smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCOc1ccc(NC(=O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 63616577 TYGQEJPWCPAWTG-UHFFFAOYSA-N 412.490 2.360 10 20 HECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 728209022 CZAZPSTXPIZIBA-CVEARBPZSA-N 421.501 2.395 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3CCN(C(C)C)C3)cc2F)CC1 730123863 WWZULKSTAJXMHX-LJQANCHMSA-N 405.562 2.497 10 20 HECD COC(=O)[C@H]1CC12CCN(Cc1cc(C(C)=O)cc(CN3CCOCC3)c1O)CC2 733791048 HXUQTCAQMGDXFP-HXUWFJFHSA-N 416.518 2.202 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCOC(C)(C)C3)CC2)cc1 735377688 LLBRCOKXEKTUDP-UHFFFAOYSA-N 404.555 2.418 10 20 HECD Cc1nc(C)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 743654379 GTNHGAWFLAVPIQ-MRXNPFEDSA-N 401.536 2.461 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N(CCO)CCOCC(F)(F)F 745593333 QQZQHRWTKVBOTH-UHFFFAOYSA-N 421.485 2.323 10 20 HECD CC[C@@H]1CO[C@@H](C)CN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 747297095 GECGTDMUKXQEAT-DOTOQJQBSA-N 419.547 2.424 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H]3C(=O)OC(C)(C)C)CC2)cc1 748832037 CUFUNGIGSKQBDG-LJQANCHMSA-N 403.523 2.150 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(F)ccc([N+](=O)[O-])c3F)nc12 752557618 CQMMVVAZUDKLBA-UHFFFAOYSA-N 422.300 2.155 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3nc(Cc4ccccc4)no3)nc12 755103299 SVTBARFABXHXEM-ZDUSSCGKSA-N 422.445 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(C(=O)C4CCCC4)C3)CC2)cc1F 762089526 OTUGYACBMHPCBD-QGZVFWFLSA-N 418.513 2.457 10 20 HECD O=C(NCc1ccnc(N2CCOCC2)c1)NCc1cccc(Br)c1O 764759586 ALNXNBWEARJSEE-UHFFFAOYSA-N 421.295 2.386 10 20 HECD CS(=O)(=O)N1CCC(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 766236427 DGQBEJUSCFEXGA-OAHLLOKOSA-N 403.495 2.270 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)NCCCN(C(C)C)S(C)(=O)=O 766270750 SIQWWNCPMRAULZ-UHFFFAOYSA-N 411.568 2.014 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C)CC3(C)C)cc2F)C[C@@H](C)O1 766999840 XWSSAELPYLUMMC-IAGOWNOFSA-N 406.546 2.082 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COc3ccc(OC)c(C)c3)CC2)cc1 768029464 NXOXASFFBBJNGD-UHFFFAOYSA-N 413.518 2.329 10 20 HECD Cc1cccc(O[C@@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c1 768444410 AXDCAWAAUDNZGX-KKSFZXQISA-N 412.486 2.238 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 768901047 UBQRAPDTYKSCKV-UHFFFAOYSA-N 422.478 2.384 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)Cc2ccc(N3CCOCC3)cc2)cc1 769499815 RAMWFAYGDDMTGL-UHFFFAOYSA-N 403.548 2.242 10 20 HECD CCN(CC)C(=O)c1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769719454 JKOCUZRMUKUWQT-UHFFFAOYSA-N 405.476 2.498 10 20 HECD COC1(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 772453678 NUYRAZLFACCCDV-UHFFFAOYSA-N 408.470 2.171 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1O 774262604 SEXZNOFKPZRSKU-NDEPHWFRSA-N 416.377 2.283 10 20 HECD CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 776118932 WVDOOYWZTRIOTM-PMACEKPBSA-N 421.513 2.124 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COC(C)(C)C)cc2F)C[C@@H](C)O1 778153967 WQBARTSYMLMOFL-HUUCEWRRSA-N 410.486 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3(O)CCCCCC3)CC2)cc1 778285545 MASUGFFLOJRBMN-ZHACJKMWSA-N 415.534 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3cccc(C)n3)CC2)cc1 778288706 WYXJCPQRBXJCLS-QXMHVHEDSA-N 408.502 2.262 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3cccc(C)c3)CC2)cc1 778389602 MMZQIEBCDJPHDS-GMAFFVFYSA-N 423.513 2.058 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(-c2ncn(C)n2)cc1 780272523 VCEUOEYPVQVSIL-UHFFFAOYSA-N 407.474 2.364 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)c2)CC1 780407914 QTONLTSFCSRZIN-UHFFFAOYSA-N 418.475 2.373 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@H](O)COc3ccccc3[N+](=O)[O-])cc2)CC1 783915400 HTXZLJBANDJMSA-SFHVURJKSA-N 415.446 2.082 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C(=O)c2ccco2)CC1 786123121 XZSKXAKAWQOZFW-UHFFFAOYSA-N 413.474 2.145 10 20 HECD NC(=O)[C@H]1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 786789321 QURDMNFWSXKFPA-UONOGXRCSA-N 413.440 2.450 10 20 HECD C[C@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 787332248 ZNXBLWCYQJIMTB-WMLDXEAASA-N 415.465 2.311 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCC3(CC2)OCCO3)C2CC2)cc1 787435242 XJBACTSHGFQGJJ-UHFFFAOYSA-N 401.507 2.046 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OC)c3ccccc23)ccc1O 790408452 ZWCHJSHJKLVNBY-UHFFFAOYSA-N 422.484 2.263 10 20 HECD COc1ccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)c(O)c1 794376510 ISGBVMQVNGDTBT-UHFFFAOYSA-N 424.544 2.496 10 20 HECD O=C(CN1CCOC[C@@H](C2CCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 795281571 OGVKYEOFMYFLJJ-IBGZPJMESA-N 405.514 2.027 10 20 HECD CCCc1nc(C)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 796553003 KTOAQWCKPPZFGM-UHFFFAOYSA-N 419.453 2.384 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 801625752 LILZZJQWOSXUMM-OAHLLOKOSA-N 418.454 2.380 10 20 HECD CCc1oc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C(=O)OC 802643148 DVNQKYSCMBAEQC-UHFFFAOYSA-N 406.504 2.153 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)cc2)CC1 803162096 MKHRVMOAURLKLC-INIZCTEOSA-N 418.538 2.132 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCN(C(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 803311524 WMJGSENFAZLNNL-SFHVURJKSA-N 416.566 2.033 10 20 HECD Cc1nc([C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)n[nH]1 805022895 HQDSMRQOLZUQCY-LJQANCHMSA-N 424.549 2.372 10 20 HECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 806639913 XJHNYROYLSMBDR-GFCCVEGCSA-N 408.476 2.404 10 20 HECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@@H]1C 808851722 IXMGQTWQVJUYJV-MOPGFXCFSA-N 412.578 2.339 10 20 HECD COC(=O)[C@H](C)NC(=O)c1ccc(NCc2cc(OC)ccc2O)c([N+](=O)[O-])c1 811805579 XDOGSENJFAAKNB-NSHDSACASA-N 403.391 2.212 10 20 HECD COCCn1c(-c2nn(C)c(=O)c3ccccc23)nnc1N(C)Cc1ccccc1O 812135590 LPCPEFNQJZBWAX-UHFFFAOYSA-N 420.473 2.180 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)C/C=C/c3ccccc3)CC2)cc1 912934906 XYLAGJLGYWZZKI-VMPITWQZSA-N 414.527 2.472 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)cc1 918229199 YQFNIAJXCJRGEK-UHFFFAOYSA-N 415.582 2.228 10 20 HECD COCCN1C(=O)/C(=C\Nc2cc(-c3cc(C)c(C)cc3C)[nH]n2)C(=O)NC1=S 920978754 PCVYFNDAHAHIAH-GDNBJRDFSA-N 413.503 2.187 10 20 HECD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCC3)c2)cc1 1335672920 FKXKGHSVCFCGMP-OAHLLOKOSA-N 403.504 2.198 10 20 HECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(C)c1 1799781264 YODIWGKHXCGHQD-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1C[C@@]1(F)Cl 1804291674 TVTKIMADEGMJEI-VNEBTJPNSA-N 424.856 2.379 10 20 HECD O=C(NC[C@H]1CCN(C(=O)/C=C/C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993735 MZUBUXGAETXXDG-OFGRBQKGSA-N 408.458 2.174 10 20 HECD CC(=O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811799795 YYZQLRMVMAZTBL-DYVFJYSZSA-N 417.849 2.055 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1cc(O)nc(O)c1 1817848591 ROIRQMJBQMFPCN-KGLIPLIRSA-N 417.491 2.417 10 20 HECD CC(=O)N1c2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc2C[C@H]1C 23398285 SMIRYVJQTFJSIB-GFCCVEGCSA-N 423.516 2.156 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc(F)c3F)cc2)C1 725825391 LCCCZRFBMCOSMB-CQSZACIVSA-N 409.458 2.145 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)C3CCCCC3)CC2)cc1 727844256 YCHSJUOFMWFRCZ-OAQYLSRUSA-N 404.555 2.058 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1 729627735 QZGRNOYGSUWQDH-FPOVZHCZSA-N 400.567 2.482 10 20 HECD O=S(=O)(Cc1ccon1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 742279053 FLVOPJSPJPQGSJ-UHFFFAOYSA-N 405.398 2.150 10 20 HECD COCCN(C)CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594332 