.365 50 20 JAGD Cc1ccn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456442 HXHAVPZJBNHWRL-OAQYLSRUSA-N 457.491 -1.040 50 20 JAGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839916430 OYFQTIOPJRUYEF-QAPCUYQASA-N 466.373 -1.240 50 20 JAGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846256563 ROKDYHISIZWYSX-UHFFFAOYSA-N 464.324 -1.120 50 20 JAGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OC 729274833 FITUJULGWHVMRO-SNVBAGLBSA-N 452.511 -1.543 50 20 JAGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CNC(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1780968395 BEQLUWSUAQZWIW-OAQYLSRUSA-N 461.523 -1.169 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011709 WMHFASZCKQYWRU-ZTENYAIWSA-N 461.523 -1.443 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834563792 RVCCXYNJXDXNGR-JOCHJYFZSA-N 498.500 -1.991 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1779034550 QXUSZODVQOEEMZ-FQEVSTJZSA-N 450.496 -2.585 50 20 JAGD CC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1 1797306589 OBWPDQLPNCMQEM-CUCQEMJRSA-N 487.561 -1.126 50 20 JAGD CN(C)C(=O)NCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800604 REKWSVXXSDIJKK-UHFFFAOYSA-N 459.356 -1.177 50 20 JAGD CCOc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1 1835930946 ARGXZCGKKCLZHI-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199796 VANPAJJDPLAOGY-AAEUAGOBSA-N 462.209 -1.142 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184430 LPKUZALCXGABRW-OAQYLSRUSA-N 466.539 -1.028 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980057 DXHCBQJPJSMVNX-OFVDUGFESA-N 496.329 -1.034 50 20 JAGD O=C(CCc1cncnc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836050318 WZLYXEWVJNMNQI-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836419767 YWDFKLAXMWQHFH-HXUWFJFHSA-N 451.480 -1.064 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840431213 ZJIOAZLWLHISOR-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(=O)n2[nH]nnc2n1 1787270022 YSRYQGFEVNGLNH-NOLJZWGESA-N 467.251 -2.601 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1813073122 HKQVJYCZYSFQQH-GCJKJVERSA-N 464.567 -1.253 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738402 OWHJZSDYRPSJCC-LRDNONRASA-N 492.957 -1.189 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486494 KMZYDPAJWWVAQC-OAQYLSRUSA-N 461.368 -1.114 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835396843 OHYJDZRAVOJEKM-NRFANRHFSA-N 462.507 -1.913 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839386761 NBFORBNFZUHXIM-JTSKRJEESA-N 493.322 -1.721 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 729276929 OMDPFYIXNDLATR-GFCCVEGCSA-N 490.560 -1.056 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779031735 XFFJPKYTNMHIAL-NRFANRHFSA-N 453.264 -1.878 50 20 JAGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(=O)nc1O 1786986577 MKIYMOKIXJGSPP-SZMVWBNQSA-N 470.291 -1.769 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1=O 1831883935 LIODVFMIDPLQTR-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832201399 DPAPATXBORCHOC-QHCPKHFHSA-N 479.302 -1.119 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(CCO)CCO)C2)C1 1783257244 YVXLKHBGVOGZLM-BQNPTPDXSA-N 464.523 -1.763 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O 1793729283 ZTBPMXHJRXXAGZ-PTEHBNRSSA-N 462.161 -1.075 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccncc1=O 1800196962 GFWVQHZYVPANMT-IHHIPJHASA-N 455.475 -1.033 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833450967 YGIASWWUAGDRMC-INIZCTEOSA-N 494.423 -1.121 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CC1 1837457880 UTFUMRHPZGTJKU-HSZRJFAPSA-N 489.577 -1.607 50 20 JAGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn2[nH]cnc(=O)c12 1838469816 VUFJNDNFQWAXQQ-HSZRJFAPSA-N 495.301 -1.605 50 20 JAGD CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1839760772 SUNVAEOUOAKXPV-NRFANRHFSA-N 460.292 -1.220 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839782997 PLCPSTNBIWANGK-UZLBHIALSA-N 481.531 -1.668 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839987603 QURWSJAJNMRDON-QFIPXVFZSA-N 477.323 -1.039 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184994 DAVAVQKXVGKQJO-YWZLYKJASA-N 456.544 -1.477 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840852622 SOLHTBDCARBKKD-DENIHFKCSA-N 461.324 -1.259 50 20 JAGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1csc(N2CCOCC2)n1 1317799145 OJSXTIFHDUZQEQ-VXGBXAGGSA-N 457.534 -1.224 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CC1 1837459999 YKFJFYBJSOTBEX-JOCHJYFZSA-N 475.550 -1.998 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837730393 YJFQPQRXHXFSHV-WIYYLYMNSA-N 463.296 -2.413 50 20 JAGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015255 XWTXFADFEUEQTC-UHFFFAOYSA-N 464.324 -1.120 50 20 JAGD CN(CC(=O)N1CC2(CCCN2C(=O)CN(CCO)CCO)C1)NC(=O)NCc1ccccc1 1846034195 MPVRMNQNVGEXRQ-UHFFFAOYSA-N 476.578 -1.177 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1779372240 DFEYMRMLXFMPEZ-NQSCKRDGSA-N 476.534 -1.537 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)C=CC3=O)[C@H]2C1 1784802334 PZTGXOVIFHGABB-JQFCIGGWSA-N 470.486 -1.407 50 20 JAGD Cc1cn(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(=O)nc1O 1785353056 KUMJKDYTJOIVJP-OAQYLSRUSA-N 456.264 -1.919 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1801285497 COMYUNNNXZJVBT-WOUAJJJCSA-N 469.307 -1.960 50 20 JAGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1)c1cccc(B(O)O)c1 1816671621 RIRFHVXDPJZLIL-LLVKDONJSA-N 480.275 -1.512 50 20 JAGD O=C(O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ncn1 1833492544 OPKBZCJOGKGESZ-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837523302 SINNZXZJTJNIMK-QUCCMNQESA-N 457.528 -2.534 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1844263862 CSPFDOCCNUTCMR-UHFFFAOYSA-N 459.488 -1.033 50 20 JAGD CN1N=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CCC1=O 1784979782 PGPFOTDUCLFINT-NUTKFTJISA-N 457.491 -1.113 50 20 JAGD 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)C(=O)O)C2 1796444110 WYAVQVCTUNLTRE-UOEJNGGWSA-N 462.463 -1.747 50 20 JAGD O=C1CCCCN1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939753 GLSCRUNGUJTQFT-JOCHJYFZSA-N 459.308 -1.551 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)Cc1cccnc1)CCO2 1836506060 MWENLURNTDMOQK-AVRDEDQJSA-N 462.551 -1.219 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1C[C@@H]2C[C@H]2C1 1837284719 YRYLMKVSWWVCPQ-ZQDYSYBYSA-N 457.336 -1.223 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1837459564 KDHIPNBJDPYCLU-UZUQRXQVSA-N 489.577 -1.609 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202969 VFLMOMGHLXNGAE-HOCLYGCPSA-N 456.309 -1.580 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n1 1840184507 RHUMWOYMCOSWAT-NRFANRHFSA-N 466.539 -1.028 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1840185629 RARBNSVRFZJIDQ-AZUAARDMSA-N 457.528 -2.534 50 20 JAGD O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1csc(N2CCOCC2)n1 1317799144 OJSXTIFHDUZQEQ-RYUDHWBXSA-N 457.534 -1.224 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779031008 LSJUPNPPFVSBOZ-OAQYLSRUSA-N 453.264 -1.878 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1837459490 RUMHKFPMRRRHIS-QFIPXVFZSA-N 483.485 -1.211 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460586 HMBOYQKIHNXIOW-JOCHJYFZSA-N 470.486 -1.024 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839386762 NBFORBNFZUHXIM-VGOFRKELSA-N 493.322 -1.721 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)CC2)CC1 1779032876 ZPZOROOGNVVZIB-JOCHJYFZSA-N 471.562 -1.091 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782960931 WGNAQMQFDRBEGM-DNVCBOLYSA-N 451.505 -1.294 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1835930230 DEHIMOXLMRQOPY-QFIPXVFZSA-N 460.340 -2.316 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388088 FQOANEYABPZKSI-DYESRHJHSA-N 487.554 -1.341 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)no1 1797751783 RZORZUUABOTRHF-IVWMJMPLSA-N 471.474 -1.385 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830733339 JAUXZCZJEYKPKM-SNUQEOBHSA-N 451.904 -1.114 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1835930646 ROZFKSHJRFCRAN-PZJWPPBQSA-N 463.296 -2.913 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1CCN(C)CC1 1835931253 KBOLVXQSAJUBEI-FDDCHVKYSA-N 474.367 -1.928 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nncn3c1)CCO2 1837015322 SHJHICZFDDPUTN-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457613 LBWQULLDMPXUGE-GOSISDBHSA-N 455.493 -2.200 50 20 JAGD CC[C@@H](NC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457540 ITVHTDXAEANJQT-FOIQADDNSA-N 463.495 -1.798 50 20 JAGD CN[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)C(=O)O 1837457971 YYNUPSRHFULXEU-YWZLYKJASA-N 464.479 -2.182 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837495757 ATSRJQDNHKWYRA-VKJFTORMSA-N 450.872 -1.463 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837498017 OYLGVWGUWYOQDI-UGKGYDQZSA-N 492.290 -2.069 50 20 JAGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(=O)C(=O)O 1819799913 HAQKXVNBQCIPEC-VIFPVBQESA-N 475.487 -1.090 50 20 JAGD CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1835481293 KDLILKPZPIDYDI-UHFFFAOYSA-N 471.411 -1.201 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800202599 JIXAGVSOBIDQHY-REGYPHIPSA-N 466.303 -1.217 50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(=O)C(=O)O 1810305410 LKIWGKNIYXNTTI-KDOFPFPSSA-N 483.485 -1.057 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)n1 1835937998 DVKIAXDIYRIXNQ-FQEVSTJZSA-N 458.284 -2.231 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939752 GKCIYMQFPASXAI-XDHUDOTRSA-N 496.329 -1.350 50 20 JAGD NC(=O)c1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779938132 GNCJPKNAZDXXQL-OPAMFIHVSA-N 467.291 -1.303 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984308 BJZRCFKKFOKPTA-QRTARXTBSA-N 466.263 -1.996 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370686 IMVRQOXWXXXFFR-POAQFYNOSA-N 453.308 -1.326 50 20 JAGD Cn1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)nc1=O 915808036 JXKRMAFZUZVROY-UHFFFAOYSA-N 465.488 -1.099 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840203121 SIZKDFZWULWCPX-SFHVURJKSA-N 473.213 -1.885 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840496533 ZVIWUCFYLHTQLD-QFIPXVFZSA-N 455.276 -1.220 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)CC1 1788112166 ZRCOJDZFBTZYGD-IHPCNDPISA-N 493.391 -1.369 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)n1 1795740278 NGSNMIGEKYTNDW-XEMDLRDOSA-N 468.319 -1.130 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934235 PYTIZWYWMSJKSI-XLIONFOSSA-N 452.338 -1.450 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c1 919689115 XVAKEWINVDTOCP-UHFFFAOYSA-N 462.488 -1.099 50 20 JAGD O=C1CCCCN1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939754 GLSCRUNGUJTQFT-QFIPXVFZSA-N 459.308 -1.551 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456077 HZRPMOZLZZVKSS-JOCHJYFZSA-N 476.534 -1.083 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1837459673 WCWKTOGTLDGZGW-FQEVSTJZSA-N 473.494 -1.912 50 20 JAGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)C(=O)O 1812390995 KOISVVIEYSHHDK-KDOFPFPSSA-N 483.485 -1.057 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457744 PEXNAEWUXNVNRC-JOCHJYFZSA-N 487.517 -1.088 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837648910 YKXHTUKIRIXMKX-OXJNMPFZSA-N 451.528 -1.256 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724232 WWAZNHKZAQTOSA-DYVFJYSZSA-N 462.912 -1.492 50 20 JAGD COCCOCCOCCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738126 MNFYUPDTBSMPSB-FXAWDEMLSA-N 482.958 -1.261 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834736152 GKVJRVZPMMGXSE-QGZVFWFLSA-N 453.588 -1.476 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839918827 HYQHYMMNJSUQQB-GOEBONIOSA-N 456.309 -1.580 50 20 JAGD N=C1NCCN1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807114279 XVRYMTUHEQEXGK-XLIONFOSSA-N 450.308 -1.079 50 20 JAGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(=O)[nH]c1C 1833386424 AJNXEYNPMQHRQC-JOCHJYFZSA-N 470.291 -1.550 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833506059 NNXCIHMJZCKTMR-OAQYLSRUSA-N 471.474 -1.133 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927074 CPHFMMYEBHMPQK-JOCHJYFZSA-N 461.324 -1.401 50 20 JAGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837521724 RLAXPVCQTZELCA-BJJXKVORSA-N 454.293 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CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831325379 YXSKDOKJVUEYMN-YWZLYKJASA-N 483.352 -2.236 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834674366 ZUNZVWUIOXEIPZ-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)N1 1834800093 VKHSRELFBLQWIU-SFHVURJKSA-N 471.323 -1.850 50 20 JAGD CN(C)C(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837455708 FBEAPOYZVWGNEK-HXUWFJFHSA-N 463.495 -1.974 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919667 VQWSKLADNMMLOP-WMLDXEAASA-N 452.346 -1.487 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COc1cccnn1)CCO2 1840411304 LFOMHHUZNHMTNX-FQEVSTJZSA-N 450.496 -1.315 50 20 JAGD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(=O)[nH]c1C 1797749849 YQWJWXFHIRNZQV-YWVIFJGQSA-N 455.475 -1.098 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[C@@H]1SC(=N)NC1=O 1797750709 NRRYMBAWVOSILM-ZNLHFFCSSA-N 475.531 -1.309 50 20 JAGD CC[S@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930319 GMUWCINOZXNWKR-GEFUHLBYSA-N 452.338 -1.405 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1835938579 ZQQMDDDZHYYFER-YQYRJILISA-N 457.336 -1.223 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1779032555 SYPSNEJPFYQBHO-QFIPXVFZSA-N 482.501 -1.228 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779176705 LTZHTLZCADQYIA-NYHFZMIOSA-N 467.291 -1.582 50 20 JAGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1786983500 VWDLGICZFXFLGV-VCQFHVMDSA-N 474.348 -1.238 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728391 SUPUATCXOOQEON-PBHICJAKSA-N 453.945 -1.532 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934270 SBMVUWVMYKTVBY-QFIPXVFZSA-N 461.324 -1.401 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CS(=O)(=O)N1CCCC1)CCO2 1783935272 RESLKFKNONJHOY-LJQANCHMSA-N 459.569 -1.385 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785215273 MSXAZICTGNSEST-WBAXXEDZSA-N 457.252 -1.235 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)no1 1801011306 HCMVTPSBZRKIIZ-HBCWATKFSA-N 450.496 -1.325 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807946607 AWLUNOADRLOKCN-BEFAXECRSA-N 488.273 -1.479 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCN1C(=O)C=CC1=O)CCO2 1832024465 GYDUCHGDDRTSSP-OAQYLSRUSA-N 465.507 -1.869 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1NC(=O)NC1=O)CCO2 1832698426 YQHMBCHRBQEMCQ-ORAYPTAESA-N 454.484 -2.586 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928103 DNYOTSAFXDMBLH-QFIPXVFZSA-N 468.080 -2.570 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1 1835937909 AYWPNSZYUSRRNH-FQEVSTJZSA-N 458.236 -1.014 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)CCO2 1779029984 CUORDWVGSPWZML-FQEVSTJZSA-N 489.514 -1.406 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3NC(=O)NC3=O)[C@H]2C1 1785157282 LCVIYOHGNIFWMG-ZVFIJVIPSA-N 473.490 -1.302 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21)c1cccc(B(O)O)c1 1786984406 KRDLZNUBVGUWOY-YEWWUXTCSA-N 488.331 -1.575 50 20 JAGD O=C(NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccc[nH]1 1835927208 MAWXTMPCFIGBDT-QHCPKHFHSA-N 484.318 -1.415 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1839664241 PUBIDSKLUUJYEV-LWROZRRASA-N 485.501 -1.166 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840852753 YMMJDXXDQOYXPE-UGKGYDQZSA-N 461.324 -1.259 50 20 JAGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(=O)C(=O)O 1779374138 CPZGVMNVIJMQJZ-QVKFZJNVSA-N 476.490 -1.644 50 20 JAGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2)NC(=O)NCc1ccccc1 1780969933 OHVSKJBRMJHBGK-MBSDFSHPSA-N 489.577 -1.245 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21)c1cccc(B(O)O)c1 1786984360 IMXIODUNPQGWCV-IEZWGBDMSA-N 455.276 -1.017 50 20 JAGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982632 KOLXNXYIWLIHQO-KYHPRHEASA-N 452.932 -1.128 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835538420 DLCYGTHDXADJHY-SFHVURJKSA-N 471.212 -2.839 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C[C@H](O)CN3)CC2)CC1 1836359508 RBZHSPVBYHMMIE-LPHOPBHVSA-N 459.551 -1.407 50 20 JAGD Cn1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1=O 1837455656 CAXZOWOWDHPJHD-QFIPXVFZSA-N 470.486 -1.232 50 20 JAGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1 917940890 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1836671845 FCJVOQPFXVNXRR-JOCHJYFZSA-N 460.340 -2.316 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839082503 FUAHRHZWVWPXTN-NRYAXDJKSA-N 485.346 -1.163 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840192766 BKBUPPHNYVJNAO-LJQANCHMSA-N 467.504 -1.427 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791291188 PENACQYCWAQHBZ-JQFCIGGWSA-N 461.523 -1.349 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc([N+](=O)[O-])cn1 1794004045 KBWDUHLRVBCJHM-DPIQGUFMSA-N 458.435 -1.307 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736224 OFVINBSJGWWUFS-KPEUIFRASA-N 463.296 -1.587 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1797750713 QUZQYOIJHHYLSC-CULMDFNYSA-N 489.514 -1.646 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831456399 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O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1)c1cccc(B(O)O)c1 1834801588 ZYCYSRRTUYTPQV-UHFFFAOYSA-N 468.319 -1.523 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1835928285 IGBJZMJCROHONZ-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928684 VDKXHESQWWHYPD-RXVVDRJESA-N 474.348 -1.537 50 20 JAGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839916431 OYFQTIOPJRUYEF-YJBOKZPZSA-N 466.373 -1.240 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840262001 KNYJFDFXWLTXLT-OAQYLSRUSA-N 457.248 -2.639 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1831019441 DDKUALBQAAHDCY-HXUWFJFHSA-N 462.463 -1.793 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1=NN(C)C(=O)CC1)CCO2 1832380967 SMTMFGHZMXMGCT-HXUWFJFHSA-N 452.512 -1.576 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798677 XDFJIDXIVVMMJH-HSZRJFAPSA-N 474.367 -1.798 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801069 JDBUBHHIBWUPMY-NRFANRHFSA-N 474.367 -1.297 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799144820 BSFUSBSPCYDCTJ-GOBLKYCHSA-N 455.320 -1.029 50 20 JAGD CN(C)c1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)o1 1833899897 YSCAJPBCFLEION-NRFANRHFSA-N 458.280 -1.196 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1835928141 FUORYXYMKWCJLP-HXUWFJFHSA-N 458.236 -2.049 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2c1CCC2 1835930259 FVMJXLAODLFTQZ-HSZRJFAPSA-N 468.319 -1.028 50 20 JAGD NC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939637 CLINPVPOOGDCPK-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)n(C)c1=O 1793110954 SLHZRIKNVXMCKK-RNJOBUHISA-N 452.899 -1.328 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1796299751 BRTXTIVHJVXELF-RMHZUWNSSA-N 492.533 -1.226 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)n(C)c1=O 1796361590 KHUOQNJKOKRGEU-QPPBUOOMSA-N 456.862 -1.442 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817814154 BZXYNBYJMOVUNM-OAHLLOKOSA-N 477.250 -1.165 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837730392 YJFQPQRXHXFSHV-RXVVDRJESA-N 463.296 -2.413 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840896418 YRSDQTBLTNDSEP-HXUWFJFHSA-N 493.372 -1.703 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291073 KRGMBFFZLBDRAU-XLAORIBOSA-N 470.523 -1.166 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccnc1C(N)=O)C2 1797751811 SPXSCFHMKWZEFT-GNXNZQSNSA-N 454.447 -1.909 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833474902 SZJXBHQWFZUKHJ-OAQYLSRUSA-N 472.458 -1.532 50 20 JAGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1839966427 DFUQOJDSGHEAFL-QAPCUYQASA-N 466.373 -1.097 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1NC(=O)NC1=O 1793941078 FYBKTZSKHPKGOV-MRAVKPJSSA-N 459.463 -1.692 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739949 VNITVJCDGKGZGU-KPEUIFRASA-N 463.296 -1.587 50 20 JAGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1830538910 UZIZMFFBRWOVKN-PIGZYNQJSA-N 484.311 -1.086 50 20 JAGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)no1 1835928298 IXHVEZZYOQTLDW-QFIPXVFZSA-N 486.290 -1.238 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185906 VOIHONWMAXAQEW-JXFKEZNVSA-N 457.528 -2.033 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1779037142 PSMSADWIIIAISG-NRFANRHFSA-N 485.457 -1.101 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)no1 1779125159 ZCZWDPKKJIWCKJ-OAQYLSRUSA-N 456.264 -1.464 50 20 JAGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cn2[nH]cnc(=O)c12 1789176418 GXEXYHSSLVAANL-SNRMKQJTSA-N 479.302 -1.082 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829753652 ZAWFDXSPAYPJFK-IBGZPJMESA-N 461.309 -1.357 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833197036 PBBRVCMGEASNBL-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938546 XRQXWWWJKRRVTP-ZHRRBRCNSA-N 469.307 -1.273 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COCCO)CCO2)C1 1839194021 MWMKMUOSPCLCHE-QCBCRBAMSA-N 451.480 -1.414 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1840185631 RARBNSVRFZJIDQ-QUCCMNQESA-N 457.528 -2.534 50 20 JAGD COc1ccc(C(=O)NNC(=O)COC(=O)C2=NC=CN3CCS(=O)(=O)N=C23)cc1OC 844199767 SFLYQHYLCMKKLS-UHFFFAOYSA-N 465.444 -1.022 50 20 JAGD CS(=O)(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835256241 CZLFJRBCSGSQPO-SFHVURJKSA-N 455.493 -2.200 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1 1835937918 BEXFDQLWHRNTGR-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@](C)(O)CC(=O)O)CCO2 1840181693 IUSURAZKLNVOQL-VQTJNVASSA-N 458.512 -1.568 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccnc3C(N)=O)C2)C1 1840185615 QDKNGBQNGIKJTB-FQEVSTJZSA-N 463.495 -1.982 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CNC(=O)C(F)(F)F)CCO2 1840203762 RBNXYQUGUQPYKF-KRWDZBQOSA-N 467.445 -1.506 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3nc4ncccn4n3)CCO2)C1 1779030854 YCQQYFJGAAOKNV-HXUWFJFHSA-N 451.447 -1.120 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1796440200 HWWBRAXPJKPLHE-RHWYEIDDSA-N 482.461 -1.850 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1796441280 TYSLVDISGQGSCR-FXOZFUDCSA-N 482.501 -1.036 50 20 JAGD O=C1CN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C(=O)N1 1815665935 LFUPFJAQQIFOLA-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830731196 IQVISRCYGLVBDQ-RVKKMQEKSA-N 450.872 -1.463 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460683 JAWZLVFGIBRBSJ-SFTDATJTSA-N 479.490 -1.629 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837610018 GGRQBDYWEJEVTF-KSFYIVLOSA-N 491.549 -1.576 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)c1cccc(B(O)O)c1 1795737306 QYKWADTUDDHIMM-PTEHBNRSSA-N 462.161 -1.075 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371764 ZOVNBJALUZPMOT-XKGZKEIXSA-N 453.308 -1.326 50 20 JAGD CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839682671 DBYDELPLNMBCMA-YCRPNKLZSA-N 464.280 -1.002 50 20 JAGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1 915058716 XBGMRRXDCPKBRD-UHFFFAOYSA-N 470.533 -1.056 50 20 JAGD O=C(O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ncn1 1833492245 LPOSWKHRMVRJCZ-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD Cn1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1=O 1835927752 XPYLGJFMIGPRAZ-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839654543 UZIVSEQJAAHPSD-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839918294 RYGJICNPSNFESX-OAQYLSRUSA-N 465.312 -3.277 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840548959 MDPOIVKVSIVGLE-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)C(=O)N1CCCC1 748247005 JFIKXCHZSAVYFI-UHFFFAOYSA-N 495.558 -1.073 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1779032472 LEBUUYOMICPAFH-OPAMFIHVSA-N 459.551 -1.236 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728621 WJFABMRTZPWFLE-NJSLBKSFSA-N 465.931 -1.072 50 20 JAGD Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1C 1830949735 PIOMINCGJSKMQQ-JOCHJYFZSA-N 456.308 -1.279 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1)[C@H](O)CCl 1833310822 UMBOLPDWJNLPBM-CQSZACIVSA-N 452.903 -1.403 50 20 JAGD Cc1cn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(=O)nc1O 1835933540 BBKZBQGAENZDGH-QFIPXVFZSA-N 486.290 -2.293 50 20 JAGD N=C(N)SCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935811 SXCKDTWRFJCFGL-IBGZPJMESA-N 450.326 -1.547 50 20 JAGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]nnc4n3)CCO2)C1 1836404806 UMBQIVZJCRBMBE-GTNSWQLSSA-N 484.311 -1.086 50 20 JAGD Cn1c(=O)c2c(ncn2CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(C)c1=O 16162740 MGRARRVTFMQZOK-AWEZNQCLSA-N 486.441 -1.646 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611036 GYTOBQVAEXFVDS-MGHWNKPDSA-N 462.507 -1.571 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836255861 XYMYZILYEHNVHT-CXAGYDPISA-N 462.912 -1.492 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839386760 NBFORBNFZUHXIM-HTAPYJJXSA-N 493.322 -1.721 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)N1 1784093499 ADHSLLULUFLTAQ-CMXYNOPPSA-N 488.994 -1.254 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809966692 JXPSMBYQQYRJKC-UHFFFAOYSA-N 453.241 -1.064 50 20 JAGD CC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829855052 DGUWLRXSMKSLHY-LAUBAEHRSA-N 462.507 -1.330 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928343 LKXMHXAEBLZLNY-JOCHJYFZSA-N 472.307 -1.407 50 20 JAGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2)NC(=O)NCc1ccccc1 1845038799 VDNFWPTXIFZPFF-UHFFFAOYSA-N 494.516 -1.024 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031975 IGDYOMGEYKBSPD-OAQYLSRUSA-N 468.474 -1.559 50 20 JAGD CN1CCN(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788610868 YGGKBKNTXHQJHQ-VDGAXYAQSA-N 473.578 -1.084 50 20 JAGD CS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797894 IUNHMJQYQIEAPA-UHFFFAOYSA-N 451.354 -1.404 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1835927329 NGUHRYPESCBQLI-OAQYLSRUSA-N 457.248 -1.851 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839649829 MBJLIBFWHAUQMU-QFIPXVFZSA-N 470.291 -1.435 50 20 JAGD Cc1cn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(=O)nc1O 1801969758 GZVMQOKVHTXQPC-JLVBRIDZSA-N 456.264 -2.159 50 20 JAGD CC(C)n1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n1 1835936810 FCPVRWVYHMDELQ-OAQYLSRUSA-N 457.296 -1.077 50 20 JAGD O=C(/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)NC1CC1 1837250955 VCZXKIDOLBMNGY-ICTHTSFCSA-N 457.292 -1.729 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839384316 AORGSSFLCXDBHU-JCGVRSQUSA-N 451.904 -1.114 50 20 JAGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c(C)n2n1 1796923541 PNGDLVYNQGHATM-CWPLJXCYSA-N 464.291 -1.062 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(B(O)O)c1 1834801203 UFQPEQJNMWXPMS-UHFFFAOYSA-N 479.151 -1.455 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927227 MYROWBVZJWJUGA-JOCHJYFZSA-N 468.275 -1.756 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCN(C)CC3)CCO2)C1 1836672475 YAFZXUZYBGQGIS-UPQSEYGOSA-N 489.577 -1.176 50 20 JAGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)C1)NC(=O)NCc1ccccc1 1843235328 MDNGWMFICZQRFY-UHFFFAOYSA-N 494.516 -1.024 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807190377 FLMJMLWBDYGVOQ-HQRMLTQVSA-N 453.308 -1.326 50 20 JAGD CC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456927 SUKOSINSSSSTSV-UTKZUKDTSA-N 462.507 -1.330 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459123 IYEJMCIUCGOCKT-QTYPKTMWSA-N 467.548 -1.086 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838394009 KDCZUBZGQFIAKF-QHCPKHFHSA-N 490.561 -1.052 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838501011 BHOICYMFGHCGGT-QHCPKHFHSA-N 493.285 -1.847 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c(=O)cn1)CCO2 1838636283 XBRSUGOLONVDHY-PFRKPPGBSA-N 471.474 -1.026 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)N(C)C)C2)C1)NC(=O)NCc1ccccc1 1839053988 ABKXYPPQTUKNIH-HSZRJFAPSA-N 490.561 -1.123 50 20 JAGD CC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1 1795734746 YPQWQYJRXNJMCX-RMFSNUHRSA-N 458.324 -2.266 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)N1CCOCC1 1797801873 NENUKFBLLWDGDV-WCOXYISYSA-N 462.507 -1.639 50 20 JAGD O=C(C[C@H]1NC(=O)NC1=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833762052 WRNBYDAIEKLMBI-GOSISDBHSA-N 471.323 -1.850 50 20 JAGD N[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1cccnc1 1835928259 HHGUVVLORDOWLK-OFNKIYASSA-N 468.319 -1.079 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837047728 PFUOPLGJSMPFTQ-UHFFFAOYSA-N 472.307 -1.470 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837209324 UFOXNDIYTHPGQO-OXQOHEQNSA-N 480.478 -2.180 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837457035 SYJWTJUCQIYSEQ-NRFANRHFSA-N 471.474 -1.133 50 20 JAGD C[C@@](O)(C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(F)(F)F 1832156050 LSXFURULEAPEQL-MSOLQXFVSA-N 460.214 -1.250 50 20 JAGD O=C(COc1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935585 UOSWKMNJMKWIFU-JOCHJYFZSA-N 455.276 -1.090 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1nc(N)n[nH]1)CCO2 1837277212 GPXZHSIAVZLHLE-LJQANCHMSA-N 452.516 -1.851 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1826085174 ILGHSZGCGPICPN-VIFPVBQESA-N 474.507 -1.132 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458764 AZYGOHFYTFATAY-UWJYYQICSA-N 478.506 -2.094 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837757783 DOIDWVBMMBFKRF-HSZRJFAPSA-N 484.318 -1.011 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)N3CCOCC3)[C@H]2C1 1788651023 CHTXYUCAXOVXCF-YCFGMDTISA-N 462.507 -2.071 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)ncn1)C2 1797749669 JGVLCZJRHZIXCY-CULMDFNYSA-N 455.431 -1.310 50 20 JAGD O=C(CN1CCOCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834619991 VEZKKSBKKNOASO-UHFFFAOYSA-N 458.368 -1.116 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCNC3=N)CCO2)C1 1835634940 WKZODNRNPAODET-XAOCGEIJSA-N 474.522 -1.583 50 20 JAGD CN1CCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2C1 1835939304 LTJFDIAEDUFEAT-DEOSSOPVSA-N 497.361 -1.218 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1840184146 VORZVABEBWJCCP-LJQANCHMSA-N 452.468 -1.669 50 20 JAGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)[C@@H]1CCS(=O)(=O)C1 753562972 GHYVYQKOKFWSPG-OAHLLOKOSA-N 474.561 -1.413 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCNS(C)(=O)=O)c(=O)n2Cc1ccccc1 920445254 VHXALPPGSREGAT-UHFFFAOYSA-N 491.530 -1.485 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028638 GNHDXDBUYJGINU-BFUOFWGJSA-N 453.521 -1.191 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779031738 XFFJPKYTNMHIAL-OAQYLSRUSA-N 453.264 -1.878 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCO)NC(=O)NCc1ccccc1 1799339053 HZALGZOHTRWWAN-RMFSNUHRSA-N 463.535 -1.069 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)NC(=O)OC(C)(C)C 1799684903 UJNDQINMWCMJIB-VLWCASSMSA-N 457.528 -1.208 50 20 JAGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1800849464 ZXPNASXVWGEQOA-OPMZPASUSA-N 488.582 -1.355 50 20 JAGD N=C1NCCN1CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834704713 PHSWXWARPGRRLP-UHFFFAOYSA-N 456.356 -1.608 50 20 JAGD O=C(O)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ncn1 1835927061 CLLVXFUSCKWYHJ-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD O=C(O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934117 LIGZTGSJTNZWKP-LJQANCHMSA-N 452.294 -1.746 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935624 VZVRRQMEBIQYDM-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD C[C@]1(NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)CCS(=O)(=O)C1 916516094 DDCKWNIGNCBNBE-KRWDZBQOSA-N 460.582 -1.086 50 20 JAGD CN1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1778847795 VCSVMNYGCPZMFT-NFBKMPQASA-N 458.368 -1.259 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1788610391 YXLQAODHQWUTHQ-OWQGQXMQSA-N 492.496 -1.005 50 20 JAGD CN(C)c1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)o1 1833899181 ITLRTZIFZOGQOO-NRFANRHFSA-N 458.280 -1.196 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935623 VZVRRQMEBIQYDM-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[n+]([O-])cc3)C2)C1 1837458819 FACMYBJAFATSLC-NRFANRHFSA-N 456.459 -1.298 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839048148 MWWUUSFOCGNPCH-QHCPKHFHSA-N 479.302 -1.278 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202968 VFLMOMGHLXNGAE-GOEBONIOSA-N 456.309 -1.580 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1840033583 KGMOOHZDRRQLLK-JLJPHGGASA-N 450.330 -1.123 50 20 JAGD Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 14231902 MZFSFPOSYIZEMQ-UHFFFAOYSA-N 465.488 -1.214 50 20 JAGD CN[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)C(=O)O 1795643857 WHXXZWVDBTZYPZ-BMQTXXJKSA-N 490.561 -1.015 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1CCSCC1)CCO2 1829715999 IFYHCOPBBRDWAC-FQEVSTJZSA-N 457.597 -1.135 50 20 JAGD O=C1CN(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C(=O)N1 1833711162 DFSKPGIGKIHRHY-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934269 SBMVUWVMYKTVBY-JOCHJYFZSA-N 461.324 -1.401 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1837461280 SJUSHVXZMZEFJQ-OXJNMPFZSA-N 481.531 -1.668 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cn1ccncc1=O)CCO2 1839665371 BZCZRVRINUVJOD-FQEVSTJZSA-N 450.496 -1.927 50 20 JAGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)C(=O)C(=O)O 1781541209 CFXFMGVYFZWHBD-IIBYNOLFSA-N 461.280 -1.963 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NNC(=O)C1)NC(=O)NCc1ccccc1 1797684352 ACRUMGOXSHYSSL-CWPLJXCYSA-N 471.518 -1.202 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831456215 GDVIMVRNXJIYGQ-FOIQADDNSA-N 468.337 -1.883 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CN1CCS(=O)(=O)CC1)CCO2 1832484365 LXIKPLDYROXZDX-QGZVFWFLSA-N 482.397 -1.042 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800658 WBKKBVSIABHUNS-UHFFFAOYSA-N 465.381 -1.014 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1835935596 LZCBVJFCMKCDQB-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2C1 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483.485 -1.520 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807950156 TYVZIAGQTDMNFN-AUUYWEPGSA-N 482.505 -1.100 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ncn3)CCO2)C1 1831737324 YULCJNDDHHDINP-HXUWFJFHSA-N 457.447 -1.436 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835446165 ZAEBDLAOYIINBI-QFIPXVFZSA-N 476.534 -1.523 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1835930512 KWOATHRXTDGRFF-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1CCN(C)CC1 1835931259 KBOLVXQSAJUBEI-MBSDFSHPSA-N 474.367 -1.928 50 20 JAGD C[C@@H](NC=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839163998 UDYYPONOHCLZEQ-JPYJTQIMSA-N 490.561 -1.077 50 20 JAGD O=C(CNC(=O)c1ccco1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787081671 LDADZGLSQVLEST-IEZWGBDMSA-N 455.276 -1.017 50 20 JAGD 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CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(=O)C(=O)O 1817476984 JPMQLUYKSJTIRS-HNNXBMFYSA-N 457.252 -1.062 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837501993 GGUASEVCKSOTNR-LAUBAEHRSA-N 486.522 -1.689 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CO)on3)CCO2)C1 1838802478 YMAUICHADIKATB-FQEVSTJZSA-N 460.447 -1.451 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(=O)C(=O)O 1839202931 UFRNMAISLOWXCK-ABAIWWIYSA-N 454.249 -1.324 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3NC(=O)NC3=O)C[C@@H]21 1787506771 LVUKSHRXHNGCOF-KWRBDPEUSA-N 473.490 -1.302 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611003 FITINKGUOSSFLN-PYTWLRIVSA-N 461.523 -1.014 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737676 IXHXOFPKBWTZSD-FAYQHZLMSA-N 453.326 -2.103 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CS(C)(=O)=O)CCO2)C1 1835254541 HXNDWMFOPFRODW-KNGGAZFVSA-N 469.520 -1.379 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459614 SXEBOBPZPCWUGA-QKKBWIMNSA-N 477.522 -1.537 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1 920276172 QHUYSENEPAVVTJ-INIZCTEOSA-N 467.548 -1.121 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784371178 PHDCCQLEBVETBG-DENIHFKCSA-N 469.307 -1.720 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)n1 1797909302 YIFPRKYCCQZWHX-XEMDLRDOSA-N 468.319 -1.130 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832326624 LAAQMFHQRRDIPG-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2C1 1839621536 CZYGNGGOZAKKAV-XMMPIXPASA-N 497.361 -1.218 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1843415857 VIJQVKPFYZXWBW-SSDVNMTOSA-N 452.435 -1.236 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372674 VJFQXNHUPRDOFL-JBYIUTFZSA-N 476.534 -1.036 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)N3CCOCC3)C[C@@H]21 1788611258 REDRGYHIGLWUBG-VZYKRBATSA-N 462.507 -2.071 50 20 JAGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(O)O)C2)C1 1838526770 CGYWRJAJEZRBAO-IBGZPJMESA-N 453.404 -1.099 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1840184707 BUJVDGSRGNVEOW-FQEVSTJZSA-N 459.544 -2.898 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779181714 NAKTYENCNYGNAM-BTYIYWSLSA-N 461.523 -1.202 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)[C@H]1SC(=N)NC1=O 1795738814 GVTHVGHNANTJLY-MIGXYKPQSA-N 460.321 -1.628 50 20 JAGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800837272 KNSSLMWGLQPISR-RMFSNUHRSA-N 464.324 -1.361 50 20 JAGD CN(C)C(=O)NCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833143664 BVHSNPVGTGTCNJ-UHFFFAOYSA-N 459.356 -1.177 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833450528 REDDZMNTKXUWCW-INIZCTEOSA-N 494.423 -1.121 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1835931732 ZIBHQVRMFFLOIZ-JOCHJYFZSA-N 498.326 -1.180 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(CCO)CCO)CCO2 1839920221 SAFUOLDXRATGNQ-HXUWFJFHSA-N 459.544 -2.898 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779067924 HPIUGWRRNFGOQD-NQIIRXRSSA-N 462.264 -1.695 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831322998 HXTYKMVXCQZBBT-QRWLVFNGSA-N 483.352 -2.236 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1 1835932152 QMEOMUHHMDQENP-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1835935480 HBCXOWZIBIJGNO-QFIPXVFZSA-N 481.274 -1.502 50 20 JAGD CC(=O)N(C)[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457666 MJQRZMWCPRXAHI-QKKBWIMNSA-N 462.507 -1.378 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979871 MWDRPICXAGESPO-QZHFEQFPSA-N 458.349 -1.014 50 20 JAGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983302 MNCVDJBHLDPGEL-VMXMFDLUSA-N 452.320 -1.075 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1835541331 YQNNXBJKUKCTOO-YPMHNXCESA-N 462.209 -1.142 50 20 JAGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cn2[nH]cnc(=O)c12 1835931201 IGFIGIMUXZTICT-HSZRJFAPSA-N 495.301 -1.605 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1835934371 QUOKGMZDVRDYRW-SBUREZEXSA-N 468.319 -1.035 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)s1 1836078589 ULEYRNQJAUACJF-HXUWFJFHSA-N 460.321 -1.161 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1837459975 XMSMLVURRJZOKR-IBGZPJMESA-N 474.434 -1.300 50 20 JAGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837513116 ATAXMFVBDVNSGW-WBVHZDCISA-N 450.330 -1.122 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840151130 