UBWJVNJSCFNYHK-OAHLLOKOSA-N 400.470 2.134 10 20 HECD Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 748980393 MXGUTELVEJVLRX-UHFFFAOYSA-N 410.518 2.148 10 20 HECD Cc1nccn1C[C@H](C)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749196930 VKTTYXPWBBHNII-VQIMIIECSA-N 412.538 2.029 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CCN(S(C)(=O)=O)C3)cc2)CC1 753070142 DNNYLJHFHDUFKT-SFHVURJKSA-N 408.568 2.004 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(CC(F)F)c1cccc(Cl)c1 753670940 NKANFXSMNCHZOI-UHFFFAOYSA-N 401.822 2.436 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)c(O)c(C(C)(C)C)c1 754736117 GXHMSUBZFMOKAM-UHFFFAOYSA-N 423.535 2.334 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1 757651191 YWYQXDXVJMUVMB-UHFFFAOYSA-N 416.452 2.175 10 20 HECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)cn1 758148944 PJBCCKFDFDEQTC-UHFFFAOYSA-N 415.493 2.051 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cn(C)c(Cl)n3)n2)c[nH]1 764528615 WFTMYOQTWIJCEL-UHFFFAOYSA-N 401.857 2.113 10 20 HECD Cc1cc(C(=O)CN2CCO[C@@H](C)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766967943 BDOKVYCEMNQFNG-ZBFHGGJFSA-N 405.520 2.033 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCCc3ccc(O)c(O)c3)cc(C(C)C)nc21 768899309 HQBXWLGRNOXGAA-UHFFFAOYSA-N 412.446 2.024 10 20 HECD Cc1nnc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)o1 774165432 MLTDGHJUKKFPQL-UHFFFAOYSA-N 421.457 2.137 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3ccco3)N3CCCC3)ccc21 774872630 UWFUKEWHJFYLTA-HXUWFJFHSA-N 410.518 2.232 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4cn[nH]c4)CC3)cc2)C1 775422905 QONWOSQJOIMHCR-SFHVURJKSA-N 410.522 2.201 10 20 HECD O=C(COC(=O)[C@@H](F)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 778199529 FIPUMFXHQZCXKJ-IBGZPJMESA-N 418.440 2.403 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3CCSCC3)CC2)cc1 778276829 WXCOOLPLSKHBHY-SREVYHEPSA-N 403.548 2.159 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCOc3ccccc3F)CC2)cc1 779219210 RRGAUMHVPPJJRR-HXUWFJFHSA-N 417.525 2.328 10 20 HECD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)OCC(=O)c3ccc(O)c(O)c3)C2=O)c1 783565590 OCHBKMPJNHECPW-HNNXBMFYSA-N 412.398 2.037 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N(C)Cc2ccc(OC)c(F)c2)cc1 784555183 MICXDSDDWRXDPB-UHFFFAOYSA-N 404.438 2.481 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C(=O)C2CC2)CC1 786648771 LSFBDFRPQGMLBM-UHFFFAOYSA-N 414.550 2.007 10 20 HECD CNc1c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cccc1[N+](=O)[O-] 787322279 OAZNACMXJSDQPB-UHFFFAOYSA-N 411.462 2.235 10 20 HECD CCS[C@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321065 SJTRTDMFBCWBIN-MOPGFXCFSA-N 405.564 2.272 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)COc3ccccc3)CC2)cc1 793683218 BJRWYICHOQUHBQ-QGZVFWFLSA-N 411.502 2.364 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)CNC(=O)OC(C)(C)C)cc2)CC1 803162097 MKHRVMOAURLKLC-MRXNPFEDSA-N 418.538 2.132 10 20 HECD C[C@H](NC(=O)C(=O)N1CCc2cccc(F)c2C1)c1ccc(N2CCOCC2)cc1 803305586 NCLXHQFUJQCTIA-INIZCTEOSA-N 411.477 2.424 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1F 804854181 ZAYUQIRQXYNVQV-IAGOWNOFSA-N 420.529 2.051 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(C)o3)cc2F)CC1 805007755 PDUDXQSHCIEQSZ-UHFFFAOYSA-N 416.497 2.144 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(C4OCCO4)CC3)cc2)CC1 805025711 WSQMOWVZGRXFEH-UHFFFAOYSA-N 415.534 2.151 10 20 HECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807672773 HUJXOTNZIKZNEX-KRWDZBQOSA-N 418.538 2.257 10 20 HECD CCOC(=O)c1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)nc1C 915038770 QKQOCCJBZWENLV-UHFFFAOYSA-N 413.474 2.448 10 20 HECD NC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCCC3)cc2)=NN1c1ccc(F)cc1 915081039 DJKBQXGTKNSABF-HXUWFJFHSA-N 409.465 2.162 10 20 HECD COc1ccc(N2CCCN([C@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 917208644 JBNUWZIFTJEHRL-HXUWFJFHSA-N 423.561 2.340 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CC(=O)N(C2CCCCC2)C1 917709304 SXXYVNRQWGORIH-QGZVFWFLSA-N 403.498 2.460 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4cccc(F)c4)=NO3)cc2)C1 917835098 ZMINOVKQPREGSX-DYESRHJHSA-N 424.476 2.337 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](CO)Cc1ccccc1 918208759 RBAUBSDELZXJOX-LJQANCHMSA-N 415.509 2.437 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(CC(F)(F)F)CC1 918223004 CIGDIRHAJNHSAO-UHFFFAOYSA-N 404.408 2.052 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H]3CCN(C)C[C@H]3c3cnn(C)c3)CC2)cc1 1355457616 OSFDBNBCEPPDHZ-YADHBBJMSA-N 411.550 2.203 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC=CO1)C1=NN(c2ccccc2)C(=O)C1 1798406490 NSLPSPFXPHXEFN-MJKGWSOKSA-N 422.485 2.110 10 20 HECD Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992147 VMGLDXYTATZSAZ-QRWLVFNGSA-N 421.457 2.158 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCCC4=O)cc3)ccc21 60763652 CJTZDBVHXXPDCB-UHFFFAOYSA-N 406.486 2.451 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)n(-c2ncccn2)n1 472785995 INHSHSWXTHJQAL-UHFFFAOYSA-N 403.446 2.026 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 727490444 QRWIDJJWQSFNRY-QGZVFWFLSA-N 412.414 2.256 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1 729535501 SDLGCJAQDYSBBW-GMBSWORKSA-N 414.458 2.350 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc([S@@](C)=O)c3)CC2)cc1 735573900 JQWAHZJZDLGJAH-GDLZYMKVSA-N 416.547 2.376 10 20 HECD COc1cccc(CNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1O 745715086 HEOXUVVOJTXYPK-UHFFFAOYSA-N 422.279 2.393 10 20 HECD C[C@H](NC(=O)N1CCO[C@H](C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 746755544 FMYUADKEHMVXAI-LPHOPBHVSA-N 419.522 2.336 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C)nc3N(C)C)CC2)cc1 750220881 IKMVOKXHWAVULX-UHFFFAOYSA-N 411.506 2.142 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)CC2)cc1F 753744324 JPIXTDLAIRAIJY-UHFFFAOYSA-N 421.494 2.061 10 20 HECD CCCn1c(=O)n(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 758198537 SQTIGJYPPNPCNX-FQEVSTJZSA-N 424.545 2.405 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 766457755 QHMPZTQSUVWBEF-UHFFFAOYSA-N 401.463 2.342 10 20 HECD CO[C@@H](C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C(C)C 770637161 XWXDGQMYOHQOCZ-LJQANCHMSA-N 422.503 2.138 10 20 HECD COC(=O)c1ccc(C)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772901953 QIIRXHJSIKJWRO-UHFFFAOYSA-N 415.465 2.486 10 20 HECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)nn1 773187691 UTTBRAIEFIPSIV-UHFFFAOYSA-N 419.489 2.134 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CO)C3)cc2Cl)C1 774241108 CXVGQIMSYNLZCJ-NVXWUHKLSA-N 407.942 2.423 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)NC3CCCCCC3)CC2)cc(OC)c1OC 774646394 FGLCUIOYPAMUPR-UHFFFAOYSA-N 419.522 2.200 10 20 HECD O=C(NCCc1ccc(F)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 774711230 HHVFXZIXBXGKBW-LJQANCHMSA-N 400.450 2.398 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCC[C@@H]3OC)CC2)cc1 774789571 TWRBJXLNYYKUDY-RXVVDRJESA-N 404.555 2.322 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1O 774903374 MSHLRQWJONMJTI-UHFFFAOYSA-N 416.390 2.175 10 20 HECD NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779493259 LUAOCFNZICSAEV-JAMSOPIASA-N 415.877 2.135 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(OC(F)F)cc2)cc1F 785411544 LXSGINJIINSXRQ-UHFFFAOYSA-N 409.408 2.468 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnc(-c4ncccn4)s3)cc2)CC1 786255223 LWSHVKDQPZFVDE-UHFFFAOYSA-N 422.514 2.199 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](NC(=O)OC(C)(C)C)C3)nc12 787351047 CUXSYPRSDURYHN-CYBMUJFWSA-N 419.482 2.101 10 20 HECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(CC)CC 788313047 OPSABPPGCOYFRM-PMACEKPBSA-N 417.550 2.239 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@H](Cc2ccncc2)C1 789867048 CSROWSMTSXSQMQ-HXUWFJFHSA-N 424.570 2.342 10 20 HECD CC(C)(C)[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 790666431 PXPYGMMFCKTNSD-PKOBYXMFSA-N 402.539 2.345 10 20 HECD O=C(c1cccc(O)c1O)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 790918480 KWYHOWDLHKHIPZ-OAHLLOKOSA-N 402.472 2.095 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc(N(C)C)cc1 793812407 LSTUHPJJRQJVOL-QGZVFWFLSA-N 405.502 2.491 10 20 HECD CN1CCN(S(=O)(=O)c2cccc(NCc3ccc(N(C)C)c(F)c3)c2)CC1 796430467 KHNBZIWFMILCAP-UHFFFAOYSA-N 406.527 2.440 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccnc(NC(=O)C2CC2)c1 796813470 HREWZNIHBBFDAF-UHFFFAOYSA-N 412.465 2.460 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(C)=O)ccc2Cl)cc1 797431465 POWWORZUWYTNCB-UHFFFAOYSA-N 417.896 2.220 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1F 803661555 GCUPWBAKBKITHG-UHFFFAOYSA-N 422.844 2.428 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CC(N)=O)C2)cc1)C1CCCCC1 803677159 HEVCUMQZSITTIK-SFHVURJKSA-N 414.550 2.186 10 20 HECD CS(=O)(=O)N1CCC(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 805034383 WOBZROWBBMGDJE-UHFFFAOYSA-N 410.323 2.170 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C(=O)N(C)C)cc1 813861719 XLYMTGVDVCGDPU-QGZVFWFLSA-N 415.559 2.474 10 20 HECD O=C(CCCS(=O)(=O)N1CCCC1)NCc1ccc(N2CCSCC2)cc1 918088162 ISEKKMJNYIRYDK-UHFFFAOYSA-N 411.593 2.062 10 20 HECD COc1ccc2c(=O)c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c[nH]c2c1 918138063 GSPMCJXZXLUWMJ-UHFFFAOYSA-N 411.433 2.442 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(OC)c1C 919839196 GSTOQYBHCKYMAB-UHFFFAOYSA-N 404.488 2.499 10 20 HECD Cn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1795152322 PQFZLZIDWJVHLN-CLLJXQQHSA-N 404.854 2.050 10 20 HECD CCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1806328388 AYFTVAKLHNJVRS-HTAPYJJXSA-N 419.485 2.290 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807999174 RQJJDBIUAGUYCR-OYVQIMPPSA-N 408.458 2.340 10 20 HECD Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845773 VVROGAFHRAGSSO-OAHLLOKOSA-N 410.434 2.472 10 20 HECD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250699 FADOUUQWNZUOEN-AWEZNQCLSA-N 413.449 2.328 10 20 HECD Cc1cc(CN2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)no1 65698202 XUSVPNXFBSYGNC-GOSISDBHSA-N 413.522 2.408 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCN(CC(F)(F)F)C1 142357864 DREVNENEISXYAJ-CQSZACIVSA-N 418.435 2.223 10 20 HECD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729052548 MMNJQYYYAUFTNA-CHWSQXEVSA-N 407.492 2.430 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2ccc3ccccc3c2)c1 731830638 XTSKWUIXSPSQHT-IBGZPJMESA-N 400.456 2.380 10 20 HECD COC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CCO1 741794323 JFAHNHQCWQANCK-IBGZPJMESA-N 400.475 2.411 10 20 HECD CN1CC[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751701 VVNVDLUILOXVHO-WMZOPIPTSA-N 418.538 2.303 10 20 HECD COCC(=O)N1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 743346778 USDMTEWIEVXUPM-UHFFFAOYSA-N 402.539 2.456 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H](NC(=O)C2CC2)[C@@H](C)O)c(C)n1-c1cccc(F)c1 745748659 TXDKINWBSRBSRI-JLTOFOAXSA-N 416.449 2.235 10 20 HECD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 747847611 WBXLUOCHTDWXJE-UHFFFAOYSA-N 422.388 2.143 10 20 HECD CN(C(=O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 748665189 RUXGBIYCTZKYCB-UHFFFAOYSA-N 406.502 2.253 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1 751236698 YICXXBQNZQBOQT-UHFFFAOYSA-N 412.533 2.243 10 20 HECD Cn1ccc(N2CCC[C@H](OC(=O)c3csc(Cc4ccc(N)cc4)n3)C2=O)n1 751936575 KGHIVIKZXAUAFO-INIZCTEOSA-N 411.487 2.402 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 752467774 QTROBBBAPPEBPW-UHFFFAOYSA-N 417.531 2.282 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)CC2)cc1F 753737157 AMQJTZOMIUKBFU-UHFFFAOYSA-N 417.393 2.476 10 20 HECD C[C@@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(Br)c(F)cc1O 756562750 JRAXCGPXZJLGBB-LLVKDONJSA-N 402.308 2.497 10 20 HECD O=C(/C=C\c1ccc(Cl)nc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 758536781 NYPFDSZZIRJDFN-YWEYNIOJSA-N 405.907 2.299 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)NCc2cccc(Br)c2O)c1C 765731188 ZFBJTDHVJRTZAC-UHFFFAOYSA-N 413.293 2.349 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC3C[C@H](C)O[C@@H](C)C3)CC2)cc1 767316919 FSCUMHMHAPCZFU-ROUUACIJSA-N 404.555 2.463 10 20 HECD CS/C=C/C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 767652393 LBKVBSRYFGRBHZ-CMDGGOBGSA-N 408.501 2.344 10 20 HECD CCOc1ccc(CN2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)c(O)c1 768155173 CCBIAXOMIYRDAI-UHFFFAOYSA-N 406.504 2.306 10 20 HECD C[C@]1(c2cccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2)NC(=O)NC1=O 769038114 BARXEHRNQJXKFL-FDDCHVKYSA-N 423.469 2.268 10 20 HECD O=C1COc2ncc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2N1 770762052 YZFIWLZKQKFMIS-ZDUSSCGKSA-N 418.400 2.413 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)COc3ccc(C)cc3)CC2)c1O 774871198 WINDWNLZKAZARX-UHFFFAOYSA-N 415.446 2.341 10 20 HECD COc1ncc(/C=C/C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)cn1 776307303 VZXDWTDSHZDODX-YXBWYFRISA-N 408.458 2.305 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 785304846 SASPFKXGJKHRAL-SNVBAGLBSA-N 406.822 2.224 10 20 HECD CC[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 785427675 GFLOJYHTDKPAPW-NRFANRHFSA-N 408.546 2.322 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCC=CO3)cc2F)C[C@@H](C)O1 787054000 RNILPXRZQNENKW-CLCXKQKWSA-N 406.454 2.291 10 20 HECD COCc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 787518513 JPKPRIZICOGGJU-KRWDZBQOSA-N 411.502 2.163 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCSC2(CCCCC2)C1 788320317 OWZHNSCNGJSBNA-UHFFFAOYSA-N 417.575 2.418 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789846794 QNASIFPCRBFXHU-CQSZACIVSA-N 416.547 2.381 10 20 HECD CS(=O)(=O)Nc1cc(C(=O)NCCc2ccc(O)c(O)c2)cc(C(F)(F)F)c1 792237709 HPJDWAQJGVQSJG-UHFFFAOYSA-N 418.393 2.461 10 20 HECD CS(=O)(=O)C1(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 793061467 KIBVXCDTOCRGPH-CYBMUJFWSA-N 417.478 2.133 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 802281166 RSFFKJUBRBJGRJ-YLJYHZDGSA-N 410.536 2.440 10 20 HECD CCn1ccc(=O)n(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)c1=O 913545383 CZOSTAXRCDEESR-UHFFFAOYSA-N 409.442 2.107 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1nc(-c2ccccc2)ccc1=O 916745214 DJABIGQESXWZKC-UHFFFAOYSA-N 418.497 2.406 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1 918111845 VCJDTHASHGTPPL-UHFFFAOYSA-N 417.531 2.330 10 20 HECD COC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 1325497599 HJNHFFHKLMWJPP-IYBDPMFKSA-N 422.501 2.423 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3cc[nH]c3cc2F)C1 1844720945 DKVDFEOQCIVRLL-UHFFFAOYSA-N 410.405 2.244 10 20 HECD C[C@H](OC(=O)c1cnn(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 12851324 KSLXUBLXQVYPBU-LBPRGKRZSA-N 403.394 2.380 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cn1c(=O)[nH]c(=O)c2ccccc21 28941132 KGSRCZHIGOANRS-UHFFFAOYSA-N 406.486 2.339 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCN(CC(F)(F)F)C1 64252941 LEWDACPONLOWLB-QGZVFWFLSA-N 414.472 2.331 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccccc3-n3cnnn3)cc2F)C[C@@H](C)O1 108287594 MHDBPTZWQGNXCZ-HUUCEWRRSA-N 410.453 2.345 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1N1CCCC1 147118636 VFLXMVCHJHQAMG-UHFFFAOYSA-N 408.502 2.378 10 20 HECD COc1cccc(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1OC 551149390 GIUYJDXHZBBQLQ-UHFFFAOYSA-N 409.486 2.479 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)n(C)c2ccccc12 552516826 