VWVDGJMXXJWHIW-YJBOKZPZSA-N 467.972 -1.573 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804346950 XFKFRIUIBNDIBG-RPVQJOFSSA-N 480.485 -1.002 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3NC(=O)NC3=O)CCO2)C1 1832691009 IYNDMLCPDMETKQ-XOBRGWDASA-N 475.462 -2.647 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459669 VYTKAADHFWEEIM-BTYIYWSLSA-N 472.506 -1.317 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cn1 1840183566 MHDYDRVWVHGNBH-FQEVSTJZSA-N 450.496 -1.072 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293016 FSKXWMXTBJVDNM-KANFNMMFSA-N 477.566 -1.190 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833307274 ABHDVVQONGXPQI-QFIPXVFZSA-N 468.275 -1.756 50 20 JAGD CC[S@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938213 QNKHCXIDXIKHKO-GEFUHLBYSA-N 452.338 -1.405 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837479854 CIAKJOAOUZNKCG-AOMKIAJQSA-N 469.307 -1.273 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(=O)O)ncn1)CCO2 1833496566 PFDPNLIWLSAYMZ-FQEVSTJZSA-N 464.479 -1.382 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833570882 QRHFIUDNCYAUGP-NRFANRHFSA-N 474.254 -1.154 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938018 GPMVRHNVQGNXPZ-QVKFZJNVSA-N 462.312 -1.856 50 20 JAGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 912522431 SVWJVPBIQVPTJN-UHFFFAOYSA-N 473.489 -1.160 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796437559 IPCNFZLSQVGDGN-HGKCTWBKSA-N 465.337 -2.005 50 20 JAGD CN1N=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCC1=O 1832375053 KPUCAKWTNNEWJT-OAQYLSRUSA-N 473.490 -1.637 50 20 JAGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)C(C)(C)C 1835927882 ZMMJJEVNPZNAKC-XXBNENTESA-N 475.351 -1.013 50 20 JAGD O=C(c1ccc2nncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937146 QHYQVNJMJHWDNW-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937436 WHQCOWFVKXVJHU-OAQYLSRUSA-N 495.363 -2.138 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)C(=O)C(=O)O 1837459960 PNQRTTZCLUHWTQ-HXUWFJFHSA-N 478.462 -2.702 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839388091 FQOANEYABPZKSI-UWJYYQICSA-N 487.554 -1.341 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840182593 OELAYRHLAAJLKD-JOCHJYFZSA-N 476.534 -1.359 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810491227 GGXGWZKTKRRWOD-UHFFFAOYSA-N 465.279 -1.349 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834564892 JUJAQKGJUKLYQT-YJYMSZOUSA-N 455.899 -1.050 50 20 JAGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935612 VRHJKIJNDXIAAE-QHCPKHFHSA-N 482.302 -1.739 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940874 CKOIUANCQDVDHX-FQEVSTJZSA-N 493.372 -1.703 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837115895 OKEZNJYKRSRPTR-KRWDZBQOSA-N 487.517 -1.105 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840203087 QKPGVBYXJFFBAG-SFHVURJKSA-N 473.213 -1.885 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779198915 KQBQXAUZUNQFNB-PLMTUMEDSA-N 463.296 -1.442 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)n(C)c1=O 1787444388 YDJADZUQPMEJPD-ASHKBJFXSA-N 470.889 -1.052 50 20 JAGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(=O)nc1O 1788611180 MVEJHUHEYUAYHG-JQFCIGGWSA-N 485.501 -1.451 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)C=CC3=O)C[C@@H]21 1788611717 UMITYZZRJAWJKR-JQFCIGGWSA-N 470.486 -1.407 50 20 JAGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)N1CCN(C)CC1 1791291113 ZPPGLNZQWUQRCV-XWSJACJDSA-N 452.600 -1.025 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1837459758 NABPVOOVQROAFP-OAQYLSRUSA-N 487.473 -1.670 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919665 VQWSKLADNMMLOP-PBHICJAKSA-N 452.346 -1.487 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)N1 1845873777 JBURSQKKIVGXKG-DLBZAZTESA-N 486.359 -1.637 50 20 JAGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1cnnn1)CCO2)NC(=O)NCc1ccccc1 1780970302 UJBNJYGYLYYPBR-NRFANRHFSA-N 471.522 -1.151 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ncccn4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983503 VWNMZTRUBQCKIZ-XIRDDKMYSA-N 450.264 -1.289 50 20 JAGD CN[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)C(=O)O 1835760652 DTZBWQIRWMNQPI-MGPUTAFESA-N 464.479 -2.182 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cn(C)c(=O)nc1O)c(=O)n2Cc1ccccc1 918016838 KNAAZHWZJSKWEG-UHFFFAOYSA-N 494.468 -1.312 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)C=CC1=O)C2 1779375790 SSZGNYGKEIYCMX-OPAMFIHVSA-N 470.486 -1.262 50 20 JAGD CN1CCN(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)CC1 1786728669 QHYUHWWZNJBUKE-JBACZVJFSA-N 458.368 -1.403 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2)c1cccc(B(O)O)c1 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JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840809464 ZCFIDBKNWYAVBV-KUHUBIRLSA-N 458.899 -1.032 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799073723 VCLIQPVHZZDYKA-ZSBFGKGUSA-N 499.553 -1.207 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927565 SXAOBPNXXOJRFH-NRFANRHFSA-N 495.363 -2.833 50 20 JAGD O=C(CN1CCSCC1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933732 BOPDUYBBLRXVGR-NRFANRHFSA-N 463.365 -1.515 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1836768428 FBYODQRELYMIDH-JOCHJYFZSA-N 482.582 -2.020 50 20 JAGD CS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457614 LBWQULLDMPXUGE-SFHVURJKSA-N 455.493 -2.200 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517208 ORQXFGKVFWZAPE-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1779036794 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COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn1 1834531567 FLQFFHQKABQFER-HXUWFJFHSA-N 450.496 -1.072 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837379559 BGIHCXRIVGXRMV-SZNDQCEHSA-N 477.522 -1.537 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H](N)C(N)=O)[C@H]2C1 1786888997 WURWOYPPRKKZBD-YZSJLHEHSA-N 461.523 -1.307 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H](O)N1CCOCC1 1810350143 PUNAIHBMQWGOSB-GREBRCKQSA-N 468.319 -1.268 50 20 JAGD O=C(CN1C(=O)CNC1=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337116 NDSLHSCKOGCGKY-LBPRGKRZSA-N 457.277 -1.400 50 20 JAGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(=O)C(=O)O 1817476987 JPMQLUYKSJTIRS-OAHLLOKOSA-N 457.252 -1.062 50 20 JAGD CCOC(=O)/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1834774572 WLVPLIUFDWUPNQ-YEFOHOTDSA-N 461.475 -1.126 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930637 QYYLHUBWCJGAQL-WIYYLYMNSA-N 463.296 -2.413 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)CC2)CC1 1839108419 JEACSJOMRDVQSW-QFIPXVFZSA-N 480.610 -1.404 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840370107 HFACRVXIBNCDGN-MDZRGWNJSA-N 457.915 -1.487 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 728510045 UBWCWNZKPPAIFX-LLVKDONJSA-N 470.551 -2.045 50 20 JAGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCS(=O)(=O)N2CCOCC2)cc1 748111882 QBCFJRKOSSPPPJ-UHFFFAOYSA-N 477.565 -1.392 50 20 JAGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812390202 RXRIYYVCXZLGKA-QFBILLFUSA-N 468.275 -1.376 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1)c1ccc(B(O)O)cc1 1834798930 HXXGAPKUGRXOOG-UHFFFAOYSA-N 467.335 -1.192 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928756 YGJRBPJBZDBPDC-FQEVSTJZSA-N 462.699 -1.014 50 20 JAGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cccc1=O 1835935583 UOLNBEUUBXQXAU-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD C/C(=C\C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 1123811184 QEJARUYPUPVGJJ-RTZSPXFWSA-N 450.583 -1.083 50 20 JAGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(=O)C(=O)O 1824670123 QWAAWEBASXNGEF-LBPRGKRZSA-N 460.277 -1.408 50 20 JAGD C[C@H](NC=O)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054186 KSVYXDMSIXOFHG-MBSDFSHPSA-N 490.561 -1.077 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840431216 ZJIOAZLWLHISOR-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982697 DLFOYUFSRRVWAC-XIRDDKMYSA-N 450.322 -1.134 50 20 JAGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(N)=O)[C@H]2C1)NC(=O)NCc1ccccc1 1792282735 RSJUHOIKBBVLGG-BZSNNMDCSA-N 475.550 -1.019 50 20 JAGD Cc1cc(C)n(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1833037550 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NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1810302104 FUGIOOJVNLKNLP-YJLNNSPDSA-N 468.518 -1.008 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)C(=O)C(=O)O 1835932024 LAIRAVGEBVTUPC-FQEVSTJZSA-N 463.252 -3.021 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932176 ROGQWOXZRUXBSH-NRFANRHFSA-N 465.312 -3.277 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831335284 LPILGMWBGDKCKF-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CC1 1837457881 UTFUMRHPZGTJKU-QHCPKHFHSA-N 489.577 -1.607 50 20 JAGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)NCc1ccco1 1837637452 OGPNGHYZBGSUNA-JXSPYEIYSA-N 497.313 -1.098 50 20 JAGD CN1CCN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)CC1 918779515 YAOWPDULKFKIBX-UHFFFAOYSA-N 478.539 -1.874 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1801013372 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CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794110891 AKFFPHUGKZAPEG-VYGYDYRJSA-N 476.534 -1.045 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486878 QLVSLFWGMPIHET-NRFANRHFSA-N 461.368 -1.114 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1835736693 BTCRJAOJJCOJGH-GOSISDBHSA-N 474.566 -1.537 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1837883020 BNRSVLZMHQCMAD-KRWDZBQOSA-N 454.572 -1.049 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2 1838826672 UDKCTSFBRKPZSQ-HXUWFJFHSA-N 458.236 -1.014 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1840184030 OKYAZCKOMSKFHI-NRFANRHFSA-N 465.507 -1.161 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1840184275 GIIKTNHRPOASBG-IBGZPJMESA-N 452.516 -1.851 50 20 JAGD CC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1797304013 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CC(C)(NCCC#N)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835674785 NPLYFBVUKCNYNO-JOCHJYFZSA-N 458.324 -1.282 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1835922756 HELINCPNYHQMCL-OAQYLSRUSA-N 482.262 -2.519 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839043810 UURASTBQMGPHRP-KUHUBIRLSA-N 472.951 -1.052 50 20 JAGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(S(=O)(=O)N2CCNCC2)cc1 730569929 BYXIQWLCMVMFHT-UHFFFAOYSA-N 495.587 -1.295 50 20 JAGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982629 KOLXNXYIWLIHQO-DFGXFYAUSA-N 452.932 -1.128 50 20 JAGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CNCP(=O)(O)O)CCO2 1835535463 OJZNSPMFJUGUSX-AWEZNQCLSA-N 458.246 -1.047 50 20 JAGD CC[S@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837238828 PCYXKYWNBHDHQQ-QJWGWKRISA-N 452.338 -1.405 50 20 JAGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn2[nH]cnc(=O)c12 1838469772 UTWBSLNGIVOWLW-QHCPKHFHSA-N 495.301 -1.605 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105895 RVPDEQLCSLVTCP-JOCHJYFZSA-N 474.518 -1.232 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031948 HXLLNSONCHRTMP-UTKZUKDTSA-N 477.474 -1.377 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1797752840 IQLIRQADIOKEAV-DBWKPXFBSA-N 478.469 -1.395 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n(C)n1 1835934994 BEAKTLHWTYMJNG-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD O=C(COc1cccnn1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939962 QMXWLZNTSJHMTD-NRFANRHFSA-N 456.264 -1.695 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835972509 XOINGGWAWCGPFT-HXUWFJFHSA-N 462.699 -1.014 50 20 JAGD O=C(Cn1ccccc1=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835995217 NNMAUTQISVNXRC-JOCHJYFZSA-N 455.276 -1.702 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1837457087 VJIUZRGJMQIKFB-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(N)=O)C[C@@H]21)NC(=O)NCc1ccccc1 1789728177 YDEGNZIFSJVNCG-BZSNNMDCSA-N 475.550 -1.019 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)N1 1790696111 UBZZHSBZXZRQSD-CMXYNOPPSA-N 488.994 -1.254 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360985 NIMGAMLZZDZIDV-DWLFOUALSA-N 468.319 -1.268 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840178931 WTIWFNUPLHBAPE-LEWJYISDSA-N 464.280 -1.948 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840187285 QPEFSTZJMFBLFK-IBGZPJMESA-N 487.604 -1.324 50 20 JAGD COCCN1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1=O 914458724 KDZASVGCUIIQPL-HNNXBMFYSA-N 454.505 -1.037 50 20 JAGD Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c2ccccc21 1795734642 WVVDIDYMWACORG-FAQVEIGNSA-N 478.314 -1.077 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812713850 CHLQYWHVPPFIDB-LAUBAEHRSA-N 485.545 -1.314 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832018952 CODLZEBLLJULIF-JOCHJYFZSA-N 471.275 -2.249 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1835928399 NWFURAXAUQUAOV-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1839155107 JIOGGUNRGCQUBH-QZTJIDSGSA-N 456.367 -1.034 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCN(S(C)(=O)=O)CC1)CCO2 1783934682 KRYOGFDNXUHBMO-FQEVSTJZSA-N 473.596 -1.139 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(CCO)CCO)[C@H]2C1 1790911080 OQTBDIUGXAWGNW-WBAXXEDZSA-N 464.523 -2.435 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1813073125 HKQVJYCZYSFQQH-XMSQKQJNSA-N 464.567 -1.253 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931978 JROJBXZUDUMDRT-BXKMTCNYSA-N 496.329 -1.350 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(=O)Nc1cccnc1)CCO2 1837632193 LGJIPQRAWCKNQK-NRFANRHFSA-N 462.507 -1.151 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838328268 ZANQONHNPMWVOF-NRFANRHFSA-N 469.263 -2.361 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)nn3)[C@H]2C1 1790590518 TZPZJFONRBBMHO-RCBQFDQVSA-N 471.474 -1.147 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1834798655 VQBXYHRSRVFNTA-UHFFFAOYSA-N 499.421 -1.284 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1835935637 WRQRHBJIFMFUFU-NRFANRHFSA-N 474.254 -1.154 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840203360 XNGLIAJJINTQDQ-GOSISDBHSA-N 488.423 -1.566 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(=O)n2[nH]cnc2n1 1786976615 YTXFQYLZZBYPEX-QRTARXTBSA-N 466.263 -1.996 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738409 OWHJZSDYRPSJCC-PJSUUKDQSA-N 492.957 -1.189 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNC(=O)O1)CCO2 1831567663 KBJHFWNKIORREO-VMCUBVGNSA-N 462.463 -1.315 50 20 JAGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(C1)C2 1835932080 NACUTNFGJSGYJN-XPPIMPSXSA-N 472.303 -1.220 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836396488 WMOHWKAMTNLRNA-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799148529 WYEHCDMGECUGFO-GOBLKYCHSA-N 455.320 -1.029 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1804089219 HLDHGTFLPHAKFY-KUHUBIRLSA-N 480.485 -1.049 50 20 JAGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835843825 YERBDJVKIDPWJB-NRFANRHFSA-N 474.367 -1.297 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940187 YJJIQTLVYJXLFQ-OFNKIYASSA-N 499.333 -2.093 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1840184910 HIGDFOCXYKCFIP-DNVCBOLYSA-N 460.553 -1.607 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)n2[nH]cnc2n1 1795730514 FGDYKTVZEPXRBU-ISHQNBSSSA-N 481.473 -1.245 50 20 JAGD CN1CCN(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)CC1 1797750493 IAOOQJCVIKVCLX-CWPLJXCYSA-N 459.551 -1.474 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831690466 JOVCCMORYYNULB-QFIPXVFZSA-N 461.324 -1.401 50 20 JAGD O=C(CC(F)(F)C(=O)O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937067 NIIQJRWTQUGBLQ-SFHVURJKSA-N 456.207 -1.454 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938143 NCYGMZFIIKBKBS-NRFANRHFSA-N 469.263 -2.361 50 20 JAGD C=CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459382 NNJKXLMSXPUYHS-SPLOXXLWSA-N 460.491 -1.554 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838531455 KVOMSUARCSVWFI-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(=O)C(=O)O 1839703767 CKYRTLAKVIYACU-IAQYHMDHSA-N 454.249 -1.324 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840151129 VWVDGJMXXJWHIW-QAPCUYQASA-N 467.972 -1.573 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1SC(=N)NC1=O 1796425821 PCKBAHFBDACDGD-BCEUIYSSSA-N 460.321 -1.628 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)n(C)c1=O 1830726844 UIMYIXVRDPRHOE-RNODOKPDSA-N 498.924 -2.510 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840182594 OELAYRHLAAJLKD-QFIPXVFZSA-N 476.534 -1.359 50 20 JAGD O=C(COC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1)NNC(=O)[C@H]1COc2ccccc2O1 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CN(C)c1ncc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)o1 1835935557 UERNOGAQEVQUOY-NRFANRHFSA-N 458.280 -1.196 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937435 WHQCOWFVKXVJHU-NRFANRHFSA-N 495.363 -2.138 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCOCC3)C2)C1 1837457794 RRUIQYIFTCVMQN-NRFANRHFSA-N 462.507 -1.913 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1778116774 GZDDSLWQGWHNAA-OAQYLSRUSA-N 494.574 -1.200 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781859731 UEZKPHFRVSZOPS-KKSFZXQISA-N 478.506 -1.028 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753709 DPBYBFGUQBJPAB-TYYYEBLRSA-N 478.506 -1.269 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1835931056 DVNDCLRNZUBGDA-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2C1 1835932179 SBWGYOQPJGLKCT-XMMPIXPASA-N 497.361 -1.218 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837516860 KMHFDFOZSCMZJU-RQOJDHGWSA-N 492.533 -1.773 50 20 JAGD O=C(CN1C(=O)CNC1=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337115 NDSLHSCKOGCGKY-GFCCVEGCSA-N 457.277 -1.400 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1831019440 DDKUALBQAAHDCY-FQEVSTJZSA-N 462.463 -1.793 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833471353 DXTXZJQOFCRCMJ-OAQYLSRUSA-N 457.248 -1.851 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCN1CCOCC1)CCO2 1835449613 LGGCGFPYLNLLLZ-NRFANRHFSA-N 455.556 -1.462 50 20 JAGD CC(C)n1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835928433 PUPFSAXUUQKDLB-NRFANRHFSA-N 457.296 -1.077 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840431214 ZJIOAZLWLHISOR-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CNC1=O)CCO2 1832334326 JJOQVWGLEXEOGV-LJQANCHMSA-N 454.484 -2.632 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN(CCO)CCO)CC2)CC1)c1ccc(B(O)O)cc1 1834798867 GEMLLEJOQKOVMQ-UHFFFAOYSA-N 476.383 -2.162 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1835930543 LXTJHLXSZFYETD-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD COCCN1C(=O)/C(=C\NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C(=O)NC1=S 920976477 UTYKTUKCZFBMDA-QINSGFPZSA-N 497.555 -1.285 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799680798 AEMKAINIAGZTJW-CXHZTBPHSA-N 463.296 -1.587 50 20 JAGD N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccn1 1835699869 GXUJLQAKIFQWSK-DENIHFKCSA-N 454.292 -1.469 50 20 JAGD CCOc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn1 1835935437 STECZELXXANTSP-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[C@H]1SC(=N)NC1=O 1796427870 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835395061 ANNQSUKGGZCCHV-PCCDRTMGSA-N 476.534 -1.091 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n(C)n1 1835927020 BNDFDPJRBJLMRR-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779032368 OPYZNNSFNRKWGN-QFIPXVFZSA-N 473.534 -1.707 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784518996 VTFTYXXBFCETBC-IKICRFKJSA-N 452.338 -1.360 50 20 JAGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812712991 GRDWAHPKNWZHBX-UGKGYDQZSA-N 470.335 -1.632 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829753171 OTORSBWJDUNXRK-IBGZPJMESA-N 461.309 -1.357 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837047401 ALVDIMZNRHJRJJ-UHFFFAOYSA-N 472.307 -1.470 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)n1ccccc1=O 1837683401 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C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[C@@H]1SC(=N)NC1=O 1801011181 LOEDGZHMXZHIBG-POPZOMSYSA-N 454.553 -1.249 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@@H]1c1cccnc1 1807190730 LIHQLNCVCUOYPS-BJZITVGISA-N 468.518 -1.008 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)CN)C2)C1 1832549561 UXMLHNPNQNVKFI-NJSLBKSFSA-N 463.963 -1.139 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1835938532 XMTXHSWISBQZDR-FPOVZHCZSA-N 463.296 -2.913 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1837657352 URYOPQICKKJLQB-XMMPIXPASA-N 498.345 -1.263 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1840151592 HCMSMZCDEHQFFU-PIGZYNQJSA-N 455.859 -1.864 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779416322 RDBJJOCYRIXEKA-VOQZNFBZSA-N 476.534 -1.537 50 20 JAGD 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O=C(O)c1cnncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788889242 OHBRUXJGEBBZQB-KKXDTOCCSA-N 454.248 -1.238 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794251606 NDIHDONHPMJJDE-QDMKHBRRSA-N 488.549 -1.555 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(=O)N(C)C)CCO2)NC(=O)NCc1ccccc1 1835433605 XMMTVMSOQCIGJH-HSZRJFAPSA-N 490.561 -1.123 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835736786 HMHXWAHZHFCMRT-UHFFFAOYSA-N 494.361 -1.136 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938144 NCYGMZFIIKBKBS-OAQYLSRUSA-N 469.263 -2.361 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1840035437 RIBCSDUQOMTSSI-WMLDXEAASA-N 452.346 -1.487 50 20 JAGD CCNC(=S)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790571855 JBCOSQARCSZUPB-RCBQFDQVSA-N 463.564 -1.238 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364250 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COCc1oncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928439 QAISLRKEZXVDHN-NRFANRHFSA-N 459.264 -1.115 50 20 JAGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c(C)n2n1 1835937112 OZDQONUMBAADQV-HSZRJFAPSA-N 494.317 -1.195 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1836765072 OWWCOOPSNIGYLB-QHCPKHFHSA-N 488.350 -2.400 50 20 JAGD O=C(CN(CCO)CCO)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921353 CATNNKJPWRISDG-UHFFFAOYSA-N 477.367 -1.735 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840151900 QOUWRODJWXLRIR-KZULUSFZSA-N 454.871 -1.259 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 728510054 UBWCWNZKPPAIFX-NSHDSACASA-N 470.551 -2.045 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 728510081 UHMCIRXSGVLICN-LLVKDONJSA-N 454.552 -1.282 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785538462 QIGMICGBGHXQQY-IBGZPJMESA-N 463.346 -1.330 50 20 JAGD CN1CCN(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)CC1 1786979420 GQNKBJHWJABOCS-JBACZVJFSA-N 458.368 -1.403 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)C(=O)C(=O)O 1834824547 AVRNKWJKHBIGAR-MRXNPFEDSA-N 450.286 -1.229 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934042 KZVHWARLJYJRQT-MGPUTAFESA-N 483.352 -2.236 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c(=O)cn3)CCO2)C1 1838638954 VLKPWPFNYPXAHS-FQEVSTJZSA-N 457.447 -1.848 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692625 HZSDOXFYQQGWLK-RUZDIDTESA-N 494.357 -1.167 50 20 JAGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1793980103 NZSVSFCYEQKHEV-NRWUCQMLSA-N 497.350 -1.193 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736009 OFVINBSJGWWUFS-CXHZTBPHSA-N 463.296 -1.587 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(C)c(O)nc1=O)C2 1796446081 LNLRDOILYINCHZ-OBAMXFLESA-N 485.501 -1.019 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(C)c(O)nc1=O 1801971720 HORNUGQIACFJGG-OBAMXFLESA-N 485.501 -1.019 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835972225 LKHMLTHVWAENDX-HXUWFJFHSA-N 462.699 -1.014 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]cnc4n3)[C@H]2C1 1786977353 CFINKTKNRJHWOJ-YDHLFZDLSA-N 460.495 -1.616 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(=O)NC1)CCO2 1829953081 BOKNRHKNBQXGLZ-SPLOXXLWSA-N 460.491 -1.719 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835395062 ANNQSUKGGZCCHV-ZRZWOPFXSA-N 476.534 -1.091 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839654542 UZIVSEQJAAHPSD-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839717637 KHDBKRDSJNDPKQ-RDTXWAMCSA-N 458.855 -1.187 50 20 JAGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)S(C)(=O)=O 914711336 WKOSKYBSSYXWFO-UHFFFAOYSA-N 462.550 -1.321 50 20 JAGD CC[S@](=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930322 GMUWCINOZXNWKR-QJWGWKRISA-N 452.338 -1.405 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934543 XOKSTCWERCUREU-OAQYLSRUSA-N 457.248 -2.639 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ncccn3)C2)C1 1837456181 DRJHSYMHDMRFPM-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1837457747 PGVFMSXEGCWLDE-QFIPXVFZSA-N 476.534 -1.523 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840481951 ABBMMYUYGFSDOJ-QFIPXVFZSA-N 455.276 -1.342 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(=O)N1CCCC1)c(=O)n2Cc1ccccc1 748246944 IBZJKNNDFIOQHG-UHFFFAOYSA-N 497.512 -1.176 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833505811 MMQGQXOPQGXABI-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930634 QYYLHUBWCJGAQL-GHTZIAJQSA-N 463.296 -2.413 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202967 VFLMOMGHLXNGAE-GDBMZVCRSA-N 456.309 -1.580 50 20 JAGD N=C(N)SCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929630 ZMFQCAUHJYVBRQ-IBGZPJMESA-N 450.326 -1.547 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939525 RKUBMZQNMBWZJO-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1840183948 JLLHGAUSCBOLRD-IBGZPJMESA-N 452.468 -1.669 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1840185428 QDOSKTIXJZTHJD-SFHVURJKSA-N 455.541 -1.274 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832486889 AJMGERNFFMTUCW-ZBFHGGJFSA-N 486.360 -1.136 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1835403793 UDLIPNVLJPLITP-QHCPKHFHSA-N 474.367 -1.926 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1C 1835938542 XRHXLKXULSEMKS-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nn1 1837459660 VIHSKKXIBVVHEB-OAQYLSRUSA-N 471.474 -1.133 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732978 WGWUOBIAHXALGX-CYGHRXIMSA-N 477.323 -1.545 50 20 JAGD Cc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1F 1833706125 UJGBFNSWYYFBDF-NRFANRHFSA-N 460.271 -1.069 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835538699 KZLKFFZERSHRFF-GOSISDBHSA-N 471.212 -2.839 50 20 JAGD CN1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1836671846 FCJVOQPFXVNXRR-QFIPXVFZSA-N 460.340 -2.316 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837464351 ULBVNRTUGFWIFQ-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837466049 XRBHBDXGRBEOIQ-HXUWFJFHSA-N 479.563 -1.761 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837522273 DONDCNAQQKPVOZ-JLJPHGGASA-N 450.330 -1.123 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1810295989 ZESPXQHHOWSAFE-QANKJYHBSA-N 480.485 -1.002 50 20 JAGD C[C@@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837479857 CIAKJOAOUZNKCG-ZHRRBRCNSA-N 469.307 -1.273 50 20 JAGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=S)NCC(N)=O)N(S(C)(=O)=O)CC2 727066141 GWFPVVAPMRICIK-GFCCVEGCSA-N 459.550 -1.067 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3NC(=O)NC3=O)[C@H]2C1 1785157281 LCVIYOHGNIFWMG-KWRBDPEUSA-N 473.490 -1.302 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801286246 BMFPIIDOYQUSIU-GTYSZEQSSA-N 484.517 -1.641 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc21 1830732203 WDWJUYIUCCVXCS-HNAYVOBHSA-N 455.899 -1.314 50 20 JAGD C=CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459380 NNJKXLMSXPUYHS-QKKBWIMNSA-N 460.491 -1.554 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839782994 PLCPSTNBIWANGK-JXFKEZNVSA-N 481.531 -1.668 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787507079 ISBMCJHNQZJPKL-ULQDDVLXSA-N 473.596 -1.235 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCN(C)CC1 1797235157 YWRDQWFCUHHKGZ-ODRBZYGGSA-N 459.551 -1.043 50 20 JAGD O=C1CN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C(=O)N1 1817474817 ZDDLHVUHTNHEQM-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)C#CC(=O)O)CCO2)C1)NC(=O)NCc1ccccc1 1840043374 UQWHJJJVGOWMPT-HSZRJFAPSA-N 487.513 -1.123 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2)c1ccc(B(O)O)cc1 1795734808 SPBBZJIBMHMEBL-FVCICTRLSA-N 474.304 -1.965 50 20 JAGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c(C)n2n1 1796923348 LYIARPZWHOHNBY-CWPLJXCYSA-N 464.291 -1.062 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458950 GBQCYXLPXVSZMS-UZLBHIALSA-N 480.478 -2.180 50 20 JAGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840081999 UHLVJRZSMZFSSJ-XLIONFOSSA-N 482.958 -1.261 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1840183839 CTVHLFFBYJKKRH-SFHVURJKSA-N 453.456 -1.239 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1840185797 XRYSRBBIQREPKP-HXUWFJFHSA-N 466.495 -1.610 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840370104 HFACRVXIBNCDGN-GJYPPUQNSA-N 457.915 -1.487 50 20 JAGD CN[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)C(=O)O 1835760654 DTZBWQIRWMNQPI-YWZLYKJASA-N 464.479 -2.182 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cncn1)c(=O)n2Cc1ccccc1 918017346 TUIVBEUQYKWELO-UHFFFAOYSA-N 451.447 -1.133 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1781854639 NYCZUWNGTBKGQO-IIBYNOLFSA-N 463.296 -1.347 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(CCO)CCO)C2)C1 1783257594 AFTJHHWUSHCEDG-FQEVSTJZSA-N 450.496 -2.585 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)N3CCOCC3)[C@H]2C1 1788651020 CHTXYUCAXOVXCF-GDEPLPEGSA-N 462.507 -2.071 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804343406 DPIPZPJQIKCKEC-VDZJLULYSA-N 465.275 -1.321 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n1 1837271974 JSHOHTBAUGAFLN-FQEVSTJZSA-N 458.284 -2.231 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n1 1837271976 JSHOHTBAUGAFLN-HXUWFJFHSA-N 458.284 -2.231 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1C 1838833512 YWVIXMHKTZRZDY-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD O=C(Cn1ccncc1=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839663406 RGNJKJQFDVBJBI-OAQYLSRUSA-N 456.264 -2.307 50 20 JAGD COCCOCCOCCOCC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783685585 DTTYEWMFNNTRGJ-JOCHJYFZSA-N 488.582 -1.115 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797325331 RMNJDTYDTKXXGO-HBCWATKFSA-N 461.523 -1.407 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797750455 FUZZXPUOGFVMKY-ZSBFGKGUSA-N 453.264 -2.118 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cnnn1)CCO2 1840477049 ZKNKQAXZJKQWIE-MELARPHDSA-N 473.494 -1.176 50 20 JAGD C[C@](O)(C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(F)(F)F 1832156030 LQSOLFJYEWTVNR-ROUUACIJSA-N 460.214 -1.250 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184982 CXQUXRYZPGKHSM-UWJYYQICSA-N 486.522 -1.689 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1840185630 RARBNSVRFZJIDQ-ICSRJNTNSA-N 457.528 -2.534 50 20 JAGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729275963 UHJWLKYJEFYTTH-LLVKDONJSA-N 464.522 -1.585 50 20 JAGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1786979858 LZYGCRQWTOENCF-VCQFHVMDSA-N 474.348 -1.238 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801013 HMGNFWAGTWDOPU-UHFFFAOYSA-N 458.368 -1.116 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1 1835930962 AZXCQFQUNSFLDK-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD O=C(CCc1cncnc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836049826 FXXLBUIZUVQKTJ-QFIPXVFZSA-N 454.292 -1.141 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840185972 XZIGJOSIJHRUBF-OAQYLSRUSA-N 462.507 -1.151 50 20 JAGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 912953113 ONTWYTMGVHXGQF-GJZGRUSLSA-N 486.572 -1.201 50 20 JAGD Cn1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cccc1=O 1833870061 JEJMUDZPJFPQRC-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD N[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1835828826 KUDYNNCMBWZOKE-REWPJTCUSA-N 468.319 -1.079 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)s1 1836078779 ZWOWRUBOKJFSSE-HXUWFJFHSA-N 460.321 -1.161 50 20 JAGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837527104 JWBNTOFWQMIWAY-REWVYZQPSA-N 475.307 -1.035 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796437808 MWDAOMMCJMCSAO-HGKCTWBKSA-N 465.337 -2.005 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804186667 LHFIWQHLOLGMFG-JXFKEZNVSA-N 465.275 -1.367 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1835932335 ZUOFNYQTXIIBIS-YLJYHZDGSA-N 466.321 -1.986 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837516852 KMHFDFOZSCMZJU-DMZUZXHHSA-N 492.533 -1.773 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1840151590 HCMSMZCDEHQFFU-DIFFPNOSSA-N 455.859 -1.864 50 20 JAGD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1 728509809 ONSVFOSWWTZJGZ-LLVKDONJSA-N 456.568 -1.036 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780062731 PEMIIPKIUSBYIJ-NRFANRHFSA-N 457.491 -1.094 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C[C@@H]21 1791289017 BIIKHFVIVQAFSP-OBJOEFQTSA-N 461.483 -2.221 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934521 WUYYVZDMMGARCF-HXUWFJFHSA-N 493.372 -1.703 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1 749354793 XLPGNTLDTMAHTN-UHFFFAOYSA-N 476.581 -1.542 50 20 JAGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1834823471 WJNJXBYNPRGBFV-RDJZCZTQSA-N 450.330 -1.122 50 20 JAGD N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccn1 1835928030 BMWBHPKSRBSCSR-DENIHFKCSA-N 454.292 -1.469 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934434 ZQKFHJJVFGICKB-QRWLVFNGSA-N 468.337 -1.883 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1835936900 IMYUOIGZSDFWRL-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1 1835939688 XWFBYPZYDYRGTJ-QFIPXVFZSA-N 454.292 -1.107 50 20 JAGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)C1=O 1837136431 MMZMGEVDRRYBAW-DEOSSOPVSA-N 493.281 -1.115 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)no1 1837547118 PVDFRMCTLXTIOW-QFIPXVFZSA-N 486.290 -1.837 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2 1838765266 AIUDPUCIEWVXFO-SFHVURJKSA-N 483.212 -1.113 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CNC3=O)C2)C1 1840182837 VUGFCCYACUDVDN-LJQANCHMSA-N 454.484 -2.632 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2)c1cccc(B(O)O)c1 1795740365 YGZVYXHHJJHVNJ-HGKCTWBKSA-N 493.285 -1.125 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)cn1)CCO2 1833599598 OKXUIGNMRJRUGS-OAQYLSRUSA-N 497.574 -1.072 50 20 JAGD CSCC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934233 PYTIZWYWMSJKSI-PXNSSMCTSA-N 452.338 -1.450 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840030611 QDGAEZUAHDYUSH-WMLDXEAASA-N 482.397 -1.043 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1830730577 BPKPWHZFFJMPSK-CRAIPNDOSA-N 467.972 -1.286 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833120452 HNKBTIPPMWAMAE-NRFANRHFSA-N 455.475 -1.212 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833474891 SZJXBHQWFZUKHJ-NRFANRHFSA-N 472.458 -1.532 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1835930672 TXFZOKLWOGTEQR-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778379329 DGCWVCGHBRUTJR-QFIPXVFZSA-N 482.501 -1.228 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939751 GKCIYMQFPASXAI-BXKMTCNYSA-N 496.329 -1.350 50 20 JAGD O=C(CCSCCC(=O)NNC(=O)C(=O)N1CCCC1)NNC(=O)C(=O)N1CCCC1 729843140 YJJXZDHWXBVPJE-UHFFFAOYSA-N 456.525 -1.961 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788256020 HDFVNPGWBUBJMD-AXHNFQJDSA-N 496.528 -1.078 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1830730580 BPKPWHZFFJMPSK-MAUKXSAKSA-N 467.972 -1.286 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799835 GOWMGRDPNONOIR-INIZCTEOSA-N 494.423 -1.121 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCC3=O)CCO2)C1 1835412321 PXCZGLUERZMLFM-NRFANRHFSA-N 460.491 -1.623 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931249 KAOPFVAGVWXTFD-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CC[S@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459128 IYEJMCIUCGOCKT-WEZXKFLESA-N 467.548 -1.086 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1837459500 SHDYWBCDZWXEKO-NRFANRHFSA-N 481.473 -1.493 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cnnn1)CCO2 1840477047 ZKNKQAXZJKQWIE-BUFPBVFASA-N 473.494 -1.176 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)no1 1783936047 QLVQBXBGSHQQOD-HXUWFJFHSA-N 450.496 -1.084 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731194 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1833316066 OAMMESJWQVTEMK-NRFANRHFSA-N 462.507 -1.377 50 20 JAGD Cn1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835935692 MJCYNYOFKLERLI-QFIPXVFZSA-N 456.308 -1.197 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)n1ccccc1=O 1835937936 BKEMCBQQTBLBPS-SBUREZEXSA-N 469.303 -1.141 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836396426 RGNHNGRQZJJYLU-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458761 AZYGOHFYTFATAY-DYESRHJHSA-N 478.506 -2.094 50 20 JAGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839163995 UDYYPONOHCLZEQ-FDDCHVKYSA-N 490.561 -1.077 50 20 JAGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839916429 OYFQTIOPJRUYEF-MAUKXSAKSA-N 466.373 -1.240 50 20 JAGD O=C1CCCCN1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840104652 RVAUXXJQLNPLSB-QFIPXVFZSA-N 459.308 -1.551 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)CC2)CC1 1781110169 YVNHTNPWNYITMB-QFIPXVFZSA-N 471.562 -1.091 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n(C)n1 1833443118 ZOMNUMRNCBPKPU-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1C[C@H]2C[C@H]2C1 1837284718 YRYLMKVSWWVCPQ-YQYRJILISA-N 457.336 -1.223 50 20 JAGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)C(=O)C(=O)O 1781541778 QLDKLLGQRGONOO-QVKFZJNVSA-N 476.490 -1.644 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784370087 KFMPUYBBJUNUNM-XMSQKQJNSA-N 484.517 -1.401 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)n(C)c1=O 1832755306 JZRJWOPDCOXCNL-RBZFPXEDSA-N 498.924 -2.510 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834797940 NVPARLRPXVVKFQ-UHFFFAOYSA-N 458.368 -1.116 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837643629 UEEACFMSCJKHBL-IERDGZPVSA-N 457.296 -1.636 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840180065 GZSREVJZUOABRP-LEWJYISDSA-N 479.490 -1.629 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CCc2nc(O)nc(O)c2C1 1794110472 ZDBUAEWXCRMLJW-ZTENYAIWSA-N 482.302 -1.424 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726634 SBWOYEWOTIICOI-PBHICJAKSA-N 453.945 -2.227 50 20 JAGD CCNC(=S)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939244 INRVUSIFJHHSQL-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(=O)[nH]c1C 1837456683 LUOCDWAUXVDJRH-JOCHJYFZSA-N 485.501 -1.231 50 20 JAGD C=CC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459377 NNJKXLMSXPUYHS-LHSJRXKWSA-N 460.491 -1.554 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1837459674 WCWKTOGTLDGZGW-HXUWFJFHSA-N 473.494 -1.912 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CSCC(=O)O)C2)C1 1837460625 IFUIGMBONWFXDQ-IBGZPJMESA-N 467.504 -1.427 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837644934 YSBCYANTUTXQHQ-QVKFZJNVSA-N 