GGESGONCYGVJEK-LJQANCHMSA-N 418.497 2.020 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)Cc2ccc([S@@](C)=O)cc2)n(C)c2ccccc12 564604185 PGPAGFXGJQRFRH-GDLZYMKVSA-N 411.527 2.499 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 726563122 VHYDWBIFRVQGNM-YSGRDPCXSA-N 413.518 2.344 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 740232994 RBWRCHZFLRHIRC-INIZCTEOSA-N 424.862 2.379 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1 748827996 XGXQUHUGVPRLET-UHFFFAOYSA-N 410.584 2.346 10 20 HECD COC(=O)c1ccsc1N1CC[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 759589926 VGCSNWOIMHVNSY-SJDLMVEWSA-N 403.412 2.308 10 20 HECD Cc1cc(C(=O)N2CCC[C@H]2C(=O)NCCc2ccc(O)c(O)c2)ccc1[N+](=O)[O-] 762268388 DRUROJRYLJNRGZ-KRWDZBQOSA-N 413.430 2.278 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C1 763281686 WOXWOQTZFWBOPT-RDTXWAMCSA-N 411.458 2.343 10 20 HECD C[C@H](NC(=O)NCCCN1CCCO[C@H](C)C1)c1ccc(N2CCOCC2)cc1 764279388 QHFGGVJZFCMERZ-MOPGFXCFSA-N 404.555 2.384 10 20 HECD COC(=O)C1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCCC1 767507410 QXFXESQSEKDSOE-UHFFFAOYSA-N 406.438 2.476 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)COC)C(C)C 769289983 GXZYWQJHOZDUGE-INIZCTEOSA-N 401.301 2.290 10 20 HECD C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 769692209 ZBOHFMHFNBKZDQ-CQSZACIVSA-N 413.440 2.417 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(C)(C)S(=O)(=O)CC3)CC2)cc1 774833242 MVIAVVRBHQGOPB-UHFFFAOYSA-N 409.552 2.273 10 20 HECD CCCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CCS(=O)(=O)C1 776039940 YVXAOUOCDLPQNQ-QFBILLFUSA-N 409.552 2.193 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)c3cc(O)cs3)C2)C(=O)C1 777208729 RZDGFFIVKNQFQB-ZDUSSCGKSA-N 409.508 2.138 10 20 HECD CCN1C(=O)C(=CNNc2nc3ccc(OC)cc3cc2C)C(=O)N(CC)C1=S 777870015 AQHOSXBDEGNZJE-UHFFFAOYSA-N 413.503 2.348 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@H](C)CCSC)CC2)cc1 778286293 WPZBKATXXQGQBE-OAGJVSPASA-N 405.564 2.500 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn([C@H](C)C4CC4)c3)CC2)cc1F 778652510 MRYLMQSEHZHTNA-CQSZACIVSA-N 415.469 2.289 10 20 HECD COC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 781732269 WDGCZFNOEASPJU-HUUCEWRRSA-N 408.470 2.168 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)CC2)cc1 782799835 NZOSSKJENWBDHT-UHFFFAOYSA-N 420.473 2.204 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 788270593 MGAFBWLCHSFLAK-RDJZCZTQSA-N 418.538 2.446 10 20 HECD CCO[C@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 788744680 YENQWHIOHGMFRU-GHTZIAJQSA-N 409.502 2.028 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(-n3cncn3)c2)cc1 788953255 ACSLHKWIBGGTQH-UHFFFAOYSA-N 406.490 2.046 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCc2c(O)cccc21 789862536 VIMQYBJZLTZHRF-IBGZPJMESA-N 411.527 2.365 10 20 HECD C[C@@H]1OCC[C@]12CN(CC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CCO2 791591996 YCNFXRNCNGPJOY-OWJWWREXSA-N 420.465 2.280 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc(-n2cccn2)c1 792342758 LHHAAQQBXUPTKT-CYBMUJFWSA-N 410.430 2.411 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c1 793414838 GYGIWGKSXHAQRD-UHFFFAOYSA-N 423.443 2.303 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(Cc2ccsc2)CC1 807095309 NUEFVNUXDYUAGG-UHFFFAOYSA-N 400.548 2.083 10 20 HECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 809235066 SOWKCSRMZCIWOY-QHBODZGPSA-N 419.591 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(COCc4cccnc4)n3)CC2)cc1 809464822 MKLDEPNZEYEDSC-UHFFFAOYSA-N 423.473 2.081 10 20 HECD CC[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)cc1O 810216107 QKBVRDCPZFYYJF-OAHLLOKOSA-N 409.474 2.029 10 20 HECD COC[C@H](C)[C@@H](C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 812479464 CJJUHEVHZDQCFZ-DLBZAZTESA-N 415.513 2.477 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](n4cccn4)C3)cc2F)C[C@@H](C)O1 812874737 FOVSVTKQUUWEQD-ZIFCJYIRSA-N 415.513 2.199 10 20 HECD O=Cc1c[nH]c(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 815094653 FQBGAYUQBBQRJA-UHFFFAOYSA-N 408.437 2.013 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2-n2ccnn2)C2CC2)cc1 918457005 QUASFZYLUVIFEJ-UHFFFAOYSA-N 404.474 2.463 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nc(SC)ncc3Cl)nc12 918929416 NXDNQWGASYDLPG-UHFFFAOYSA-N 423.838 2.134 10 20 HECD O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969146 XGWUQCBTWBUKPT-UHFFFAOYSA-N 422.485 2.028 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 1253478886 NIOKIYGWNRATLE-UHFFFAOYSA-N 404.488 2.429 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COc2ccc(F)cc2C1 1320397828 FAHONOGTTSLIBK-HOCLYGCPSA-N 403.406 2.079 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccoc2C1)c1cc(O)nc(O)c1 1793285783 CYNIFIXIOPAUTJ-MXASKKJJSA-N 411.458 2.143 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799169390 OCKGJBOJKBFFQP-IMCXFHMJSA-N 408.882 2.001 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1 1815285874 YECXAFPHVDDRAN-JYMLRBTQSA-N 415.425 2.414 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824546146 KNDKUDCUIDPLAV-VHFSOBRXSA-N 419.522 2.133 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2ccco2)C1 1842071554 XEOXTQYWESEKST-VMPITWQZSA-N 412.442 2.246 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)O[C@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1 7176668 AJJKYXPTXNNIRG-VQIMIIECSA-N 418.515 2.285 10 20 HECD O=S(=O)(Nc1ccc(F)c(-n2nnnc2C2CC2)c1)c1cccc2nsnc12 525155711 YGJDAECMOKYLQO-UHFFFAOYSA-N 417.451 2.484 10 20 HECD O=C(NC[C@@H](O)COc1ccc(I)cc1)c1cc(O)cs1 732284532 VPDMZMTYLZSMTB-LLVKDONJSA-N 419.240 2.228 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)c1 734879019 ZBIIGOXRULJMTM-HNNXBMFYSA-N 407.467 2.302 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1O 737278181 FUMPILXSPDWNOC-KRWDZBQOSA-N 400.431 2.214 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(Br)cn3C)CC2)cc1 742948550 XZZMEYXVMQLFAQ-UHFFFAOYSA-N 421.339 2.348 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@H](N(C)C)C3)CC2)cc1 749543525 RMONKRCVXNEBQB-FPOVZHCZSA-N 417.598 2.379 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 751240612 TWVRZALBPQXXPQ-UHFFFAOYSA-N 424.544 2.388 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCN(C)c3ccccc3)CC2)cc1 754031043 QKCZXLFQTSJDSX-HSZRJFAPSA-N 412.578 2.246 10 20 HECD C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758348286 UACKTDGCHKPZPM-WBMJQRKESA-N 421.544 2.467 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cn(CC3(C)COC3)nn2)cc1 759683865 VWDNSQGDMKXHSF-LJQANCHMSA-N 413.522 2.202 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)cc1Cl 759735187 BWSXAZHJSBZUAT-UHFFFAOYSA-N 413.883 2.080 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)cc1 760204317 QMEAGDLBXFDAHE-HKUYNNGSSA-N 400.479 2.090 10 20 HECD CCN1CCN(C[C@H](C)CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 761126472 QDAKIKDJJAEENX-HNNXBMFYSA-N 408.930 2.083 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O 763283380 JMENLCYSBDYGES-ALLJEULLSA-N 417.506 2.282 10 20 HECD CCOC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 770347744 YLCFSUPEFUZTPD-HLLBOEOZSA-N 422.501 2.469 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)Nc1ccccc1F 770380144 LXLUIRAGMJFTAM-UHFFFAOYSA-N 412.509 2.419 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N=c3cc[nH]c(C)c3Cl)CC2)cc1 771769625 UQZLCBDHKYEWAO-UHFFFAOYSA-N 403.914 2.418 10 20 HECD CCOC(=O)[C@H]1CCCCN1C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775260823 QBGXXCKHLXKJSR-YLJYHZDGSA-N 403.523 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)COc3ccccc3)CC2)cc1 778244053 BLCRWUQDWCAWFC-HYSAVQALSA-N 423.513 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](OCC(C)C)C3)CC2)cc1 778323883 LGELYGFWJXOZFY-SHBDEGQCSA-N 415.534 2.174 10 20 HECD C[C@@H](OC(=O)c1ccncn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778451347 