472.506 -1.317 50 20 JAGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919714 XVTAVNLGQFYUMK-MAUKXSAKSA-N 466.373 -1.097 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792885538 CEKCLWGSBRMODN-CYGHRXIMSA-N 477.323 -1.545 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831442339 FREULKHEDQRRAY-HXUWFJFHSA-N 466.321 -1.657 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935355 BTHLIXOHSJFITD-QFIPXVFZSA-N 468.080 -2.570 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)C(=O)C(=O)O 1839702938 LRSBBNMHNAUXFZ-INIZCTEOSA-N 450.286 -1.229 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1840186092 ZKKNHJOHMRLKAD-QGZVFWFLSA-N 467.445 -1.506 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920298967 WSKBAEXBSNZFQO-ZDUSSCGKSA-N 462.550 -1.275 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1NC(=O)NC1=O)C2 1779371133 GXBHFQPEKAVOED-VTJXTGGHSA-N 473.490 -1.589 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797751555 GBMIENCPYRAZHX-DPIQGUFMSA-N 468.474 -1.799 50 20 JAGD Cc1cn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(=O)nc1O 1801970365 XDHNWUJKXGYBJR-JLVBRIDZSA-N 456.264 -2.159 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1NC(=O)NC1=O)CCO2 1832698422 YQHMBCHRBQEMCQ-BFUOFWGJSA-N 454.484 -2.586 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836768277 ATJVWHIIBVKTSF-XLIONFOSSA-N 460.959 -1.139 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838499080 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NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(CCO)CCO 1800580288 JAJYSAQSLCQCGG-ZSBFGKGUSA-N 450.496 -2.825 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COC(=O)C(F)(F)F)CCO2 1837319753 GMNHCBCGNHNMOX-KRWDZBQOSA-N 468.429 -1.079 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1837459563 KDHIPNBJDPYCLU-SBUREZEXSA-N 489.577 -1.609 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)n1ccccc1=O 1837684477 TXTPLXGDVXAMIL-HXOBKFHXSA-N 469.303 -1.141 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3NC(=O)NC3=O)C2)C1 1840182859 WRUKYYZRUUIQJM-BFUOFWGJSA-N 454.484 -2.586 50 20 JAGD CCc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1CCOCC1 729277351 ZWCXQXKLKPOGOE-GFCCVEGCSA-N 462.550 -1.031 50 20 JAGD CN1N=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CCC1=O 1835934035 KVJFUPKMYKCZMM-NRFANRHFSA-N 458.280 -1.955 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939956 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477.323 -1.545 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2n(n1)CCCNC2=O 1797323379 ULQUEPFTDYZLMJ-CCWDJLKJSA-N 467.291 -1.787 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801170 OCZWAVSMRYPSIW-HXUWFJFHSA-N 476.339 -1.384 50 20 JAGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783681126 PMAIZPJISFJCTI-HSZRJFAPSA-N 494.350 -1.494 50 20 JAGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)[C@H]2C1 1785190218 JYHYNGIICMRTPK-AJNGGQMLSA-N 496.952 -1.333 50 20 JAGD NC(=O)[C@@H](N)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797907 KKCNXFJQPPJFFW-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD CC(=O)N/C(C)=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839647583 NTIDKGLICDJEHC-PBAKHKOTSA-N 460.491 -1.205 50 20 JAGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(=O)n2[nH]nnc2n1 1777821480 FAHQSAQIMKBNEI-IIBYNOLFSA-N 481.278 -2.066 50 20 JAGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1)c1cccc(B(O)O)c1 1819879945 HCCHHZXYDABUIL-LIRRHRJNSA-N 460.321 -1.301 50 20 JAGD CC[C@@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835056168 ZQKDHZGJTAMCQX-LJQANCHMSA-N 459.356 -1.002 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835930361 HDBXOIVKPHQYPQ-XMMPIXPASA-N 498.345 -1.263 50 20 JAGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn2[nH]cnc(=O)c12 1838469817 VUFJNDNFQWAXQQ-QHCPKHFHSA-N 495.301 -1.605 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779525163 HWDHVZRDXFEYJE-HXUWFJFHSA-N 455.431 -1.069 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)[C@@H]1SC(=N)NC1=O 1783934267 CXKRYGPPYKWGQL-VRHCTWJESA-N 454.553 -1.008 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2 1783940165 UURXYQQEBRZAFP-NYHFZMIOSA-N 498.581 -1.042 50 20 JAGD 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3c(O)nnc13)C2)c1ccc(B(O)O)cc1 1795734201 JAQLPVMWLJXVOZ-XOIINTDNSA-N 451.248 -1.368 50 20 JAGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812389625 IYIOLHBPUQMCEY-QFBILLFUSA-N 468.275 -1.376 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837205413 ZAIHCNLHUITKJK-OXJNMPFZSA-N 465.268 -2.499 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnnc3O)C2)C1 1837459292 BHJOOSCEDPFDSL-HXUWFJFHSA-N 457.447 -1.436 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)N1CCN(C)CC1 1797753089 SHYJDAABAYZDAI-GGXPGOJBSA-N 459.551 -1.476 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831337285 PUJWPYURABZAFT-IBGZPJMESA-N 469.520 -1.810 50 20 JAGD NC(=O)[C@@H](N)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801108 OWDYTCGMCZVHNB-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCN1CCOCC1)CCO2 1835449614 LGGCGFPYLNLLLZ-OAQYLSRUSA-N 455.556 -1.462 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)n1 1835930744 YEMMRXWJCLALIE-FQEVSTJZSA-N 458.284 -2.231 50 20 JAGD COCc1oncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835936815 FHEWGUFILOWDCH-OAQYLSRUSA-N 459.264 -1.115 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938155 NNHYQQIBWYYUMI-GHTZIAJQSA-N 463.296 -2.413 50 20 JAGD CC(=O)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n[nH]1 1837456459 IGJRZQYBSVFHEN-NRFANRHFSA-N 471.474 -1.005 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839174421 AUDSUZBECBCNAN-QFIPXVFZSA-N 460.292 -1.054 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833506319 YVHHDGIMOYHWFT-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839043811 UURASTBQMGPHRP-LIRRHRJNSA-N 472.951 -1.052 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)COCCO)C2)C1)NC(=O)NCc1ccccc1 1839054337 UQXIPUJISGUGLL-QHCPKHFHSA-N 493.561 -1.202 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936087 QSKPKVZIRLLANK-OXQOHEQNSA-N 456.496 -1.316 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21)c1cccc(B(O)O)c1 1786984719 ASZDLDARPGZFMT-SNRMKQJTSA-N 498.370 -1.135 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796436807 BYFLUYYYPAZWTN-ZSBFGKGUSA-N 480.547 -1.686 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779201457 XVEMUJWRHHHMNZ-FYINFDKHSA-N 478.506 -1.123 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807045305 WAOLROWRRSIVJD-KPFFTGBYSA-N 453.308 -1.326 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810492021 UCGKALFEPIWODQ-UHFFFAOYSA-N 465.279 -1.349 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1835403167 CXFKQHMSVBPGAO-HSZRJFAPSA-N 474.367 -1.926 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836475649 SUDLSEGTNSLDPK-GHTZIAJQSA-N 474.348 -1.537 50 20 JAGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)c(=O)n2C 912642916 ITENHVXWMSIRFD-UHFFFAOYSA-N 489.514 -1.321 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1835935594 LZCBVJFCMKCDQB-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836472558 LZTLHUHIFIBALK-IQUTYRLHSA-N 465.931 -1.072 50 20 JAGD CCN1CCN(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C(=O)C1=O 1115975222 DTMVMBRXTPUXAT-UHFFFAOYSA-N 452.537 -1.244 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983535 RPDIYPXQKGWIMQ-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD CS(=O)(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611410 XRRLWTVLAHVVED-RCBQFDQVSA-N 453.521 -1.287 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790175934 SWBJFMXVITUWEZ-PCODUJHASA-N 477.323 -1.197 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807042014 BYKBAHWRNKVODM-XKGZKEIXSA-N 453.308 -1.326 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831325430 XYZUFPRRYASXCZ-XOBRGWDASA-N 498.562 -1.917 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)N(C)C)C2)C1)NC(=O)NCc1ccccc1 1839053989 ABKXYPPQTUKNIH-QHCPKHFHSA-N 490.561 -1.123 50 20 JAGD CN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C(=O)N(C)C1=O 920975606 INHBSYDZTMGFLZ-UHFFFAOYSA-N 451.461 -1.124 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1779032473 LEBUUYOMICPAFH-ZHRRBRCNSA-N 459.551 -1.236 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930367 HOQSOXBHMGXJCB-JXFKEZNVSA-N 465.268 -2.499 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)C(=O)C(=O)O 1835939696 DYWWSMLNVSMUDX-FQEVSTJZSA-N 463.252 -3.021 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837516858 KMHFDFOZSCMZJU-GVWIZHFKSA-N 492.533 -1.773 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837643252 MEXWHAGUMYJCLD-IERDGZPVSA-N 457.296 -1.636 50 20 JAGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840077036 VNKYUUKNTGAGEJ-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(=O)nc1O 1792132038 AKEXVNNSWAHPIF-JQFCIGGWSA-N 485.501 -1.451 50 20 JAGD C[C@](O)(C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(F)(F)F 1835934082 MNDVOQPQNQLOQS-ZWKOTPCHSA-N 460.214 -1.250 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1837461032 MUUJWSFTAQUMOV-IBGZPJMESA-N 476.519 -1.335 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 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Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1C 750659387 OQDDKZUSZWUMPD-UHFFFAOYSA-N 458.522 -1.282 50 20 JAGD CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931870 FGXZJIPUCYZUIO-BTYIYWSLSA-N 464.280 -1.002 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1835935903 WLGSRXADOAQQEN-HSZRJFAPSA-N 483.286 -1.084 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnn3n1)CCO2 1838425750 QUYSKTRSALSBLC-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804185079 BFNKBVIQGTUJSL-AUUYWEPGSA-N 480.485 -1.049 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1835932188 SKIJKYLSQVZMLI-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1835936797 DMZXTMNWXJXJML-OAQYLSRUSA-N 466.263 -1.812 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)N1 1782871588 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JAMSABWVKZEFED-NRFANRHFSA-N 456.264 -1.464 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(CCO)CCO)C2 1779375730 SCUIUAMMDAVHCG-XMSQKQJNSA-N 478.550 -1.901 50 20 JAGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CN1CCS(=O)(=O)CC1)CCO2 1832484364 LXIKPLDYROXZDX-KRWDZBQOSA-N 482.397 -1.042 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930599 OZOPADMTQQDESB-QMHKHESXSA-N 497.317 -1.955 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)C(=O)N1 1835934101 OAUKSSJKHSTAKY-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460681 JAWZLVFGIBRBSJ-RTWAWAEBSA-N 479.490 -1.629 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461410 VPVLRVHPQVYQIP-IBGZPJMESA-N 469.520 -1.810 50 20 JAGD COCCOCCOCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840081997 UHLVJRZSMZFSSJ-FXAWDEMLSA-N 482.958 -1.261 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1840184387 JIJDDCMYTLSORE-FQEVSTJZSA-N 455.512 -1.342 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cncn1 1840419026 RNPWEBILLJRGJC-VBKZILBWSA-N 458.479 -1.392 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cnnn1 1840477418 LRBLLCSACLRTNC-YJYMSZOUSA-N 459.467 -1.997 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979939 RIEYQDRYMJQGMF-WDSOQIARSA-N 479.364 -1.615 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984018 KDASNWDGGMADLB-FRYIKTPZSA-N 476.291 -1.546 50 20 JAGD 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](O)CCl 1792983655 SOYYRZFJEXPJAY-KBRXKUPHSA-N 462.931 -1.056 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804185103 BFNKBVIQGTUJSL-KUHUBIRLSA-N 480.485 -1.049 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)COCCO)CCO2)C1)NC(=O)NCc1ccccc1 1839194860 XPWKNCXQWSUAED-QHCPKHFHSA-N 493.561 -1.202 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cnnn1 1840477416 LRBLLCSACLRTNC-DJJJIMSYSA-N 459.467 -1.997 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779067934 HPIUGWRRNFGOQD-WIYYLYMNSA-N 462.264 -1.695 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738406 OWHJZSDYRPSJCC-MNVSYLFESA-N 492.957 -1.189 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837629673 MAKCBQSCZDDHLU-JOCHJYFZSA-N 483.485 -1.211 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)n1ccccc1=O 1837684474 TXTPLXGDVXAMIL-GAJHUEQPSA-N 469.303 -1.141 50 20 JAGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCCN1C(=O)CNC1=O 731116885 DJRBYLCOUAOBLL-UHFFFAOYSA-N 496.546 -1.088 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748644 PAGMLPSKKVJYOH-NFFDBFGFSA-N 468.536 -1.784 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)N1 1832694497 QUNXJEUMGMDQJO-QRWLVFNGSA-N 460.252 -2.966 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1837456584 KRPWZVWRHQZHJW-QHCPKHFHSA-N 499.528 -1.097 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)N1 1807362547 LEEGRRMEWHKDKT-AYBZRNKSSA-N 465.275 -1.321 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H](O)N1CCOCC1 1810350148 PXHYYMPBYMUZTD-GREBRCKQSA-N 468.319 -1.268 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983591 SLTIYMKHVMINJD-IKICRFKJSA-N 467.353 -1.713 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)N1CCN(C)CC1 1789798855 SQZSBYDBFIBDLA-LGYWMIHWSA-N 458.368 -1.404 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831325427 XYZUFPRRYASXCZ-VLIAUNLRSA-N 498.562 -1.917 50 20 JAGD Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1F 1833706126 UJGBFNSWYYFBDF-OAQYLSRUSA-N 460.271 -1.069 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798678 XDFJIDXIVVMMJH-QHCPKHFHSA-N 474.367 -1.798 50 20 JAGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(=O)nc1O 1834800332 CRTLUDSVILZTLT-UHFFFAOYSA-N 497.361 -1.177 50 20 JAGD O=C(CSc1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933989 KKDVIQXOVBNEJY-LJQANCHMSA-N 461.309 -1.653 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939800 IQOCFBIVZMMMCM-OAQYLSRUSA-N 465.312 -3.277 50 20 JAGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CNC(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1780968393 BEQLUWSUAQZWIW-NRFANRHFSA-N 461.523 -1.169 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787393338 HRWJHRVZULMZQM-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816676041 WHXRLYXIJPCSTD-SECBINFHSA-N 474.507 -1.132 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461413 VPVLRVHPQVYQIP-LJQANCHMSA-N 469.520 -1.810 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804091505 QEIGIIOGLKMQQI-OXJNMPFZSA-N 465.275 -1.367 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797770 DEWYSVNGZADJDI-MRXNPFEDSA-N 494.423 -1.121 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839384319 AORGSSFLCXDBHU-VFVRVIDISA-N 451.904 -1.114 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1779030563 CHQGAYFUZUGRJA-QGZVFWFLSA-N 456.396 -2.147 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(=O)nc1O 1779036014 TVPMAHCLJYUKKX-NRFANRHFSA-N 471.474 -1.600 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)CC2)CC1 1781107469 PWCWMQMXGFPXGQ-JOCHJYFZSA-N 456.352 -1.410 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3NC(=O)NC3=O)C[C@@H]21 1788611459 CPLZJTBVONXQBU-HPEDKQMDSA-N 459.463 -2.124 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1)c1cccc(B(O)O)c1 1834801063 MKMJQXGMTIPRKJ-UHFFFAOYSA-N 494.361 -1.195 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028722 JRBUCSKDZRLCDC-ORAYPTAESA-N 468.536 -1.544 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199798 VANPAJJDPLAOGY-WCQYABFASA-N 462.209 -1.142 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840195938 LXDXRQCKKZIHBJ-YLJYHZDGSA-N 452.338 -1.450 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840548825 CPXTUGWPMZBWGB-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798428 UUHFLMRQSNLMFK-UHFFFAOYSA-N 480.334 -1.246 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838394788 WXEIGOWVHCJLJQ-UHFFFAOYSA-N 492.577 -1.416 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(N)=O)C2)C1)NC(=O)NCc1ccccc1 1839054574 FRKVKLDFGLYNSV-JOCHJYFZSA-N 491.549 -1.543 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031703 DPFWTRAVWCQIDS-RCDICMHDSA-N 482.501 -1.263 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCNC3=O)CCO2 1783934277 CDXNHVXPCNKYRZ-OAQYLSRUSA-N 461.523 -1.167 50 20 JAGD Cc1cn(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(=O)nc1O 1785354903 VLYNZKVPEVQCSI-FQEVSTJZSA-N 450.496 -1.540 50 20 JAGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(=O)nc1O 1792131255 JXAGNFNBWPHFHO-SZMVWBNQSA-N 470.291 -1.769 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1=O 1831884283 SWVMXTKPUHDHIG-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CN[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(=O)O 1835759859 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50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837516981 NHSUHXKPLABNPF-FPOVZHCZSA-N 463.296 -2.913 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839782996 PLCPSTNBIWANGK-OXQOHEQNSA-N 481.531 -1.668 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)n(C)c1=O 1848151769 KIOHKBYYIJMDOX-HOTGVXAUSA-N 480.290 -2.371 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN1CCS(=O)(=O)CC1)CCO2 1783933517 OKVGCGOWDZGGIS-IBGZPJMESA-N 459.569 -2.080 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)CCO2 1783933851 JKWUBKVXIADHRQ-IBGZPJMESA-N 468.536 -1.345 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370683 IMVRQOXWXXXFFR-HQRMLTQVSA-N 453.308 -1.326 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC(=O)NC1)CCO2 1829953075 BOKNRHKNBQXGLZ-LHSJRXKWSA-N 460.491 -1.719 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831335285 LPILGMWBGDKCKF-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835843827 YERBDJVKIDPWJB-OAQYLSRUSA-N 474.367 -1.297 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(=O)[nH]c1C 1835927123 GRPOPMPBTOCAHS-JOCHJYFZSA-N 470.291 -1.550 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837606489 VHXNWILJNHQGHH-ZUEVXXBESA-N 455.899 -1.349 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[C@H]1SC(=N)NC1=O 1779030279 NHAFXSNULYAJJV-GZNWPSJOSA-N 475.531 -1.069 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788564967 PUVQNGRCJSFXNP-PYTWLRIVSA-N 461.523 -1.014 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365789 WHPYFYMELCKHMD-YVWKXTFCSA-N 453.308 -1.326 50 20 JAGD CC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829855046 DGUWLRXSMKSLHY-DYESRHJHSA-N 462.507 -1.330 50 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)c1ccc(B(O)O)cc1 1795735284 VWGSNMQYXXOAST-GOBLKYCHSA-N 455.320 -1.029 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2)c1cccc(B(O)O)c1 1795737277 NUGDNQPHLJJOMB-ZTENYAIWSA-N 482.302 -1.424 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371414 ULLNSFAYXHWTCN-HNAYVOBHSA-N 488.273 -1.479 50 20 JAGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c(C)n2n1 1835930604 PBBSYYSHSNUABB-HSZRJFAPSA-N 494.317 -1.195 50 20 JAGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)(C1)C2 1835939586 BDEHQTINQJUCCP-XPPIMPSXSA-N 472.303 -1.220 50 20 JAGD CS(=O)(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939929 PEPAPJCDGNKGAO-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD CC[C@H](NC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457541 ITVHTDXAEANJQT-MGPUTAFESA-N 463.495 -1.798 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782783708 IUSVYQLVDDBMHP-NRFANRHFSA-N 470.247 -1.420 50 20 JAGD O=C1CN(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)C(=O)N1 1834797562 YWELRLREKRBFHO-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837527101 JWBNTOFWQMIWAY-PIVQEWKSSA-N 475.307 -1.035 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)n1ccccc1=O 1837684484 TXTPLXGDVXAMIL-UZUQRXQVSA-N 469.303 -1.141 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cncn1 1840419028 RNPWEBILLJRGJC-XOBRGWDASA-N 458.479 -1.392 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382528 KVUIPJFHLHIJNB-OAQYLSRUSA-N 461.523 -1.167 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2)c1cccc(B(O)O)c1 1795740180 APDPJRPNKKZHNH-ZSBFGKGUSA-N 468.300 -1.047 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829757059 COQMIKINHMEWGS-LJQANCHMSA-N 476.519 -1.038 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927681 WQGZJFGGHKBYLT-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1835935505 IBROYSHWNOSVRD-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807193316 VHLKKQBORVDFFJ-HQRMLTQVSA-N 453.308 -1.326 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837442333 WEIUZYWJHZBQPH-SGCYSOCQSA-N 458.324 -1.092 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198639 LYJGNTIWXJQAFV-ZBFHGGJFSA-N 486.360 -1.136 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)no1 1786984035 KWGUEMQRKQZIKW-IEZWGBDMSA-N 470.291 -1.314 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1835935529 JPKPNOHVDMRSAQ-NRFANRHFSA-N 482.262 -2.519 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CNC(=O)C1)CCO2 1839869828 PJUXHJAPSCRKBK-BVJQPZNLSA-N 460.491 -1.287 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1779035662 KXSLRKBTSKPBTK-IBGZPJMESA-N 478.556 -1.011 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780062732 PEMIIPKIUSBYIJ-OAQYLSRUSA-N 457.491 -1.094 50 20 JAGD COC[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 1796441654 NODKRWZBGLSTCP-VTYBRSPESA-N 462.507 -1.139 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[C@H]1SC(=N)NC1=O 1835928758 YHAWATPNAOAMRI-CQURBHOASA-N 490.347 -1.761 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940125 VBNLZLYPZCCHNX-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840182814 JCGWPDYFUSSAIZ-HXUWFJFHSA-N 457.597 -1.135 50 20 JAGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(=O)nc1O 1791292449 RLYSSYLIDWSFDO-JYJNAYRXSA-N 464.523 -1.390 50 20 JAGD CNc1nsnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456955 UHXQMEURYQXUOU-IBGZPJMESA-N 476.519 -1.038 50 20 JAGD CS(=O)(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782716213 JTAFKPGCJJNDFA-YLJYHZDGSA-N 452.338 -1.071 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979933 QRYYDUWIRPVIFH-YEWWUXTCSA-N 488.331 -1.575 50 20 JAGD COC[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 1797964445 KUGDIONDBVXJTM-VTYBRSPESA-N 462.507 -1.139 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938223 RBSYXXWGUNWJPS-JOCHJYFZSA-N 483.290 -2.251 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1ccnn1 1839709173 YJMUYDNHLOIGRL-XOBRGWDASA-N 458.479 -1.392 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3NC(=O)NC3=O)C2)C1 1840182872 WRUKYYZRUUIQJM-YJYMSZOUSA-N 454.484 -2.586 50 20 JAGD C/C(=C/C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 1123811185 QEJARUYPUPVGJJ-TZNPFNDMSA-N 450.583 -1.083 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1779034063 KXEFHWQWFKSOOF-KRWDZBQOSA-N 458.397 -1.193 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCS3(=O)=O)[C@H]2C1 1790748177 URDCVZWLBQBZRL-STECZYCISA-N 465.532 -1.144 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830733340 JAUXZCZJEYKPKM-VEVIJQCQSA-N 451.904 -1.114 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCNC1=N)NC(=O)NCc1ccccc1 1795581105 TZYAQHLFTCQTGU-RMFSNUHRSA-N 486.577 -1.238 50 20 JAGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2)c1ccc(B(O)O)cc1 1815340071 DSICZHSXPFWJNO-LLVKDONJSA-N 480.275 -1.512 50 20 JAGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1cccnc1 1835927571 TWXRQNHKOTXKHS-HSZRJFAPSA-N 482.302 -1.739 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1835938276 RMCCEBCEJPGFLJ-JOCHJYFZSA-N 469.259 -1.126 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938418 USMRFMIWKPKOQS-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)nn3)C2)C1 1837456965 RDZVUCINPOEMSE-FQEVSTJZSA-N 457.447 -1.436 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(CCO)CCO)CCO2 1839920220 SAFUOLDXRATGNQ-FQEVSTJZSA-N 459.544 -2.898 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1 1840184227 DVLBVHRWBUGHQX-QFIPXVFZSA-N 482.582 -2.020 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccn2c(O)nnc12 1796286606 KDHYHJIDHUFDSW-XOIINTDNSA-N 451.248 -1.368 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnnc1O)CCO2 1838372783 QAVFVDLLKFUVJB-HXUWFJFHSA-N 457.447 -1.436 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840486177 PTUBRLJGPBNYNH-TWKPZUECSA-N 452.276 -1.060 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840809462 ZCFIDBKNWYAVBV-AUUYWEPGSA-N 458.899 -1.032 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028721 JRBUCSKDZRLCDC-DJJJIMSYSA-N 468.536 -1.544 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748476 FDCDMDLGEQSSEP-RMHZUWNSSA-N 492.533 -1.226 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1810294407 KIHLBOYTWCOQNJ-AUUYWEPGSA-N 480.485 -1.049 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n(C)n1 1833448150 DMATUXXHIJLKDX-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939524 RKUBMZQNMBWZJO-HSZRJFAPSA-N 467.287 -1.151 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837730700 AGWKESZIQKSDRB-RAXNRFIOSA-N 492.533 -1.272 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839082504 FUAHRHZWVWPXTN-WWEVIYMKSA-N 485.346 -1.163 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780935176 FEKBLCGKNWDZFD-QFIPXVFZSA-N 484.343 -1.285 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369121 AYUPLLIFAPRNEC-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)n1 1835930745 YEMMRXWJCLALIE-HXUWFJFHSA-N 458.284 -2.231 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837211172 JCTOTZUBZNTBKC-QFBILLFUSA-N 459.500 -2.120 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838499078 OYJBDKLASKMJJN-IFXJQAMLSA-N 451.867 -1.241 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nn1C 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N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccn1 1835935741 PCYFVHGGKLCWFZ-DENIHFKCSA-N 454.292 -1.469 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)CC1 1786979665 IQAJUIZESPGBEC-JBACZVJFSA-N 472.351 -1.876 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931979 JROJBXZUDUMDRT-XDHUDOTRSA-N 496.329 -1.350 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941063 FIQBRHUHZBKKLN-KNQAVFIVSA-N 461.324 -1.259 50 20 JAGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(=O)C(=O)O 1824670122 QWAAWEBASXNGEF-GFCCVEGCSA-N 460.277 -1.408 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)Cc1cscn1)C2 1797750994 YBBKVYUDAOLFNQ-LZDSYCOUSA-N 459.532 -1.085 50 20 JAGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800973964 JNFSIACKMLZZBD-XFMPKHEZSA-N 482.925 -1.723 50 20 JAGD 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CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790175935 SWBJFMXVITUWEZ-XPYUAMARSA-N 477.323 -1.197 50 20 JAGD O=C(CN(CCO)CCO)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812714406 SWNVVXWAJVPELV-DENIHFKCSA-N 470.335 -1.632 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937958 CJBYZCLHJNUJQP-YQNSVDCASA-N 458.324 -1.092 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941065 FIQBRHUHZBKKLN-UGKGYDQZSA-N 461.324 -1.259 50 20 JAGD Cc1noc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457769 QOULQBMKHDSJJO-HXUWFJFHSA-N 459.463 -1.311 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CO)on3)CCO2)C1 1838802479 YMAUICHADIKATB-HXUWFJFHSA-N 460.447 -1.451 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(=O)C(=O)O 1839202934 UFRNMAISLOWXCK-XHDPSFHLSA-N 454.249 -1.324 50 20 JAGD O=C(Cn1ccncc1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781484526 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COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)(C1)C2 1835939584 BDEHQTINQJUCCP-VNXZQDSDSA-N 472.303 -1.220 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183082 ZYYQWCHQUKPYIK-KXBFYZLASA-N 462.569 -1.504 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1840184708 BUJVDGSRGNVEOW-HXUWFJFHSA-N 459.544 -2.898 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840852624 SOLHTBDCARBKKD-SIKLNZKXSA-N 461.324 -1.259 50 20 JAGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1 1841985253 LOPCBNNWWLRROS-GFCCVEGCSA-N 452.899 -1.109 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372708 YRXPCXOFUFFTAH-FQELHTAISA-N 478.506 -1.123 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786260248 NTCFQHARNBFZIF-ZQIUZPCESA-N 461.523 -1.407 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979778 POXVXQPHPMVXTP-LEAZDLGRSA-N 476.291 -1.546 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1797750609 MBUJTJSEPICPQP-IVWMJMPLSA-N 482.501 -1.468 50 20 JAGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1)c1ccc(B(O)O)cc1 1816670853 BIAAGFOSDNBIAG-LLVKDONJSA-N 480.275 -1.512 50 20 JAGD O=C(CN1CCSCC1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829710647 GTWPHYINZNOZJY-OAQYLSRUSA-N 463.365 -1.515 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834665627 OCPDMYBKYNCCHX-UHFFFAOYSA-N 476.515 -1.344 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1835937392 SSLATVLSWZPSFP-QHCPKHFHSA-N 488.350 -2.400 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N1CCN(C)CC1 1840185397 QFZYLLQNFCRRJI-AVRDEDQJSA-N 468.599 -1.548 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061150 HUCDYCYEXGEIFR-JOCHJYFZSA-N 463.259 -1.473 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2)c1ccc(B(O)O)cc1 1795734772 PBJSXEYOPWZTRL-DRXBFXEBSA-N 453.224 -2.991 50 20 JAGD Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1C 1830949194 JNARLLOILYMWJC-JOCHJYFZSA-N 456.308 -1.279 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1835935530 JPKPNOHVDMRSAQ-OAQYLSRUSA-N 482.262 -2.519 50 20 JAGD CC(=O)NC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457211 ZTGXYOYGGMTDOQ-OAQYLSRUSA-N 462.507 -1.330 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)CNC(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1840920395 OPDGXXALCZRPPF-JOCHJYFZSA-N 491.549 -1.543 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982900 GYCLCIWGYFKOOK-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486489 KMZYDPAJWWVAQC-NRFANRHFSA-N 461.368 -1.114 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833197037 PBBRVCMGEASNBL-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2 1835701685 NHSKHBDBULGKIR-XMSQKQJNSA-N 469.502 -1.150 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459672 VYTKAADHFWEEIM-YCRPNKLZSA-N 472.506 -1.317 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)n(C)c1=O 1843013037 ASBFGWWATFEEJD-UHFFFAOYSA-N 480.290 -2.369 50 20 JAGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800756995 LCIFYPZKCOWXIS-FMSGJZPZSA-N 497.350 -1.193 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1810294415 KIHLBOYTWCOQNJ-LIRRHRJNSA-N 480.485 -1.049 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832332481 QVMBOMDJSGLKBV-IUODEOHRSA-N 451.249 -1.315 50 20 JAGD CCNC(=S)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932130 PHBRQRONMMFYTA-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)n1ccccc1=O 1837683402 FLKCJPKJGBNVTO-UZUQRXQVSA-N 469.303 -1.141 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839918804 OJKDIGQMNAVDTA-OAQYLSRUSA-N 480.522 -2.958 50 20 JAGD 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](O)CCl 1792983652 SOYYRZFJEXPJAY-ARUSPNSKSA-N 462.931 -1.056 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1CCN(C)CC1 1835931260 KBOLVXQSAJUBEI-WZONZLPQSA-N 474.367 -1.928 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nn1C 1837459257 AHPYOZDYFSWQNT-NRFANRHFSA-N 473.490 -1.189 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cncn1 1840419027 RNPWEBILLJRGJC-VLIAUNLRSA-N 458.479 -1.392 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836847019 PWJQAQGMOVLUHZ-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1837459174 LCDDHTFUTTWJHN-BNOLWBGWSA-N 472.502 -1.410 50 20 JAGD COC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1839897597 COYNTPAHJSWQBS-HXUWFJFHSA-N 461.475 -1.292 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1781854641 NYCZUWNGTBKGQO-KKSFZXQISA-N 463.296 -1.347 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607947 YHMHCFKIYCRRMQ-PYTWLRIVSA-N 482.563 -1.394 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804091522 QEVVNDYVRBZJOQ-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD Cn1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1=O 1835927754 XPYLGJFMIGPRAZ-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456818 NNWRUEBUTRIOSQ-NRFANRHFSA-N 473.490 -1.189 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837626104 BKVJQIMCNOYGKG-JOCHJYFZSA-N 468.275 -1.530 50 20 JAGD COCCOCCOCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830738131 MNFYUPDTBSMPSB-XLIONFOSSA-N 482.958 -1.261 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833506320 YVHHDGIMOYHWFT-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1837456223 FUTVOQHZHWUFOD-FQEVSTJZSA-N 459.463 -1.311 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784517252 IIRSDGJRPXMWRJ-KCMWZYNZSA-N 452.338 -1.360 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471426 NJRFSQNSBXTCFL-HNNXBMFYSA-N 477.250 -1.165 50 20 JAGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836255866 XYMYZILYEHNVHT-GUYCJALGSA-N 462.912 -1.492 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788491 ZNYNGNDSJOCUES-NRFANRHFSA-N 485.457 -1.101 50 20 JAGD CCS(=O)(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784451532 ZCUNCNMMBMTNDX-RCBQFDQVSA-N 453.521 -1.287 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1810294413 KIHLBOYTWCOQNJ-IFXJQAMLSA-N 480.485 -1.049 50 20 JAGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1834825024 RJZXIZLPWRVICZ-QGZVFWFLSA-N 452.346 -1.486 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835929565 WIYUYZNEDRYUHU-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CN(CCO)CCO)CCO2 1839917730 ROJIAEFPEZTFBM-QGZVFWFLSA-N 452.346 -1.486 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNCP(=O)(O)O)C2)C1 1840032370 WSASREOYBWQVNY-FZMZJTMJSA-N 458.246 -1.049 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CNC1=O)C2 1796439502 HYNYBWPRDNLOKQ-CNKKGNCFSA-N 459.463 -1.738 50 20 JAGD Cn1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cn1 1835928448 QRWFSBRCGLTSDQ-QFIPXVFZSA-N 456.308 -1.197 50 20 JAGD O=C(CCN1CCOCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929552 VSOARICCHAYQBU-JOCHJYFZSA-N 461.324 -1.841 50 20 JAGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930679 UGJAPGABVXZGCP-VJIOCRDPSA-N 475.307 -1.035 50 20 JAGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccco1 1835935498 HSRWOHGRSVSHQO-QFIPXVFZSA-N 471.275 -1.541 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CC2)CC1 1835939138 GKVPXHNGJIZVEH-HSZRJFAPSA-N 486.378 -1.784 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)CCO2 1783933852 JKWUBKVXIADHRQ-LJQANCHMSA-N 468.536 -1.345 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)n(C)c1=O 1784086233 XDLFIKUVRSLQTM-FQUUOJAGSA-N 482.925 -1.987 50 20 JAGD Cc1cn(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(=O)nc1O 1785354215 ZAVGSWINKPESLX-OAQYLSRUSA-N 456.264 -1.919 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)n(C)c1=O 1793980271 RQMFSDAZNNSBOI-IQOUGMIPSA-N 456.862 -1.442 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1835403790 UDLIPNVLJPLITP-HSZRJFAPSA-N 474.367 -1.926 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1835930164 AIETYQOPSPTVOR-HSZRJFAPSA-N 484.318 -1.011 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931874 FGXZJIPUCYZUIO-QVKFZJNVSA-N 464.280 -1.002 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1839104124 LIOXHCGVWCFEAM-UZUQRXQVSA-N 489.577 -1.609 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779416911 DTDQLZMZNKHWCZ-MAODMQOUSA-N 455.556 -1.476 50 20 JAGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(=O)[nH]c1C 1833387379 XTOOXEBENSQGOC-JOCHJYFZSA-N 470.291 -1.550 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1835931090 FVIXFXMLXOSZJH-HSZRJFAPSA-N 493.285 -1.847 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840183969 LNKQXHORHBRZMR-HXUWFJFHSA-N 476.494 -2.139 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840496121 AUWCUHPGMSIHBS-QFIPXVFZSA-N 455.276 -1.220 50 20 JAGD O=C(Cc1ccc(O)cn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840496532 ZVIWUCFYLHTQLD-JOCHJYFZSA-N 455.276 -1.220 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365783 WHPYFYMELCKHMD-POAQFYNOSA-N 453.308 -1.326 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc21 1836776288 PMODIGDRKBMECE-HNAYVOBHSA-N 455.899 -1.314 50 20 JAGD Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNC(=O)CN2CCCC2=O)cc1C 920826602 PNOYFAPAGHSGBR-OAHLLOKOSA-N 453.521 -1.014 50 20 JAGD CN1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1834799957 IOXPZISMEDXSHV-UHFFFAOYSA-N 471.411 -1.201 50 20 JAGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cn1 1835928072 CQNGMXWXPMDKFM-HSZRJFAPSA-N 483.286 -1.068 50 20 JAGD O=C([C@H](O)N1CCOCC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837521727 RLAXPVCQTZELCA-NOLJZWGESA-N 454.293 -1.216 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2n(n1)CCNC2=O 1786259549 ONPDTGTYKKGPMZ-QOKNQOGYSA-N 467.291 -1.787 50 20 JAGD CN1CCN(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)CC2)CC1 1799192962 NOWLIVWZZFQYCZ-XEMDLRDOSA-N 450.584 -1.271 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371412 ULLNSFAYXHWTCN-BEFAXECRSA-N 488.273 -1.479 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779553123 AEYYLTURYUPSEU-JBYIUTFZSA-N 476.534 -1.036 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611006 FNWQCLAFUNKGRB-FGVQXAILSA-N 464.479 -1.657 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(=O)nc2cccnn12 1789197069 FYIUITOCOXURMI-IEZWGBDMSA-N 477.286 -1.324 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364536 QQHPDUOWJJIJFZ-FXAWDEMLSA-N 450.308 -1.079 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837946169 WGJLNOPREJPFNK-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199132 QLQQTJICEYVXKF-DOMZBBRYSA-N 451.249 -1.315 50 20 JAGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)nc1 749352119 GANHRZJWYAPEQO-UHFFFAOYSA-N 463.586 -1.028 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21)c1ccc(B(O)O)cc1 1786981800 LZHPYJBLIQHVBC-SNRMKQJTSA-N 498.370 -1.135 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)n2[nH]cnc2n1 1796185719 WURVLXRSVSLIAY-ZSBIGDGJSA-N 451.447 -1.018 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(CCO)CCO)CC2 1826089808 ORJWAMPUQMMCMA-ZDUSSCGKSA-N 456.569 -1.285 50 20 JAGD COCCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1836551222 MVJWQDCDXZOPAA-QFIPXVFZSA-N 487.517 -1.088 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840183635 QLIVYFXDSHDBHQ-HXUWFJFHSA-N 464.479 -1.382 50 20 JAGD COc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1CCOCC1 729274714 BAVNRJWBOFDPGD-LLVKDONJSA-N 464.522 -1.585 50 20 JAGD O=C(/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NC1CC1 1835938539 XRCURVAEGMZDRX-DYRFGFBLSA-N 457.292 -1.729 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(=O)C(=O)O 1839703013 QBENGPWLZDRGQU-HXUWFJFHSA-N 463.252 -3.021 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccncc3=O)C2)C1 1840184883 DYGWMUPWFYSKFO-FQEVSTJZSA-N 450.496 -1.927 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCO)C2)NC(=O)NCc1ccccc1 1799097072 AQRXWQORVFEGEA-RMFSNUHRSA-N 463.535 -1.069 50 20 JAGD C[C@@](O)(C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(F)(F)F 1835934080 MNDVOQPQNQLOQS-QZTJIDSGSA-N 460.214 -1.250 50 20 JAGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937929 BJNYJUHLZDUIOQ-ZHRRBRCNSA-N 461.324 -1.259 50 20 JAGD CC[S@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837239316 VXXWGMSBFPXXDN-QJWGWKRISA-N 452.338 -1.405 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459671 VYTKAADHFWEEIM-VFNWGFHPSA-N 472.506 -1.317 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840195937 LXDXRQCKKZIHBJ-XLIONFOSSA-N 452.338 -1.450 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786986642 SUKOBNVXSCTXQQ-QEJZJMRPSA-N 457.214 -1.362 50 20 JAGD