KIDGZLVWWHXRFL-GFCCVEGCSA-N 401.378 2.436 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1 779500040 KRVNGIXZEHXSDN-UXBLZVDNSA-N 402.472 2.212 10 20 HECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2C1 784649914 JHBFVKKOUCUYBX-JOCHJYFZSA-N 423.513 2.234 10 20 HECD CO[C@H](C)COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785396863 HQBASIJKNQHVQN-LLVKDONJSA-N 410.404 2.293 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)nc4onc(C)c34)cc2)CC1 786263147 SUAODOOCQRMLTI-UHFFFAOYSA-N 407.474 2.438 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)cc([N+](=O)[O-])c3N)cc2)CC1 787327896 OZFPKTCUJCHQDJ-UHFFFAOYSA-N 411.462 2.084 10 20 HECD CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321072 SJTRTDMFBCWBIN-RBUKOAKNSA-N 405.564 2.272 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@H](OCC(F)(F)F)C1 788909975 JHYNVQRSNYLMDX-KRWDZBQOSA-N 413.440 2.473 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCC(=O)c4cccn43)CC2)cc1 789875196 OQXWASZVYDENAP-OAQYLSRUSA-N 410.518 2.343 10 20 HECD O=C(NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1)c1cccc(O)c1O 790905975 RQAQQAUBDCBWPA-UHFFFAOYSA-N 408.451 2.210 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccc(S(=O)(=O)NC)cn2)cc1F 792395853 VLDRSZMCSDNRLZ-UHFFFAOYSA-N 409.487 2.297 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)n3)cc2F)C[C@@H](C)O1 792956099 JOTAPBXEXGWKII-BETUJISGSA-N 404.417 2.228 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)Oc3ccc(C=O)cc3)CC2)cc1 795775227 MCVKGJUAVWAHLS-SFHVURJKSA-N 411.502 2.213 10 20 HECD COc1cccc(O)c1CNc1cccc(S(=O)(=O)N2CCC(CO)CC2)c1 796445797 XMLMYWASMPFTNB-UHFFFAOYSA-N 406.504 2.406 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(N2CCCS2(=O)=O)c1 797614779 ZJUHWAJLPIFNMN-ZDUSSCGKSA-N 405.476 2.390 10 20 HECD COC(=O)[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 802166497 GLIYDJYTEMKHKD-TZMCWYRMSA-N 410.467 2.490 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cc1F 803663629 VGCKHJPOGZKQLG-LJQANCHMSA-N 421.419 2.386 10 20 HECD O=C(N[C@@H]1CCc2c(O)cccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804399655 AYORWTIQPJMRKQ-VQIMIIECSA-N 410.470 2.409 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCO1 807972069 HPTPMOBSCZEEGG-LMMKCTJWSA-N 404.507 2.221 10 20 HECD Cc1cnc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 808483116 LIOFRNOBXQDREO-OAHLLOKOSA-N 402.520 2.124 10 20 HECD Cc1cccc2c1OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 812009516 IHHYUKKYMHLALX-PMACEKPBSA-N 422.529 2.500 10 20 HECD Cc1cc(CCNC(=O)C2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1 832884420 SVIVAMYCZILSDT-UHFFFAOYSA-N 403.548 2.424 10 20 HECD Cc1noc(N)c1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 913243913 VCWBYBVRUINXKZ-UHFFFAOYSA-N 405.366 2.136 10 20 HECD CCn1c(O)nc2cc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc2c1=O 916745536 VEYOZECDCSNDGG-UHFFFAOYSA-N 422.485 2.231 10 20 HECD COC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 1325497597 HJNHFFHKLMWJPP-HOTGVXAUSA-N 422.501 2.423 10 20 HECD O=C(c1ccc(F)nc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547443 WYPWXSYELNNJLA-UHFFFAOYSA-N 414.437 2.186 10 20 HECD CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814163096 YPARCOUUSNQHAT-QOWAEHBASA-N 411.458 2.328 10 20 HECD O=C([C@H]1C[C@H]1c1ccc(F)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248779 MIKJHCZKLGOPAZ-IRXDYDNUSA-N 411.433 2.253 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc(-c3cnco3)c2)C1 1845414368 UKSCMDVCTIDIIY-UHFFFAOYSA-N 420.425 2.279 10 20 HECD CCN(CC)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 147110934 GGBRWMVZBPXWFS-UHFFFAOYSA-N 411.506 2.019 10 20 HECD Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)C(=O)NCc1c(C)c2ccccc2n1C 673315637 PJGCGFGQOLLKEA-HXUWFJFHSA-N 423.517 2.053 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)CCC3CCCC3)cc2)C1 726527687 SHWIMPZIDBMBTR-IBGZPJMESA-N 414.550 2.091 10 20 HECD C[C@H](CN1CCOCC1)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726615003 ZFRGMYZLRBDPJZ-OAHLLOKOSA-N 412.481 2.277 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 726976855 RZISUBVJZFSGBK-UHFFFAOYSA-N 408.545 2.017 10 20 HECD NC(=O)CC[C@@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 727158590 VKGUAVXVGGZUNR-HNNXBMFYSA-N 419.481 2.378 10 20 HECD C[C@H](NC(=O)N1CCN([C@@H]2CCCN(C)C2)CC1)c1ccc(N2CCOCC2)cc1 734665488 XMQCOASUHTUQLS-SIKLNZKXSA-N 415.582 2.006 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCNC(=O)[C@@H]1c1c(C)nc2ccccn12 734668906 NPYVSOMEGCJVIQ-NRFANRHFSA-N 420.517 2.400 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4cnn(C)c4)C3=O)c2C)cc1 735477886 WUCDTKZVZMEXSX-FQEVSTJZSA-N 407.474 2.372 10 20 HECD COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1nc(-c2cnn(C)c2)cs1 743046805 LIOXRVVDPAYAER-UHFFFAOYSA-N 407.477 2.311 10 20 HECD C[C@@H](NC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 743321591 HWMQRNFIBSRTLC-UZLBHIALSA-N 421.497 2.219 10 20 HECD CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 752095424 UYTMDYRALHDKBG-PMACEKPBSA-N 416.566 2.065 10 20 HECD C[C@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1cc2c(cc1O)CCCC2 756525303 NSLMSVSSTMEJQJ-KRWDZBQOSA-N 409.534 2.451 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN([C@H]2CCC[C@H]2O)CC1 765531994 AWAVWKWWYBZTOW-JKSUJKDBSA-N 412.328 2.332 10 20 HECD C[C@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 768254277 DCGVNPUBBGMJDQ-CUSZFKRNSA-N 409.502 2.121 10 20 HECD Cc1cccc(O[C@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c1 768444406 AXDCAWAAUDNZGX-IERDGZPVSA-N 412.486 2.238 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=N)COC(C)(C)C)cc2F)C[C@@H](C)O1 768933904 XGCKYMKXPLJJAE-HUUCEWRRSA-N 424.517 2.369 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OC(F)F)cn3)CC2)cc1 772543766 DJEWDEZJEQMGJV-UHFFFAOYSA-N 421.400 2.197 10 20 HECD C[C@H](NC(=O)NCCS(=O)(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 773621917 PXHZOBAGEGBHQF-INIZCTEOSA-N 404.536 2.232 10 20 HECD O=S(=O)([C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)N1CCc2ccccc21 779607917 QNRSBSMKDDYQPQ-QGZVFWFLSA-N 416.499 2.478 10 20 HECD CN(c1ccc(CNC(=O)C(=O)Nc2cccc(C(N)=O)n2)cc1)C1CCCCC1 780048087 VDJPBDGRRRMUGG-UHFFFAOYSA-N 409.490 2.204 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N=c3cc[nH]cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 781452390 CYUPMXJOPXDPGH-BETUJISGSA-N 403.414 2.486 10 20 HECD CCCOC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785294541 NBQBTZDJQKLVNB-ZDUSSCGKSA-N 400.431 2.351 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(N2CCCC2=O)c1 788221849 DXTRKQLIIUXQMC-UHFFFAOYSA-N 420.513 2.346 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(N2CCC2=O)c1 790963784 GIBBWCVPJJIDQU-UHFFFAOYSA-N 418.247 2.146 10 20 HECD CCc1nn(C)c(CC)c1CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 791490217 TZQLGPPCZOVVDQ-UHFFFAOYSA-N 400.523 2.355 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H]3CCC[C@@H](OC)C3)CC2)cc1 796059509 BRFARWAYMODFJX-YLJYHZDGSA-N 404.507 2.482 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H](CN2CCOCC2)C1 800997899 GMPHKXDCYXZTFW-HXUWFJFHSA-N 418.607 2.494 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1F 802556428 WMXMWFNQAIRBKY-UHFFFAOYSA-N 405.401 2.381 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3nc(-c4cccc(F)c4)no3)ccc21 803686376 JDUWZLLSQMNWFC-UHFFFAOYSA-N 423.448 2.191 10 20 HECD CCCCN1CCC(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 803995557 GACOREJACLZTJL-UHFFFAOYSA-N 416.566 2.115 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCC[C@H](C(=O)N(C)C)C1 806178565 HRKLYCFBIBGTHM-FUHWJXTLSA-N 403.523 2.284 10 20 HECD COc1cccnc1CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 807245414 DECCPUWSYBXGRY-UHFFFAOYSA-N 401.463 2.007 10 20 