O=C(CN1CCOCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834620084 ZJUDNAPHLVAZLY-UHFFFAOYSA-N 458.368 -1.116 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926639 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O=C(CSc1nc[nH]n1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840379720 ISPSMILIPCDWCJ-LJQANCHMSA-N 461.309 -1.653 50 20 JAGD Cn1cc(C=NNC(=O)c2ccc(NN=Cc3cn(C)c(=O)n(C)c3=O)cc2)c(=O)n(C)c1=O 807184219 USISVZKWAZOUEG-UHFFFAOYSA-N 466.458 -1.309 50 20 JAGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)c1cccc(B(O)O)c1 1819879943 HCCHHZXYDABUIL-IFXJQAMLSA-N 460.321 -1.301 50 20 JAGD CC(=O)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n[nH]1 1835929402 OABYKXRALFLYRB-OAQYLSRUSA-N 456.264 -1.324 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)c3ccccn3)C2)C1 1837457944 XORKTJPQDPPXPY-PGRDOPGGSA-N 469.502 -1.150 50 20 JAGD N=C(N)SCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457975 ZDEFAMOCGMMAFZ-LJQANCHMSA-N 465.536 -1.228 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839987741 UCOXMHQOEOJLDB-JOCHJYFZSA-N 477.323 -1.039 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1840151242 YHKPDMYOOLXIMF-YJYMSZOUSA-N 455.899 -1.050 50 20 JAGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 912953112 ONTWYTMGVHXGQF-CABCVRRESA-N 486.572 -1.201 50 20 JAGD CS(=O)(=O)NCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920424845 LARMHPWRGJQKLV-UHFFFAOYSA-N 462.550 -1.273 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792886175 XFCLMOFORPKQPB-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cn1 1796075823 MZLNRVGBZFZEGN-XEMDLRDOSA-N 487.343 -1.177 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839083002 MEIFLGXCUHNTEF-FPGHNAPASA-N 485.346 -1.163 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028720 JRBUCSKDZRLCDC-BFUOFWGJSA-N 468.536 -1.544 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)[C@@H]1SC(=N)NC1=O 1796425186 FAWACCUEYHMKTP-ZNLHFFCSSA-N 475.531 -1.309 50 20 JAGD O=C1CN(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C(=O)N1 1807360452 BUGMPNZXJZUSST-JXFKEZNVSA-N 465.275 -1.367 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779030999 LSJUPNPPFVSBOZ-NRFANRHFSA-N 453.264 -1.878 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788610618 MHIKUNCNELCYLY-JVPBZIDWSA-N 467.291 -1.728 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935626 VZVRRQMEBIQYDM-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)C=CC3=O)CCO2)C1 1840261868 DDYWFGIDGIMMRZ-NMWDDECMSA-N 486.485 -1.498 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)N1 1807369616 QICUDJOCXGTRKF-IEZWGBDMSA-N 465.275 -1.321 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)N1 1832697792 QSAZPWNDXWKJEU-CCUNJIBTSA-N 451.249 -1.269 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nn1 1835930963 AZXCQFQUNSFLDK-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933931 HJFJFNPRSXCTAM-JOCHJYFZSA-N 471.275 -2.249 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=N)N)C2)C1)NC(=O)NCc1ccccc1 1839054228 MKXBDTNWYFQODF-JOCHJYFZSA-N 490.565 -1.728 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CNC(=O)C(F)(F)F)CCO2 1840203763 RBNXYQUGUQPYKF-QGZVFWFLSA-N 467.445 -1.506 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831465845 OBUSHVDHWAYZGF-HNAYVOBHSA-N 462.569 -1.504 50 20 JAGD Nc1n[nH]c(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1835666568 SALDNZPHRXPCCY-UHFFFAOYSA-N 469.355 -1.115 50 20 JAGD CN[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)C(=O)O 1835760651 DTZBWQIRWMNQPI-FOIQADDNSA-N 464.479 -2.182 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1837459139 JVVFXQGYWRPULZ-OAQYLSRUSA-N 476.490 -1.403 50 20 JAGD 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]1NC(=O)NC1=O)C2 1796439583 NUFDQBGHEVOVHV-MRAVKPJSSA-N 459.463 -1.692 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799681585 ZIUXCCQZDNAPTN-CXHZTBPHSA-N 463.296 -1.587 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(CCO)CCO 1800576428 RHQLYOZSMBCOSI-DFGXFYAUSA-N 493.001 -1.005 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833471863 MVUMBEBEKJVBTC-NRFANRHFSA-N 457.248 -1.851 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835763278 AKLQHAXPSZKIRT-QFIPXVFZSA-N 468.599 -1.418 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837376476 BFAUOBMLSXTJOR-BTYIYWSLSA-N 462.312 -1.856 50 20 JAGD Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1C 110902719 ZZAKALRSGSHISH-HNNXBMFYSA-N 481.487 -1.072 50 20 JAGD CS(=O)(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782716036 BIEFWWQLRSKUPN-YLJYHZDGSA-N 452.338 -1.071 50 20 JAGD O=C(COc1ccc(O)nn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790589413 PQLFIVZDVVBXDH-XIRDDKMYSA-N 456.264 -1.466 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2n(n1)CCNC2=O 1794972872 NAQQAMKPNIXXTB-ZSBFGKGUSA-N 453.264 -2.177 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373198 OWKBTYGJXPXFKT-UGKGYDQZSA-N 470.335 -1.632 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1)c1ccc(B(O)O)cc1 1834798817 BLIVSAWISIECBJ-UHFFFAOYSA-N 468.319 -1.523 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1835935638 WRQRHBJIFMFUFU-OAQYLSRUSA-N 474.254 -1.154 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1835936850 GXIYSTRCBNRWIG-FQEVSTJZSA-N 458.236 -2.049 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1835939615 VSHICWJIGZQWKY-JOCHJYFZSA-N 472.259 -1.133 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837376483 BFAUOBMLSXTJOR-VFNWGFHPSA-N 462.312 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1837457537 IPSNWNQYIWUPDH-UWJYYQICSA-N 489.558 -1.218 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840852752 YMMJDXXDQOYXPE-SIKLNZKXSA-N 461.324 -1.259 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1 861635591 OOGNQUZZVROQOR-UHFFFAOYSA-N 460.472 -1.043 50 20 JAGD COC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779556028 YQHZOCZUIJQFPT-NNMXDRDESA-N 461.324 -1.355 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783934354 FHZXPHSZFZBGMP-NRFANRHFSA-N 452.556 -1.647 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1801011552 NKJCJMVVGWJXBQ-HBCWATKFSA-N 461.523 -1.407 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1O 1837456869 OSWXZYBPZZTFNZ-HXUWFJFHSA-N 459.463 -1.492 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839682669 DBYDELPLNMBCMA-QVKFZJNVSA-N 464.280 -1.002 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1779032554 SYPSNEJPFYQBHO-JOCHJYFZSA-N 482.501 -1.228 50 20 JAGD N=C1NCCN1CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835637275 WSGBOYQWLARIMR-HXUWFJFHSA-N 460.495 -2.405 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836968083 AFPOOMOHHSLAJX-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839082502 FUAHRHZWVWPXTN-FPGHNAPASA-N 485.346 -1.163 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CN2CCS(=O)(=O)CC2)C1 1841894243 DJWPWDRHGOYQTN-UHFFFAOYSA-N 450.521 -1.768 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1779092485 IOXCSPQCEOYTEE-JJLXJTODSA-N 462.507 -1.399 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)nc3O)[C@H]2C1 1787431711 RPOIZKBUOMDHMM-LKTVYLICSA-N 457.447 -1.207 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831443062 NCENGNLHKAAXKW-HXUWFJFHSA-N 466.321 -1.657 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812716142 HNGMCTWEENCHJS-GCJKJVERSA-N 464.567 -1.253 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928098 DNYOTSAFXDMBLH-JOCHJYFZSA-N 468.080 -2.570 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cnnn1 1837460507 GYWDGVJQXNMVBX-BFUOFWGJSA-N 459.467 -1.997 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840361534 NLAIHXNGNKVGPN-UZUQRXQVSA-N 468.319 -1.035 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348278 KJJZRZXDVSFBDG-CYBMUJFWSA-N 454.273 -1.026 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835644734 TVQUMSAPEVFTMP-FQEVSTJZSA-N 491.549 -1.065 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2 1837090982 SDZWAHBILAUQKP-QFIPXVFZSA-N 454.292 -1.107 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839083004 MEIFLGXCUHNTEF-WWEVIYMKSA-N 485.346 -1.163 50 20 JAGD CN1CC(=O)N(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1=O 747461493 PKNVGDYFQNSBOZ-UHFFFAOYSA-N 467.504 -1.319 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931331 MUCAKBCXFBWMPJ-HSZRJFAPSA-N 479.302 -1.278 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839372388 XUFNWPXZEHKKLB-JOCHJYFZSA-N 472.259 -1.133 50 20 JAGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CN(C)S(C)(=O)=O)N(S(C)(=O)=O)CC2 744313304 BFVAZTJHELGADZ-AWEZNQCLSA-N 492.576 -1.009 50 20 JAGD Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c2ccccc21 1795738764 FDZGBZSZPLOTHC-FAQVEIGNSA-N 478.314 -1.077 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(CCO)CCO)C2 1796443944 RJSNGFILANHJAP-GWGBFROSSA-N 464.523 -2.003 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738470 PDYDQAHXCDBPTE-GJYPPUQNSA-N 457.915 -1.487 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)N1 1832697794 QSAZPWNDXWKJEU-ISOBSLSZSA-N 451.249 -1.269 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837467438 LHYRALMQSDZWSX-IBGZPJMESA-N 458.585 -1.700 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839782180 PABQKAZSKYSEDY-XLIONFOSSA-N 466.321 -1.986 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1840185515 OMBHQOGKTZFCIB-NRFANRHFSA-N 480.522 -1.458 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829714184 YRUAEUQVBPCIGK-NRFANRHFSA-N 478.575 -1.196 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837457036 SYJWTJUCQIYSEQ-OAQYLSRUSA-N 471.474 -1.133 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1840151241 YHKPDMYOOLXIMF-ORAYPTAESA-N 455.899 -1.050 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CC(=O)NC3=O)C[C@@H]21 1787507076 WBVJKIYGRMJWBM-HVEJOWRVSA-N 473.490 -1.348 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927566 SXAOBPNXXOJRFH-OAQYLSRUSA-N 495.363 -2.833 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21)c1cccc(B(O)O)c1 1786984959 CZDHOVPQQJMMSZ-IEZWGBDMSA-N 484.274 -1.270 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740542 GOICKMPUERXRFY-REGYPHIPSA-N 466.303 -1.217 50 20 JAGD CCOC(=O)/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1834774571 WLVPLIUFDWUPNQ-SHTLVRLNSA-N 461.475 -1.126 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1835928624 SQEOGKSQWBRQPG-QHCPKHFHSA-N 483.286 -1.084 50 20 JAGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(C)(C)C 1835933898 GHPAHVXDFLCWJD-AUSIDOKSSA-N 475.351 -1.013 50 20 JAGD CSCC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939996 RVHSFGZEJOIPNK-FXAWDEMLSA-N 452.338 -1.450 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456340 GTXLKBXQUXJPIM-NRFANRHFSA-N 471.474 -1.133 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839649828 MBJLIBFWHAUQMU-JOCHJYFZSA-N 470.291 -1.435 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COc1ccc(O)nn1)CCO2 1839670370 FFZJWPAPEXPTPG-HXUWFJFHSA-N 466.495 -1.610 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccnc1)C2 1797748440 AUQRGSFTMQMIQN-CCWDJLKJSA-N 467.486 -1.287 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804185091 BFNKBVIQGTUJSL-IFXJQAMLSA-N 480.485 -1.049 50 20 JAGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)no1 1835937395 TYMOCDNORLWFNO-JOCHJYFZSA-N 486.290 -1.238 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1783982323 KNVBULFVKRVRMG-KRWDZBQOSA-N 458.397 -1.193 50 20 JAGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnnn3)[C@H]2C1)NC(=O)NCc1ccccc1 1787092185 CNLZSNDERMHDDF-FHWLQOOXSA-N 485.549 -1.001 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788703613 NESLNFROBRNBKI-QQDKQVRDSA-N 481.318 -1.432 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1806699702 OCBHGCJICVUTHK-UHFFFAOYSA-N 477.392 -1.058 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1833864862 RUYPQSOBJBWCGP-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)COCCO)CCO2)C1)NC(=O)NCc1ccccc1 1839194858 XPWKNCXQWSUAED-HSZRJFAPSA-N 493.561 -1.202 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1840185650 RRQHJAUIWUNGAI-QFIPXVFZSA-N 487.517 -1.468 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840370106 HFACRVXIBNCDGN-JTDSTZFVSA-N 457.915 -1.487 50 20 JAGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nn1 742774137 DOOFLKJNMABBBN-UHFFFAOYSA-N 493.546 -1.219 50 20 JAGD Cc1cn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(=O)nc1O 1795736727 CTGCLJCXGROSFU-JLVBRIDZSA-N 456.264 -2.159 50 20 JAGD CC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1796441945 JCAPXKLFYBSQBQ-CUCQEMJRSA-N 487.561 -1.126 50 20 JAGD Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1F 1833705436 DTQYREVZWHIEAA-OAQYLSRUSA-N 460.271 -1.069 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836768275 ATJVWHIIBVKTSF-PXNSSMCTSA-N 460.959 -1.139 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837204300 FQNJAPKKZHUZSU-JXFKEZNVSA-N 465.268 -2.499 50 20 JAGD CN[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)C(=O)O 1837457970 YYNUPSRHFULXEU-QRWLVFNGSA-N 464.479 -2.182 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1840153210 HNYKWNMGPZRGFC-PXNSSMCTSA-N 460.959 -1.139 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1840183431 DZNYMVOGATXBRX-HXUWFJFHSA-N 451.480 -1.471 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840482936 IHYJXZBWNUUDGK-JOCHJYFZSA-N 470.486 -1.024 50 20 JAGD COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1848150991 TVTKERGHMQLOCG-AVGNSLFASA-N 452.899 -1.111 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CC(=O)NC1=O)C2 1782209507 UXKKIHQXNHWJHZ-JLTOFOAXSA-N 452.512 -1.575 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1807190742 LIHQLNCVCUOYPS-LSBZLQRGSA-N 468.518 -1.008 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831690411 IPAZTZQPIIOCQS-JOCHJYFZSA-N 461.324 -1.401 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933501 ATUCPVLHKQOELU-QFIPXVFZSA-N 455.276 -1.342 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1778378614 CYZBJGRFHOTWSY-QFIPXVFZSA-N 467.291 -1.546 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732791 KWCVQEQTGHCYQS-FAYQHZLMSA-N 453.326 -2.103 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373197 OWKBTYGJXPXFKT-SIKLNZKXSA-N 470.335 -1.632 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934535 XESMVJDPXINRST-UGKGYDQZSA-N 461.324 -1.259 50 20 JAGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794404996 WRKHSZLTAUJQOZ-CWPLJXCYSA-N 487.343 -1.177 50 20 JAGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754034 PVCYZOPMXZFBCA-CWPLJXCYSA-N 479.534 -1.042 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc21 1835937440 WOCBPUJIHAHBNQ-QHCPKHFHSA-N 497.317 -1.920 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[C@H]1SC(=N)NC1=O 1840183851 DSRVYVXCKJXUCE-OWZDWXTDSA-N 484.579 -1.382 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840185258 HTUBJRMIFYGHQH-NRFANRHFSA-N 477.522 -1.872 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1779037323 VXONTWTTWJQQGI-HXUWFJFHSA-N 457.447 -1.297 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804344783 SFALXXWLSFQYFI-HHXXYDBFSA-N 465.275 -1.321 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n(C)n1 1833443117 ZOMNUMRNCBPKPU-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927394 NXVOQQQNYZTICL-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748643 PAGMLPSKKVJYOH-JFILPPLUSA-N 468.536 -1.784 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832332483 QVMBOMDJSGLKBV-WFASDCNBSA-N 451.249 -1.315 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938033 GPMVRHNVQGNXPZ-VFNWGFHPSA-N 462.312 -1.856 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938119 MESWOJKVYDXXEO-ROZQTZPBSA-N 475.307 -1.035 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(CCO)CCO)C2 1793879235 REKMRTJMEBIBDU-DFGXFYAUSA-N 493.001 -1.005 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802105216 COFCEFQCDFLQCC-CULMDFNYSA-N 478.556 -1.251 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371415 ULLNSFAYXHWTCN-KXBFYZLASA-N 488.273 -1.479 50 20 JAGD CCOc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nn1 1835937978 DCQMETVGUKHNSD-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1CCN(C)CC1 1835939361 OJAREXIKNFONTM-JPYJTQIMSA-N 474.367 -1.928 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCN(C)CC3)CCO2)C1 1836672474 YAFZXUZYBGQGIS-DMUURETOSA-N 489.577 -1.176 50 20 JAGD CC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456925 SUKOSINSSSSTSV-LAUBAEHRSA-N 462.507 -1.330 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837606488 VHXNWILJNHQGHH-ZBQZNYHESA-N 455.899 -1.349 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(O)O 1847446394 JLJSXONIAMADDU-ULQDDVLXSA-N 477.323 -1.685 50 20 JAGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1 725874362 XQAYQORMZORYHW-UHFFFAOYSA-N 460.538 -1.587 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979989 XCQPJGOJKXPATP-IEZWGBDMSA-N 455.276 -1.017 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1835405425 ZIQMGSXIYXTJMK-JOCHJYFZSA-N 468.599 -1.547 50 20 JAGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccco1 1836126873 VKWBAWMZVGDQDZ-QFIPXVFZSA-N 471.275 -1.541 50 20 JAGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)C(=O)O 1807373869 VDBGYLRZJVWDGQ-QFBILLFUSA-N 468.275 -1.376 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930683 UHUOHBPNTZYDIE-KKSFZXQISA-N 457.296 -1.636 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840182294 FRTJXMFGBXNHRP-IBGZPJMESA-N 467.483 -1.379 50 20 JAGD O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794033689 FNXCOEHLAHOYCE-CWPLJXCYSA-N 454.292 -1.282 50 20 JAGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1807373866 VDBGYLRZJVWDGQ-LPHOPBHVSA-N 468.275 -1.376 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831325422 XYZUFPRRYASXCZ-VBKZILBWSA-N 498.562 -1.917 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835645333 FEZKWGJFWRAYCK-FQEVSTJZSA-N 470.571 -1.005 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835738099 SRACMJRZOHVRQM-QHCPKHFHSA-N 489.577 -1.479 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930707 VRARCDJVUPZQKP-QFIPXVFZSA-N 483.290 -2.251 50 20 JAGD Cc1cnn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457941 XMXWJBMQNUAGJY-OAQYLSRUSA-N 457.491 -1.040 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832018953 CODLZEBLLJULIF-QFIPXVFZSA-N 471.275 -2.249 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(=O)n2[nH]nnc2n1 1834972278 YEMNSJGVYXDGOH-CQSZACIVSA-N 452.903 -1.403 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839782179 PABQKAZSKYSEDY-PXNSSMCTSA-N 466.321 -1.986 50 20 JAGD Cn1nc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c2ccccc2c1=O 16231266 NFZDUPLCRROVOZ-UHFFFAOYSA-N 452.431 -1.468 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734511 RMXUJEFRAZOWNM-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)n1 1835927067 CNOSRTWOHNGUIU-QFIPXVFZSA-N 456.308 -1.050 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931976 JOGVZZQAXWRRGS-OAQYLSRUSA-N 472.263 -1.989 50 20 JAGD C[C@H](NC=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054184 KSVYXDMSIXOFHG-FDDCHVKYSA-N 490.561 -1.077 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1840035438 RIBCSDUQOMTSSI-YOEHRIQHSA-N 452.346 -1.487 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926996 BCZXERNNLDAAMC-HXUWFJFHSA-N 466.321 -1.657 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838476928 JYNSCOSOPXMNKO-QFIPXVFZSA-N 469.259 -1.126 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1840186019 YZHMHFYCAHBZLN-GOSISDBHSA-N 453.456 -1.239 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CNC(=O)c2ccco2)c1 725902424 MLQGJZWEPWUWQU-UHFFFAOYSA-N 451.461 -1.163 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)Cc1cccnc1)CCO2 1836506061 MWENLURNTDMOQK-PGRDOPGGSA-N 462.551 -1.219 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCOC3=O)C2)C1 1837457058 WOCFTCNGKYBFSC-HXUWFJFHSA-N 462.463 -1.793 50 20 JAGD Cc1noc(N)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457506 GOPCDULVHNWXDZ-FQEVSTJZSA-N 459.463 -1.052 50 20 JAGD O=C(Cn1ccncc1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781484533 CORGFHRWTSNMCD-XMSQKQJNSA-N 454.292 -1.249 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833713545 WTCIRQQKMTUOHJ-KRWDZBQOSA-N 465.016 -1.112 50 20 JAGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1834819787 UZRLRYXSLIXLCJ-KRWDZBQOSA-N 482.397 -1.042 50 20 JAGD Cc1noc(N)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835625944 IQTZMBBHSBRMBG-HXUWFJFHSA-N 459.463 -1.052 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937926 BJNYJUHLZDUIOQ-KSFYIVLOSA-N 461.324 -1.259 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc[n+]([O-])cc3)CCO2)C1 1838336616 JHUDHCAOVOJBNL-NRFANRHFSA-N 456.459 -1.298 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784441667 QPJSWOGHEDURDE-KCMWZYNZSA-N 467.353 -1.713 50 20 JAGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)CN)C[C@@H]21)NC(=O)NCc1ccccc1 1789726640 HZEYGFIDFVMNPS-VJANTYMQSA-N 461.567 -1.402 50 20 JAGD O=C(CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1CCCC1 1832420055 GPGPAGPYLOKXMS-QHCPKHFHSA-N 473.335 -1.161 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H](O)CN3)CC2)CC1 1835738128 GJNQMEQFBGRSEC-LPHOPBHVSA-N 459.551 -1.407 50 20 JAGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)(C1)C2 1840005402 ZGGQASCBLQOLDX-VNXZQDSDSA-N 472.303 -1.220 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840185970 XZIGJOSIJHRUBF-NRFANRHFSA-N 462.507 -1.151 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732766 AIXYWFUYMOGVKL-IFXJQAMLSA-N 472.951 -1.052 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833713549 WTCIRQQKMTUOHJ-QGZVFWFLSA-N 465.016 -1.112 50 20 JAGD N=C1NCCN1CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834704768 UKCXDFIYMVIGLU-UHFFFAOYSA-N 456.356 -1.608 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837239315 VXXWGMSBFPXXDN-PLTNMMHCSA-N 452.338 -1.405 50 20 JAGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(=O)nc1O 1786982255 VGWHASKWXPWASS-SZMVWBNQSA-N 470.291 -1.769 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740627 DYHUWQKXBRPHSQ-WOUAJJJCSA-N 469.307 -1.960 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831458969 VIXPHSREOHWRSW-VBKZILBWSA-N 483.547 -1.564 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832327951 YOZGSYSMBIEUSO-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD CNC(=S)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779377280 UBUDBDAECDXNNW-DYESRHJHSA-N 462.381 -1.022 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(=O)nc2sccn12 1798413644 ZNXLZDMIFSZNCB-ZSBFGKGUSA-N 468.300 -1.047 50 20 JAGD N=C1NCCN1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807114280 XVRYMTUHEQEXGK-YLJYHZDGSA-N 450.308 -1.079 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735001 BRJQFXDAJWYRPC-KSSFIOAISA-N 458.855 -1.187 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934237 PYTIZWYWMSJKSI-YLJYHZDGSA-N 452.338 -1.450 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031950 HXLLNSONCHRTMP-UWJYYQICSA-N 477.474 -1.377 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372709 YRXPCXOFUFFTAH-FYINFDKHSA-N 478.506 -1.123 50 20 JAGD O=C(CN(CCO)CCO)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053066 BCDNKZOJWFCWFF-OAQYLSRUSA-N 461.368 -1.114 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)N1 1832693720 LDCUXALKZIVRFV-FOIQADDNSA-N 460.252 -2.966 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1CCN(C)CC1 1835939360 OJAREXIKNFONTM-FDDCHVKYSA-N 474.367 -1.928 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839669425 APACBUZDPZLAQU-NRFANRHFSA-N 487.473 -1.670 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797786552 UGOIMTKLFFJSEE-NBMJBFSESA-N 462.264 -1.936 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797930 NHNORSXNALEBGE-UHFFFAOYSA-N 479.151 -1.455 50 20 JAGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1 1838351975 DPRLOPVEMZECBM-HXUWFJFHSA-N 450.496 -1.072 50 20 JAGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837522274 DONDCNAQQKPVOZ-LXZKKBNFSA-N 450.330 -1.123 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837841738 KNQYNPDTMFZDAY-KRWDZBQOSA-N 454.572 -1.049 50 20 JAGD CN1C(=O)CC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839215058 UYGFWEHKAFHUQM-HRAATJIYSA-N 460.491 -1.624 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)C(=O)O)C2)C1 1840035162 IDYSGCAZYYEMGP-ZBEGNZNMSA-N 450.286 -1.231 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN(C)C(C)=O)c(=O)n2Cc1ccccc1 914756126 HADGIMCRRSAKAD-UHFFFAOYSA-N 485.501 -1.320 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ncccn4n3)C2)C1 1777830063 YSVXTFCPOBJGKP-FQEVSTJZSA-N 451.447 -1.120 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21 1788609712 CGLYLUDKFFYMQI-STECZYCISA-N 465.532 -1.144 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804343404 DPIPZPJQIKCKEC-IEZWGBDMSA-N 465.275 -1.321 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833678814 CGGDJGXHEVWJSU-UHFFFAOYSA-N 465.555 -1.517 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930321 GMUWCINOZXNWKR-PLTNMMHCSA-N 452.338 -1.405 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1835931304 MLJPPMFZJJPODD-NRYAXDJKSA-N 485.346 -1.163 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837115897 OKEZNJYKRSRPTR-QGZVFWFLSA-N 487.517 -1.105 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837206693 OVVHRHFWVVAHGY-FFRRBZOQSA-N 494.505 -1.359 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845874384 AJZATPUDTYGVLB-LSDHHAIUSA-N 480.591 -1.257 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779076541 NTSQBXWIRBCVEB-OXJNMPFZSA-N 456.496 -1.316 50 20 JAGD CN[C@@H](CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(=O)O 1779373461 UJEVHNPKGOCJOE-GCKMJXCFSA-N 462.507 -1.125 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H](N)C(N)=O)C2)NC(=O)NCc1ccccc1 1799095197 YZZGOALBLSIZDG-BMQTXXJKSA-N 489.577 -1.485 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)N1 1807369615 QICUDJOCXGTRKF-HHXXYDBFSA-N 465.275 -1.321 50 20 JAGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(=O)C(=O)O 1819799909 HAQKXVNBQCIPEC-SECBINFHSA-N 475.487 -1.090 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731181 HNKCSRAXCOFSBQ-KUHUBIRLSA-N 451.867 -1.241 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc21 1830732204 WDWJUYIUCCVXCS-KXBFYZLASA-N 455.899 -1.314 50 20 JAGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(=O)[nH]c1C 1833388419 VQSOZCGBGWFZPH-QFIPXVFZSA-N 485.501 -1.231 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797880 HFUGBJSLYGAXIR-UHFFFAOYSA-N 479.151 -1.455 50 20 JAGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934094 NHLJEZMTXNJYFD-QFIPXVFZSA-N 461.324 -1.257 50 20 JAGD O=C(CCN1CCOC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937168 QSCHAPNUSJVMFD-NRFANRHFSA-N 461.280 -1.721 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417224 GBYXVWHVODTTAW-OAQYLSRUSA-N 457.248 -1.444 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2 1837090907 PLNGCDDZJPFVTQ-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cncn1 1837460425 FZVAKQQBHFJUDR-VBKZILBWSA-N 458.479 -1.392 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460947 LXDSRMMGICCELZ-OAQYLSRUSA-N 477.522 -1.872 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184991 DAVAVQKXVGKQJO-MGPUTAFESA-N 456.544 -1.477 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)CN)C1 1842876890 UZVCYUIZUBFLAP-KRWDZBQOSA-N 460.340 -1.036 50 20 JAGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)[C@H]1CCS(=O)(=O)C1 753562945 GHYVYQKOKFWSPG-HNNXBMFYSA-N 474.561 -1.413 50 20 JAGD CC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1 1795738786 GADDMWWLDYTKID-RMFSNUHRSA-N 458.324 -2.266 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)N1 1832697795 QSAZPWNDXWKJEU-ZSGNIPIJSA-N 451.249 -1.269 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN3CCNC3=N)CC2)CC1 1834704885 KVHKMLSCSJMDPI-UHFFFAOYSA-N 450.588 -1.229 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1835930216 CUEURMCNDYTOMB-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984524 QHTYOQIKCILOJK-NOLJZWGESA-N 467.251 -2.601 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)n1 1795734361 MYNWEIGSMSQPFD-XEMDLRDOSA-N 468.319 -1.130 50 20 JAGD CC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829855054 DGUWLRXSMKSLHY-UTKZUKDTSA-N 462.507 -1.330 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1833478036 BOYWPWZRPKZOST-HXUWFJFHSA-N 451.480 -1.471 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1835927321 NGUHRYPESCBQLI-NRFANRHFSA-N 457.248 -1.851 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)N1 1835935071 FHNGWOQVDBIXKY-FOIQADDNSA-N 460.252 -2.966 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779067853 HDVUTYFKLDTNDN-WIYYLYMNSA-N 462.264 -1.695 50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1807373862 VDBGYLRZJVWDGQ-APWZRJJASA-N 468.275 -1.376 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832326637 LAAQMFHQRRDIPG-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD CN(C)c1ncc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)o1 1835929277 IUFCEOIDVLDYQQ-NRFANRHFSA-N 458.280 -1.196 50 20 JAGD CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939952 QBYUJEVVNKJWRT-BTYIYWSLSA-N 464.280 -1.002 50 20 JAGD CSCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840199412 ZLRONGIXKVGDHS-OXJNMPFZSA-N 467.548 -1.131 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1ccccc1=O 1835930593 OPCXSBKFXPQOIN-HXOBKFHXSA-N 469.303 -1.141 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1C 1838833375 RMJCQVFRXWMIEZ-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839384317 AORGSSFLCXDBHU-SNUQEOBHSA-N 451.904 -1.114 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737751 PUKGOUUCTVCAEQ-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360534 BECOGZCGPGRXQN-KXBFYZLASA-N 488.273 -1.479 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801294 XDZFOOZIAYCWMG-UHFFFAOYSA-N 480.334 -1.246 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3C(N)=O)C2)C1 1837459460 PSZMLVRGGYSURB-OAQYLSRUSA-N 484.473 -2.042 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)C(=O)O)CCO2)C1 1839704497 RKYUOOOQVOHJIY-BZNIZROVSA-N 450.286 -1.231 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779176708 LTZHTLZCADQYIA-OYHNWAKOSA-N 467.291 -1.582 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3nccnc3C(N)=O)C2)C1 1779877760 JGWOZBMQHIULKL-FQEVSTJZSA-N 454.447 -1.669 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)CC1 1786983421 RTYGOIPSAKUJHS-IHPCNDPISA-N 493.391 -1.369 50 20 JAGD Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)nn1C 1835926521 PVULCUCOKVWIPM-QFIPXVFZSA-N 456.308 -1.279 50 20 JAGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1=O 1835938575 ZPYADDKKFPXCCR-DEOSSOPVSA-N 493.281 -1.115 50 20 JAGD Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(=O)[nH]c1C 1786980144 NNPPTFNXZARSHD-SZMVWBNQSA-N 454.292 -1.026 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCNC(=O)c1ccc[nH]1)CCO2 1832881791 SPDLTUBLGMMJRW-QFIPXVFZSA-N 478.550 -1.036 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833120453 HNKBTIPPMWAMAE-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(=O)[nH]c1C 1833387380 XTOOXEBENSQGOC-QFIPXVFZSA-N 470.291 -1.550 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927228 MYROWBVZJWJUGA-QFIPXVFZSA-N 468.275 -1.756 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1835937090 NZHPJXVXPWSWHX-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1835939673 DIKICODVOYRCJU-SBUREZEXSA-N 468.319 -1.035 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)C=CC3=O)CCO2)C1 1840262937 PZQXHQLSJVIFRR-OAQYLSRUSA-N 472.458 -2.320 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1779035666 KXSLRKBTSKPBTK-LJQANCHMSA-N 478.556 -1.011 50 20 JAGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919303 ZRDYBAFNZWFYQZ-ROUUACIJSA-N 456.367 -1.034 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799364725 BLVFODNNPJIYCN-YNVMFWSZSA-N 491.350 -1.155 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1836765106 RGIRZPJEJKKSOZ-QHCPKHFHSA-N 488.350 -2.400 50 20 JAGD CC(=O)N(C)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457030 VZYWBEAGUVPHGA-NRFANRHFSA-N 462.507 -1.377 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1840185427 QDOSKTIXJZTHJD-GOSISDBHSA-N 455.541 -1.274 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(=O)nc1O 1840807472 OUAUUTPCQLEXTF-QFIPXVFZSA-N 486.290 -2.293 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 729274908 HCYZWVBQAGEZBP-AWEZNQCLSA-N 489.576 -1.615 50 20 JAGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)c1 919887591 BPESEZNWIZODGR-HNNXBMFYSA-N 473.577 -1.036 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735896 IPZPMJOJYBJLQX-YNVMFWSZSA-N 491.350 -1.155 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1C 1838833376 RMJCQVFRXWMIEZ-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1779123225 MCZQGDXKBCHYEU-NRFANRHFSA-N 471.474 -1.145 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1835404028 YBGSQKRBXDQGSV-HSZRJFAPSA-N 489.577 -1.607 50 20 JAGD O=C(CN(CCO)CCO)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202970 VFLMOMGHLXNGAE-ZBFHGGJFSA-N 456.309 -1.580 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840178933 WTIWFNUPLHBAPE-RTWAWAEBSA-N 464.280 -1.948 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184985 DAVAVQKXVGKQJO-FOIQADDNSA-N 456.544 -1.477 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840410604 IHIWBDRHOXKQTB-NRFANRHFSA-N 471.474 -1.376 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1779032621 OQEUIFWDRQMAMT-QFIPXVFZSA-N 478.469 -1.155 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1788610819 VSPBJZZANHDHSQ-PJODQICGSA-N 481.473 -1.677 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797868334 ORXHLDSVUWXNOC-AMVTXUCVSA-N 467.291 -1.822 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCS(=O)(=O)CC1)C2)[C@H](F)Br 1799344541 NMESVMSAYNIBNL-XCCSTKFXSA-N 456.334 -1.003 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)NC1)CCO2 1829953079 BOKNRHKNBQXGLZ-QKKBWIMNSA-N 460.491 -1.719 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)N1 1832694498 QUNXJEUMGMDQJO-YWZLYKJASA-N 460.252 -2.966 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1)[C@H](O)CCl 1833308239 LYUDGBJJRYHZQY-QGZVFWFLSA-N 465.016 -1.112 50 20 JAGD CS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834569561 BLNVBIHYPGSRBU-UHFFFAOYSA-N 451.354 -1.404 50 20 JAGD N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccnc1 1835828891 NBHFTFVAQUGTNI-NFBKMPQASA-N 468.319 -1.079 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939957 QJZGQIGJSPIGQR-OAQYLSRUSA-N 457.248 -2.639 50 20 JAGD CSCC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460319 BESKVHFWMUUACF-OXJNMPFZSA-N 467.548 -1.131 50 20 JAGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837513113 ATAXMFVBDVNSGW-DOTOQJQBSA-N 450.330 -1.122 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839349977 BMZZBLBSLMAVCC-QHCPKHFHSA-N 467.287 -1.151 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185338 LPSJTQCRRPDQHH-OXJNMPFZSA-N 451.528 -1.256 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185534 OOKWLSUIBWAGMQ-KSFYIVLOSA-N 491.549 -1.576 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365779 WHPYFYMELCKHMD-ILZDJORESA-N 453.308 -1.326 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868902 UKAFBXLKYLANPP-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840184114 SVCKEPYFKVVUOC-OXJNMPFZSA-N 468.580 -1.158 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788640364 NJYSQUOPVIWKFL-QZHFEQFPSA-N 491.501 -1.227 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[C@H]1SC(=N)NC1=O 1835928760 YHAWATPNAOAMRI-QSZISKGPSA-N 490.347 -1.761 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1835930238 DUCRAROENITMED-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1835931305 MLJPPMFZJJPODD-WWEVIYMKSA-N 485.346 -1.163 50 20 JAGD CN1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1836671832 DOSCGBOFBKCMCZ-QFIPXVFZSA-N 460.340 -2.316 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CNC3=O)C2)C1 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COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)C2=O)cc1 919883834 FXTXUAMLXKDWSH-KZULUSFZSA-N 453.477 -1.020 50 20 JAGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)N1CCN(C)CC1 1786981718 IIVIGRJHPKHMHI-LGYWMIHWSA-N 458.368 -1.404 50 20 JAGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1832755131 FRXNUQHYIURURI-SPLOXXLWSA-N 496.952 -1.093 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797769 DEWYSVNGZADJDI-INIZCTEOSA-N 494.423 -1.121 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933715 BCGJSZZXCDYUGC-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839654550 VGNQZLCRNZAZTM-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1784371151 OMGMUQQWEOWNOD-KNQAVFIVSA-N 469.307 -1.720 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367239 KBLQLKBKXWFSRN-DENIHFKCSA-N 470.335 -1.632 50 20 JAGD CC[C@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800193 YGLMVPKDVSRKFZ-IBGZPJMESA-N 459.356 -1.002 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1836888000 KPCUPKLOHQRDBH-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(N)=O)NC(=O)NCc1ccccc1 1802165274 XSXUMWWZMBOAGS-HGKCTWBKSA-N 461.523 -1.410 50 20 JAGD CCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831185762 UFIFBSKARHATOD-SZNDQCEHSA-N 462.507 -1.330 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832020097 ZFYNEZPUTFFZBE-JOCHJYFZSA-N 471.275 -2.249 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837526373 DILNEYNUSONMSY-PIVQEWKSSA-N 475.307 -1.035 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1840184543 UCQCUKTVFFYKHL-KRWDZBQOSA-N 468.429 -1.079 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCN3C(=O)CNC3=O)nc2)CC1 731118315 QNXAGSSTQXKKMK-UHFFFAOYSA-N 454.513 -1.414 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028723 JRBUCSKDZRLCDC-YJYMSZOUSA-N 468.536 -1.544 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[C@@H]1SC(=N)NC1=O 1779030284 NHAFXSNULYAJJV-YZIJFISFSA-N 475.531 -1.069 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1797792888 GEOSGJMHZJONHK-YYAJDYIMSA-N 456.496 -1.556 50 20 JAGD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1802104779 JXFUYOWBIFEILN-FVCICTRLSA-N 463.346 -1.570 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807193318 VHLKKQBORVDFFJ-POAQFYNOSA-N 453.308 -1.326 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833571243 ZECVPIXQMKTXNH-NRFANRHFSA-N 474.254 -1.154 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835675247 ZVAQOZPIEPBORC-JOCHJYFZSA-N 458.324 -1.282 50 20 JAGD O=C(/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NC1CC1 1835930331 GTWIFDBELPQFHE-RHVSLNNASA-N 457.292 -1.729 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837209326 UFOXNDIYTHPGQO-UZLBHIALSA-N 480.478 -2.180 50 20 JAGD COC(=O)CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784513380 JENBEFVQDRGSOZ-XIRDDKMYSA-N 450.322 -1.134 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)n(C)c1=O 1832755312 JZRJWOPDCOXCNL-ZUOKHONESA-N 498.924 -2.510 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927113 GLXCDDHVRLACQJ-FQEVSTJZSA-N 473.251 -1.759 50 20 JAGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835936920 JXJIMNPYPXPUDC-NZQKXSOJSA-N 468.319 -1.599 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939724 FUPOBFLCWZDYEX-OAQYLSRUSA-N 472.263 -1.989 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC(=O)NC3)C2)C1 1837457072 WPVYRGHSGHGBET-QKKBWIMNSA-N 460.491 -1.719 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840380451 BIYBCMCJPPULHS-LJQANCHMSA-N 476.519 -1.335 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847090687 CFSJDNYLKPGMRQ-INIZCTEOSA-N 474.323 -1.048 50 20 JAGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCS(=O)(=O)CC3)[C@H]2C1 1785036577 MZVKYODYJORAOJ-JONQDZQNSA-N 451.973 -1.050 50 20 JAGD O=C(O)c1cnncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788888880 LZJPTFWGINWHFG-KKXDTOCCSA-N 454.248 -1.238 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[C@@H]1SC(=N)NC1=O 1796427853 HGQXBFWGWMSCDL-POPZOMSYSA-N 454.553 -1.249 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360978 NIMGAMLZZDZIDV-CZTZKLFOSA-N 468.319 -1.268 50 20 JAGD 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O=C(Cn1cc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835972224 LKHMLTHVWAENDX-FQEVSTJZSA-N 462.699 -1.014 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840151902 QOUWRODJWXLRIR-XIKOKIGWSA-N 454.871 -1.259 50 20 JAGD COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980169 QTEGVTWGGJJXAQ-XIRDDKMYSA-N 450.322 -1.134 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=N)N)CCO2)C1)NC(=O)NCc1ccccc1 1835574578 ODJJZCAWAYBWSV-JOCHJYFZSA-N 490.565 -1.728 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934070 LXENWZRMQMGWMG-HXUWFJFHSA-N 466.321 -1.657 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940123 VBNLZLYPZCCHNX-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791542467 JYMGNAZVQIKRHO-KANFNMMFSA-N 477.566 -1.190 50 20 JAGD O=C(Cn1ccccc1=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935808 SMPKEZAJIRLYRS-JOCHJYFZSA-N 455.276 -1.702 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3sccn13)CCO2 1838415716 SWSBPWMHONCIEC-QFIPXVFZSA-N 498.326 -1.180 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837880142 KYIFEMQFVSCUKR-LJQANCHMSA-N 460.340 -1.429 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1779028144 FKNINWYYJHAWNX-LJQANCHMSA-N 458.435 -1.067 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979941 RMCUGIUMAJNLFR-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735894 IPZPMJOJYBJLQX-WQDJSCAQSA-N 491.350 -1.155 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnnn1)C2)NC(=O)NCc1ccccc1 1799095012 PXESJMQZDIDRCZ-XEMDLRDOSA-N 471.522 -1.391 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833506057 NNXCIHMJZCKTMR-NRFANRHFSA-N 471.474 -1.133 50 20 JAGD 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CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830728620 WJFABMRTZPWFLE-KSMMKXTCSA-N 465.931 -1.072 50 20 JAGD Cc1nnc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)s1 1835928272 HWQKRJPIWBJDDC-HXUWFJFHSA-N 460.321 -1.161 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1839077496 GMPRUEYNIPTWDT-WDZFJAKXSA-N 462.507 -1.700 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1840151591 HCMSMZCDEHQFFU-GTNSWQLSSA-N 455.859 -1.864 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840360879 DHCDLVGQWOPUKG-SBUREZEXSA-N 468.319 -1.035 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)CCO2 1783936063 BXPNVWJBWPQWFE-FQEVSTJZSA-N 464.479 -1.041 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807045298 WAOLROWRRSIVJD-IMFGXOCKSA-N 453.308 -1.326 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1810295398 SJBRNBIQZRULTA-AUUYWEPGSA-N 480.485 -1.049 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930741 XJCWHSGDBRVKPI-KSFYIVLOSA-N 461.324 -1.259 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935360 CAQYUFDUEAETKM-FQEVSTJZSA-N 462.699 -1.014 50 20 JAGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)s1 1836078588 ULEYRNQJAUACJF-FQEVSTJZSA-N 460.321 -1.161 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)CC2)CC1 1839108418 JEACSJOMRDVQSW-JOCHJYFZSA-N 480.610 -1.404 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839666684 TVYDJZZWXHIVID-XDHUDOTRSA-N 496.329 -1.350 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015655 SLUVTCWITNTILN-INIZCTEOSA-N 474.323 -1.048 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccc[nH]1)C2)c1ccc(B(O)O)cc1 1795732774 IFQALPGROQCOTE-CWPLJXCYSA-N 454.292 -1.282 50 20 JAGD O=C1CN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)C(=O)N1 1817470810 HOVSRFXKDKPLFI-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832484196 YJTRFJBQNLRBRM-YOEHRIQHSA-N 453.945 -2.227 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833307273 ABHDVVQONGXPQI-JOCHJYFZSA-N 468.275 -1.756 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930530 LITWGWYGUWRRHK-AOMKIAJQSA-N 469.307 -1.273 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1837459518 HIUGCIDYRVLSQK-QFIPXVFZSA-N 485.501 -1.117 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840852750 YMMJDXXDQOYXPE-DENIHFKCSA-N 461.324 -1.259 50 20 JAGD NC(=O)c1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779938183 IMELOAWZANVDLQ-OPAMFIHVSA-N 467.291 -1.303 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980009 YMCSWVMAOAHZAS-VDGAXYAQSA-N 452.081 -2.047 50 20 JAGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1846360755 DPXLOHRFQZFZSB-LBPRGKRZSA-N 452.899 -1.109 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784443298 VVDNBIYJQSBOBO-PYTWLRIVSA-N 482.563 -1.394 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[C@H]1SC(=N)NC1=O 1797750700 NRRYMBAWVOSILM-IUPFNGILSA-N 475.531 -1.309 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011437 LJRCZRHTSKHNES-YYAJDYIMSA-N 456.496 -1.556 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810350147 PUNAIHBMQWGOSB-NOXFTYBFSA-N 468.319 -1.268 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(=O)C(=O)O 1839202932 UFRNMAISLOWXCK-IAQYHMDHSA-N 454.249 -1.324 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1840186065 YSFQRRUUKMEOFT-FQEVSTJZSA-N 451.480 -2.259 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1 1778357778 CTLOIXPBNIPFEU-OAQYLSRUSA-N 452.556 -1.647 50 20 JAGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1781093582 ODEUFLKNJYGGIK-OPAMFIHVSA-N 459.551 -1.236 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981814 MHPJPLNCAQZAGV-XPYUAMARSA-N 477.323 -1.197 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3nc(N)n[nH]3)[C@H]2C1 1788504679 AFSPYKVSWBKVKY-CQDKDKBSSA-N 457.495 -1.389 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H](N)C(N)=O)NC(=O)NCc1ccccc1 1795635542 CZSDCSHWCZRHNC-NYUBLWNDSA-N 489.577 -1.485 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807041995 BYKBAHWRNKVODM-IMFGXOCKSA-N 453.308 -1.326 50 20 JAGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(=O)[nH]c1C 1833390820 GTDKFFLLXVVFLE-NRFANRHFSA-N 464.523 -1.170 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1)CCO2 1835305675 RZTAJPAUXPHHPI-LXPZDEJYSA-N 460.491 -1.145 50 20 JAGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)n3[nH]nnc3n1)CCO2 1836404923 WSFFLCNUSKAWAG-SFHVURJKSA-N 465.543 -1.266 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838760908 JNKCNNOCFHFWRH-UHFFFAOYSA-N 471.599 -1.355 50 20 JAGD O=C(NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1csc(N2CCOCC2)n1 746386906 XAOGSIBPZNGCGM-AWEZNQCLSA-N 452.537 -1.079 50 20 JAGD Cn1cnc2c1c(=O)n(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)c(=O)n2C 825366948 SGYOPPNRZMDHRF-ZDUSSCGKSA-N 472.414 -2.036 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(CCO)CCO)C1 1781839015 LBVOBROIALRNMS-XMSQKQJNSA-N 478.550 -1.901 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1837456773 NDPFEMDNAUJFQM-QFIPXVFZSA-N 498.500 -1.991 50 20 JAGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(=O)n2[nH]nnc2n1 1777821469 DVRPRNWHANJMPM-IIBYNOLFSA-N 481.278 -2.066 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1796439979 AHAWAMGXRBZTNB-ISHQNBSSSA-N 481.473 -1.245 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831456397 JJLIJHAIKWYELR-MGPUTAFESA-N 468.337 -1.883 50 20 JAGD CN1N=C(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCC1=O 1832375049 KPUCAKWTNNEWJT-NRFANRHFSA-N 473.490 -1.637 50 20 JAGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1=O 1835938576 ZPYADDKKFPXCCR-XMMPIXPASA-N 493.281 -1.115 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456080 HZRPMOZLZZVKSS-QFIPXVFZSA-N 476.534 -1.083 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(=O)nc1O 1840807071 APLVVVPKMNFLAB-JOCHJYFZSA-N 486.290 -2.293 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1cccc(B(O)O)c1 1786986842 LYPSGBXOWULURD-BPUTZDHNSA-N 477.373 -1.180 50 20 JAGD O=C(NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccc[nH]1 1835935302 NMHBUBMIGCQVDB-QHCPKHFHSA-N 484.318 -1.415 50 20 JAGD CC(C)CNC(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457502 GAAPVPNXNKJLDX-NRFANRHFSA-N 462.507 -1.473 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1840183699 UWENHPLOVTZDFK-OAQYLSRUSA-N 497.574 -1.072 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782467972 VTDKWTRMMZCILR-PQNGQFLHSA-N 497.361 -1.036 50 20 JAGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)C(=O)O 1812390200 RXRIYYVCXZLGKA-LPHOPBHVSA-N 468.275 -1.376 50 20 JAGD N[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1835828824 KUDYNNCMBWZOKE-NZQKXSOJSA-N 468.319 -1.079 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833676879 QUQLHNCWCCVEMX-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)N1 1835927142 IXIRQWAOSOLHPI-MGPUTAFESA-N 460.252 -2.966 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn1 1835935040 CPSBVJLUHFNSQB-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838531526 OXYYBVXELBBOKN-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1840183057 ZWXPUZPGUATETC-HXUWFJFHSA-N 452.512 -1.576 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184303 ZCQJFNVCLXSJQT-OLCUMFGGSA-N 491.549 -1.050 50 20 JAGD CS(=O)(=O)NCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 727065301 UENNIMJIVBTFSI-UHFFFAOYSA-N 493.633 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1810295400 SJBRNBIQZRULTA-IFXJQAMLSA-N 480.485 -1.049 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1813070530 INZIEGGMRQKXAC-AUUYWEPGSA-N 482.505 -1.100 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928789 ZORLHUVOENZNHF-VUEBRRCKSA-N 497.317 -1.430 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCNC(=O)C1)CCO2 1840230443 LASRWRAUECDOEF-SZNDQCEHSA-N 460.491 -1.719 50 20 JAGD CCS(=O)(=O)NCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916517220 YKIRVRHXVZSEKW-UHFFFAOYSA-N 491.592 -1.090 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[C@@H]1SC(=N)NC1=O 1797750703 NRRYMBAWVOSILM-VHKOSHJNSA-N 475.531 -1.309 50 20 JAGD O=C(CN1C(=O)CNC1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815597406 OGDWHFYBVQDVNQ-HNNXBMFYSA-N 454.252 -1.053 50 20 JAGD O=C(Cn1ccccc1=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835995218 NNMAUTQISVNXRC-QFIPXVFZSA-N 455.276 -1.702 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837648911 YKXHTUKIRIXMKX-OXQOHEQNSA-N 451.528 -1.256 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199133 QLQQTJICEYVXKF-IUODEOHRSA-N 451.249 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787506063 BBZWJUHZUILFGI-WBAXXEDZSA-N 494.574 -1.296 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799682231 PHWDFZMHGDBHKN-TYYYEBLRSA-N 478.506 -1.269 50 20 JAGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 915635404 MVUJXQMGGUPKEU-UHFFFAOYSA-N 486.532 -1.820 50 20 JAGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783681128 PMAIZPJISFJCTI-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495803 OBSWCQXMJLNXNO-DIMBHLCBSA-N 474.348 -1.238 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739948 VNITVJCDGKGZGU-CXHZTBPHSA-N 463.296 -1.587 50 20 JAGD N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccn1 1835699872 GXUJLQAKIFQWSK-UGKGYDQZSA-N 454.292 -1.469 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927474 PETQUSFDPXGQBZ-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)CCO2 1836259667 JPJBJUFBIDNFBI-HXUWFJFHSA-N 498.562 -1.719 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837455733 FMESWYNBXJLDCF-HXUWFJFHSA-N 481.531 -1.339 50 20 JAGD Cc1ccn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456439 HXHAVPZJBNHWRL-NRFANRHFSA-N 457.491 -1.040 50 20 JAGD Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c2ccccc21 1797171809 YSMYXCPXPAYCJX-FAQVEIGNSA-N 478.314 -1.077 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1835939671 DIKICODVOYRCJU-HXOBKFHXSA-N 468.319 -1.035 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCC3=O)C2)C1 1837457505 GENSQVAENSCJIE-OAQYLSRUSA-N 460.491 -1.623 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1)c1cccc(B(O)O)c1 1817473918 GXQNGUCBEZGVJL-HNNXBMFYSA-N 454.252 -1.053 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939530 RNQZCBBCXXCRLZ-JOCHJYFZSA-N 460.292 -1.054 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(=O)cn3)C2)C1 1837459501 GEFFNHUIGVVBIB-HXUWFJFHSA-N 457.447 -1.848 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(=O)C(=O)O 1839202933 UFRNMAISLOWXCK-NHYWBVRUSA-N 454.249 -1.324 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)C=CC3=O)C[C@@H]21)c1cccc(B(O)O)c1 1786982633 ABXJWMOSMFQYOQ-SZMVWBNQSA-N 455.276 -1.725 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388090 FQOANEYABPZKSI-UTKZUKDTSA-N 487.554 -1.341 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779404482 SHCUWGXCXXQKCK-MIZPHKNDSA-N 490.318 -1.011 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788471330 UPRQWYSKPZTQGS-FGVQXAILSA-N 464.479 -1.657 50 20 JAGD N=C(N)SCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835647925 QVOCRZDYXUQAPP-IBGZPJMESA-N 450.326 -1.547 50 20 JAGD O=C(Cn1ccncc1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939148 GUVDALAVINOCFS-NRFANRHFSA-N 456.264 -2.307 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941064 FIQBRHUHZBKKLN-SIKLNZKXSA-N 461.324 -1.259 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](N)CN)C1 1843349375 XVJKIEKYKKVKRX-ROUUACIJSA-N 489.382 -1.708 50 20 JAGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1ccc(=O)[nH]c1=O 28663212 QQHYOUPXNBYKAK-UHFFFAOYSA-N 465.488 -1.662 50 20 JAGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1783873900 WHFCYQRWGWZGIJ-RNODOKPDSA-N 482.925 -1.483 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1782210658 AOLYWHDXLBXEAY-QVKFZJNVSA-N 474.522 -1.082 50 20 JAGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783680366 DZNYQTWQSZQYQQ-HSZRJFAPSA-N 494.350 -1.494 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1793837831 IZJDQFCACBZROS-ZMJPVWNMSA-N 456.334 -1.003 50 20 JAGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812712989 GRDWAHPKNWZHBX-SIKLNZKXSA-N 470.335 -1.632 50 20 JAGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cnnn1 1834801483 ODUJBNYHKJHSSN-HNNXBMFYSA-N 455.328 -1.201 50 20 JAGD N[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1cccnc1 1835928258 HHGUVVLORDOWLK-NZQKXSOJSA-N 468.319 -1.079 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839655867 UZYOQJPAOMCUPY-IBGZPJMESA-N 458.585 -1.700 50 20 JAGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1 1841985254 LOPCBNNWWLRROS-LBPRGKRZSA-N 452.899 -1.109 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782783683 IEAMQHORRFKEGJ-OAQYLSRUSA-N 470.247 -1.420 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[C@H]1SC(=N)NC1=O 1786979856 LZYGCRQWTOENCF-NOTNWKISSA-N 474.348 -1.238 50 20 JAGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737344 TZKHRDBIUSASOH-CWPLJXCYSA-N 487.343 -1.177 50 20 JAGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)nn1 1838830085 HPIYMUDQPSGNFX-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)N1CCOCC1)C2 1779372242 DFEYMRMLXFMPEZ-PIPMEXSNSA-N 476.534 -1.537 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061704 SUVYAMQDHQGGHT-JOCHJYFZSA-N 478.469 -1.155 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732904 QFMRNDHQVPWYEI-NBMJBFSESA-N 491.350 -1.155 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732981 WGWUOBIAHXALGX-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccn2c(O)nnc12 1796286344 AMOSYGJOGHCZAI-XOIINTDNSA-N 451.248 -1.368 50 20 JAGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1830544021 LCVRJGGLAQTFMY-YJBOKZPZSA-N 466.373 -1.240 50 20 JAGD O=C(COC(=O)C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837317034 LOXINLMUUONEQE-GOSISDBHSA-N 474.197 -1.458 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNS(=O)(=O)c3cnn(C)c3)cc2)CC1 728213468 CFHBHEOBBQVXOB-UHFFFAOYSA-N 471.565 -1.222 50 20 JAGD O=C(O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ncn1 1785640019 VDKKRKIDWNIONA-YEWWUXTCSA-N 454.248 -1.238 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371030 OIJTYIYDMCXROE-XLIONFOSSA-N 450.308 -1.079 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931748 APXCBVZDBLUORX-JOCHJYFZSA-N 470.291 -1.435 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CNC(=O)c1ccco1)CCO2 1836129938 HDQDMWOPQGQYPN-NRFANRHFSA-N 465.507 -1.161 50 20 JAGD CN1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1836671831 DOSCGBOFBKCMCZ-JOCHJYFZSA-N 460.340 -2.316 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1840183916 HURHJQGGUVKTQP-FQEVSTJZSA-N 498.562 -1.719 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1840184450 NEPHLCZVLMHUIV-HXUWFJFHSA-N 460.495 -1.433 50 20 JAGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCOCC2)c1 748112422 ZLLNZHXUADENFK-UHFFFAOYSA-N 463.538 -1.457 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)nn1)C2 1797753696 DLEUONZSFIIONV-KSPBDQMDSA-N 457.447 -1.537 50 20 JAGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)c1ccc(B(O)O)cc1 1819881640 XGAWQLYHTGFEDY-AUUYWEPGSA-N 460.321 -1.301 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(O)O)C2)C1 1832549562 NCUXQEYWHXIRDV-KPZWWZAWSA-N 451.904 -1.114 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1837166904 LRNYLTYJMBLOKZ-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840192243 WKIRYLJTWCGIJR-IBGZPJMESA-N 452.294 -1.746 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)CC1 1797139152 CFWRSJSPYSTSOJ-JLVBRIDZSA-N 494.574 -1.440 50 20 JAGD Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)no1 1797828249 PCJFBNMNGPBVCN-CCWDJLKJSA-N 456.264 -1.704 50 20 JAGD COCCn1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928344 LKXMHXAEBLZLNY-QFIPXVFZSA-N 472.307 -1.407 50 20 JAGD CN1C(=O)CC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459779 NAGCVYBKIDDIMC-KKSFZXQISA-N 460.491 -1.624 50 20 JAGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cn2[nH]cnc(=O)c12 1795740287 ODSNIMSXHYIEPX-JLVBRIDZSA-N 465.275 -1.472 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1802151557 GYBBYNZAHGNELQ-YGTYGHESSA-N 498.581 -1.282 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834797948 OFGXSRPHKSXSHY-UHFFFAOYSA-N 493.333 -1.404 50 20 JAGD Nc1n[nH]c(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1835666577 SRDWXDRONUHKHI-UHFFFAOYSA-N 469.355 -1.115 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1ccccc1=O 1835930595 OPCXSBKFXPQOIN-UZUQRXQVSA-N 469.303 -1.141 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840203361 XNGLIAJJINTQDQ-SFHVURJKSA-N 488.423 -1.566 50 20 JAGD COc1ccc(C(=O)NNC(=O)COC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1OC 16161725 TYHDZEFXEJPIEP-UHFFFAOYSA-N 488.457 -1.155 50 20 JAGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C[C@@H]21 1791252643 QLJQPOAFZRVBOZ-XQLPTFJDSA-N 496.952 -1.333 50 20 JAGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1834822463 OTDINJZFULOUNN-INIZCTEOSA-N 470.284 -1.332 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927114 GLXCDDHVRLACQJ-HXUWFJFHSA-N 473.251 -1.759 50 20 JAGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn2[nH]cnc(=O)c12 1835938458 WAILRNXVBRSHIA-HSZRJFAPSA-N 495.301 -1.605 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838501633 OFYOQLFUDYGOLG-HSZRJFAPSA-N 493.285 -1.847 50 20 JAGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C1)CCC2 1839582723 IVDOSFOBTKVQBQ-QHCPKHFHSA-N 468.319 -1.028 50 20 JAGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919301 ZRDYBAFNZWFYQZ-MSOLQXFVSA-N 456.367 -1.034 50 20 JAGD O=C(COCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NNC(=O)[C@@H]1COc2ccccc2O1 820100627 OEFJPBFLCIVKBF-ROUUACIJSA-N 486.437 -1.022 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cn(C)c(=O)n(C)c1=O)c(=O)n2Cc1ccccc1 839397865 JZPWGIZRZQEOOX-UHFFFAOYSA-N 492.496 -1.024 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736845 MPYULZWNYDXMGX-WOUAJJJCSA-N 469.307 -1.960 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488148 SGZKXPMYACOLLI-RHSMWYFYSA-N 482.397 -1.043 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833450531 REDDZMNTKXUWCW-MRXNPFEDSA-N 494.423 -1.121 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938507 WYXGJQNWIWOGKI-IIBYNOLFSA-N 457.296 -1.636 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186007 WDYBINRSEHSEJI-XMSQKQJNSA-N 493.565 -1.714 50 20 JAGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928565 RIKPFLRXMMGQGA-NZQKXSOJSA-N 468.319 -1.599 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n(C)n1 1835934993 BEAKTLHWTYMJNG-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1837457637 LGSKGERJYNFBKG-JOCHJYFZSA-N 486.485 -1.222 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1840183955 JTMDFKPOVBOSAC-OAQYLSRUSA-N 475.506 -1.122 50 20 JAGD CS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)nc1 1795737273 NRPLOBJZFIDKOP-CCWDJLKJSA-N 473.316 -1.318 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COC(=O)C(F)(F)F 1797656655 SFJKTELMURHUIN-WDAIWFPHSA-N 459.381 -1.006 50 20 JAGD O=C(CN1CCSCC1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829710620 FJTYYACGGWWSNB-NRFANRHFSA-N 463.365 -1.515 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc21 1834562086 NSFZPKKBGMUCLB-QFIPXVFZSA-N 483.290 -2.310 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834564804 JUJAQKGJUKLYQT-DJJJIMSYSA-N 455.899 -1.050 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1C[C@H]2C[C@H]2C1 1837283433 KLDMBKATLYGLCL-NZQNYPKQSA-N 457.336 -1.223 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](N)c3ccccn3)C2)C1 1837457945 XORKTJPQDPPXPY-XMSQKQJNSA-N 469.502 -1.150 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1779124419 JEHAAPCKGOQKDF-HXUWFJFHSA-N 450.496 -1.084 50 20 JAGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cn2[nH]cnc(=O)c12 1780019869 PKZHQFPTYODOSN-JOCHJYFZSA-N 465.275 -1.232 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2)c1ccc(B(O)O)cc1 1795732782 JHTSEFYNHLGMBP-BKEDOTJMSA-N 482.302 -1.424 50 20 JAGD CCS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833453829 YAHOSFVPXAPPTE-UHFFFAOYSA-N 465.381 -1.014 50 20 JAGD O=C(CN1CCSCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926623 VJRZBXLOXPAXJN-OAQYLSRUSA-N 463.365 -1.515 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1CCN(C)CC1 1839105131 QQZIMOPOPFKEOK-XMSQKQJNSA-N 468.599 -1.548 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839785618 WRFITIYEWUXNMO-BEFAXECRSA-N 460.553 -1.607 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748578 JULDDFPFYBUMAM-NFFDBFGFSA-N 453.521 -1.431 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1 1809978346 RHVJWFSNLQWBMX-UHFFFAOYSA-N 465.279 -1.349 50 20 JAGD CCNC(=S)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460027 QTIXIHLZNNJPPN-FQEVSTJZSA-N 479.563 -1.761 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1840184276 GIIKTNHRPOASBG-LJQANCHMSA-N 452.516 -1.851 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnn[nH]1)c(=O)n2Cc1ccccc1 918300174 BQZQZYDDPNLHPR-UHFFFAOYSA-N 467.446 -1.366 50 20 JAGD CCNC(=S)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781474828 UERIGFTXHHRJNE-DYESRHJHSA-N 462.381 -1.022 50 20 JAGD NC(=O)c1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789091091 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CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1801010524 BQRBMXKZXJMPJY-CCWDJLKJSA-N 459.569 -2.321 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804344778 SFALXXWLSFQYFI-AYBZRNKSSA-N 465.275 -1.321 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488055 OSMAVXUYRDOKCQ-CRAIPNDOSA-N 467.972 -1.573 50 20 JAGD N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1835828823 KUDYNNCMBWZOKE-NFBKMPQASA-N 468.319 -1.079 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926638 WDAIPFICAFJUJQ-KOIKXXGWSA-N 457.292 -1.705 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938017 GPMVRHNVQGNXPZ-BTYIYWSLSA-N 462.312 -1.856 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1839664242 PUBIDSKLUUJYEV-NJRDNMGOSA-N 485.501 -1.166 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3C(=O)C=CC3=O)C2)C1 1840182484 JTZKDZUUYGJQOU-OAQYLSRUSA-N 465.507 -1.869 50 20 JAGD C/C(=C/C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C 1123811183 QEJARUYPUPVGJJ-GHRAKNKNSA-N 450.583 -1.083 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)C=CC3=O)[C@H]2C1 1791395531 UEGCLHYGVRQWHJ-RCBQFDQVSA-N 456.459 -1.797 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830732515 ZPRYATVTGBUONM-ZBQZNYHESA-N 455.899 -1.349 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831458975 VIXPHSREOHWRSW-XOBRGWDASA-N 483.547 -1.564 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1833864861 RUYPQSOBJBWCGP-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1835937098 OGKGFFXLKNDYDI-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)C1 1840151901 QOUWRODJWXLRIR-SGTLLEGYSA-N 454.871 -1.259 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840431092 VRWUOQYILBUMOK-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD O=C(CN1CCN(S(=O)(=O)N2CCOCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 913053443 UFXXFKDDKQNFAJ-UHFFFAOYSA-N 456.481 -1.450 50 20 JAGD Cc1cn(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(=O)nc1O 1785353054 KUMJKDYTJOIVJP-NRFANRHFSA-N 456.264 -1.919 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786982972 DNAASOOIHCEQPR-QEJZJMRPSA-N 457.214 -1.362 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931270 KOJRBPIVELNOKE-JOCHJYFZSA-N 460.292 -1.054 50 20 JAGD Cc1cnn(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1836199374 PBUIXEUSCHUVCE-OAQYLSRUSA-N 457.491 -1.040 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839623893 HZKLUUPUGQRSHZ-QFIPXVFZSA-N 483.265 -1.068 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)C=CC3=O)CCO2)C1 1840262936 PZQXHQLSJVIFRR-NRFANRHFSA-N 472.458 -2.320 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779030870 JFTLHIISNGNLIL-JOCHJYFZSA-N 459.551 -1.234 50 20 JAGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CNC(=N)N)CCO2)C1)NC(=O)NCc1ccccc1 1780970596 YBDRWCGGZNFUML-OAQYLSRUSA-N 460.539 -1.354 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981144 UZBGSKXYWLHCCV-QQDKQVRDSA-N 481.318 -1.432 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737677 IXHXOFPKBWTZSD-JJAZEVLHSA-N 453.326 -2.103 50 20 JAGD 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]1NC(=O)NC1=O)C2 1796439584 NUFDQBGHEVOVHV-OQVYJZQFSA-N 459.463 -1.692 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[C@H]1SC(=N)NC1=O 1801011182 LOEDGZHMXZHIBG-RWNPNPFLSA-N 454.553 -1.249 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927748 XOQCFERPZWWFGN-QRWLVFNGSA-N 468.337 -1.883 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940029 TVDRMCJDTMGWLX-SFHVURJKSA-N 473.213 -1.885 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(C)n1 1840183494 HQYIHJDLEHLOFK-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1840186020 YZHMHFYCAHBZLN-SFHVURJKSA-N 453.456 -1.239 50 20 JAGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2cnn(C)c2)cc1OC 108767163 OPUYPARPXPIVBB-UHFFFAOYSA-N 455.449 -1.280 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccncc3=O)C[C@@H]21 1788609820 LZIVINAAQHZAAJ-JQFCIGGWSA-N 455.475 -1.465 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799072895 DMTZITXDAFVATQ-HGKCTWBKSA-N 484.343 -1.525 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1826085173 ILGHSZGCGPICPN-SECBINFHSA-N 474.507 -1.132 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(CCO)CCO)CC2 1826089806 ORJWAMPUQMMCMA-CYBMUJFWSA-N 456.569 -1.285 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830720131 TWQZGHBQZXOCPN-BIENJYKASA-N 465.931 -1.072 50 20 JAGD O=C1CN(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)C(=O)N1 1832476508 VBDWFTPSSPHEMA-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778089966 BCQDJVUQFYDXGS-DENIHFKCSA-N 493.391 -1.081 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)no1 1835930728 WUPVPNMSJWLPQC-JOCHJYFZSA-N 486.290 -1.837 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1835931074 FFECOIASAYTGGA-GOSISDBHSA-N 483.212 -1.113 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837209320 UFOXNDIYTHPGQO-JXFKEZNVSA-N 480.478 -2.180 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2c(c1)CCNCC2 1800242638 BOHOOPVOEKKQFA-HATOLVCRSA-N 464.331 -1.033 50 20 JAGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804343402 DPIPZPJQIKCKEC-HHXXYDBFSA-N 465.275 -1.321 50 20 JAGD CN[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)O 1834801123 QLTZNHUTKMSKRV-IBGZPJMESA-N 460.340 -1.386 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837250113 JRJDWECHDGNSCM-BNOLWBGWSA-N 472.502 -1.410 50 20 JAGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccs1 1833030307 RZTIPHIDKALTQC-QFIPXVFZSA-N 487.343 -1.072 50 20 JAGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(=O)[nH]c1C 1835935633 WNHFJMJRBMJZGY-JOCHJYFZSA-N 470.291 -1.550 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837648909 YKXHTUKIRIXMKX-JXFKEZNVSA-N 451.528 -1.256 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1837919343 HMQPFIRESJIZML-UHFFFAOYSA-N 495.305 -1.582 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1CCN(C)CC1 1839101971 VDEOGCZUUHYFIJ-MBSDFSHPSA-N 474.367 -1.928 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817814913 ZFCAEOAKSNHCGW-OAHLLOKOSA-N 477.250 -1.165 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1835936744 BCPKONUICIDEGS-HXUWFJFHSA-N 458.236 -2.049 50 20 JAGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccco1 1836126992 ZQZRVLZRJYUNJY-JOCHJYFZSA-N 471.275 -1.541 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1837274657 OARMGNZNBAJYCA-HXUWFJFHSA-N 473.494 -1.912 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734252 LGOXQBZUNYWGIW-AMVTXUCVSA-N 467.291 -1.822 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831444183 KZJFYXLOYKWJGO-HXUWFJFHSA-N 481.531 -1.339 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933867 HTVXPHXMUMJZEJ-RTWAWAEBSA-N 464.280 -1.948 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1835934986 ATAQUAGGBKVPCN-OAQYLSRUSA-N 457.248 -1.851 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1835938053 HRIOINQMZVPNEN-JOCHJYFZSA-N 498.326 -1.180 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1837461507 WQUKTCXAPLTIBZ-SFHVURJKSA-N 488.423 -1.566 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788258817 XGKBCTGRTNUYOX-MPGHIAIKSA-N 475.550 -1.017 50 20 JAGD O=C(CN1C(=O)C=CC1=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826316027 UXJCXKWZSPDQGP-CYBMUJFWSA-N 454.273 -1.026 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(=O)n2[nH]nnc2n1 1834973115 SQRCFSDRNZWGEC-UHFFFAOYSA-N 494.321 -2.009 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840196755 XSPGCHUMBHILDQ-XLIONFOSSA-N 452.338 -1.450 50 20 JAGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 920273773 AYENROPHOBCMDS-UHFFFAOYSA-N 465.492 -1.538 50 20 JAGD Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1832928248 URZXKYQJELDUIW-FQEVSTJZSA-N 459.463 -1.311 50 20 JAGD C[C@](O)(C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)C(F)(F)F 1835927389 NRDFRUVMHPXGFD-ROUUACIJSA-N 460.214 -1.250 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnnn3)CCO2)C1 1836145242 FMDKSUFESYSARZ-KWJZBXMYSA-N 459.467 -1.737 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837519012 SARRPXNBABGIRL-FPOVZHCZSA-N 478.506 -2.594 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)[C@@H]1SC(=N)NC1=O 1795738809 GVTHVGHNANTJLY-APDPGRRMSA-N 460.321 -1.628 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753707 DPBYBFGUQBJPAB-ABXQLRGKSA-N 478.506 -1.269 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1830966537 RIQLAHCEXGXKIZ-NRFANRHFSA-N 455.475 -1.212 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCN3C(=O)C=CC3=O)C2)C1 1840182481 JTZKDZUUYGJQOU-NRFANRHFSA-N 465.507 -1.869 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cnnn1)c(=O)n2Cc1ccccc1 789855254 FMMFVNDTPOZTPT-UHFFFAOYSA-N 452.435 -1.738 50 20 JAGD Cn1c(=O)ccn(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1=O 915059828 YDBJRPQSBIJLTD-UHFFFAOYSA-N 479.515 -1.652 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833677274 BBFROOGIPQUJOB-UHFFFAOYSA-N 486.533 -1.578 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1835930388 IFTIDRFWNKXDDK-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930496 JKVGUUSEYMUNLU-UGKGYDQZSA-N 492.290 -2.069 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932155 QQILMTUQMSGDJI-JTSKRJEESA-N 493.322 -1.721 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1835939271 JPTKLSPQOVUXFT-NRYAXDJKSA-N 485.346 -1.163 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785609022 KDEQFMMCOMKGNB-NYHFZMIOSA-N 498.581 -1.042 50 20 JAGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)CC1 1788247761 QAYUNFFUHKPMAD-FHWLQOOXSA-N 466.583 -1.497 50 20 JAGD CS(=O)(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791770493 NUPOENRDXGLOSQ-RCBQFDQVSA-N 453.521 -1.287 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1810295887 ZESPXQHHOWSAFE-FDQGKXFDSA-N 480.485 -1.002 50 20 JAGD CC(=O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n[nH]1 1833821980 ZOPJUFMOQXLNSX-NRFANRHFSA-N 456.264 -1.324 50 20 JAGD CC[C@H](NC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457543 ITVHTDXAEANJQT-YWZLYKJASA-N 463.495 -1.798 50 20 JAGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837526390 DILNEYNUSONMSY-REWVYZQPSA-N 475.307 -1.035 50 20 JAGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800973951 JNFSIACKMLZZBD-QVHKTLOISA-N 482.925 -1.723 50 20 JAGD C[C@@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833196770 LOESDTOHXIVUKE-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938465 WBASUMGKODIPIL-HJPURHCSSA-N 497.317 -1.955 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CC(=O)NC3=O)C2)C1 1837456100 IQQTZWSIGIUTOM-HXUWFJFHSA-N 475.462 -2.693 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)N1 1782871580 JSDXSJFWKXJECV-HLBODDRNSA-N 474.967 -1.404 50 20 JAGD N=C1NCCN1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807113915 WUUZJXXZLMCNIP-YLJYHZDGSA-N 450.308 -1.079 50 20 JAGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)N1CCOCC1)CC2)c1ccc(B(O)O)cc1 1815344272 QQEHDSVFZZNGPY-KUHUBIRLSA-N 460.321 -1.301 50 20 JAGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778090488 RLGSAHVEZOXYMH-DENIHFKCSA-N 493.391 -1.081 50 20 JAGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919713 XVTAVNLGQFYUMK-CRAIPNDOSA-N 466.373 -1.097 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840852751 YMMJDXXDQOYXPE-KNQAVFIVSA-N 461.324 -1.259 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1779028685 NTNQXXPLPJOPAS-FQEVSTJZSA-N 480.547 -2.141 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793370251 GECSHLJNBXFSHJ-JFILPPLUSA-N 453.521 -1.431 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2c1CS(=O)(=O)C2 1795931728 KCSNYAQEKJAGPV-FVCICTRLSA-N 474.304 -1.965 50 20 JAGD CN1CCN(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)CC2)CC1 1799192555 YHPZAMZPMFLAIU-OPVJXMOQSA-N 456.352 -1.650 50 20 JAGD N=C(N)SCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835647929 QVOCRZDYXUQAPP-LJQANCHMSA-N 450.326 -1.547 50 20 JAGD O=C(CCc1cncnc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836050319 WZLYXEWVJNMNQI-QFIPXVFZSA-N 454.292 -1.141 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1837456580 KRPWZVWRHQZHJW-HSZRJFAPSA-N 499.528 -1.097 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837523303 SINNZXZJTJNIMK-UYAOXDASSA-N 457.528 -2.534 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784803642 VXZDFBURCXIGIC-SZMVWBNQSA-N 455.276 -1.725 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833864091 ANJGOCFBCHXIHQ-NRFANRHFSA-N 473.490 -1.189 50 20 JAGD O=C(/C=N/O[C@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938117 MESWOJKVYDXXEO-PIVQEWKSSA-N 475.307 -1.035 50 20 JAGD COCCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457953 YFCYROKFAIPANX-HXUWFJFHSA-N 451.480 -1.582 50 20 JAGD C=CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837698259 AXGVMXBVWAPABL-LHSJRXKWSA-N 460.491 -1.554 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1837919116 GGBKEKICMNRTLQ-QHCPKHFHSA-N 475.351 -1.371 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031613 BUZNQINIHXTBRM-DNVCBOLYSA-N 450.452 -1.807 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)N1 1832693723 LDCUXALKZIVRFV-YWZLYKJASA-N 460.252 -2.966 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)C(=O)C(=O)O 1839703707 ZAWDTOQQKRWQJJ-HXUWFJFHSA-N 478.462 -2.702 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2)c1cccc(B(O)O)c1 1795741259 PKUZMMCMSBFKDF-HATOLVCRSA-N 464.331 -1.033 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834797853 DUHDGAVXIGGVTR-UHFFFAOYSA-N 494.321 -2.009 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1CCN(C)CC1 1835939362 OJAREXIKNFONTM-MBSDFSHPSA-N 474.367 -1.928 50 20 JAGD O=C(CN(CCO)CCO)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839918293 RYGJICNPSNFESX-NRFANRHFSA-N 465.312 -3.277 50 20 JAGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nn1 1840185197 GYMWLVSJXQBKGJ-HXUWFJFHSA-N 450.496 -1.072 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185340 LPSJTQCRRPDQHH-OXQOHEQNSA-N 451.528 -1.256 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1846385915 KJQIRAJXKIAAGN-LSDHHAIUSA-N 480.591 -1.257 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)C2 1798440200 GWPJAEHMXGEURK-JGPRNRPPSA-N 452.435 -1.623 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831325368 YXSKDOKJVUEYMN-FOIQADDNSA-N 483.352 -2.236 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1)[C@@H](O)CCl 1833308238 LYUDGBJJRYHZQY-KRWDZBQOSA-N 465.016 -1.112 50 20 JAGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1834823472 WJNJXBYNPRGBFV-WBVHZDCISA-N 450.330 -1.122 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933860 HTVXPHXMUMJZEJ-LEWJYISDSA-N 464.280 -1.948 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182268 BTCVDYJMLJMJNW-HNAYVOBHSA-N 477.584 -1.856 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840182809 JCGWPDYFUSSAIZ-FQEVSTJZSA-N 457.597 -1.135 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CC2)CC1 1781107479 QOVMHFOSYGAHNT-JOCHJYFZSA-N 456.352 -1.410 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788495 ZNYNGNDSJOCUES-OAQYLSRUSA-N 485.457 -1.101 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471431 NJRFSQNSBXTCFL-OAHLLOKOSA-N 477.250 -1.165 50 20 JAGD NC(=O)[C@@H](N)CCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834733453 OKFUOZMROIKFFV-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)O 1834740321 UULQCNUYMSMWSM-GOSISDBHSA-N 475.550 -1.067 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934015 LCQCPVAKBHWULS-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840081998 UHLVJRZSMZFSSJ-PXNSSMCTSA-N 482.958 -1.261 50 20 JAGD COC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840320144 CIAPKDUXPSWQRZ-IBGZPJMESA-N 450.452 -1.889 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734731 MXIIZJDLNLEXGU-UKBAYJJMSA-N 490.366 -1.188 50 20 JAGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(=O)C(=O)O 1821715325 WUCJPBDUFAIRFK-HNNXBMFYSA-N 457.252 -1.062 50 20 JAGD CC(=O)N(C)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1832296326 WMJCKJSOABGKPF-NRFANRHFSA-N 462.507 -1.377 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2 1835701683 NHSKHBDBULGKIR-GCJKJVERSA-N 469.502 -1.150 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837239314 VXXWGMSBFPXXDN-PKHCJMHPSA-N 452.338 -1.405 50 20 JAGD CN1CCN(C2(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)CC2)CC1 1839107631 GWKLYIYYXSGABZ-QHCPKHFHSA-N 486.378 -1.784 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1779031657 CPDCUWWCLCVBNF-OAQYLSRUSA-N 471.474 -1.145 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1779124417 JEHAAPCKGOQKDF-FQEVSTJZSA-N 450.496 -1.084 50 20 JAGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1780968871 GIIRKGYZKMLANL-JPYJTQIMSA-N 489.577 -1.245 