HECD CSC[C@@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807263052 FQXIDMTXSQJVQU-CHWSQXEVSA-N 401.479 2.241 10 20 HECD COCc1csc(NC(=O)C(=O)NCc2cc(Br)ccc2O)n1 807386904 PKVIKGWMWMMNLP-UHFFFAOYSA-N 400.254 2.013 10 20 HECD Cc1nnnn1-c1cccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 915350159 KDVZFFVDLQQRJP-UHFFFAOYSA-N 407.478 2.471 10 20 HECD CCC[C@@H](C)N1C[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 919583617 JAZHBUMJNOEEFA-AEFFLSMTSA-N 403.523 2.291 10 20 HECD C[C@H](NS(=O)(=O)c1cccc2c1COC2=O)c1ccc(N2CCOCC2)cc1 920866047 UVMNKZSDEYBYSB-AWEZNQCLSA-N 402.472 2.233 10 20 HECD CC(C)(C)N1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 1115868320 BSDZJFJDAFJVCA-SFHVURJKSA-N 401.555 2.014 10 20 HECD C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602918 ZXOPJBPVUWTMER-MXASKKJJSA-N 411.458 2.212 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)n1cccc1 1846544222 LUAONWZULQXQKC-PMGBHYCQSA-N 411.458 2.083 10 20 HECD Cn1cnc2c1c(=O)n(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)c(=O)n2C 255627925 CTUBMUTUFLCIJY-UHFFFAOYSA-N 417.429 2.488 10 20 HECD NC(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)c(OCC(F)F)c1 578182991 HTPJUFQNPORDMD-UHFFFAOYSA-N 414.415 2.235 10 20 HECD O=C(COc1cccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 728070299 AHJMBQWOWFOPQB-UHFFFAOYSA-N 422.464 2.033 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3csc(C)n3)CC2)cc1 733581413 OLVVTGHAIKDWLI-UHFFFAOYSA-N 403.504 2.285 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1C 735198384 LOFXOUSUZASAMV-UHFFFAOYSA-N 417.531 2.169 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c1C 739697102 WKDFKJMREBPRFS-KRWDZBQOSA-N 404.536 2.048 10 20 HECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741090692 LVGAMONPGRQIDY-IEBWSBKVSA-N 400.523 2.136 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H](CCO)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741788706 ZSQHQOIWJUDSCU-QGZVFWFLSA-N 419.547 2.019 10 20 HECD COc1ccc(C[C@@H](CO)CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1O 745839305 WLRIFBWCPZRGDS-LJQANCHMSA-N 411.502 2.427 10 20 HECD CC(C)(C)C(=O)Cn1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1 746133539 UJARYBZPBAGCRP-UHFFFAOYSA-N 401.536 2.377 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C[C@H](O)c3ccco3)nc12 758828369 RWXLODKJIVSUFA-HOCLYGCPSA-N 400.435 2.293 10 20 HECD Cn1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C(F)F 758963090 CBYIRRQYYSHQTC-CYBMUJFWSA-N 408.405 2.210 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3C[C@@H](OC)C3(C)C)CC2)cc(OC)c1OC 759281225 PLKMNQMIHIPULS-ZWKOTPCHSA-N 407.511 2.358 10 20 HECD CCC1(CC)[C@H](NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1OC 759603668 ZLLHWOFJMQAJPE-KSEOMHKRSA-N 405.583 2.361 10 20 HECD CCc1cc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n(C)n1 759984413 VNKWADSCLNEHOW-UHFFFAOYSA-N 403.483 2.362 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@@H](c4ccccc4)N(C)C3=O)CC2)cc1 761187550 WBDXGQDOIYVLLQ-OAQYLSRUSA-N 408.502 2.453 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1 762567487 FSXMCUYOSZRWMJ-GOSISDBHSA-N 414.510 2.458 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 765658971 MMMBLPOOATWKLR-CXHZTBPHSA-N 406.502 2.153 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@H](O)[C@H](O)c1nc2ccccc2s1 765729588 PLIIYPICIMWIFE-GJZGRUSLSA-N 423.288 2.475 10 20 HECD Cc1cccc2c(=O)n(CC(=O)NCc3cccc(Br)c3O)cnc12 765753827 QHCKEFFNIFVJGH-UHFFFAOYSA-N 402.248 2.489 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1OC 768451098 LZVMRXWULDGPBA-UHFFFAOYSA-N 405.539 2.222 10 20 HECD COC(=O)c1cn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 768517532 CMGUOLFWOYLKBA-OKILXGFUSA-N 418.469 2.047 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1 770466562 SCBJEHDDQHIPER-UHFFFAOYSA-N 414.462 2.251 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)c1 775372733 HLKOGFTUFJMVNC-NVXWUHKLSA-N 424.563 2.400 10 20 HECD COCC(=O)N1CCc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)ccc21 778730635 WYMLOLFFHHLERV-HNNXBMFYSA-N 424.501 2.104 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CC[C@@H](O)C1 781798187 NEWZCOYUCYYPMW-HSZRJFAPSA-N 424.545 2.089 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 784023925 GZCVXARKCAPNNI-UHFFFAOYSA-N 408.451 2.312 10 20 HECD Cc1cnc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 787876163 FTJGJKATMGVHLJ-UHFFFAOYSA-N 406.845 2.274 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)sc1C 789854735 KVZBQPXWLIQSGU-UHFFFAOYSA-N 404.561 2.246 10 20 HECD C[C@@H]1CN(c2ccnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2)C[C@@H](C)O1 789967812 NYXFSNNBZNTPFY-QZTJIDSGSA-N 410.518 2.462 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3C[C@@H](C)O[C@@]4(CCOC4)C3)cc2F)CC1 792991607 ADEAREVSSPVELT-VGSWGCGISA-N 420.529 2.057 10 20 HECD CC[C@H]1CCCCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716320 CEDLQTYOPAKVEQ-OALUTQOASA-N 414.550 2.186 10 20 HECD NC(=O)CCNC(=O)Nc1cccc(NCc2ccc(N3CCOCC3)c(F)c2)c1 797893642 OXTAWJRMRBTNGO-UHFFFAOYSA-N 415.469 2.271 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H]3CCCc4nn(C)cc43)CC2)cc(OC)c1OC 798497712 YFMHYQNKDCUVMB-MRXNPFEDSA-N 414.506 2.215 10 20 HECD CC1(C)C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C(C)(C)O1 806952094 VJKAHURNBCFJQF-AEFFLSMTSA-N 404.507 2.362 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)c1 807292357 PPBCEEFDSGQNTJ-UHFFFAOYSA-N 420.513 2.036 10 20 HECD COC(=O)Cc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387509 MAGXFOCXDNKGSQ-UHFFFAOYSA-N 421.247 2.125 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)cc1 815394953 BFQAHXMLKDLZOT-UHFFFAOYSA-N 406.490 2.428 10 20 HECD Cc1cc(C(=O)COC(=O)CCNS(C)(=O)=O)c(C)n1-c1ccc2c(c1)CCC2 914649427 MIDYSPLGXGZGJF-UHFFFAOYSA-N 418.515 2.248 10 20 HECD CO/C=C(\C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798306844 ZDLNXUJJSJCRCA-ZBYHAXBZSA-N 402.447 2.005 10 20 HECD CC(=O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283313 QHHJRBRDALSQAZ-BEVBHUTCSA-N 416.474 2.070 10 20 HECD O=C(c1cc(F)cc(F)c1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251278 PDHBEBGIJKBYOJ-UHFFFAOYSA-N 407.348 2.041 10 20 HECD COc1ccc(N(C)CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC 63616741 YRLCIHLRINTMPE-UHFFFAOYSA-N 414.462 2.397 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)n(C)c2ccccc12 580852936 CFVCGOWPCPXLOZ-SFHVURJKSA-N 419.529 2.403 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c1 728610699 LISQHDGAYKWWRI-KRWDZBQOSA-N 417.531 2.058 10 20 HECD CCC(CC)N1C[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1=O 729328855 WTSWXHBGNPJAGL-MSOLQXFVSA-N 414.550 2.042 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)OCC(F)(F)F)cc2F)C[C@@H](C)O1 732059647 DNQDZFCZOOLGGI-VXGBXAGGSA-N 421.391 2.344 10 20 HECD C[C@H](NC(=O)NC1CCN(C[C@H]2CCOC2)CC1)c1ccc(N2CCOCC2)cc1 736379649 IOMKTORXHQILML-RBUKOAKNSA-N 416.566 2.384 10 20 HECD C[C@@H](NC(=O)N1CCC(N(C)CCCO)CC1)c1ccc(N2CCOCC2)cc1 741080364 ICLDXNYTXYVEJA-GOSISDBHSA-N 404.555 2.072 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 743975193 NWSKDLMHDOEWBW-CQSZACIVSA-N 420.416 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)CCOc4ccccc43)CC2)cc1F 753737844 FCDYQSGOOADXPN-UHFFFAOYSA-N 413.449 2.299 10 20 HECD O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NCCc1ccc(O)c(O)c1 762275523 SNQLCIWLJNCGTN-UHFFFAOYSA-N 418.515 2.174 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)[C@]2(O)CCSC2)NC(=O)OC(C)(C)C)cc1 765836500 NJUOIDSEEPKNGG-UZLBHIALSA-N 409.552 2.303 10 20 HECD C[C@H](NC1CCN(CC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)cc1Cl 765898513 JAOZFUIOXXNOJN-INIZCTEOSA-N 408.974 2.380 10 20 HECD COC[C@@H](O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 765902290 BXSZODRKIBUITB-GVIGZQTCSA-N 414.574 2.243 10 20 HECD COC(=O)c1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 772909446 HDBOEKFKPVQFFV-UHFFFAOYSA-N 415.465 2.486 10 20 HECD Cc1cccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 773670420 RUDUXTMWMQNKSS-INIZCTEOSA-N 402.882 2.468 10 20 HECD COc1ccccc1[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N1CCCC1 774919136 POOZWKYTNNYMRJ-OAQYLSRUSA-N 424.545 2.331 10 20 HECD C[C@@H](NC[C@H](O)Cn1c(-c2ccccc2)noc1=O)c1ccc(N2CCOCC2)cc1 775262186 ZHCWVGDHNRJJMB-UTKZUKDTSA-N 424.501 2.052 10 20 HECD Cn1cc(/C=C(/Cl)c2nc3ccc(Br)cc3n2C)c(=O)n(C)c1=O 776724088 OOUQORDNLVPOJK-IZZDOVSWSA-N 409.671 2.470 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cnn(C)c3)cc2F)C[C@@H](C)O1 780397416 LDCYEIUFULACNK-ZIAGYGMSSA-N 412.469 2.493 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCC(=O)NCC)cc1 784026579 BIOYYZHKYHFXPP-UHFFFAOYSA-N 413.474 2.284 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CC3CCC4(CC3)OCCO4)cc2)CC1 788103314 WPFVHQAWWQIDMR-UHFFFAOYSA-N 415.534 2.295 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 790130806 XHGSKTXXPHWFAJ-UHFFFAOYSA-N 406.464 2.466 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 790836149 PYOXVHOLYAWECH-HNNXBMFYSA-N 421.494 2.015 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)N2C(=O)c3ccccc3C2=O)c(O)c1 794388256 SSMGADWLHYSINI-KRWDZBQOSA-N 414.483 2.435 10 20 HECD COc1cccc(C2(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)CC2)c1 795369143 YLYYRSJMSAXWAN-UHFFFAOYSA-N 414.527 2.278 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccoc1C1(O)CCOCC1 798163582 XEUUPGPOMNFJGC-UHFFFAOYSA-N 404.438 2.183 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 804315960 WIIVDPFSQLHYLI-YLJYHZDGSA-N 403.523 2.100 10 20 HECD Cc1nnnn1-c1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807513221 UXJZSGYNZQKAQM-UHFFFAOYSA-N 421.244 2.238 10 20 HECD COc1cc(NC(=O)Cc2cccs2)c(C(=O)OCC(=O)C(C)=O)cc1OC 808485014 JXDVSVWQQOQJEX-UHFFFAOYSA-N 405.428 2.261 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3c(C)cnn3C)c2C)cc1 813991961 RFJLQOWYGOUZRI-UHFFFAOYSA-N 402.476 2.263 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3Cc4ccccc4C(=O)O3)CC2)cc1 843443792 RECGJRKNZVWGNU-QFIPXVFZSA-N 423.513 2.105 10 20 HECD COc1ccc(C(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cc1 912888091 MWNSZEHEANVESA-UHFFFAOYSA-N 424.545 2.178 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccccc3OC)CC2)cc1 920254858 QOKFPYZWFZFKOJ-VAWYXSNFSA-N 423.513 2.268 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCCN2C(=O)NC(C)(C)C2=O)C2CC2)cc1 1123735462 OEWDKVJVEIDZIH-UHFFFAOYSA-N 401.511 2.147 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc1 1320990201 VAGANIXKZMDZPI-UHFFFAOYSA-N 415.468 2.347 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(Cl)c1)c1cc(O)nc(O)c1 1795115374 DQFUNDPJADGBAI-BTTYYORXSA-N 402.838 2.107 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(c3ccc(F)cc3)CC2)C1 1841866436 HDAAWKMPGDOGBO-UHFFFAOYSA-N 411.433 2.181 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1C 7201581 FXHXSKSSHZRXOA-IRXDYDNUSA-N 418.515 2.251 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)c3c(F)cccc3F)CC2)cc1 303199389 NYCNCQOZJXTIAG-UHFFFAOYSA-N 416.472 2.105 10 20 HECD CC[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)C(=O)N1CCOCC1 437975540 NMWRMKWLESOOHY-IBGZPJMESA-N 401.507 2.272 10 20 HECD Cc1ccc([C@@H](CN2CCOCC2)NCC(=O)NCc2ccc(N(C)C)cc2)cc1 727384100 KXAZWKKDKOMESI-HSZRJFAPSA-N 410.562 2.340 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)ccc1Cl 729061518 GQJSOUFTUXNGLF-JTQLQIEISA-N 405.838 2.230 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1ccc(N2CCSCC2)cc1 729286011 XGDUYSFONMNJOZ-UHFFFAOYSA-N 411.531 2.464 10 20 HECD CNC(=O)C1(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 730043832 PBAZFXORAKDRJR-UHFFFAOYSA-N 412.442 2.117 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1F 731364905 RVHUDTLGUUWVQE-UHFFFAOYSA-N 414.528 2.380 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)CC(C)(C)C)CC2)cc1 735377802 LSOWNRMUYRPARP-LJQANCHMSA-N 406.571 2.304 10 20 HECD O=C(CNC(=O)OCc1ccccc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 742807756 ROTITARIDTYZSI-UHFFFAOYSA-N 415.465 2.329 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc4c(C)nn(C)c4nc3C)CC2)cc1 742920591 KKSAPBIIOPAFNE-UHFFFAOYSA-N 422.533 2.146 10 20 HECD CN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCS(=O)(=O)C1 745905823 NVPXZNZTZCBCKZ-UKRRQHHQSA-N 417.478 2.085 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3c(F)cccc3F)c2)CC1 748676289 ZNPTXBVWFLPUHC-UHFFFAOYSA-N 402.444 2.000 10 20 HECD COC(=O)c1nscc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751135957 BTYCDXXZHQOYSU-ZDUSSCGKSA-N 412.489 2.005 10 20 HECD COCC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 756374776 YOZJZHLJUYGEND-GJZGRUSLSA-N 410.486 2.271 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1ccc(Br)o1 759011564 QSMUQMVVZYGVID-UHFFFAOYSA-N 401.282 2.357 10 20 HECD COc1cc(N2CCN(C(=O)Cc3ccn(C(C)C)n3)CC2)cc(OC)c1OC 759242140 NFXPINJDOSOWGC-UHFFFAOYSA-N 402.495 2.381 10 20 HECD CO[C@](C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1F 760147612 FXDUQCTTYUGWOP-NRFANRHFSA-N 420.506 2.239 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCC[C@H]3CCCCO3)CC2)cc1 761009246 AYZMOQRUXABMKX-RJRNSMGGSA-N 415.534 2.366 10 20 HECD C[C@]1(c2ccccc2)NC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 761126819 UVPVHKKIBNSNTI-GAJHUEQPSA-N 406.486 2.356 10 20 HECD COc1ccc2c(c1)[C@@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)CC2 761591754 AZQBBVPYXXLORE-FQEVSTJZSA-N 414.527 2.276 10 20 HECD Cn1ccnc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)cc1 769637245 QJUGTETYRPUROP-KRWDZBQOSA-N 418.450 2.156 10 20 HECD COc1cc(O)c(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)cc1OC 775645132 WBTJNPNNVATAKP-UHFFFAOYSA-N 409.490 2.253 10 20 HECD Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)c3cccc(O)c3O)C2)cc1 776344206 NZTGDWNFRDVPOS-HNNXBMFYSA-N 404.488 2.237 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)cc2F)CC1 777240403 BRZKSMJHARGJNK-INIZCTEOSA-N 421.561 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3c3ncc[nH]3)CC2)cc1 778252078 NHICRTXPGHAEEU-GDCKJWNLSA-N 423.517 2.377 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1 785293726 AHAONSLEMVIVHN-HUUCEWRRSA-N 413.474 2.009 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 785296137 BVTDTLYSKPINPP-SNVBAGLBSA-N 405.838 2.396 10 20 HECD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)Nc1ccc2c(c1)C(=O)NC2=O 788322105 UXGASTNXMZSIMS-UHFFFAOYSA-N 403.778 2.048 10 20 HECD Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 790240242 BHCGQIAXBXZOBW-JOCHJYFZSA-N 422.529 2.432 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c(O)c1 794388456 UWRBQBNKBNHDRV-MRXNPFEDSA-N 408.458 2.446 10 20 HECD CCOC(=O)c1c(NC(=O)C(=O)NCc2ccc(OC)cc2O)sc2c1CCC2 797389826 AIYXXZGAUCHJMJ-UHFFFAOYSA-N 418.471 2.383 10 20 HECD Cc1nc(C)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 807354171 GPWVVKIBCFHSSQ-INIZCTEOSA-N 403.504 2.290 10 20 HECD CS(=O)(=O)c1ccccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807511874 ZDTDNNAHQHOQIK-UHFFFAOYSA-N 417.270 2.357 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C[C@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 815063040 UVNLOAVHHIPHBU-BFYDXBDKSA-N 412.527 2.270 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc4c(cn3)CCC4)CC2)cc1 818982311 DOHNPDFWEASPQR-KTKRTIGZSA-N 406.486 2.422 10 20 HECD C[C@H](Sc1nnc(N)n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 913193981 ISKPVVOPSHCZGA-JTQLQIEISA-N 407.455 2.292 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CS4)cc2)C1 917831812 AMEWETPAMVFODD-INIZCTEOSA-N 424.526 2.363 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1N1CCCCC1 1116591839 KUOSXSZWAHAPRQ-KRWDZBQOSA-N 413.474 2.387 10 20 HECD