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939313 LWJRENUHSXYESF-QHCPKHFHSA-N 479.302 -1.278 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837379557 BGIHCXRIVGXRMV-SPLOXXLWSA-N 477.522 -1.537 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837501996 GGUASEVCKSOTNR-UWJYYQICSA-N 486.522 -1.689 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1779092486 IOXCSPQCEOYTEE-QVWPOWONSA-N 462.507 -1.399 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc21 1830732199 WDWJUYIUCCVXCS-BEFAXECRSA-N 455.899 -1.314 50 20 JAGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831197709 XMRXDTUICLYQJS-JOCHJYFZSA-N 461.324 -1.257 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832486886 AJMGERNFFMTUCW-GDBMZVCRSA-N 486.360 -1.136 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837318242 NSNVURFIYYXPJB-GOSISDBHSA-N 489.407 -1.139 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1782210808 NUOXDEDEOMXIOF-RDTXWAMCSA-N 463.472 -1.402 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CC[C@H]2CCC(=O)N2C1 1799144817 BSFUSBSPCYDCTJ-DNMVWIPKSA-N 455.320 -1.029 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728618 WJFABMRTZPWFLE-CKFHNAJUSA-N 465.931 -1.072 50 20 JAGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(=O)O 1834797892 ISAYDNDVLMEROJ-LJQANCHMSA-N 460.340 -1.386 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935941 XZVCFBXJTOXEMA-JOCHJYFZSA-N 468.080 -2.570 50 20 JAGD CC[S@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837241704 PXZCHQAXJRXQCV-CGKQSPDFSA-N 467.548 -1.086 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840185951 XHVAISKOCFBXEE-IBGZPJMESA-N 458.585 -1.700 50 20 JAGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1781093583 ODEUFLKNJYGGIK-ZHRRBRCNSA-N 459.551 -1.236 50 20 JAGD COc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833505807 MMQGQXOPQGXABI-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840486255 VVGGJYYRRASLIG-BDNZGDGKSA-N 452.276 -1.060 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1779028675 NKSABHWHRMLRRR-JOCHJYFZSA-N 467.486 -1.046 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)nn3)C[C@@H]21 1791293975 UWWHBXKMUAYCFG-KKUMJFAQSA-N 450.496 -1.086 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1SC(=N)NC1=O 1796426290 RFBOUTWZIJPHTB-APDPGRRMSA-N 460.321 -1.628 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1SC(=N)NC1=O 1796426293 RFBOUTWZIJPHTB-BCEUIYSSSA-N 460.321 -1.628 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830568650 HGLWQHPUXBUZOK-TYILLQQXSA-N 465.931 -1.072 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930372 HOQSOXBHMGXJCB-OXJNMPFZSA-N 465.268 -2.499 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930408 IKIODLJAXNHVKC-VFNWGFHPSA-N 462.312 -1.856 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933714 BCGJSZZXCDYUGC-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD CC[S@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837241707 PXZCHQAXJRXQCV-WEZXKFLESA-N 467.548 -1.086 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n1 1840184508 RHUMWOYMCOSWAT-OAQYLSRUSA-N 466.539 -1.028 50 20 JAGD O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794034336 YOAKZPFAQCOSKA-CWPLJXCYSA-N 454.292 -1.282 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2)c1ccc(B(O)O)cc1 1795734274 AJEPKYDADDEVQH-FVCICTRLSA-N 452.236 -2.386 50 20 JAGD CC(=O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n[nH]1 1833821728 JZLREXAPLMWXIY-NRFANRHFSA-N 456.264 -1.324 50 20 JAGD CN(C)C(=O)NCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798159 XVUCWDYTPRCEBD-UHFFFAOYSA-N 459.356 -1.177 50 20 JAGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cccc1=O 1835935581 UOLNBEUUBXQXAU-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN1C(=O)CN(C)C1=O)c(=O)n2Cc1ccccc1 920445487 WMEFZTPVEQXDMB-UHFFFAOYSA-N 496.484 -1.531 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807950159 TYVZIAGQTDMNFN-IFXJQAMLSA-N 482.505 -1.100 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(O)O)CCO2)NC(=O)NCc1ccccc1 1830401278 QTVOITOTDQYGOC-NRFANRHFSA-N 465.507 -1.900 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834798694 YJLLWMXSEQHGKP-UHFFFAOYSA-N 469.355 -1.115 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1835736694 BTCRJAOJJCOJGH-SFHVURJKSA-N 474.566 -1.537 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1837949124 KEONLJCZSXHZPX-HXUWFJFHSA-N 464.479 -1.382 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3sccn13)CCO2 1838415715 SWSBPWMHONCIEC-JOCHJYFZSA-N 498.326 -1.180 50 20 JAGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)c1 919887592 BPESEZNWIZODGR-OAHLLOKOSA-N 473.577 -1.036 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nccn3)CCO2)C1 1839235603 CSIQQSJVJCBSAG-FBTHGLLTSA-N 458.479 -1.132 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1840155526 ADBLSOPRUOTXBW-KUHUBIRLSA-N 458.899 -1.032 50 20 JAGD O=C(COC(=O)C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930795 ZXQKPDNVCNCIQG-SFHVURJKSA-N 474.197 -1.458 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934111 LCQCPVAKBHWULS-VGSWGCGISA-N 456.308 -1.031 50 20 JAGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccco1 1836126994 ZQZRVLZRJYUNJY-QFIPXVFZSA-N 471.275 -1.541 50 20 JAGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1839155109 JIOGGUNRGCQUBH-ZWKOTPCHSA-N 456.367 -1.034 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182296 FSMQMJWPBAOXBL-NRFANRHFSA-N 455.556 -1.022 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cnnn1 1840477417 LRBLLCSACLRTNC-ORAYPTAESA-N 459.467 -1.997 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783992918 XAZLXOAUZKFFMC-KANFNMMFSA-N 491.350 -1.155 50 20 JAGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794404662 DQWBVTDIWNBSFD-CWPLJXCYSA-N 487.343 -1.177 50 20 JAGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(=O)nc1O 1834801405 GWWLBJFKTSGDMB-UHFFFAOYSA-N 497.361 -1.177 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931276 KOJRBPIVELNOKE-QFIPXVFZSA-N 460.292 -1.054 50 20 JAGD C[C@](O)(C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(F)(F)F 1835934081 MNDVOQPQNQLOQS-ROUUACIJSA-N 460.214 -1.250 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935025 CFEIDIARHXWXLN-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1835939618 VSHICWJIGZQWKY-QFIPXVFZSA-N 472.259 -1.133 50 20 JAGD Cn1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1835986742 FMRULTHFLUVIAJ-QFIPXVFZSA-N 456.308 -1.197 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1837459138 JVVFXQGYWRPULZ-NRFANRHFSA-N 476.490 -1.403 50 20 JAGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1839760773 SUNVAEOUOAKXPV-OAQYLSRUSA-N 460.292 -1.220 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccnc1C(N)=O)C2 1796441493 LHTLZIGXEXJBOJ-DVMGPBRKSA-N 468.474 -1.087 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1797871427 RICXVZKNPUEMOZ-ZTENYAIWSA-N 461.523 -1.443 50 20 JAGD Cc1cn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(=O)nc1O 1801970658 XXUMJPMVGGYPMJ-FVCICTRLSA-N 471.474 -1.841 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935477 HABCOXFKLNQZSK-GHTZIAJQSA-N 474.348 -1.537 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938157 NNHYQQIBWYYUMI-RXVVDRJESA-N 463.296 -2.413 50 20 JAGD O=C(/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NC1CC1 1835938540 XRCURVAEGMZDRX-ICTHTSFCSA-N 457.292 -1.729 50 20 JAGD CCOC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1835939901 NFNONCWKZCERAX-OAQYLSRUSA-N 460.292 -1.220 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837455729 FMESWYNBXJLDCF-FQEVSTJZSA-N 481.531 -1.339 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C(=O)N1 1839198696 MUAMVBVIVPQIAA-WFASDCNBSA-N 451.249 -1.315 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1779030774 HSWBQPWAGFNJJW-HXUWFJFHSA-N 467.446 -1.827 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784518999 VTFTYXXBFCETBC-KCMWZYNZSA-N 452.338 -1.360 50 20 JAGD N=C1NCCN1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457468 DEBAXDHZEFOEBR-FQEVSTJZSA-N 460.495 -2.405 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1840183698 UWENHPLOVTZDFK-NRFANRHFSA-N 497.574 -1.072 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184586 WBUWCFAFQRBEJW-VQIMIIECSA-N 459.500 -2.120 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781859724 UEZKPHFRVSZOPS-HRAATJIYSA-N 478.506 -1.028 50 20 JAGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1832755129 FRXNUQHYIURURI-QKKBWIMNSA-N 496.952 -1.093 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927659 WIKLXLDPTOJOQM-HSZRJFAPSA-N 479.302 -1.119 50 20 JAGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930533 LITWGWYGUWRRHK-ZHRRBRCNSA-N 469.307 -1.273 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836847110 SDRUHFRRIBJOOM-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839386845 QAXQDYBDTUDLIM-JTSKRJEESA-N 493.322 -1.721 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cn1ccncc1=O)CCO2 1839665372 BZCZRVRINUVJOD-HXUWFJFHSA-N 450.496 -1.927 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939999 RVHSFGZEJOIPNK-YLJYHZDGSA-N 452.338 -1.450 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459612 SXEBOBPZPCWUGA-LHSJRXKWSA-N 477.522 -1.537 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837648912 YKXHTUKIRIXMKX-UZLBHIALSA-N 451.528 -1.256 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1837798835 FBJVJKUMHKDFGC-SFHVURJKSA-N 453.456 -1.239 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1838728979 KLBIXBCQLABDJR-UHFFFAOYSA-N 469.539 -1.099 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1779032618 OQEUIFWDRQMAMT-JOCHJYFZSA-N 478.469 -1.155 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCCNC3=O)CCO2 1783934275 CDXNHVXPCNKYRZ-NRFANRHFSA-N 461.523 -1.167 50 20 JAGD O=C(CNC(=O)c1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785167709 JOGZMIUPSRRJDG-IHPCNDPISA-N 466.303 -1.215 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)n(C)c1=O 1785190142 BZRQBAZZNNGQKA-ASHKBJFXSA-N 470.889 -1.052 50 20 JAGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1834819788 UZRLRYXSLIXLCJ-QGZVFWFLSA-N 482.397 -1.042 50 20 JAGD O=C(O)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ncn1 1835927063 CLLVXFUSCKWYHJ-OAQYLSRUSA-N 470.247 -1.762 50 20 JAGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939566 ALEVJQNSQJRMEP-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840486256 VVGGJYYRRASLIG-IOUFHMPJSA-N 452.276 -1.060 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291318 SJBWNKDRSVCYGO-OVWQWFNUSA-N 475.550 -1.052 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797789637 WAHFXHQOLMXGNS-DACLVMHWSA-N 477.474 -1.617 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1835744617 ZXUDATYMYMEWNJ-FOIQADDNSA-N 463.495 -2.652 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1835935381 DBXKRWXNDUEVNK-QHCPKHFHSA-N 474.367 -1.926 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCN3C(=O)C=CC3=O)CCO2)C1 1779028935 LEGLWOVDDWKTQJ-NRFANRHFSA-N 456.459 -1.556 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@H]2C1 1786888996 WURWOYPPRKKZBD-CGEVSQDCSA-N 461.523 -1.307 50 20 JAGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(=O)O 1834739450 AWEBASPSLISITM-KRWDZBQOSA-N 454.572 -1.006 50 20 JAGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cnnn1 1834800269 BZRUYLONBAMOFK-HNNXBMFYSA-N 455.328 -1.201 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1840151589 HCMSMZCDEHQFFU-APPDUMDISA-N 455.859 -1.864 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)n(C)c1=O 1843010704 SZPWGUKEUOLDCD-UHFFFAOYSA-N 480.290 -2.369 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1779031227 OCCJUGHEJHEVCD-NRFANRHFSA-N 468.474 -1.618 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)no1 1779123033 JAMSABWVKZEFED-OAQYLSRUSA-N 456.264 -1.464 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978669 JCUHXOAPYNNZNS-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(=O)[nH]c1C 1794309547 HTQWBXFDGDIEIX-YWVIFJGQSA-N 455.475 -1.098 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3=NNC(=O)C3)CC2)CC1 1835701481 GXDCNSCHGHAHFW-UHFFFAOYSA-N 456.507 -1.254 50 20 JAGD O=C(CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)N1CCCC1 1835927069 COZUDLYBNHIIRY-HSZRJFAPSA-N 473.335 -1.161 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1835937495 ZUQBEMLTJNMLFL-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)nn3)[C@H]2C1 1790589313 AADATSZAJZRWEE-KKUMJFAQSA-N 450.496 -1.086 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1 1835744623 ZXUDATYMYMEWNJ-YWZLYKJASA-N 463.495 -2.652 50 20 JAGD N[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935598 MAGORWRBBGJPEV-NFBKMPQASA-N 468.319 -1.079 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nncn3c1)CCO2 1837014692 CDQXAIBQQVUAHW-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837442132 PNJGGDJYAVXJAR-YQNSVDCASA-N 458.324 -1.092 50 20 JAGD CC(=O)N/C(C)=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459554 JVQUVECSJVYCJJ-ZGQNHIEXSA-N 460.491 -1.205 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc(O)nn1)CCO2 1839651456 FKOZYBDPEHMCHC-NRFANRHFSA-N 464.523 -1.056 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840360877 DHCDLVGQWOPUKG-HXOBKFHXSA-N 468.319 -1.035 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831443059 NCENGNLHKAAXKW-FQEVSTJZSA-N 466.321 -1.657 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835936798 DRFXFQMAUMCBPT-LRULAXNGSA-N 497.317 -1.430 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837608094 UUJGLNQTQFUARW-HJPURHCSSA-N 497.317 -1.955 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837731968 PCNHOKJDLSDCSW-LAUBAEHRSA-N 478.506 -2.094 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920960 MVUHHDZRMXWGEF-UHFFFAOYSA-N 469.303 -1.096 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812716144 HNGMCTWEENCHJS-XMSQKQJNSA-N 464.567 -1.253 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829001613 YSBCRWOKVKRVOB-DEOSSOPVSA-N 497.313 -1.257 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1835925445 DXCDNNXXTUGDMH-KZULUSFZSA-N 454.871 -1.259 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928435 PWIWTRJDYFJFDO-JOCHJYFZSA-N 468.080 -2.570 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835930355 HDBXOIVKPHQYPQ-DEOSSOPVSA-N 498.345 -1.263 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1835934373 QUOKGMZDVRDYRW-UZUQRXQVSA-N 468.319 -1.035 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198638 LYJGNTIWXJQAFV-HOCLYGCPSA-N 486.360 -1.136 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1840183954 JTMDFKPOVBOSAC-NRFANRHFSA-N 475.506 -1.122 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840380450 BIYBCMCJPPULHS-IBGZPJMESA-N 476.519 -1.335 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2)c1cccc(B(O)O)c1 1795739062 SSCCBHGEVDPCQA-FVCICTRLSA-N 474.304 -1.965 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812713854 CHLQYWHVPPFIDB-UWJYYQICSA-N 485.545 -1.314 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939804 IYQCACHRPVWSBC-QFIPXVFZSA-N 455.276 -1.342 50 20 JAGD COCCOCCOCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840082000 UHLVJRZSMZFSSJ-YLJYHZDGSA-N 482.958 -1.261 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(C)n1 1840183495 HQYIHJDLEHLOFK-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1840185408 QGEHMUAZVWNWQB-OAQYLSRUSA-N 464.523 -1.056 50 20 JAGD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785216090 ZEJKSXGCHDIXFK-WBAXXEDZSA-N 457.252 -1.235 50 20 JAGD Cc1cc(NC(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)no1 1795734161 GWONJUZSHCIFRN-YVWYUNDQSA-N 456.264 -1.105 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)N1 1800335358 CBAJHLZVHVZSJZ-GNIPQWQFSA-N 474.967 -1.644 50 20 JAGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(=O)C(=O)O 1824670255 UDLKRBQNIGPZLX-LBPRGKRZSA-N 460.277 -1.408 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839386844 QAXQDYBDTUDLIM-HTAPYJJXSA-N 493.322 -1.721 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840262000 KNYJFDFXWLTXLT-NRFANRHFSA-N 457.248 -2.639 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)CC1 1786984262 WBAOXRWHWAJFPP-JBACZVJFSA-N 472.351 -1.876 50 20 JAGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)N1CCN(C)CC1 1789799233 DFQBRZWGNNRCKW-FVCZOJIISA-N 473.578 -1.086 50 20 JAGD Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)nn1C 1835926520 PVULCUCOKVWIPM-JOCHJYFZSA-N 456.308 -1.279 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837608104 VGPMJJWGERGQPQ-HJPURHCSSA-N 497.317 -1.955 50 20 JAGD CN1C(=O)CC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839215059 UYGFWEHKAFHUQM-KKSFZXQISA-N 460.491 -1.624 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CC[C@@H]2CCC(=O)N2C1 1799144822 BSFUSBSPCYDCTJ-JHLLAZCVSA-N 455.320 -1.029 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928720 WSJZPOWXHTXNNJ-QFIPXVFZSA-N 458.324 -1.282 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnccn3)C2)C1 1837455644 BOGLXOICLNBGNQ-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1837456225 FUTVOQHZHWUFOD-HXUWFJFHSA-N 459.463 -1.311 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840261949 HSQJBBYRLYGHQP-OAQYLSRUSA-N 457.248 -2.639 50 20 JAGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840852625 SOLHTBDCARBKKD-UGKGYDQZSA-N 461.324 -1.259 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(CCO)CCO)C1 1781837437 SJQVBLNMAJVSQW-RCBCJABQSA-N 492.577 -1.079 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1783935984 ZLEKFJFHYWTATF-OAQYLSRUSA-N 457.491 -1.094 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1835934369 QUOKGMZDVRDYRW-HXOBKFHXSA-N 468.319 -1.035 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cnnn1 1837460516 GYWDGVJQXNMVBX-ORAYPTAESA-N 459.467 -1.997 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782783709 IUSVYQLVDDBMHP-OAQYLSRUSA-N 470.247 -1.420 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373195 OWKBTYGJXPXFKT-DENIHFKCSA-N 470.335 -1.632 50 20 JAGD O=C(CN1C(=O)CNC1=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350359 SDNXQPORENZJRW-GFCCVEGCSA-N 457.277 -1.400 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830733338 JAUXZCZJEYKPKM-JCGVRSQUSA-N 451.904 -1.114 50 20 JAGD CN1N=C(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CCC1=O 1832375554 RPIBCRMQDKNFNA-NRFANRHFSA-N 458.280 -1.955 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)N1 1832693721 LDCUXALKZIVRFV-MGPUTAFESA-N 460.252 -2.966 50 20 JAGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)O 1835736706 DOZIURMVJKQGCS-GOSISDBHSA-N 475.550 -1.067 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779555967 XFPZNNSFGZVGTO-WOIUINJBSA-N 461.324 -1.355 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1830966540 RIQLAHCEXGXKIZ-OAQYLSRUSA-N 455.475 -1.212 50 20 JAGD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807190380 FLMJMLWBDYGVOQ-ILZDJORESA-N 453.308 -1.326 50 20 JAGD COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1834528007 KJDSVHJVBHTVTC-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccn1 1835700968 XLFGDQWMGXCXSP-UGKGYDQZSA-N 454.292 -1.469 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1836888448 OHILIKHVLZGTQP-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839668977 AIVHEMHKXADJDV-NRFANRHFSA-N 472.263 -1.989 50 20 JAGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928757 YGJRBPJBZDBPDC-HXUWFJFHSA-N 462.699 -1.014 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061705 SUVYAMQDHQGGHT-QFIPXVFZSA-N 478.469 -1.155 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1835931058 DWPPNZHVOGHQEB-JOCHJYFZSA-N 469.259 -1.126 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935511 IGTSNHRXUOJJCW-JOCHJYFZSA-N 458.324 -1.282 50 20 JAGD CNC(=S)NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610988 DKACTNUEIJCJIH-RCBQFDQVSA-N 463.564 -1.238 50 20 JAGD COc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833861258 AEZUABICNVOPQC-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1)c1cccc(B(O)O)c1 1834800979 DGSVXZDGBRZZIM-HSZRJFAPSA-N 474.367 -1.798 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1840183469 GHYWSLLUYKYEIP-OAQYLSRUSA-N 462.507 -1.377 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1778378612 CYZBJGRFHOTWSY-JOCHJYFZSA-N 467.291 -1.546 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1779032665 QIHDEWLBEFNGCH-HXUWFJFHSA-N 454.447 -1.669 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1807048829 SSERIMGBQSSHQK-DKSSEZFCSA-N 468.518 -1.008 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807947906 LODAQULRNJZZDA-HNAYVOBHSA-N 488.273 -1.479 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1836208111 RNMNCNASKTWNRG-VRMLFSPKSA-N 458.479 -1.132 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837385018 MYRJJMTYHGMYNH-QRWLVFNGSA-N 456.544 -1.477 50 20 JAGD Cn1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837461299 TXZLVZLTHUOWLF-NRFANRHFSA-N 457.491 -1.269 50 20 JAGD COc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cn1 1840183567 MHDYDRVWVHGNBH-HXUWFJFHSA-N 450.496 -1.072 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CSc1nc[nH]n1)CCO2 1840381832 WGHVNLQOILUUQT-SFHVURJKSA-N 455.541 -1.274 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832249141 OMELTAMQZNAXGA-QGZVFWFLSA-N 492.187 -1.208 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1837459176 LCDDHTFUTTWJHN-LJBSOROUSA-N 472.502 -1.410 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837643633 UEEACFMSCJKHBL-KKSFZXQISA-N 457.296 -1.636 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(N)=O)C2)C1)NC(=O)NCc1ccccc1 1839054575 FRKVKLDFGLYNSV-QFIPXVFZSA-N 491.549 -1.543 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1840185188 MEVSRLVYSYBGSL-UXHICEINSA-N 458.512 -1.568 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)[C@@H]1SC(=N)NC1=O 1783934263 CXKRYGPPYKWGQL-ODYMNIRHSA-N 454.553 -1.008 50 20 JAGD 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CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831330975 ZEETWUYSMCGRCO-KXBFYZLASA-N 477.584 -1.856 50 20 JAGD CCOC(=O)/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456106 CLEBKPHPMDKRDO-SHTLVRLNSA-N 461.475 -1.126 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)n(C)n1 1837457190 XOMDIJPPRUDRST-NRFANRHFSA-N 473.490 -1.189 50 20 JAGD COC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1840320278 CFDDTXGFMBYZEJ-RXULLKCLSA-N 464.479 -1.067 50 20 JAGD Cc1cn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(=O)nc1O 1840807072 APLVVVPKMNFLAB-QFIPXVFZSA-N 486.290 -2.293 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779067848 HDVUTYFKLDTNDN-RXVVDRJESA-N 462.264 -1.695 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927746 XOQCFERPZWWFGN-MGPUTAFESA-N 468.337 -1.883 50 20 JAGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)C1=O 1837136990 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1835930647 ROZFKSHJRFCRAN-TZIWHRDSSA-N 463.296 -2.913 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937924 BJNYJUHLZDUIOQ-AOMKIAJQSA-N 461.324 -1.259 50 20 JAGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839654261 UDAZLSGHUOZPKY-HXUWFJFHSA-N 479.563 -1.761 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1840185189 MEVSRLVYSYBGSL-VQTJNVASSA-N 458.512 -1.568 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1840185632 RARBNSVRFZJIDQ-UYAOXDASSA-N 457.528 -2.534 50 20 JAGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)[C@H]2C1 1785190220 JYHYNGIICMRTPK-XQLPTFJDSA-N 496.952 -1.333 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCCS1(=O)=O 1790747517 LKUABUBNPVSGFO-DKIMLUQUSA-N 450.322 -1.463 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)[C@@H]1SC(=N)NC1=O 1795734258 LWZLHULSDVYVNP-BCEUIYSSSA-N 460.321 -1.628 50 20 JAGD CCC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831185756 UFIFBSKARHATOD-LHSJRXKWSA-N 462.507 -1.330 50 20 JAGD C[C@](O)(C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(F)(F)F 1832156059 LSXFURULEAPEQL-ZWKOTPCHSA-N 460.214 -1.250 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3NC(=O)NC3=O)CCO2)C1 1832691005 IYNDMLCPDMETKQ-VLIAUNLRSA-N 475.462 -2.647 50 20 JAGD COc1nccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927481 PETQUSFDPXGQBZ-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927576 UDVQFXHVFHCCIG-QFIPXVFZSA-N 471.275 -2.249 50 20 JAGD O=C(CCc1cnccn1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939780 HPNRZFVSTJUMKT-QFIPXVFZSA-N 454.292 -1.141 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457549 JBUCDOFEYVCURG-QFIPXVFZSA-N 487.517 -1.088 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H](N)C(N)=O)C2)C1 1837457889 UWAPFWHVFDDCGF-MGPUTAFESA-N 463.495 -2.652 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184992 DAVAVQKXVGKQJO-QRWLVFNGSA-N 456.544 -1.477 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831323002 HXTYKMVXCQZBBT-YWZLYKJASA-N 483.352 -2.236 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n(C)n1 1833442909 SPRZLBMSMLLUKU-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCC3=O)CCO2)C1 1835412322 PXCZGLUERZMLFM-OAQYLSRUSA-N 460.491 -1.623 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N1C[C@H]2C[C@@H]2C1 1835930180 AKPUEIINMLLECR-DYVMYPEFSA-N 457.336 -1.223 50 20 JAGD N[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935600 MAGORWRBBGJPEV-NZQKXSOJSA-N 468.319 -1.079 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1835938280 RMCCEBCEJPGFLJ-QFIPXVFZSA-N 469.259 -1.126 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837379549 BGIHCXRIVGXRMV-LHSJRXKWSA-N 477.522 -1.537 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1837460336 BUBWJTPYUQVPQV-NRFANRHFSA-N 471.474 -1.376 50 20 JAGD CN1CCN(C(=O)CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 916433142 BJJRNCDCYJJYPA-UHFFFAOYSA-N 468.584 -1.192 50 20 JAGD CN1CCN(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779030876 JFTLHIISNGNLIL-QFIPXVFZSA-N 459.551 -1.234 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787393713 XXYXKKQSXOTVAY-WNHJNPCNSA-N 491.350 -1.155 50 20 JAGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(C)(C)C 1831086915 ICBOOGYHYBBEFT-AUSIDOKSSA-N 475.351 -1.013 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738167 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O=C(Cc1cn2c(nc1=O)SCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732765 AIXYWFUYMOGVKL-AUUYWEPGSA-N 472.951 -1.052 50 20 JAGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830737145 BJKSNGJABXVWAS-BDJLRTHQSA-N 451.954 -1.097 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1835939675 DIKICODVOYRCJU-UZUQRXQVSA-N 468.319 -1.035 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc[n+]([O-])c3)C2)C1 1837456236 GAEMKHITRRKQSC-OAQYLSRUSA-N 456.459 -1.298 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(=O)C(=O)O 1839703769 CKYRTLAKVIYACU-XHDPSFHLSA-N 454.249 -1.324 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936951 BKSIRJYMSMEQDJ-DYESRHJHSA-N 463.539 -1.340 50 20 JAGD O=C(CC(F)(F)C(=O)O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928790 ZPQWENQKLHSXHN-GOSISDBHSA-N 456.207 -1.454 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1C[C@@H]2C[C@H]2C1 1837283439 KLDMBKATLYGLCL-ZQDYSYBYSA-N 457.336 -1.223 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840178286 BXFXRZYDTMVLGY-SFTDATJTSA-N 464.280 -1.948 50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1807366682 NVNIWXJUNYKSSI-APWZRJJASA-N 468.275 -1.376 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1=O 1831888012 OELZJBOMUZWBFS-QFIPXVFZSA-N 470.486 -1.232 50 20 JAGD O=C1NC(=O)[C@@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)N1 1835927143 IXIRQWAOSOLHPI-QRWLVFNGSA-N 460.252 -2.966 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1835930223 CZTUCFFIOKDBFD-HSZRJFAPSA-N 488.350 -2.400 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)CCC(N)=O)C2)C1 1837457538 IRJPPHVGTYHQFO-MGPUTAFESA-N 463.495 -2.652 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCNC(=O)C3)C2)C1 1837461255 RKFAAYPANLZUNC-SPLOXXLWSA-N 460.491 -1.719 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837629674 MAKCBQSCZDDHLU-QFIPXVFZSA-N 483.485 -1.211 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837729709 JUEJIBKTODOZGG-RXVVDRJESA-N 463.296 -2.413 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182267 BTCVDYJMLJMJNW-DNVCBOLYSA-N 477.584 -1.856 50 20 JAGD CN1CCN(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)CC1 1795445801 CUTCPTVBEVFDIL-CWPLJXCYSA-N 459.551 -1.474 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797786348 JYPNXESAYYNUQJ-UKBAYJJMSA-N 462.264 -1.936 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011435 LJRCZRHTSKHNES-RCJHGTSTSA-N 456.496 -1.556 50 20 JAGD CNc1nsnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835933944 HQKGVQICUPYPNT-LJQANCHMSA-N 461.309 -1.357 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199134 QLQQTJICEYVXKF-SWLSCSKDSA-N 451.249 -1.315 50 20 JAGD O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916251273 BFHJDSTUQFFUAK-UHFFFAOYSA-N 469.520 -1.100 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037320 VSQXBMZFKUPTEB-IIBYNOLFSA-N 478.506 -1.028 50 20 JAGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2)NC(=O)NCc1ccccc1 1780969349 XYRHGOAHNPSBBM-YDHSSHFGSA-N 474.562 -1.115 50 20 JAGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783937045 NPLWDZUVMVKIMB-QFIPXVFZSA-N 488.582 -1.115 50 20 JAGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1835512340 DBKPIJXLNNIBNB-UHFFFAOYSA-N 499.421 -1.284 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1835930644 ROZFKSHJRFCRAN-CTNGQTDRSA-N 463.296 -2.913 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837516980 NHSUHXKPLABNPF-CTNGQTDRSA-N 463.296 -2.913 50 20 JAGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn2[nH]cnc(=O)c12 1838472670 WNTTXQGEAXXAJO-JOCHJYFZSA-N 489.533 -1.226 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1CC[C@@H]2CCC(=O)N2C1 1799148533 WYEHCDMGECUGFO-JHLLAZCVSA-N 455.320 -1.029 50 20 JAGD Cc1nccn1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839715315 RXZCQTIOLQIDSF-NRFANRHFSA-N 457.491 -1.040 50 20 JAGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919715 XVTAVNLGQFYUMK-QAPCUYQASA-N 466.373 -1.097 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933499 ATUCPVLHKQOELU-JOCHJYFZSA-N 455.276 -1.342 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3cncn3)C2)C1 1837461240 RBZKHLQGLFBPAQ-FQEVSTJZSA-N 458.479 -1.563 50 20 JAGD O=C([C@H](O)N1CCOCC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837521725 RLAXPVCQTZELCA-DUVNUKRYSA-N 454.293 -1.216 50 20 JAGD C=CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837698260 AXGVMXBVWAPABL-QKKBWIMNSA-N 460.491 -1.554 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)[C@H]1SC(=N)NC1=O 1783934248 CXKRYGPPYKWGQL-HGQUKEQDSA-N 454.553 -1.008 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(CCO)CCO)C[C@@H]21 1787507595 HQQPZQZSXCZMAP-MPKALDKKSA-N 478.550 -1.613 50 20 JAGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C[C@@H]21 1791252641 QLJQPOAFZRVBOZ-AJNGGQMLSA-N 496.952 -1.333 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1797748653 QBTQKQDWWKHEAV-ZSBFGKGUSA-N 480.547 -2.381 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927076 CPHFMMYEBHMPQK-QFIPXVFZSA-N 461.324 -1.401 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1835930645 ROZFKSHJRFCRAN-FPOVZHCZSA-N 463.296 -2.913 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837457981 ZPFHRLBXKKHHCJ-QFIPXVFZSA-N 483.290 -2.251 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1837461283 SJUSHVXZMZEFJQ-UZLBHIALSA-N 481.531 -1.668 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@](C)(O)CC(=O)O)CCO2 1840181691 IUSURAZKLNVOQL-PMACEKPBSA-N 458.512 -1.568 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 729276930 OMDPFYIXNDLATR-LBPRGKRZSA-N 490.560 -1.056 50 20 JAGD C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C[C@@H](C)O1 918779157 CPWHNUOZPMCTID-HUUCEWRRSA-N 493.550 -1.012 50 20 JAGD O=C(Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981071 OQIKXPRMFBZKMR-SNRMKQJTSA-N 452.276 -1.007 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)n(C)c1=O 1832755308 JZRJWOPDCOXCNL-RNODOKPDSA-N 498.924 -2.510 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1835932333 ZUOFNYQTXIIBIS-PXNSSMCTSA-N 466.321 -1.986 50 20 JAGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)C(=O)C(=O)O 1837459959 PNQRTTZCLUHWTQ-FQEVSTJZSA-N 478.462 -2.702 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837758446 QOVXVRKXCWRAJM-QHCPKHFHSA-N 484.318 -1.011 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)C=CC1=O)NC(=O)NCc1ccccc1 1801119943 QJWVEPXFSFRBBL-FEJSZKPUSA-N 498.540 -1.153 50 20 JAGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)c1cccc(B(O)O)c1 1815356756 PKRFRHLFEUOMBZ-IFXJQAMLSA-N 460.321 -1.301 50 20 JAGD O=C(c1cc(=O)nc2cccnn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731176 HNKCSRAXCOFSBQ-AUUYWEPGSA-N 451.867 -1.241 50 20 JAGD CN1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1835936937 KONAWPWJKIXUDQ-QFIPXVFZSA-N 460.340 -2.316 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417223 GBYXVWHVODTTAW-NRFANRHFSA-N 457.248 -1.444 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105896 RVPDEQLCSLVTCP-QFIPXVFZSA-N 474.518 -1.232 50 20 JAGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cn2[nH]cnc(=O)c12 1835938461 WAILRNXVBRSHIA-QHCPKHFHSA-N 495.301 -1.605 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCOCC3)C2)C1 1837457795 RRUIQYIFTCVMQN-OAQYLSRUSA-N 462.507 -1.913 50 20 JAGD NC(=O)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839349976 BMZZBLBSLMAVCC-HSZRJFAPSA-N 467.287 -1.151 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)CC2)CC1 1840184843 CPYGQMYPIAYARD-QFIPXVFZSA-N 480.610 -1.404 50 20 JAGD O=C(CN(CCO)CCO)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053063 BCDNKZOJWFCWFF-NRFANRHFSA-N 461.368 -1.114 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801109 OWDYTCGMCZVHNB-LJQANCHMSA-N 459.356 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1 1835744619 ZXUDATYMYMEWNJ-MGPUTAFESA-N 463.495 -2.652 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382527 KVUIPJFHLHIJNB-NRFANRHFSA-N 461.523 -1.167 50 20 JAGD O=C(CN(CCO)CCO)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060628 VMCFWYXCDBZORB-OAQYLSRUSA-N 461.368 -1.114 50 20 JAGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(O)O)CCO2)NC(=O)NCc1ccccc1 1830401279 QTVOITOTDQYGOC-OAQYLSRUSA-N 465.507 -1.900 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1835936795 DMZXTMNWXJXJML-NRFANRHFSA-N 466.263 -1.812 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1837457430 AVSBMFHRYHKHDR-JOCHJYFZSA-N 470.486 -1.383 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2 1838826671 UDKCTSFBRKPZSQ-FQEVSTJZSA-N 458.236 -1.014 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1840186088 ZIADIEZQQBDNNV-OAQYLSRUSA-N 453.540 -1.172 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782960927 WGNAQMQFDRBEGM-BEFAXECRSA-N 451.505 -1.294 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCNC3=N)C[C@@H]21 1787509085 ZJNFNHWASCEZPK-SKIHNHESSA-N 458.523 -1.060 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(=O)nc2cccnn12 1798497728 TWRQDFJVFTWZFL-YVWYUNDQSA-N 463.259 -1.714 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc21 1835929388 NGUILKLYJLCZGQ-QFIPXVFZSA-N 483.290 -2.310 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934533 XESMVJDPXINRST-KNQAVFIVSA-N 461.324 -1.259 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417480 WBYJSQZUPNFLCF-OAQYLSRUSA-N 457.248 -1.444 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837204301 FQNJAPKKZHUZSU-OXJNMPFZSA-N 465.268 -2.499 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCN3C(=O)C=CC3=O)CCO2)C1 1779028939 LEGLWOVDDWKTQJ-OAQYLSRUSA-N 456.459 -1.556 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)CC2)CC1 1781112335 XXZRCNVWBRLBOS-OAQYLSRUSA-N 450.584 -1.031 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1788611389 YZFBKNPFUVUFRP-AXHNFQJDSA-N 496.528 -1.078 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)C(F)(F)F)C2 1797753938 DUYTVPFPKQRVMH-WDAIWFPHSA-N 458.397 -1.433 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969621 YDOOOXAPGRRZGA-UHFFFAOYSA-N 477.392 -1.058 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831465844 OBUSHVDHWAYZGF-DNVCBOLYSA-N 462.569 -1.504 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831690464 JOVCCMORYYNULB-JOCHJYFZSA-N 461.324 -1.401 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838476927 JYNSCOSOPXMNKO-JOCHJYFZSA-N 469.259 -1.126 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3cncn3)CCO2)C1 1840358031 RJAUYSJDFITNAF-HXUWFJFHSA-N 458.479 -1.563 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CNC(N)=O)C2)C1)NC(=O)NCc1ccccc1 1785629808 ZWZSBWULYNHRHK-OAQYLSRUSA-N 461.523 -1.169 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1CCS(=O)(=O)CC1)CCO2 1832486920 CRWFJXABWAVIOH-FQEVSTJZSA-N 489.595 -2.454 50 20 JAGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cccc1=O 1837456207 FORXRPBLDDBMPK-JOCHJYFZSA-N 470.486 -1.232 50 20 JAGD O=C(CCc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839649996 XIHNFNVBDLUOMI-JOCHJYFZSA-N 470.291 -1.435 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N1CCN(C)CC1 1840185402 QFZYLLQNFCRRJI-PGRDOPGGSA-N 468.599 -1.548 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838327818 KDFQAPUKTCNDIZ-OAQYLSRUSA-N 469.263 -2.361 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1840183949 JLLHGAUSCBOLRD-LJQANCHMSA-N 452.468 -1.669 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782786207 BSUZAUSUBUJTRG-FQEVSTJZSA-N 464.479 -1.041 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1835925459 DXCDNNXXTUGDMH-XIKOKIGWSA-N 454.871 -1.259 50 20 JAGD N=C(N)SCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457516 HSZZXSCLKZFMTG-GOSISDBHSA-N 451.509 -1.618 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[C@@H]1SC(=N)NC1=O 1840183853 DSRVYVXCKJXUCE-ZSOFBXJNSA-N 484.579 -1.382 50 20 JAGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)CC2)CC1 1786981954 RVCIYEGSDMCJIM-JBACZVJFSA-N 470.379 -1.260 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830731197 IQVISRCYGLVBDQ-VKJFTORMSA-N 450.872 -1.463 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837729708 JUEJIBKTODOZGG-NQIIRXRSSA-N 463.296 -2.413 50 20 JAGD O=C(CCc1cnccn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840457098 FKNDIMSMXTYPGR-JOCHJYFZSA-N 454.292 -1.141 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)n(C)c1=O 1784086244 XDLFIKUVRSLQTM-XUXIUFHCSA-N 482.925 -1.987 50 20 JAGD O=C(NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1cccnc1 1786980078 GTQNYZJGLDYVPG-IHPCNDPISA-N 466.303 -1.215 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)n(C)c1=O 1796189793 BDJDYDIVTMNFMK-BJWYYQGGSA-N 494.317 -1.935 50 20 JAGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CC(=O)NC1=O)CC2 1819792990 GDBIBNJNCDZAJP-VIFPVBQESA-N 472.487 -1.081 50 20 JAGD O=C(COc1cccnn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939963 QMXWLZNTSJHMTD-OAQYLSRUSA-N 456.264 -1.695 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)C1 1840182469 JPODGJHARJLEAN-HXUWFJFHSA-N 489.595 -2.454 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1840184449 NEPHLCZVLMHUIV-FQEVSTJZSA-N 460.495 -1.433 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792885539 CEKCLWGSBRMODN-MVJTYMMSSA-N 477.323 -1.545 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(=O)n2[nH]cnc2n1 1795728290 DRZSINYZAJUFGI-FVCICTRLSA-N 452.236 -2.386 50 20 JAGD N=C1NCCN1CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807114277 XVRYMTUHEQEXGK-PXNSSMCTSA-N 450.308 -1.079 50 20 JAGD O=C(CN1C(=O)CNC1=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815596900 GJZNGUMCBUQDFP-OAHLLOKOSA-N 454.252 -1.053 50 20 JAGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1830538909 UZIZMFFBRWOVKN-GTNSWQLSSA-N 484.311 -1.086 50 20 JAGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(CCO)CCO)C2)C1 1830544020 LCVRJGGLAQTFMY-QAPCUYQASA-N 466.373 -1.240 50 20 JAGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccnc1 1832728544 OQIBZAHVGWQXFO-HSZRJFAPSA-N 482.302 -1.739 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nn3)CCO2)C1 1833834224 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CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CNC(=O)c1cccnc1)CCO2 1832731681 IMILMPQAJRDBRI-JOCHJYFZSA-N 476.534 -1.359 50 20 JAGD CC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n[nH]1 1833824206 GXTJBQSRDULGMK-OAQYLSRUSA-N 471.474 -1.005 50 20 JAGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1835929158 CLGLPIXDUNOLAQ-QHCPKHFHSA-N 474.367 -1.926 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)N1 1835935072 FHNGWOQVDBIXKY-MGPUTAFESA-N 460.252 -2.966 50 20 JAGD O=C(c1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938211 QKHAIKPCMOCAGC-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD O=C(CN1CCN(S(=O)(=O)N2CCOCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 913053254 CYQNHANXYCRSDC-UHFFFAOYSA-N 456.481 -1.450 50 20 JAGD O=C(CNC(=O)c1cccnc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793959563 XLHCWIXSVPCWAG-XEMDLRDOSA-N 452.276 -1.605 50 20 JAGD C[C@@](O)(C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)C(F)(F)F 1835927388 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BJHZZYLTPNQDAW-OAQYLSRUSA-N 457.491 -1.269 50 20 JAGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C2)C1 1839142303 LQFVDEBDVLJGQO-QKKBWIMNSA-N 496.952 -1.093 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1ccnn1 1839709172 YJMUYDNHLOIGRL-VLIAUNLRSA-N 458.479 -1.392 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21)c1cccc(B(O)O)c1 1786984931 APPPPUGCUGEKTM-DKIMLUQUSA-N 450.322 -1.463 50 20 JAGD Cc1cn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(=O)nc1O 1797753987 HMZNPVNJRQRWPK-FVCICTRLSA-N 471.474 -1.841 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829753663 ZAWFDXSPAYPJFK-LJQANCHMSA-N 461.309 -1.357 50 20 JAGD CC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CC1 1797306265 SPUUDWQAYWXZJG-UPHUGPLXSA-N 452.556 -1.887 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371413 ULLNSFAYXHWTCN-DNVCBOLYSA-N 488.273 -1.479 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1837456767 NDPFEMDNAUJFQM-JOCHJYFZSA-N 498.500 -1.991 50 20 JAGD Cn1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457509 GTTXATZRVYWPSE-OAQYLSRUSA-N 457.491 -1.269 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c(=O)cn1)CCO2 1838636282 XBRSUGOLONVDHY-NFCNUSAFSA-N 471.474 -1.026 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012975 VWBNJJWPKOPEOV-INIZCTEOSA-N 474.323 -1.048 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782212132 WRNGLQXGPVQNID-XMSQKQJNSA-N 460.340 -1.133 50 20 JAGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)c1cccc(B(O)O)c1 1817475463 RPAYUUPTXYKUQA-OAHLLOKOSA-N 477.250 -1.165 50 20 JAGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829753178 OTORSBWJDUNXRK-LJQANCHMSA-N 461.309 -1.357 50 20 JAGD CN1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1834798582 NDNQDXFEJFYPAV-UHFFFAOYSA-N 471.411 -1.201 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H](N)C(N)=O)C2)C1 1837457891 UWAPFWHVFDDCGF-YWZLYKJASA-N 463.495 -2.652 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N1CCN(C)CC1 1840185404 QFZYLLQNFCRRJI-XMSQKQJNSA-N 468.599 -1.548 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1840185520 OMBHQOGKTZFCIB-OAQYLSRUSA-N 480.522 -1.458 50 20 JAGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1[nH]cc2c(=O)ncnc1-2 730516041 GRYDOMOTNXRGQS-UHFFFAOYSA-N 489.514 -1.128 50 20 JAGD N=C(N)SCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835511922 CUPJBEOTOOCUCT-GOSISDBHSA-N 451.509 -1.618 50 20 JAGD O=C(c1ccc2nncn2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930737 WXUAEQXTXUSRME-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)C1 1837456518 JOJMUFXXKCCKJD-VBKZILBWSA-N 475.462 -2.647 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459742 XBAIJRMETZHOSY-HXUWFJFHSA-N 479.563 -1.761 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1801009609 RPRURIRQNPUAAP-VYGYDYRJSA-N 476.534 -1.045 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)C(=O)N1 1835927561 STIVLDXEQBKMLB-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3ccnn3)C2)C1 1837461317 UEYAMQHATVIPHS-HXUWFJFHSA-N 458.479 -1.563 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840183805 BFWANKSEQJYYDR-OAQYLSRUSA-N 462.312 -2.191 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)n(C)c1=O 1841984823 ONZHSKHLUJTYMP-UHFFFAOYSA-N 495.500 -2.051 50 20 JAGD CN[C@H](CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(=O)O 1779373462 UJEVHNPKGOCJOE-WHSLLNHNSA-N 462.507 -1.125 50 20 JAGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H](O)N1CCOCC1 1779413622 RLJBZNSBBYIYDJ-STZQEDGTSA-N 461.324 -1.856 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1NC(=O)NC1=O)C2 1782209490 TYCOMCFZYMOYHP-ARGWCVDVSA-N 452.512 -1.529 50 20 JAGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1792889351 OADANARVTXIDIS-KRXQYRFLSA-N 471.555 -1.165 50 20 JAGD N=C1NCCN1CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807114276 XVRYMTUHEQEXGK-FXAWDEMLSA-N 450.308 -1.079 50 20 JAGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)O 1834737241 HKPGBSPYXYUKKF-LJQANCHMSA-N 460.340 -1.386 50 20 JAGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cn1 1835928076 CQNGMXWXPMDKFM-QHCPKHFHSA-N 483.286 -1.068 50 20 JAGD N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccn1 1835935742 PCYFVHGGKLCWFZ-KNQAVFIVSA-N 454.292 -1.469 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1835937496 ZUQBEMLTJNMLFL-QFIPXVFZSA-N 470.291 -1.271 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1837455621 AKPSIYXGGONRAP-NRFANRHFSA-N 478.575 -1.196 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ncccn3)C2)C1 1837456179 DRJHSYMHDMRFPM-NRFANRHFSA-N 455.475 -1.212 50 20 JAGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C1)CCC2 1839582519 CWUYLUNRAAPRPG-QHCPKHFHSA-N 468.319 -1.028 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839781808 FKEPWEKBZOCHAV-XLIONFOSSA-N 466.321 -1.986 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNC(=O)C1)CCO2 1839869829 PJUXHJAPSCRKBK-CESSLWIKSA-N 460.491 -1.287 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1783982327 KNVBULFVKRVRMG-QGZVFWFLSA-N 458.397 -1.193 50 20 JAGD NC(=O)c1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833307305 BUDSJJJDMBYJIL-JOCHJYFZSA-N 468.275 -1.756 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1840184144 VORZVABEBWJCCP-IBGZPJMESA-N 452.468 -1.669 50 20 JAGD CS(=O)(=O)NCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 727066353 UWSILONAUVXSDE-UHFFFAOYSA-N 465.579 -1.634 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779200524 JJKPGFFYZVMXCN-LXGCGDOSSA-N 457.528 -1.062 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781859729 UEZKPHFRVSZOPS-IIBYNOLFSA-N 478.506 -1.028 50 20 JAGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737663 HHTAEFBAQODMSJ-UGFIEOPBSA-N 495.341 -1.251 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754392 UOAMKDZJVYTFTL-GTYSZEQSSA-N 484.517 -1.641 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804091508 QEIGIIOGLKMQQI-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1837457085 VJIUZRGJMQIKFB-NRFANRHFSA-N 455.475 -1.212 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840182295 FRTJXMFGBXNHRP-LJQANCHMSA-N 467.483 -1.379 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936090 QSKPKVZIRLLANK-UZLBHIALSA-N 456.496 -1.316 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459616 SXEBOBPZPCWUGA-SPLOXXLWSA-N 477.522 -1.537 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459727 XBAIJRMETZHOSY-FQEVSTJZSA-N 479.563 -1.761 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1840184388 JIJDDCMYTLSORE-HXUWFJFHSA-N 455.512 -1.342 50 20 JAGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831442334 FREULKHEDQRRAY-FQEVSTJZSA-N 466.321 -1.657 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837205414 ZAIHCNLHUITKJK-OXQOHEQNSA-N 465.268 -2.499 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 1838835270 NSHDCVPGNROKIA-HXUWFJFHSA-N 452.512 -1.128 50 20 JAGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840077035 VNKYUUKNTGAGEJ-HSZRJFAPSA-N 494.350 -1.494 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183078 ZYYQWCHQUKPYIK-DNVCBOLYSA-N 462.569 -1.504 50 20 JAGD Cn1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cccc1=O 1833870230 SVJGGVBSFLESBW-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940017 STGRDMOGPMLXSZ-ZDUIWUOISA-N 452.276 -1.060 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784803323 FZBXSBUIYXLXHO-SZMVWBNQSA-N 455.276 -1.725 50 20 JAGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795737143 XCKWYVVLENEOOD-HATOLVCRSA-N 494.350 -1.734 50 20 JAGD CC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829855056 DGUWLRXSMKSLHY-UWJYYQICSA-N 462.507 -1.330 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2 1835701682 NHSKHBDBULGKIR-AVRDEDQJSA-N 469.502 -1.150 50 20 JAGD COCCn1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835928120 DYQOAUAGVZJBQJ-QFIPXVFZSA-N 472.307 -1.407 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1837457152 WWZYPGQAAQKPCK-JOCHJYFZSA-N 483.485 -1.437 50 20 JAGD CN(CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)C(=O)O 1837921576 QARWPZTYONXPJM-UHFFFAOYSA-N 475.307 -1.478 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779373139 FMNXPZJDIQIGTB-AUSIDOKSSA-N 481.318 -1.194 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061132 HCDDJWQDDNWIIN-QFIPXVFZSA-N 463.259 -1.473 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833571245 ZECVPIXQMKTXNH-OAQYLSRUSA-N 474.254 -1.154 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930680 UHUOHBPNTZYDIE-HRAATJIYSA-N 457.296 -1.636 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)C(=O)N1 1839198686 MUAMVBVIVPQIAA-DOMZBBRYSA-N 451.249 -1.315 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)C(=O)C(=O)O)CCO2 1839704359 LOLAISUZQSEZJQ-LJQANCHMSA-N 457.484 -2.641 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816676042 WHXRLYXIJPCSTD-VIFPVBQESA-N 474.507 -1.132 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(O)O)C2)C1 1832549564 NCUXQEYWHXIRDV-SGTLLEGYSA-N 451.904 -1.114 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n(C)n1 1833442912 SPRZLBMSMLLUKU-OAQYLSRUSA-N 458.280 -1.508 50 20 JAGD O=C1CN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)C(=O)N1 1835934102 OAUKSSJKHSTAKY-HXUWFJFHSA-N 460.252 -3.012 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839781807 FKEPWEKBZOCHAV-PXNSSMCTSA-N 466.321 -1.986 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187057 UABWYMRTKJIJFC-MRXNPFEDSA-N 458.364 -1.023 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)n(C)c1=O 1841984577 MRGGHHOVWLCSLS-UHFFFAOYSA-N 480.290 -2.369 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935512 IGTSNHRXUOJJCW-QFIPXVFZSA-N 458.324 -1.282 50 20 JAGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccco1 1836126872 VKWBAWMZVGDQDZ-JOCHJYFZSA-N 471.275 -1.541 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837457980 ZPFHRLBXKKHHCJ-JOCHJYFZSA-N 483.290 -2.251 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779076533 NTSQBXWIRBCVEB-JXFKEZNVSA-N 456.496 -1.316 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21)c1ccc(B(O)O)cc1 1786981091 QSTTWKWOJODUHK-IEZWGBDMSA-N 477.286 -1.324 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831335644 OAFROGSVLOEPCZ-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2)NC(=O)NCc1ccccc1 1780969932 OHVSKJBRMJHBGK-FDDCHVKYSA-N 489.577 -1.245 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2)c1cccc(B(O)O)c1 1795739913 PWIKCQHIUPHFMF-HGKCTWBKSA-N 484.343 -1.525 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807946609 AWLUNOADRLOKCN-HNAYVOBHSA-N 488.273 -1.479 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1835930709 VSCCSODHOBXGKX-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]nnc4n3)CCO2)C1 1836404805 UMBQIVZJCRBMBE-DIFFPNOSSA-N 484.311 -1.086 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CCN(C)CC1 1839104122 LIOXHCGVWCFEAM-HXOBKFHXSA-N 489.577 -1.609 50 20 JAGD CNC(=S)NCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788614459 BTJYFLZEJJMKHV-RCBQFDQVSA-N 463.564 -1.238 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797868039 DCUGWJFBLVTIMY-AMVTXUCVSA-N 467.291 -1.822 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCS1(=O)=O 1800393452 BBPODGISRVIDBK-NOXHYTERSA-N 451.505 -1.535 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1835937449 XLRIBZOALLPITG-IBGZPJMESA-N 459.224 -1.619 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CO)on3)C2)C1 1837459282 BBXFIXIPJBJKLV-HXUWFJFHSA-N 460.447 -1.451 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840371115 PTJROQAEAZLPMU-OFNKIYASSA-N 499.333 -2.093 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)c1cccc(B(O)O)c1 1795739872 MGUIBTUJSPGONO-VAVQPMOSSA-N 455.320 -1.029 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1=O 1831883934 LIODVFMIDPLQTR-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1)c1cccc(B(O)O)c1 1834801238 RXSVNAQCYIOCIJ-UHFFFAOYSA-N 453.308 -1.051 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937956 CJBYZCLHJNUJQP-SGCYSOCQSA-N 458.324 -1.092 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939937 PMIKWVFXTTVJJF-SFTDATJTSA-N 464.280 -1.948 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868903 UKXWNZKFLLHYIF-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CNCP(=O)(O)O)C2)C1 1840184240 XLMYCSAFMQZYJV-QGZVFWFLSA-N 465.444 -2.459 50 20 JAGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1319301211 FMYVBPAPXISPNI-LLVKDONJSA-N 451.548 -1.106 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[C@H]1SC(=N)NC1=O 1797750706 NRRYMBAWVOSILM-VOAKKNSGSA-N 475.531 -1.309 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1801011476 OQAQJVZTDTXGJB-KRXQYRFLSA-N 471.555 -1.165 50 20 JAGD C[C@@](O)(C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(F)(F)F 1832156020 LQSOLFJYEWTVNR-MSOLQXFVSA-N 460.214 -1.250 50 20 JAGD N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccn1 1835935743 PCYFVHGGKLCWFZ-SIKLNZKXSA-N 454.292 -1.469 50 20 JAGD O=C(Cn1ccccc1=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835996025 YFTCOUPKWVRHAQ-JOCHJYFZSA-N 455.276 -1.702 50 20 JAGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(CCO)CCO)CCO2)C1 1839919304 ZRDYBAFNZWFYQZ-ZWKOTPCHSA-N 456.367 -1.034 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840178284 BXFXRZYDTMVLGY-NHCUHLMSSA-N 464.280 -1.948 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787496841 WVBWVEUPZQKZED-VCQFHVMDSA-N 474.348 -1.238 50 20 JAGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)C(=O)O 1810305404 LKIWGKNIYXNTTI-KBXCAEBGSA-N 483.485 -1.057 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829773712 REEZGHPBXKJJHO-JKTFDMFLSA-N 451.524 -1.326 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n1 1835938205 QCAJBVGMMQABTB-DEOSSOPVSA-N 498.345 -1.263 50 20 JAGD N=C(N)SCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457974 ZDEFAMOCGMMAFZ-IBGZPJMESA-N 465.536 -1.228 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840183907 HMGLQOCUQDHBPV-PGRDOPGGSA-N 462.551 -1.219 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778785494 NNEQJLGORUAELC-DNVCBOLYSA-N 450.452 -1.807 50 20 JAGD CN1CCN(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1 1786726839 BUQNFTFMXFBFNG-VDGAXYAQSA-N 473.578 -1.084 50 20 JAGD N=C1NCCN1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797856 DVFZJBBZAHNZHP-UHFFFAOYSA-N 456.356 -1.608 50 20 JAGD O=C(CN1CCSCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933733 BOPDUYBBLRXVGR-OAQYLSRUSA-N 463.365 -1.515 50 20 JAGD CNc1nsnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835933943 HQKGVQICUPYPNT-IBGZPJMESA-N 461.309 -1.357 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cncn3)CCO2)C1 1836134713 USZJNMSMDJRQKS-UDIPQKBFSA-N 458.479 -1.132 50 20 JAGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 919884373 FFIOKHQSMWOSSV-OAHLLOKOSA-N 473.577 -1.181 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936082 QSKPKVZIRLLANK-JXFKEZNVSA-N 456.496 -1.316 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)N1CCN(C)CC1 1786984886 VDJOKRDIMSNBMK-GIUOSPMZSA-N 458.368 -1.404 50 20 JAGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)no1 1788670030 DQCMXMFJDUFYJQ-IEZWGBDMSA-N 470.291 -1.314 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790652806 PPUXOIBJOVVQRU-IEZWGBDMSA-N 484.274 -1.270 50 20 JAGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938059 HZBZYIFDDVLJCQ-FQEVSTJZSA-N 464.353 -2.080 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCOC3=O)C2)C1 1837457055 WOCFTCNGKYBFSC-FQEVSTJZSA-N 462.463 -1.793 50 20 JAGD Cc1cn(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(=O)nc1O 1785354904 VLYNZKVPEVQCSI-HXUWFJFHSA-N 450.496 -1.540 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979616 DIHZHIFKHCJUCG-JVPBZIDWSA-N 467.291 -1.728 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835764779 QIYCFKWBYPQPDE-QHCPKHFHSA-N 489.577 -1.479 50 20 JAGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935611 VRHJKIJNDXIAAE-HSZRJFAPSA-N 482.302 -1.739 50 20 JAGD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1781093581 ODEUFLKNJYGGIK-KSFYIVLOSA-N 459.551 -1.236 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801071 JDBUBHHIBWUPMY-OAQYLSRUSA-N 474.367 -1.297 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834801257 WQUYYRDRWMHORB-UHFFFAOYSA-N 493.333 -1.404 50 20 JAGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835843201 MFZRMYZHDZPHCI-OAQYLSRUSA-N 474.367 -1.297 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1835937420 VNNAMCODMMQFQH-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD NC(=O)CC[C@H](N)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807045315 WAOLROWRRSIVJD-XKGZKEIXSA-N 453.308 -1.326 50 20 JAGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928682 VDKXHESQWWHYPD-GHTZIAJQSA-N 474.348 -1.537 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1CCN(C)CC1 1835939363 OJAREXIKNFONTM-WZONZLPQSA-N 474.367 -1.928 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1840185774 XKLTWLGXSZFSIT-DYESRHJHSA-N 487.554 -1.341 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984536 RJKYPSKRFZPKPJ-VDGAXYAQSA-N 452.081 -2.047 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)n(C)c1=O 1796361587 KHUOQNJKOKRGEU-IQOUGMIPSA-N 456.862 -1.442 50 20 JAGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cccc1=O 1837456208 FORXRPBLDDBMPK-QFIPXVFZSA-N 470.486 -1.232 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1837459744 NABPVOOVQROAFP-NRFANRHFSA-N 487.473 -1.670 50 20 JAGD CN1CCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2C1 1839621535 CZYGNGGOZAKKAV-DEOSSOPVSA-N 497.361 -1.218 50 20 JAGD CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790175584 PJHBCKJKSAUSOW-PCODUJHASA-N 477.323 -1.197 50 20 JAGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800849611 PWWNHPASJNFKKY-HATOLVCRSA-N 494.350 -1.734 50 20 JAGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2)c1ccc(B(O)O)cc1 1815340072 DSICZHSXPFWJNO-NSHDSACASA-N 480.275 -1.512 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835643605 CTDJDUBXQFYJQB-HXUWFJFHSA-N 476.339 -1.384 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939562 AJTLUUNGLCGLHT-OAQYLSRUSA-N 462.312 -2.191 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cncn1 1837460423 FZVAKQQBHFJUDR-JLTOFOAXSA-N 458.479 -1.392 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1839663557 BYRLOSTVCSXYQH-NRFANRHFSA-N 471.474 -1.988 50 20 JAGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800756999 LCIFYPZKCOWXIS-NRWUCQMLSA-N 497.350 -1.193 50 20 JAGD NC(=O)[C@H](N)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365775 WHPYFYMELCKHMD-HQRMLTQVSA-N 453.308 -1.326 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815349997 CCKBENAPNJKCRT-HNNXBMFYSA-N 492.388 -1.221 50 20 JAGD COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1834528311 PHIUISOXONRPOA-OAQYLSRUSA-N 456.264 -1.451 50 20 JAGD CN[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(=O)O 1835759858 QXPYCOCRPJIGRY-LXPZDEJYSA-N 478.506 -1.361 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933763 CKFHOXXWCUCJRY-LJQANCHMSA-N 454.310 -2.129 50 20 JAGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839666683 TVYDJZZWXHIVID-BXKMTCNYSA-N 496.329 -1.350 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1840151239 YHKPDMYOOLXIMF-BFUOFWGJSA-N 455.899 -1.050 50 20 JAGD C[C@@](O)(CC(=O)O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791283596 UMSWIGNZVVMDPU-UKKSMEIOSA-N 463.491 -1.106 50 20 JAGD CN[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)C(=O)O 1799094994 OORRYSYKZVVFNV-NYUBLWNDSA-N 490.561 -1.015 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837376480 BFAUOBMLSXTJOR-QVKFZJNVSA-N 462.312 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)C1 1837457073 WPVYRGHSGHGBET-SPLOXXLWSA-N 460.491 -1.719 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837501995 GGUASEVCKSOTNR-UTKZUKDTSA-N 486.522 -1.689 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CNC3=O)[C@H]2C1 1784951631 XGNWCNUUAIDTQE-HVEJOWRVSA-N 473.490 -1.348 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCNC1=N)C2)NC(=O)NCc1ccccc1 1799094762 JGQFLCRVIBACDQ-RMFSNUHRSA-N 486.577 -1.238 50 20 JAGD CC[C@@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835055894 QEZCOPNCIDYVLA-LJQANCHMSA-N 459.356 -1.002 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835929564 WIYUYZNEDRYUHU-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1835935906 WLGSRXADOAQQEN-QHCPKHFHSA-N 483.286 -1.084 50 20 JAGD O=C(O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840191900 AHLVFANOAKZLJI-LJQANCHMSA-N 452.294 -1.746 50 20 JAGD CSCC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840196757 XSPGCHUMBHILDQ-YLJYHZDGSA-N 452.338 -1.450 50 20 JAGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)CC1 914555813 ZJRSAYYSLPBETB-UHFFFAOYSA-N 484.564 -1.132 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C[C@@H]21 1787508605 CHRBSYUSXPEBNS-OCCUQACQSA-N 496.488 -1.460 50 20 JAGD CN1CCN(C2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)CC2)CC1 1801012806 YVUVPVYDBTWQNU-XEMDLRDOSA-N 450.584 -1.271 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc(B(O)O)c1 1834801255 WNNYUSMAVAICNI-UHFFFAOYSA-N 479.151 -1.455 50 20 JAGD O=C1NCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc21 1835934984 AOOFSZIHZHQIRN-QFIPXVFZSA-N 483.290 -2.310 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cnnn1 1840477415 LRBLLCSACLRTNC-BFUOFWGJSA-N 459.467 -1.997 50 20 JAGD NC(=O)CC[C@H](N)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364256 PNOBFSAYQCETTC-KPFFTGBYSA-N 453.308 -1.326 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1835736773 HFXZMASXAGYSPM-SFHVURJKSA-N 474.566 -1.537 50 20 JAGD O=C(COc1cccnn1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933633 DZBJMHDJPQXZSU-NRFANRHFSA-N 456.264 -1.695 50 20 JAGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)CN)CCO2 1836491037 ZDOKIAJRMFGVTE-JXFKEZNVSA-N 465.463 -1.124 50 20 JAGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1 919690042 MZLBSNKVJWABAA-UHFFFAOYSA-N 476.515 -1.034 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788564966 PUVQNGRCJSFXNP-OQUILHJVSA-N 461.523 -1.014 50 20 JAGD Cn1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1=O 1831884288 SWVMXTKPUHDHIG-QFIPXVFZSA-N 455.276 -1.551 50 20 JAGD CN(C)c1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)o1 1833899898 YSCAJPBCFLEION-OAQYLSRUSA-N 458.280 -1.196 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)N1 1835935074 FHNGWOQVDBIXKY-YWZLYKJASA-N 460.252 -2.966 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nncn3c1)CCO2 1837014691 CDQXAIBQQVUAHW-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD CN1N=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CCC1=O 1788611633 NPNBMQAOQFCXHM-NUTKFTJISA-N 457.491 -1.113 50 20 JAGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1832728829 UVAKLGWBRBMDKB-HSZRJFAPSA-N 482.302 -1.739 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1)c1cccc(B(O)O)c1 1834800004 OAUCRHAHQYGZFK-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)C(C)(C)C 1835927880 ZMMJJEVNPZNAKC-CVDCTZTESA-N 475.351 -1.013 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1837271723 CJMJGIGBNCFXFR-HXUWFJFHSA-N 458.284 -2.231 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)N1 1839198933 OZCPFORJASWCQZ-ZVWUFJHRSA-N 451.249 -1.269 50 20 JAGD COCCS(=O)(=O)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915636363 QYWWQEAKYNQOEP-UHFFFAOYSA-N 477.561 -1.151 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1813070538 INZIEGGMRQKXAC-LIRRHRJNSA-N 482.505 -1.100 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732768 AIXYWFUYMOGVKL-KUHUBIRLSA-N 472.951 -1.052 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837318243 NSNVURFIYYXPJB-SFHVURJKSA-N 489.407 -1.139 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837517685 ZCYXBAFPUKNPPD-FPOVZHCZSA-N 463.296 -2.913 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc21 1778378581 CCYASKZBWPGRHX-QFIPXVFZSA-N 467.291 -1.546 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732792 KWCVQEQTGHCYQS-JJAZEVLHSA-N 453.326 -2.103 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2)c1cccc(B(O)O)c1 1795737572 WXAIILOGBGRFBA-FVCICTRLSA-N 452.236 -2.386 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1SC(=N)NC1=O 1796425818 PCKBAHFBDACDGD-APDPGRRMSA-N 460.321 -1.628 50 20 JAGD N[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935604 MAGORWRBBGJPEV-REWPJTCUSA-N 468.319 -1.079 50 20 JAGD Cn1ccc(=O)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460282 ZHYICSFFMKTFPZ-QFIPXVFZSA-N 470.486 -1.232 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839623892 HZKLUUPUGQRSHZ-JOCHJYFZSA-N 483.265 -1.068 50 20 JAGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1318507943 SSROLCXYBMCBED-UHFFFAOYSA-N 454.557 -1.399 50 20 JAGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782783682 IEAMQHORRFKEGJ-NRFANRHFSA-N 470.247 -1.420 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983593 SLTIYMKHVMINJD-KCMWZYNZSA-N 467.353 -1.713 50 20 JAGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1)c1cccc(B(O)O)c1 1816671623 RIRFHVXDPJZLIL-NSHDSACASA-N 480.275 -1.512 50 20 JAGD Cc1cn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(=O)nc1O 1835941823 QRNXTPJXLAZFMJ-JOCHJYFZSA-N 486.290 -2.293 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459226 MXZYJZAHUXSXGG-JOCHJYFZSA-N 498.500 -1.933 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1840155525 ADBLSOPRUOTXBW-IFXJQAMLSA-N 458.899 -1.032 50 20 JAGD CCNC(=S)NCC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185727 WGYKJBZYCXAYRY-IBGZPJMESA-N 458.585 -1.700 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1nc2ncccn2n1 1787937037 QAZWIUXRBQCULP-XIRDDKMYSA-N 450.264 -1.289 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799073040 LBANPQXDHTXKOM-HGKCTWBKSA-N 484.343 -1.525 50 20 JAGD N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccn1 1835699870 GXUJLQAKIFQWSK-KNQAVFIVSA-N 454.292 -1.469 50 20 JAGD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935519 IOCIDXQSXVSXPN-NRFANRHFSA-N 457.248 -1.444 50 20 JAGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(=O)C(=O)O 1839703768 CKYRTLAKVIYACU-NHYWBVRUSA-N 454.249 -1.324 50 20 JAGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1839760641 KVPYIKGZWNXNFP-OAQYLSRUSA-N 460.292 -1.220 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185910 VOIHONWMAXAQEW-OXJNMPFZSA-N 457.528 -2.033 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1779032407 QUFDQUYLWDBNCF-HXUWFJFHSA-N 455.431 -1.069 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)n(C)c1=O 1785190143 BZRQBAZZNNGQKA-JUFZMCDQSA-N 470.889 -1.052 50 20 JAGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccs1 1833029789 APMPVOKCZGEHGX-JOCHJYFZSA-N 487.343 -1.072 50 20 JAGD C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840431091 VRWUOQYILBUMOK-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787495808 OBSWCQXMJLNXNO-MUMJOVGASA-N 474.348 -1.238 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3C(N)=O)C[C@@H]21 1788609976 IJSOLTJOZFWQPT-CQDKDKBSSA-N 468.474 -1.519 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)Cc1cscn1 1796308389 WMACNMLBSRABQZ-LZDSYCOUSA-N 459.532 -1.085 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835644337 NULXBTGPEKKGAT-FQEVSTJZSA-N 476.339 -1.384 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1840184498 QTBKNEWLGIZDAK-QFIPXVFZSA-N 491.549 -1.540 50 20 JAGD CCNC(=S)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781474655 LLMBJQFSHUQRJA-DYESRHJHSA-N 462.381 -1.022 50 20 JAGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)C(=O)C(=O)O 1790635518 RTAKUCIHFMNNKK-CQDKDKBSSA-N 462.463 -2.179 50 20 JAGD COC[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 1796441652 NODKRWZBGLSTCP-SZSFSPGGSA-N 462.507 -1.139 50 20 JAGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(=O)C(=O)O 1815360056 KMGNPVNYSTXDFC-GFCCVEGCSA-N 460.277 -1.408 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(C)c1=O 1832755963 UZPUZESRFDXDSC-AUUYWEPGSA-N 486.888 -1.576 50 20 JAGD O=C1CN(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)C(=O)N1 1834800144 XQAOSIPXVAUIFP-UHFFFAOYSA-N 471.323 -1.897 50 20 JAGD O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NCc1ccco1 1835930759 YOGSVUIIKFMGJD-UROCCOEBSA-N 497.313 -1.098 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840371114 PTJROQAEAZLPMU-NFBKMPQASA-N 499.333 -2.093 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799364724 BLVFODNNPJIYCN-WQDJSCAQSA-N 491.350 -1.155 50 20 JAGD CC[C@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835055893 QEZCOPNCIDYVLA-IBGZPJMESA-N 459.356 -1.002 50 20 JAGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836768272 ATJVWHIIBVKTSF-FXAWDEMLSA-N 460.959 -1.139 50 20 JAGD CSCC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460318 BESKVHFWMUUACF-JXFKEZNVSA-N 467.548 -1.131 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921020 SULNFWZEVCBCQY-UHFFFAOYSA-N 480.135 -1.028 50 20 JAGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 728510787 UCPUUIUZVDOCJU-MRVPVSSYSA-N 482.484 -1.226 50 20 JAGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1)c1cccc(B(O)O)c1 1819879944 HCCHHZXYDABUIL-KUHUBIRLSA-N 460.321 -1.301 50 20 JAGD Nc1n[nH]c(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834801131 MWNHQUZFSHBEQZ-UHFFFAOYSA-N 469.355 -1.115 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939935 PMIKWVFXTTVJJF-NHCUHLMSSA-N 464.280 -1.948 50 20 JAGD O=C(COC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)NNC(=O)[C@H]1COc2ccccc2O1 728323851 STCDQDFUAXNCPE-DVOMOZLQSA-N 481.483 -1.447 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 728510788 UCPUUIUZVDOCJU-QMMMGPOBSA-N 482.484 -1.226 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]cnc4n3)[C@H]2C1 1786977310 ASPQBQMQFDJRFK-PJODQICGSA-N 481.473 -1.677 50 20 JAGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)N1CCN(C)CC1 1786984887 VDJOKRDIMSNBMK-LGYWMIHWSA-N 458.368 -1.404 50 20 JAGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926990 BCZXERNNLDAAMC-FQEVSTJZSA-N 466.321 -1.657 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1835928286 IGBJZMJCROHONZ-QFIPXVFZSA-N 465.275 -1.207 50 20 JAGD CC[S@@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938214 QNKHCXIDXIKHKO-PKHCJMHPSA-N 452.338 -1.405 50 20 JAGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938543 XRQXWWWJKRRVTP-AOMKIAJQSA-N 469.307 -1.273 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)C1 1837456523 JOJMUFXXKCCKJD-XOBRGWDASA-N 475.462 -2.647 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458762 AZYGOHFYTFATAY-LAUBAEHRSA-N 478.506 -2.094 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839372389 XUFNWPXZEHKKLB-QFIPXVFZSA-N 472.259 -1.133 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-n2c(O)nnc2O)cc1 1798599641 GUGDMLAJIBZBJJ-HGKCTWBKSA-N 493.285 -1.125 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812716143 HNGMCTWEENCHJS-PGRDOPGGSA-N 464.567 -1.253 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1813073124 HKQVJYCZYSFQQH-PGRDOPGGSA-N 464.567 -1.253 50 20 JAGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1)c1cccc(B(O)O)c1 1834800980 DGSVXZDGBRZZIM-QHCPKHFHSA-N 474.367 -1.798 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840361532 NLAIHXNGNKVGPN-SBUREZEXSA-N 468.319 -1.035 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061152 HUCDYCYEXGEIFR-QFIPXVFZSA-N 463.259 -1.473 50 20 JAGD O=C(NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1cccnc1 1795732971 TUCCMAJKDSSKRL-XEMDLRDOSA-N 452.276 -1.605 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825332118 XRAKEGKNBJTWKJ-CYBMUJFWSA-N 456.569 -1.285 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1846384248 UTYSTMFKCWBWAO-UHFFFAOYSA-N 474.522 -1.990 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982716 FMBJCICCACGANK-IKICRFKJSA-N 452.338 -1.360 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)nn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982934 CUFPLELFTRBJEL-XIRDDKMYSA-N 456.264 -1.466 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788706171 QUSOANUPNXBPKR-OVWQWFNUSA-N 475.550 -1.052 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CC[C@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828523236 MTYUANGYOCOUNA-DEOSSOPVSA-N 497.313 -1.257 50 20 JAGD CC(=O)NC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831475121 GAMMWXARCMIORH-NRFANRHFSA-N 462.507 -1.330 50 20 JAGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1833431819 LIMXHDMVYKLQJH-QFIPXVFZSA-N 470.291 -1.061 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCNC3=O)CCO2 1834564957 MTSYAFPVBYAHLU-OAQYLSRUSA-N 477.522 -1.931 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199135 QLQQTJICEYVXKF-WFASDCNBSA-N 451.249 -1.315 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779032202 LPGUWCHRQCILJN-OAQYLSRUSA-N 494.574 -1.200 50 20 JAGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783665195 VKECSOVDZVAODP-JOCHJYFZSA-N 464.324 -1.120 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)n(C)c1=O 1785190295 CDWBORAQBAGINZ-FQUUOJAGSA-N 482.925 -1.987 50 20 JAGD N[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccnc1 1835828894 NBHFTFVAQUGTNI-REWPJTCUSA-N 468.319 -1.079 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927585 UPRHNXNSLKZESB-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837464352 ULBVNRTUGFWIFQ-HXUWFJFHSA-N 464.353 -2.080 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935250 PDMMEZWANJRCQF-YCRPNKLZSA-N 461.523 -1.202 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788640797 XOAYYKFRMWNMBX-XSLAGTTESA-N 470.523 -1.166 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C(N)=O)[C@H]2C1 1789092589 AWNNPJYHEGUDNN-CQDKDKBSSA-N 468.474 -1.519 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1C(N)=O 1794268838 OCGJZNAOVMKOIY-DRXBFXEBSA-N 453.459 -1.304 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCN(C)CC1)C2 1796442190 VLLQRXICVABCRU-ODRBZYGGSA-N 459.551 -1.043 50 20 JAGD Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1C 1830949736 PIOMINCGJSKMQQ-QFIPXVFZSA-N 456.308 -1.279 50 20 JAGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccnc1 1832728830 UVAKLGWBRBMDKB-QHCPKHFHSA-N 482.302 -1.739 50 20 JAGD O=C(Cn1nnc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927668 WIKLXLDPTOJOQM-QHCPKHFHSA-N 479.302 -1.119 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnccn3)C2)C1 1837455643 BOGLXOICLNBGNQ-NRFANRHFSA-N 455.475 -1.212 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1838328064 NJQGNMLLKHMWNH-QESWDSMOSA-N 498.500 -1.221 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839668978 AIVHEMHKXADJDV-OAQYLSRUSA-N 472.263 -1.989 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCNC3=N)[C@H]2C1 1786842575 FFLLPRAEWFZVPC-SKIHNHESSA-N 458.523 -1.060 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1835936948 LOFIGUIYHRRZME-JOCHJYFZSA-N 465.275 -1.207 50 20 JAGD Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1C 110902722 ZZAKALRSGSHISH-OAHLLOKOSA-N 481.487 -1.072 50 20 JAGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)c1cnn[nH]1 729456618 WQLUWQHQHBJRSX-UHFFFAOYSA-N 465.492 -1.263 50 20 JAGD CNC(=S)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779377224 MLYFFKBFZSWBOT-DYESRHJHSA-N 462.381 -1.022 50 20 JAGD Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)no1 1797828026 FIYJIZATNPSSFN-CCWDJLKJSA-N 456.264 -1.704 50 20 JAGD COC[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 1797964443 KUGDIONDBVXJTM-SZSFSPGGSA-N 462.507 -1.139 50 20 JAGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1834528006 KJDSVHJVBHTVTC-NRFANRHFSA-N 456.264 -1.451 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1837457786 RKXJKOBIUISIHL-NRFANRHFSA-N 472.458 -1.125 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184585 WBUWCFAFQRBEJW-QFBILLFUSA-N 459.500 -2.120 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)C[C@@H]21 1788611457 CPLZJTBVONXQBU-HJPIBITLSA-N 459.463 -2.124 50 20 JAGD 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O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2 1839532171 WZDGTQUGWJBFSN-QFIPXVFZSA-N 454.292 -1.107 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)C1 1840182869 WRUKYYZRUUIQJM-ORAYPTAESA-N 454.484 -2.586 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1840185776 XKLTWLGXSZFSIT-LAUBAEHRSA-N 487.554 -1.341 50 20 JAGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H](O)N1CCOCC1 1779413565 QIBBQAMDRJBCCC-BVYCBKJFSA-N 461.324 -1.856 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCS(=O)(=O)CC3)[C@H]2C1 1785036575 MYQFOZJEFUGQMM-ULQDDVLXSA-N 473.596 -1.931 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21 1788611703 SHBAKKHORSJQSX-WBAXXEDZSA-N 494.574 -1.991 50 20 JAGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1807366697 NVNIWXJUNYKSSI-LPHOPBHVSA-N 468.275 -1.376 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835997269 IPYVUUKRMNXLSH-JOCHJYFZSA-N 470.486 -1.383 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[C@H]1SC(=N)NC1=O 1779030277 NHAFXSNULYAJJV-CJAGKMTESA-N 475.531 -1.069 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785609023 KDEQFMMCOMKGNB-OYHNWAKOSA-N 498.581 -1.042 50 20 JAGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cn2[nH]cnc(=O)c12 1797751901 XZQAQUIADSMQRU-FVCICTRLSA-N 480.485 -1.153 50 20 JAGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1)c1ccc(B(O)O)cc1 1817470080 HZCGKQIAVKCGGH-HNNXBMFYSA-N 454.252 -1.053 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828523237 MTYUANGYOCOUNA-XMMPIXPASA-N 497.313 -1.257 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1ccnn1 1837459933 OZDVGQPIBMLZQF-VBKZILBWSA-N 458.479 -1.392 50 20 JAGD O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1csc(N2CCOCC2)n1 1317799143 OJSXTIFHDUZQEQ-NWDGAFQWSA-N 457.534 -1.224 50 20 JAGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)CC1 1786979670 JPSAGNDIHQKLFC-IHPCNDPISA-N 493.391 -1.369 50 20 JAGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812390204 RXRIYYVCXZLGKA-VQIMIIECSA-N 468.275 -1.376 50 20 JAGD O=C(Cn1ccncc1=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839663112 AMJTYNBRVGGHPO-OAQYLSRUSA-N 456.264 -2.307 50 20 JAGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1ccnn1 1839709170 YJMUYDNHLOIGRL-JLTOFOAXSA-N 458.479 -1.392 50 20 JAGD Cn1c(=O)c2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n(C)c2n(C)c1=O 728336379 YHCONRUYXKCRFT-HNNXBMFYSA-N 471.426 -1.280 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607946 YHMHCFKIYCRRMQ-OQUILHJVSA-N 482.563 -1.394 50 20 JAGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792238807 XQCLWQJYBNXACE-BPUTZDHNSA-N 477.373 -1.180 50 20 JAGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1793981051 KEVUJLLJUQNRGL-XFMPKHEZSA-N 482.925 -1.723 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1801011231 CMLDJRIQSSXNRG-HGKCTWBKSA-N 473.596 -1.379 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831322990 HXTYKMVXCQZBBT-FOIQADDNSA-N 483.352 -2.236 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)n1ccccc1=O 1835937937 BKEMCBQQTBLBPS-UZUQRXQVSA-N 469.303 -1.141 50 20 JAGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939532 RNQZCBBCXXCRLZ-QFIPXVFZSA-N 460.292 -1.054 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837377932 WLAQJIKONPTTBL-YCRPNKLZSA-N 462.312 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779416325 RDBJJOCYRIXEKA-ZPMCFJSWSA-N 476.534 -1.537 50 20 JAGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)N1CCN(C)CC1 1791291112 ZPPGLNZQWUQRCV-VJANTYMQSA-N 452.600 -1.025 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[C@@H]1SC(=N)NC1=O 1801011180 LOEDGZHMXZHIBG-LZPUHMRESA-N 454.553 -1.249 50 20 JAGD C[C@H](Cn1cccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927397 NXVOQQQNYZTICL-VGOFRKELSA-N 456.308 -1.031 50 20 JAGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1835932054 LNGGWILHZHETIU-NRFANRHFSA-N 460.292 -1.220 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836472560 LZTLHUHIFIBALK-NJSLBKSFSA-N 465.931 -1.072 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1840185191 MEVSRLVYSYBGSL-WOJBJXKFSA-N 458.512 -1.568 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1779037143 PSMSADWIIIAISG-OAQYLSRUSA-N 485.457 -1.101 50 20 JAGD 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O=C(Nc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938568 ZAGORQIQYDMMIO-QFIPXVFZSA-N 468.275 -1.530 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456176 KCQFQGIZTXRFTC-VBKZILBWSA-N 483.547 -1.564 50 20 JAGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C2)C1 1839142304 LQFVDEBDVLJGQO-SPLOXXLWSA-N 496.952 -1.093 50 20 JAGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1840153209 HNYKWNMGPZRGFC-FXAWDEMLSA-N 460.959 -1.139 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3C(=O)C=CC3=O)C2)C1 1837457111 XUQYBKMWBZGUAK-JOCHJYFZSA-N 486.485 -1.930 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CCN(C)CC1 1837459562 KDHIPNBJDPYCLU-HXOBKFHXSA-N 489.577 -1.609 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837673898 QOENVFYKZISJBU-KSFYIVLOSA-N 461.324 -1.259 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829000340 HFGHOQDICVQFFZ-DEOSSOPVSA-N 497.313 -1.257 50 20 JAGD O=C(CNCP(=O)(O)O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929306 KHVPFBQVHLTKLG-SFHVURJKSA-N 471.212 -2.839 50 20 JAGD O=C(/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NC1CC1 1835930329 GTWIFDBELPQFHE-KOIKXXGWSA-N 457.292 -1.729 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1C[C@@H]2C[C@H]2C1 1835938580 ZQQMDDDZHYYFER-ZQDYSYBYSA-N 457.336 -1.223 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1O 1837456866 OSWXZYBPZZTFNZ-FQEVSTJZSA-N 459.463 -1.492 50 20 JAGD CC(C)CNC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457503 GAAPVPNXNKJLDX-OAQYLSRUSA-N 462.507 -1.473 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1837460812 LFJJNIJCDWCGOA-JOCHJYFZSA-N 474.518 -1.232 50 20 JAGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840178932 WTIWFNUPLHBAPE-NHCUHLMSSA-N 464.280 -1.948 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984267 XBDNYHYYADQXAN-JVPBZIDWSA-N 467.291 -1.728 50 20 JAGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NNC(=O)C1)C2)NC(=O)NCc1ccccc1 1799097718 VCMOFYBRAIZANZ-CWPLJXCYSA-N 471.518 -1.202 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807947905 LODAQULRNJZZDA-DNVCBOLYSA-N 488.273 -1.479 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1835740029 WIYAHQDRASXIPQ-DWZWIFCTSA-N 477.522 -1.830 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837376486 BFAUOBMLSXTJOR-YCRPNKLZSA-N 462.312 -1.856 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1837460058 ZYVMQLHVDAHLTO-TZIWHRDSSA-N 478.506 -2.594 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839669328 WJARWGYJYZDPFF-OAQYLSRUSA-N 472.263 -1.989 50 20 JAGD CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840852623 SOLHTBDCARBKKD-KNQAVFIVSA-N 461.324 -1.259 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCCS1(=O)=O 1790748359 ULSMFKUKWJPJTI-LEUOFYLZSA-N 450.322 -1.463 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2n(n1)CCCNC2=O 1797323331 PSWBSLXPJPCOSZ-CCWDJLKJSA-N 467.291 -1.787 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804185140 BZLPVIPIKRVJOY-JXFKEZNVSA-N 465.275 -1.367 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1835541634 BFDXNFNJHNXNGQ-BXUZGUMPSA-N 458.246 -1.049 50 20 JAGD O=C(O)c1cnncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931379 PPNSYMOMRCABDM-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934017 LCQCPVAKBHWULS-JTSKRJEESA-N 456.308 -1.031 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934221 PXTMIZZSBPFNBA-GOSISDBHSA-N 473.213 -1.885 50 20 JAGD O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NCc1ccco1 1835937970 CVJQPOPYDCNBBE-JXSPYEIYSA-N 497.313 -1.098 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837253188 AKAYLEAHMWOQAA-JEUZPXFCSA-N 451.524 -1.349 50 20 JAGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779067845 HDVUTYFKLDTNDN-NQIIRXRSSA-N 462.264 -1.695 50 20 JAGD NC(=O)c1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981002 JVVOBGNUDAAFGK-BPUTZDHNSA-N 453.264 -1.838 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3sccn13)CCO2 1838415579 NHMOCUUVMRFPOP-QFIPXVFZSA-N 498.326 -1.180 50 20 JAGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nn1C 1840185874 URAWMKAEEOKHNP-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD Cn1cccc1C(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840482297 VKUBOINPLBBZBP-QFIPXVFZSA-N 455.276 -1.342 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785328855 JOYPQJMTTOVQPH-MLZJRGSSSA-N 496.329 -1.034 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)[C@H]1SC(=N)NC1=O 1795734260 LWZLHULSDVYVNP-MIGXYKPQSA-N 460.321 -1.628 50 20 JAGD C[C@@](O)(C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C(F)(F)F 1835934079 MNDVOQPQNQLOQS-MSOLQXFVSA-N 460.214 -1.250 50 20 JAGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccs1 1835935185 FQXHABMYVTYXGY-JOCHJYFZSA-N 487.343 -1.072 50 20 JAGD Cn1c(=O)c2c(ncn2CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)n(C)c1=O 1801015387 AFOWOQVRXMCKGI-PEGIJTEDSA-N 473.317 -1.173 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360512 BECOGZCGPGRXQN-BEFAXECRSA-N 488.273 -1.479 50 20 JAGD O=C(COc1cccnc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832675156 GFGGKIHPDQEXJQ-QFIPXVFZSA-N 455.276 -1.090 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1ccccc1=O 1835930594 OPCXSBKFXPQOIN-SBUREZEXSA-N 469.303 -1.141 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N1C[C@H]2C[C@@H]2C1 1835938577 ZQQMDDDZHYYFER-DYVMYPEFSA-N 457.336 -1.223 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1837516862 KMHFDFOZSCMZJU-VGWIDUNESA-N 492.533 -1.773 50 20 JAGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)N1CCN(C)CC1 1789799235 DFQBRZWGNNRCKW-LPWQTFTOSA-N 473.578 -1.086 50 20 JAGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1793981049 KEVUJLLJUQNRGL-QVHKTLOISA-N 482.925 -1.723 50 20 JAGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830720136 TWQZGHBQZXOCPN-TYILLQQXSA-N 465.931 -1.072 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1835932146 QIRYMDGAMRFMMQ-JOCHJYFZSA-N 472.259 -1.133 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)N1 1837115041 BHVHLQMCOCHMAM-SFHVURJKSA-N 472.307 -1.423 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)CCO2 1839718703 JXHITUISIXKWSQ-OAQYLSRUSA-N 494.505 -1.414 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034718 SWCPYTWLPIXLDW-XMSQKQJNSA-N 484.517 -1.401 50 20 JAGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831692010 AWODSRSVAXWYFV-QFIPXVFZSA-N 476.534 -1.083 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1 1835931363 ONORUMZMOBPXBP-FQEVSTJZSA-N 458.236 -1.014 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779198909 KQBQXAUZUNQFNB-HGHGUNKESA-N 463.296 -1.442 50 20 JAGD CN1CCN(C2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1795734990 FXRFZEYJTKREQX-OPVJXMOQSA-N 456.352 -1.650 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1797756398 HXOFPQZKSMPKCT-CULMDFNYSA-N 478.556 -1.251 50 20 JAGD O=C1CN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C(=O)N1 1815665934 LFUPFJAQQIFOLA-HNNXBMFYSA-N 454.252 -1.053 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3NC(=O)NC3=O)CCO2)C1 1832691002 IYNDMLCPDMETKQ-VBKZILBWSA-N 475.462 -2.647 50 20 JAGD CC(C)(NCCC#N)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835675248 ZVAQOZPIEPBORC-QFIPXVFZSA-N 458.324 -1.282 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1CCN(C)CC1 1839101031 CODKMMOXWTZQOV-FDDCHVKYSA-N 474.367 -1.928 50 20 JAGD Cn1nc2c(c1C(=O)N1CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C1)CCC2 1839582722 IVDOSFOBTKVQBQ-HSZRJFAPSA-N 468.319 -1.028 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1840184907 HIGDFOCXYKCFIP-BEFAXECRSA-N 460.553 -1.607 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)n3)[C@H]2C1 1787440580 YPAMCRHOUGVABU-XEGUGMAKSA-N 457.447 -1.207 50 20 JAGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)Cc1cccnc1)C2 1797750917 VMGUQYACASAHPC-QXGSTGNESA-N 453.503 -1.147 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832249422 ZJKUDKVXLRNIJM-KRWDZBQOSA-N 492.187 -1.208 50 20 JAGD O=C1NCCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc21 1836776287 PMODIGDRKBMECE-DNVCBOLYSA-N 455.899 -1.314 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)no1 1837549916 CYBDVJLQHIHXAZ-OAQYLSRUSA-N 480.522 -1.458 50 20 JAGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1837657351 URYOPQICKKJLQB-DEOSSOPVSA-N 498.345 -1.263 50 20 JAGD CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839682841 IKXUJGGMBXJRGK-YCRPNKLZSA-N 464.280 -1.002 50 20 JAGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840915325 QYUWAOFQPFUAAC-PJSUUKDQSA-N 492.957 -1.189 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788610507 CLAADGKBIZYMHF-JVPBZIDWSA-N 467.291 -1.728 50 20 JAGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732559 VHOXGDXYHZRDFD-CWPLJXCYSA-N 487.343 -1.177 50 20 JAGD O=C1NCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc21 1835938009 GATYWMXEQQYNPO-XMMPIXPASA-N 479.298 -1.006 50 20 JAGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3c(=O)c4c(ncn4C)n(C)c3=O)cc2)CC1 728212925 LWYJVCXCEDIRPF-UHFFFAOYSA-N 490.546 -1.487 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1778354726 TYDYBSCVSRHJFE-QFIPXVFZSA-N 458.324 -2.026 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373111 BLFKPSAOKSHQQG-IIBYNOLFSA-N 458.523 -1.347 50 20 JAGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793085333 DWFXUWCYMCDEPU-UKBAYJJMSA-N 491.350 -1.155 50 20 JAGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1SC(=N)NC1=O 1796425826 PCKBAHFBDACDGD-MIGXYKPQSA-N 460.321 -1.628 50 20 JAGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)C(=O)O 1835738291 STRCKZKPBPRFGV-UHFFFAOYSA-N 489.533 -1.587 50 20 JAGD O=C(COC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 753636944 XYADIVRXQVBMIT-LRDDRELGSA-N 494.482 -1.318 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938034 GPMVRHNVQGNXPZ-YCRPNKLZSA-N 462.312 -1.856 50 20 JAGD CCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455660 CEFHMQGKBNCHNB-SZNDQCEHSA-N 462.507 -1.330 50 20 JAGD O=C(COc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839669327 WJARWGYJYZDPFF-NRFANRHFSA-N 472.263 -1.989 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCn3ccnn3)CCO2)C1 1840448515 VAFYWMMOTVRVJO-FQEVSTJZSA-N 458.479 -1.563 50 20 JAGD CS(=O)(=O)NCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916295060 ZOGTURRWTLPCSO-UHFFFAOYSA-N 477.565 -1.480 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778116041 FAMCJHFGTWVLON-FQEVSTJZSA-N 473.596 -1.139 50 20 JAGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)[C@@H]1SC(=N)NC1=O 1795738811 GVTHVGHNANTJLY-BCEUIYSSSA-N 460.321 -1.628 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779067837 HDVUTYFKLDTNDN-GHTZIAJQSA-N 462.264 -1.695 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)c1ccc(B(O)O)cc1 1795732763 HBVMAFFTEJAOMR-PTEHBNRSSA-N 462.161 -1.075 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812713847 CHLQYWHVPPFIDB-DYESRHJHSA-N 485.545 -1.314 50 20 JAGD N=C(N)SCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929631 ZMFQCAUHJYVBRQ-LJQANCHMSA-N 450.326 -1.547 50 20 JAGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932072 MHASOJZFJYUVSJ-QFIPXVFZSA-N 477.323 -1.039 50 20 JAGD CN(C)c1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)o1 1835935559 UERNOGAQEVQUOY-OAQYLSRUSA-N 458.280 -1.196 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1835939832 JXVZNDOUJDNICX-YLJYHZDGSA-N 466.321 -1.986 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456821 NNWRUEBUTRIOSQ-OAQYLSRUSA-N 473.490 -1.189 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838394008 KDCZUBZGQFIAKF-HSZRJFAPSA-N 490.561 -1.052 50 20 JAGD COCCN1C(=O)/C(=C/NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C(=O)NC1=S 920978041 QQITUNUBFABGLC-JLHYYAGUSA-N 455.518 -1.055 50 20 JAGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1)NC(=O)NCc1ccccc1 1780968875 GIIRKGYZKMLANL-MBSDFSHPSA-N 489.577 -1.245 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829765245 OMFUEURFBGOREK-RHVSLNNASA-N 457.292 -1.705 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1834672751 LYPGIURTDDJOLA-SFHVURJKSA-N 474.566 -1.537 50 20 JAGD Cn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c2c1CCC2 1835937458 XWLUXECORSHNBS-QHCPKHFHSA-N 468.319 -1.028 50 20 JAGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]nnc3n1)CCO2 1836404922 WSFFLCNUSKAWAG-GOSISDBHSA-N 465.543 -1.266 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2 1838765264 AIUDPUCIEWVXFO-GOSISDBHSA-N 483.212 -1.113 50 20 JAGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)N1CCN(C)CC1 1839101037 CODKMMOXWTZQOV-MBSDFSHPSA-N 474.367 -1.928 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265307 PFRQGNCDAMFCQP-QGZVFWFLSA-N 454.491 -1.027 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793836110 PRPORILYFBPRRP-HGKCTWBKSA-N 465.337 -2.700 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364550 QQHPDUOWJJIJFZ-XLIONFOSSA-N 450.308 -1.079 50 20 JAGD CC[C@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835056167 ZQKDHZGJTAMCQX-IBGZPJMESA-N 459.356 -1.002 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2 1837090980 SDZWAHBILAUQKP-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(=O)NC3)C2)C1 1837457069 WPVYRGHSGHGBET-LHSJRXKWSA-N 460.491 -1.719 50 20 JAGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 1838835269 NSHDCVPGNROKIA-FQEVSTJZSA-N 452.512 -1.128 50 20 JAGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1779123228 MCZQGDXKBCHYEU-OAQYLSRUSA-N 471.474 -1.145 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835644338 NULXBTGPEKKGAT-HXUWFJFHSA-N 476.339 -1.384 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1837881774 MTTFEXJCKVISJV-GOSISDBHSA-N 475.550 -1.110 50 20 JAGD Cc1nccn1CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839715316 RXZCQTIOLQIDSF-OAQYLSRUSA-N 457.491 -1.040 50 20 JAGD NC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785513770 JGKPQIYHZPSHRX-WBAXXEDZSA-N 452.276 -1.233 50 20 JAGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)[C@H]1SC(=N)NC1=O 1795738813 GVTHVGHNANTJLY-LLKOPVJYSA-N 460.321 -1.628 50 20 JAGD Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)n1 1835935682 ZXPLXCLSBHBVLC-QFIPXVFZSA-N 456.308 -1.050 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CNC3=O)C2)C1 1837457201 ZRHXJPLEFDCVCQ-FQEVSTJZSA-N 475.462 -2.693 50 20 JAGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OC 729274832 FITUJULGWHVMRO-JTQLQIEISA-N 452.511 -1.543 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)N1CCN(C)CC1 1839101969 VDEOGCZUUHYFIJ-FDDCHVKYSA-N 474.367 -1.928 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978737 OYMDJPMPBWACOE-KCMWZYNZSA-N 467.353 -1.713 50 20 JAGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804091501 QEIGIIOGLKMQQI-JXFKEZNVSA-N 465.275 -1.367 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1835938534 XMTXHSWISBQZDR-TZIWHRDSSA-N 463.296 -2.913 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836968700 QRTZRHZFMPNSJM-JOCHJYFZSA-N 470.291 -1.271 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837117281 KFDYXWFNVVKKRG-MRXNPFEDSA-N 466.539 -1.044 50 20 JAGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840076696 AOLUFWDBOYXUAS-QHCPKHFHSA-N 494.350 -1.494 50 20 JAGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)N1 1845873800 MDQFWZMVOAPKID-DLBZAZTESA-N 486.359 -1.637 50 20 JAGD COCCN1C(=O)/C(=C/NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C(=O)NC1=S 920976288 UTYKTUKCZFBMDA-NTCAYCPXSA-N 497.555 -1.285 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2)c1ccc(B(O)O)cc1 1795734957 BBEVSSGACPOHGP-HGKCTWBKSA-N 493.285 -1.125 50 20 JAGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)N1 1807369617 QICUDJOCXGTRKF-VDZJLULYSA-N 465.275 -1.321 50 20 JAGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935279 MKNBHENNZUCYCX-NRFANRHFSA-N 458.280 -1.508 50 20 JAGD CC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839860306 NSUNZIMNIAGBBU-HSZRJFAPSA-N 490.561 -1.075 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1840184916 HIGDFOCXYKCFIP-KXBFYZLASA-N 460.553 -1.607 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2 1801012704 WBRXIJFRMSJYFF-RMHZUWNSSA-N 457.528 -1.208 50 20 JAGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)C(C)(C)C 1831088317 XHRIJWYXYVVNQN-CVDCTZTESA-N 475.351 -1.013 50 20 JAGD C[C@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930682 UHUOHBPNTZYDIE-IIBYNOLFSA-N 457.296 -1.636 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)C(=O)C(=O)O)CCO2 1839704358 LOLAISUZQSEZJQ-IBGZPJMESA-N 457.484 -2.641 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782211855 BLAPRWDNALPUFA-XMSQKQJNSA-N 460.340 -1.133 50 20 JAGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)CN)[C@H]2C1)NC(=O)NCc1ccccc1 1787427823 YYLQZFBQVYYMTQ-VJANTYMQSA-N 461.567 -1.402 50 20 JAGD CC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)CC1 1797304636 QPKWQZBUBMKHDF-CWPLJXCYSA-N 473.534 -1.948 50 20 JAGD O=C(O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ncn1 1833492239 LPOSWKHRMVRJCZ-NRFANRHFSA-N 470.247 -1.762 50 20 JAGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c(C)n2n1 1835930605 PBBSYYSHSNUABB-QHCPKHFHSA-N 494.317 -1.195 50 20 JAGD O=C(/C=C/c1cnccn1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934471 UMTFOSDSBIMVOU-IOUFHMPJSA-N 452.276 -1.060 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128482 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CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793312178 OHECSUYFSASRRI-JFILPPLUSA-N 468.536 -1.784 50 20 JAGD O=C(CN1C(=O)CNC1=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350360 SDNXQPORENZJRW-LBPRGKRZSA-N 457.277 -1.400 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938142 NCGMSGXRCOOIIY-UZLBHIALSA-N 465.268 -2.499 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837519011 SARRPXNBABGIRL-CTNGQTDRSA-N 478.506 -2.594 50 20 JAGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)nn1 1838830082 HNGGKAVZYUQHBG-JOCHJYFZSA-N 470.291 -1.061 50 20 JAGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C2)C1 1839142305 LQFVDEBDVLJGQO-SZNDQCEHSA-N 496.952 -1.093 50 20 JAGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1782212173 YZMDIOQDURTBNO-JLTOFOAXSA-N 475.510 -1.687 50 20 JAGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792238791 UMWMPJYWHHRWPS-BPUTZDHNSA-N 477.373 -1.180 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796441989 MEQZQCAZGZFTLD-UFVHBUFZSA-N 464.479 -1.226 50 20 JAGD O=C1CN(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C(=O)N1 1815337285 QWUWBDUNNBUGBU-GFCCVEGCSA-N 457.277 -1.400 50 20 JAGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)CC2)CC1 1835931424 RYSFGYQBUNCHAQ-QHCPKHFHSA-N 486.378 -1.784 50 20 JAGD CCOC(=O)/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456108 CLEBKPHPMDKRDO-YEFOHOTDSA-N 461.475 -1.126 50 20 JAGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cncn1 1837460430 FZVAKQQBHFJUDR-XOBRGWDASA-N 458.479 -1.392 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837737444 XFPWEMNHXMHZPF-JXFKEZNVSA-N 457.528 -2.033 50 20 JAGD COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1848150976 TVTKERGHMQLOCG-AGIUHOORSA-N 452.899 -1.111 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779200523 JJKPGFFYZVMXCN-HEFCMCLBSA-N 457.528 -1.062 50 20 JAGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800848227 YUFVWMXPXCPAQT-KYHPRHEASA-N 452.932 -1.128 50 20 JAGD Cn1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cccc1=O 1833870060 JEJMUDZPJFPQRC-JOCHJYFZSA-N 455.276 -1.551 50 20 JAGD CCCC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837673545 GAIIETDHZZGGMQ-AOMKIAJQSA-N 461.324 -1.259 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831337290 PUJWPYURABZAFT-LJQANCHMSA-N 469.520 -1.810 50 20 JAGD O=C(O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934113 LIGZTGSJTNZWKP-IBGZPJMESA-N 452.294 -1.746 50 20 JAGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[C@@H]1SC(=N)NC1=O 1779030282 NHAFXSNULYAJJV-UHBVIIIMSA-N 475.531 -1.069 50 20 JAGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cn1 1795734809 SPJXTQGYYGFVMC-XEMDLRDOSA-N 487.343 -1.177 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738956 MMVKJQWFPZRKEH-WVNFENISSA-N 467.291 -1.296 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nn3)C2)C1 1837456968 RDZVUCINPOEMSE-HXUWFJFHSA-N 457.447 -1.436 50 20 JAGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CS(C)(=O)=O)c(=O)n2Cc1ccccc1 919702833 HQKOHJZJHAWTMS-UHFFFAOYSA-N 492.514 -1.754 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936954 BKSIRJYMSMEQDJ-UTKZUKDTSA-N 463.539 -1.340 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2)c1ccc(B(O)O)cc1 1795735283 VWGSNMQYXXOAST-DNMVWIPKSA-N 455.320 -1.029 50 20 JAGD COC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837460618 HTAFVAUDPRUZNF-HXUWFJFHSA-N 461.475 -1.292 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837610017 GGRQBDYWEJEVTF-AOMKIAJQSA-N 491.549 -1.576 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1837881775 MTTFEXJCKVISJV-SFHVURJKSA-N 475.550 -1.110 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838503541 ZKPQFCXVKPJGML-QFIPXVFZSA-N 487.517 -1.468 50 20 JAGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846256468 GCEURVYJJCLJQT-UHFFFAOYSA-N 464.324 -1.120 50 20 JAGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611002 FITINKGUOSSFLN-OQUILHJVSA-N 461.523 -1.014 50 20 JAGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CNC1=O)CC2 1826082706 BDBHDAVYRYWNLX-SNVBAGLBSA-N 451.509 -1.020 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831325371 YXSKDOKJVUEYMN-MGPUTAFESA-N 483.352 -2.236 50 20 JAGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834564794 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CCOC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1797584898 JIVFLSZGWKSGPV-UFVHBUFZSA-N 464.479 -1.226 50 20 JAGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751723 QLKBZAZQHOYXQB-DACLVMHWSA-N 477.474 -1.617 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371024 OIJTYIYDMCXROE-FXAWDEMLSA-N 450.308 -1.079 50 20 JAGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831456398 JJLIJHAIKWYELR-QRWLVFNGSA-N 468.337 -1.883 50 20 JAGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1834527280 OVUVENBMPBTQQO-NRFANRHFSA-N 471.474 -1.133 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[C@H]1SC(=N)NC1=O 1835937131 QBWHIRMDEBMKRP-CQURBHOASA-N 490.347 -1.761 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1779028679 NKSABHWHRMLRRR-QFIPXVFZSA-N 467.486 -1.046 50 20 JAGD O=C1CN(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C(=O)N1 1815350219 KWWJTWADYWCWRN-GFCCVEGCSA-N 457.277 -1.400 50 20 JAGD O=C(CN1C(=O)CNC1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815596891 GJZNGUMCBUQDFP-HNNXBMFYSA-N 454.252 -1.053 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(S(C)(=O)=O)c1)CCO2 1833401419 OJFGDZDKZDQJOU-NRFANRHFSA-N 497.574 -1.072 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(=O)Nc1cccnc1)CCO2 1837632194 LGJIPQRAWCKNQK-OAQYLSRUSA-N 462.507 -1.151 50 20 JAGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)C[C@@H](C)O1 725870816 BFYOFQMJPOLPSA-OKILXGFUSA-N 472.524 -1.278 50 20 JAGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2n(n1)CCNC2=O 1786259212 KUTQXHZLSZHYHR-QOKNQOGYSA-N 467.291 -1.787 50 20 JAGD CC(=O)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)n[nH]1 1835935445 TWYGFAGRNWOMOD-OAQYLSRUSA-N 456.264 -1.324 50 20 JAGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1=O 1835930505 KOQOUHSGYPNCQU-DEOSSOPVSA-N 493.281 -1.115 50 20 JAGD O=C(/C=N/N1CCCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930623 QFABLCMSQIYLME-YQNSVDCASA-N 458.324 -1.092 50 20 JAGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)n(C)n1 1837457193 XOMDIJPPRUDRST-OAQYLSRUSA-N 473.490 -1.189 50 20 JAGD O=C(CN(CCO)CCO)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920301 YEFZZQUNLXVRAY-UHFFFAOYSA-N 477.367 -1.735 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)nn3)C[C@@H]21 1788609758 GZGRNKZHIQODQW-RCBQFDQVSA-N 471.474 -1.147 50 20 JAGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748473 FDCDMDLGEQSSEP-DLTLXFJOSA-N 492.533 -1.226 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1840183846 DRJJBZHMODSDGR-NRFANRHFSA-N 455.556 -1.462 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)C(=O)O)CCO2)C1 1839704496 RKYUOOOQVOHJIY-BDJLRTHQSA-N 450.286 -1.231 50 20 JAGD Cn1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1840465481 ZWNXZHCLKQWMQV-NRFANRHFSA-N 457.491 -1.269 50 20 JAGD N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787472525 HXUAZBDWPCCVAE-VMXMFDLUSA-N 452.320 -1.075 50 20 JAGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799354974 HVJCJSYZZHRSKR-UKBAYJJMSA-N 491.350 -1.155 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973405 XQANXWDQYLGNRG-UHFFFAOYSA-N 488.553 -1.629 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930636 QYYLHUBWCJGAQL-RXVVDRJESA-N 463.296 -2.413 50 20 JAGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)n4[nH]nnc4n3)CCO2)C1 1836404802 UMBQIVZJCRBMBE-APPDUMDISA-N 484.311 -1.086 50 20 JAGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456832 QKHGZCPCIORAGD-XOBRGWDASA-N 498.562 -1.917 50 20 JAGD 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839669426 APACBUZDPZLAQU-OAQYLSRUSA-N 487.473 -1.670 50 20 JAGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[C@@H]1SC(=N)NC1=O 1796427835 HGQXBFWGWMSCDL-LZPUHMRESA-N 454.553 -1.249 50 20 JAGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825332130 XRAKEGKNBJTWKJ-ZDUSSCGKSA-N 456.569 -1.285 50 20 JAGD COCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835242375 XKMACDILCKKPDD-FQEVSTJZSA-N 451.480 -1.582 50 20 JAGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cncn1 1837460428 FZVAKQQBHFJUDR-VLIAUNLRSA-N 458.479 -1.392 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C1(C(N)=O)CC1)c(=O)n2Cc1ccccc1 729260735 XFRJRMOXKWALAR-UHFFFAOYSA-N 453.459 -1.159 50 20 JAGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(C)(=O)=O)NC(=O)NCc1ccccc1 1795360765 RJIZUHHHMFBPCD-XEMDLRDOSA-N 481.575 -1.033 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797867801 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CCOC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458893 GBQCYXLPXVSZMS-OXJNMPFZSA-N 480.478 -2.180 50 20 JAGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 728450235 UFEDOPUJPYGNGV-NSHDSACASA-N 465.579 -1.037 50 20 JAGD CS(=O)(=O)CCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1318332452 TURLPGHWKDQIND-UHFFFAOYSA-N 450.564 -1.139 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780061130 HCDDJWQDDNWIIN-JOCHJYFZSA-N 463.259 -1.473 50 20 JAGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784443295 VVDNBIYJQSBOBO-OQUILHJVSA-N 482.563 -1.394 50 20 JAGD O=C(Cn1ccccc1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935809 SMPKEZAJIRLYRS-QFIPXVFZSA-N 455.276 -1.702 50 20 JAGD Cn1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837457508 GTTXATZRVYWPSE-NRFANRHFSA-N 457.491 -1.269 50 20 JAGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837608095 UUJGLNQTQFUARW-QMHKHESXSA-N 497.317 -1.955 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1839663558 BYRLOSTVCSXYQH-OAQYLSRUSA-N 471.474 -1.988 50 20 JAGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1ccnn1 1839709171 YJMUYDNHLOIGRL-VBKZILBWSA-N 458.479 -1.392 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1840183847 DRJJBZHMODSDGR-OAQYLSRUSA-N 455.556 -1.462 50 20 JAGD CN(CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)C(=O)O 1807373873 VDBGYLRZJVWDGQ-VQIMIIECSA-N 468.275 -1.376 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3NC(=O)NC3=O)CCO2)C1 1832692254 XCGBWRQJJPSYRI-CWYOGTHVSA-N 489.489 -1.825 50 20 JAGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1840033585 KGMOOHZDRRQLLK-QRTARXTBSA-N 450.330 -1.123 50 20 JAGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)C(=O)N3CCCC3)ncnc1-2 729625300 REVYHJNWEJVLRR-UHFFFAOYSA-N 454.289 -1.136 50 20 JAGD CC(=O)N1CCN(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783934358 FHZXPHSZFZBGMP-OAQYLSRUSA-N 452.556 -1.647 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2 1783940166 UURXYQQEBRZAFP-OYHNWAKOSA-N 498.581 -1.042 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376068 TVLUPDJXBIVIGX-DWLFOUALSA-N 468.319 -1.268 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1835933788 DIWDVSSEQVROGG-KRWDZBQOSA-N 492.187 -1.208 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1837460056 ZYVMQLHVDAHLTO-FPOVZHCZSA-N 478.506 -2.594 50 20 JAGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H](O)N1CCOCC1 1810350145 PUNAIHBMQWGOSB-JXHRLWIKSA-N 468.319 -1.268 50 20 JAGD O=C(CCN1C(=O)C=CC1=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933933 HJFJFNPRSXCTAM-QFIPXVFZSA-N 471.275 -2.249 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1835938193 PRHOKOVTSICVEL-HSZRJFAPSA-N 484.318 -1.011 50 20 JAGD Cn1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1835987101 VJLHEDSCZYDGHJ-JOCHJYFZSA-N 456.308 -1.197 50 20 JAGD CN1N=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CCC1=O 1837455876 GMXCQOVQAAHJBK-NRFANRHFSA-N 473.490 -1.637 50 20 JAGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837731970 PCNHOKJDLSDCSW-UWJYYQICSA-N 478.506 -2.094 50 20 JAGD CN1CCCn2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)cc2C1 1800129362 UUQPWPGAMHPWAS-UPHUGPLXSA-N 467.335 -1.085 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1810295405 SJBRNBIQZRULTA-LIRRHRJNSA-N 480.485 -1.049 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833712094 DKIXKSHAZMSXPI-UHFFFAOYSA-N 486.533 -1.578 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1840183053 ZWXPUZPGUATETC-FQEVSTJZSA-N 452.512 -1.576 50 20 JAGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NCC(N)=O)c(=O)n2Cc1ccccc1 727067193 GHCJVRORSUMQKP-UHFFFAOYSA-N 458.504 -1.592 50 20 JAGD O=C(NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367247 KBLQLKBKXWFSRN-KNQAVFIVSA-N 470.335 -1.632 50 20 JAGD Cn1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1835986741 FMRULTHFLUVIAJ-JOCHJYFZSA-N 456.308 -1.197 50 20 JAGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840184726 CHXSJGHSGOACEL-QFIPXVFZSA-N 488.582 -1.115 50 20 JAGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611625 MUTJNKXJVPYAFN-PYTWLRIVSA-N 467.548 -1.041 50 20 JAGD Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)no1 1796416208 ZROGDENGTCWZDX-YVWYUNDQSA-N 456.264 -1.105 50 20 JAGD O=C1CN(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C(=O)N1 1807360481 BUGMPNZXJZUSST-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835644735 TVQUMSAPEVFTMP-HXUWFJFHSA-N 491.549 -1.065 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1837461259 RKRLJKBQHZGWKZ-OAQYLSRUSA-N 472.458 -2.320 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CNC(=O)C1)CCO2 1839869830 PJUXHJAPSCRKBK-IADYETIUSA-N 460.491 -1.287 50 20 JAGD O=C(COC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)NNC(=O)[C@H]1COc2ccccc2O1 728323854 STCDQDFUAXNCPE-XJKCOSOUSA-N 481.483 -1.447 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833765551 ZNGXTPDBHRLVAL-MRXNPFEDSA-N 465.555 -1.471 50 20 JAGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[C@@H]1SC(=N)NC1=O 1835937136 QBWHIRMDEBMKRP-UYTHQXMGSA-N 490.347 -1.761 50 20 JAGD O=C(CNC(=O)c1ccco1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 725872471 WYBAOLQQHJNHML-UHFFFAOYSA-N 479.519 -1.113 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1788610140 FRUARPJYBZAMPR-WBAXXEDZSA-N 494.574 -1.296 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791544692 FHSIAKOYXPAJLQ-DVWBAYGPSA-N 483.334 -1.570 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807950171 TYVZIAGQTDMNFN-KUHUBIRLSA-N 482.505 -1.100 50 20 JAGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(C)n1 1833443282 CGSAHEPOQIHMFR-OAQYLSRUSA-N 473.490 -1.189 50 20 JAGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn1 1834531565 FLQFFHQKABQFER-FQEVSTJZSA-N 450.496 -1.072 50 20 JAGD NC(=O)[C@@H](N)CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834733349 JPDOHPALDBBYTR-IBGZPJMESA-N 459.356 -1.856 50 20 JAGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840431089 VRWUOQYILBUMOK-HTAPYJJXSA-N 456.308 -1.031 50 20 JAGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)n1 760962969 MXJSISYSCUDMEX-UHFFFAOYSA-N 463.476 -1.478 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)CCO2 1779029989 CUORDWVGSPWZML-HXUWFJFHSA-N 489.514 -1.406 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1779030549 SKFSEWGUPDZVGY-FQEVSTJZSA-N 480.547 -1.446 50 20 JAGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCS(=O)(=O)CC3)CCO2)C1 1832488147 SGZKXPMYACOLLI-PBHICJAKSA-N 482.397 -1.043 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931876 FGXZJIPUCYZUIO-VFNWGFHPSA-N 464.280 -1.002 50 20 JAGD C[C@@H](Cn1cncn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938503 WYXGJQNWIWOGKI-HRAATJIYSA-N 457.296 -1.636 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840187286 QPEFSTZJMFBLFK-LJQANCHMSA-N 487.604 -1.324 50 20 JAGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840261948 HSQJBBYRLYGHQP-NRFANRHFSA-N 457.248 -2.639 50 20 JAGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1779373573 ZYWWHRSJZKCYQD-OPAMFIHVSA-N 495.500 -1.143 50 20 JAGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)CC1 1788245537 CAVYNXBLBYNRBN-JBACZVJFSA-N 472.351 -1.876 50 20 JAGD CS(=O)(=O)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795737342 TWKIPNUVCMZNHU-HGKCTWBKSA-N 473.316 -1.318 50 20 JAGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2 1839532170 WZDGTQUGWJBFSN-JOCHJYFZSA-N 454.292 -1.107 50 20 JAGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(=O)n2[nH]nnc2n1 1796109788 BBIPCVYOXZFCPD-DRXBFXEBSA-N 453.224 -2.991 50 20 JAGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801289460 YJUJWMLKQQDMCP-DOHHPOSVSA-N 463.539 -1.581 50 20 JAGD N=C1NCCN1CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371028 OIJTYIYDMCXROE-PXNSSMCTSA-N 450.308 -1.079 50 20 JAGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)N1CCOCC1)CC2)c1cccc(B(O)O)c1 1815356758 PKRFRHLFEUOMBZ-LIRRHRJNSA-N 460.321 -1.301 50 20 JAGD CCNC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930402 IKIODLJAXNHVKC-BTYIYWSLSA-N 462.312 -1.856 50 20 JAGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1837517690 ZCYXBAFPUKNPPD-TZIWHRDSSA-N 463.296 -2.913 50 20 JAGD CSCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840196751 XSPGCHUMBHILDQ-FXAWDEMLSA-N 452.338 -1.450 50 20 JAGD O=C(CN1C(=O)CNC1=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832327950 YOZGSYSMBIEUSO-FQEVSTJZSA-N 460.252 -3.012 50 20 JAGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729275964 UHJWLKYJEFYTTH-NSHDSACASA-N 464.522 -1.585 50 20 JAGD O=C(CC1(CC(=O)NNC(=O)C(=O)N2CCCC2)CCCC1)NNC(=O)C(=O)N1CCCC1 729842767 MMVSQVQZRMJMIE-UHFFFAOYSA-N 464.523 -1.133 50 20 JAGD O=C(CN1CC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804186674 LHFIWQHLOLGMFG-UZLBHIALSA-N 465.275 -1.367 50 20 JAGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)C1 1830538907 UZIZMFFBRWOVKN-APPDUMDISA-N 484.311 -1.086 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831335643 OAFROGSVLOEPCZ-IBGZPJMESA-N 454.310 -2.129 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940028 TVDRMCJDTMGWLX-GOSISDBHSA-N 473.213 -1.885 50 20 JAGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)C(=O)C(=O)O 1839702935 LQFKAJBRNJBDIA-HXUWFJFHSA-N 463.252 -3.021 50 20 JAGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840183277 WXLBJMLZDVVQTC-JKTFDMFLSA-N 451.524 -1.326 50 20 JAGD O=C(COC(=O)C1=NC=CN2CCS(=O)(=O)N=C12)NNC(=O)[C@H]1COc2ccccc2O1 844198639 MBUJWTNKWOEHLH-CYBMUJFWSA-N 463.428 -1.513 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)Nc1cccnc1 1797887016 SDKLBSBINRSHCY-FVCICTRLSA-N 453.459 -1.078 50 20 JAGD O=C1CN(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C(=O)N1 1807360477 BUGMPNZXJZUSST-OXQOHEQNSA-N 465.275 -1.367 50 20 JAGD N[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1cccnc1 1835935602 MAGORWRBBGJPEV-OFNKIYASSA-N 468.319 -1.079 50 20 JAGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939312 LWJRENUHSXYESF-HSZRJFAPSA-N 479.302 -1.278 50 20 JAGD O=C1CN(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C(=O)N1 1807369751 UOPCZHGOCQRXSB-OXJNMPFZSA-N 465.275 -1.367 50 20 JAGD O=C(CN(CCO)CCO)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060627 VMCFWYXCDBZORB-NRFANRHFSA-N 461.368 -1.114 50 20 JAGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931954 IWHOKRDNTJCJOP-RUZDIDTESA-N 494.357 -1.167 50 20 JAGD O=C(CNC(=O)C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840203085 QKPGVBYXJFFBAG-GOSISDBHSA-N 473.213 -1.885 50 20 JAGD Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)s1 1835928271 HWQKRJPIWBJDDC-FQEVSTJZSA-N 460.321 -1.161 50 20 JAGD CN1N=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)CCC1=O 1837455889 GMXCQOVQAAHJBK-OAQYLSRUSA-N 473.490 -1.637 50 20 JAGD CCS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456893 RUXFRRQTROZGTG-LJQANCHMSA-N 469.520 -1.810 50 20 JAGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839682839 IKXUJGGMBXJRGK-QVKFZJNVSA-N 464.280 -1.002 50 20 JAGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)C2=O)cc1 919883836 FXTXUAMLXKDWSH-XIKOKIGWSA-N 453.477 -1.020 50 20 JAGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611007 FNWQCLAFUNKGRB-HEWDHTHVSA-N 464.479 -1.657 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCS1(=O)=O 1800393455 BBPODGISRVIDBK-VZAMPYOESA-N 451.505 -1.535 50 20 JAGD O=C(Cc1cn2c(nc1=O)SCC2)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780936623 WNJXYEMULCGHKS-JOCHJYFZSA-N 484.343 -1.285 50 20 JAGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793835975 AJHCITDUPLTOPB-HGKCTWBKSA-N 465.337 -2.700 50 20 JAGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735849 GKNSHTNQAMEVAC-UKBAYJJMSA-N 491.350 -1.155 50 20 JAGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(=O)C(=O)O 1817474233 AXXFCTVLSHSHGL-OAHLLOKOSA-N 457.252 -1.062 50 20 JAGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1)CCO2 1835119107 RZTAJPAUXPHHPI-PXSCKZLRSA-N 460.491 -1.145 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1837455970 AHVLEMILDLHLGG-FQEVSTJZSA-N 488.461 -1.440 50 20 JAGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1837460832 LFJJNIJCDWCGOA-QFIPXVFZSA-N 474.518 -1.232 50 20 JAGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1840183819 BQCGMLVCVFLIKR-HXUWFJFHSA-N 489.595 -1.759 50 20 JAGD