Cc1nc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)no1 1324670817 AGCZKFFYYRIRIQ-VIFPVBQESA-N 408.461 2.437 10 20 HECD CC(C)c1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)co1 1794580969 WUWLYYQOUQKNKP-BTTYYORXSA-N 400.435 2.170 10 20 HECD Cc1noc(N)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796019209 LUOFSOUMSPUGRS-ZSBIGDGJSA-N 420.853 2.195 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnn1)c1cc(O)c(O)c(Cl)c1 1798741395 UPVVMPQLFYDZTM-CLLJXQQHSA-N 402.838 2.107 10 20 HECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)sc1C 1799087205 ADVKKFNZLFJLSU-BTTYYORXSA-N 402.476 2.132 10 20 HECD Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808496296 HRRIIGBADBKGBM-HNAYVOBHSA-N 422.441 2.423 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCCC12CN(C(=O)C(F)(F)C(F)F)C2 1845500491 HEFHTUBPPRIJAX-UHFFFAOYSA-N 410.751 2.469 10 20 HECD O=C(c1cnnc(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500873 YQTCCNNSJYZRFH-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c1 51137131 SBGXFOMGEKIDOE-UHFFFAOYSA-N 404.488 2.097 10 20 HECD C[C@H](Nc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1)c1ccc(N(C)C)cc1 302760107 JWNVMRYLONDOOW-HNNXBMFYSA-N 402.520 2.191 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(OC)c1 442743233 BFILGMHSMWKWDT-UHFFFAOYSA-N 406.460 2.136 10 20 HECD COCCCN(C(=O)NCc1c(C)c2ccccc2n1C)[C@H]1CCS(=O)(=O)C1 472243768 WVVRAZZABZRFPU-INIZCTEOSA-N 407.536 2.222 10 20 HECD C[C@H](NC(=O)CCNC(=O)c1n[nH]c2ccccc12)c1ccc(N2CCOCC2)cc1 728071778 YDKHIBPLQWBIRT-INIZCTEOSA-N 421.501 2.397 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 728941052 MFAJUNDQNDARQN-ZDUSSCGKSA-N 407.492 2.010 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H](N2CCCC2=O)C1)c1ccc(N2CCOCC2)cc1 732243939 WIQCDEJOGFFDCQ-XLIONFOSSA-N 400.523 2.381 10 20 HECD O=C(NCc1ccccc1O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 735580990 WEZYRVOHZVHAJY-UHFFFAOYSA-N 403.504 2.186 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccc(F)n3)CC2)cc1 748034490 TULBCIWBLUJUIN-UHFFFAOYSA-N 401.486 2.241 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)CCc3ccccc3)cc2)C1 753122636 SSPQYVOGTDMXLH-UNMCSNQZSA-N 424.545 2.181 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@](C)(O)C3CC3)cc2F)C[C@@H](C)O1 756331796 YYZAIZYNMIPGJU-KIMHZCHSSA-N 422.497 2.150 10 20 HECD C[C@@H]1C[C@H](NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c2c(O)ccc(F)c21 756740670 SJJUVCMXZKCQCO-WBMJQRKESA-N 408.499 2.256 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)CCNCc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 757955817 FZMPCGISFJUSDJ-UHFFFAOYSA-N 415.811 2.426 10 20 HECD CCNc1nnc(SC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1 758195677 BXPRTDOGAKHRDL-HNNXBMFYSA-N 409.581 2.254 10 20 HECD Cc1nnc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 759313493 ILGZTLNQYNZVBA-IUODEOHRSA-N 402.524 2.109 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)cc1 760890154 WOUHCQXHUKLGPN-UHFFFAOYSA-N 422.489 2.105 10 20 HECD CC[C@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 760913036 SHEMGLJVSTWPPH-ZMPRRUGASA-N 423.529 2.377 10 20 HECD O=C(CN1CC[C@@H](N2CCCC2=O)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761121776 YWRGYFAZPUFJBX-MRXNPFEDSA-N 417.465 2.097 10 20 HECD NS(=O)(=O)c1cc(F)cc(NC(=O)NCc2cccc(Br)c2O)c1 765281099 CZDRKKNMXXEZBS-UHFFFAOYSA-N 418.244 2.263 10 20 HECD CC(C)(C)OC(=O)NCCOCC(=O)NCc1cccc(Br)c1O 765752704 ZBOBGAQOVPLGGH-UHFFFAOYSA-N 403.273 2.312 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 765756879 NUOBSNULSAFSAT-GJZGRUSLSA-N 423.307 2.212 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)c1 771640264 FDBJJIZEMKCUFK-UHFFFAOYSA-N 422.478 2.113 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc([N+](=O)[O-])c1F 771728684 DKVARVSVSSIINI-UHFFFAOYSA-N 409.439 2.357 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC[C@]2(C)NC(=O)NC2=O)cc1 771832264 KHZXHCITVPQBLU-GCJKJVERSA-N 416.522 2.029 10 20 HECD CCCN(C(=O)NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCS(=O)(=O)C1 776038423 XTLMJPQPSQEFKT-GOSISDBHSA-N 411.593 2.349 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)NC(=O)OC(C)(C)C 777825992 DISKLFOYNLKDBN-LLVKDONJSA-N 400.859 2.460 10 20 HECD O=Cc1ccc(OCCn2cc(C(=O)NCc3ccc(O)c(O)c3)nn2)c(Cl)c1 778915120 QMUYREVACFFORQ-UHFFFAOYSA-N 416.821 2.164 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CS(C)(=O)=O)cc1 784027511 IZVUADCUTIRGPF-UHFFFAOYSA-N 404.488 2.314 10 20 HECD COc1cccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785444241 QAUHIDZUQKQGAT-SFHVURJKSA-N 410.518 2.163 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](C)O[C@@H](CO)C3)c2C)cc1 787314224 BFOBGNDAHNSMHG-DNVCBOLYSA-N 400.475 2.145 10 20 HECD C[C@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1 801735326 SHNBUVHLOVQWAU-GOSISDBHSA-N 403.548 2.370 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803307523 HIXZVAPIYMOIFH-GJZGRUSLSA-N 414.506 2.053 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C 807099927 HNSRNWHRWGRDFZ-GCJKJVERSA-N 408.546 2.314 10 20 HECD O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 857456348 BGDSEBKOSUCILA-UHFFFAOYSA-N 409.465 2.226 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1 861819514 LXCITAXNBFNPAF-UHFFFAOYSA-N 423.560 2.014 10 20 HECD O=C(Nc1ccccc1-n1cncn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294050 CAOJLSMKIAQUIW-QGZVFWFLSA-N 421.457 2.119 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3)cc2F)C[C@@H](C)O1 918853038 UGSAQLSJUXQTNH-HUUCEWRRSA-N 401.438 2.308 10 20 HECD Cc1nc(-c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)no1 920194402 BQZKPPJABUGFBG-UHFFFAOYSA-N 421.457 2.137 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)C3CCCCC3)CC2)cc1 24110207 XFENKJRNXXTMAG-UHFFFAOYSA-N 416.566 2.020 10 20 HECD CN(Cc1ccccc1O)C(=O)CNC(=O)c1ccccc1I 71963589 WPRBUPPPEWMCBZ-UHFFFAOYSA-N 424.238 2.385 10 20 HECD COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)NCc1c(C)c2ccccc2n1C 472239303 IGBBRVNNFXMXGU-FPAYPSAMSA-N 413.474 2.121 10 20 HECD CCCOc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 727177330 GROCIVLJALOEHE-SDNWHVSQSA-N 400.547 2.226 10 20 HECD Cc1ncccc1/C=C1/SC(=S)N(Cc2ccc(S(N)(=O)=O)cc2)C1=O 728982497 CQKMCMJYRPPLBU-OQLLNIDSSA-N 405.526 2.439 10 20 HECD COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NCc1cccc(OC)c1O 729552060 AOKIROLBRMGHJX-UHFFFAOYSA-N 421.475 2.172 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H](CCO)c1ccccc1 743856408 JNFARPCTMJITJQ-OAQYLSRUSA-N 415.509 2.334 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cncc(Br)c1 744244187 XELAFQDPZBRDEA-UHFFFAOYSA-N 412.309 2.159 10 20 HECD C[C@@H](NC(=O)N1CCC(N2CCCNC2=O)CC1)c1ccc(N2CCOCC2)cc1 747958597 ZPSPNNMAXDNJGT-QGZVFWFLSA-N 415.538 2.174 10 20 HECD COc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1NC(C)=O 749730744 CZGICWSPCYVYKP-UHFFFAOYSA-N 408.505 2.347 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(OCCCc3ccccc3)C2)c1 751070629 LEZQCJREEWAGEM-UHFFFAOYSA-N 404.488 2.238 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)C(C)(C)NS(C)(=O)=O)c2C)cc1 751694959 MDQBWSGJTNSXNG-UHFFFAOYSA-N 406.504 2.456 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4ccc(F)cc43)CC2)cc1 754060766 IMSYXSJDGWBMFD-IBGZPJMESA-N 401.482 2.216 10 20 HECD COc1cc(N2CCN(C(=O)COc3ccccc3C=O)CC2)cc(OC)c1OC 759237275 IPGXWFRGTIMYFV-UHFFFAOYSA-N 414.458 2.253 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@H]([C@@H]4CCCOC4)C3=O)cc2F)C[C@@H](C)O1 761097480 IYTGGXSRDMZVAO-NPNMTCQASA-N 405.470 2.286 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)c3ccccc3Cl)nc12 768598838 JPNYFELRSGQNGH-OAHLLOKOSA-N 405.794 2.042 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)CC2)cc1 768970229 OYKCWEXHERLAQO-QHCPKHFHSA-N 422.485 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)CC2)cc1F 769157515 WHXJCECJFDWBOW-WOJBJXKFSA-N 420.529 2.044 10 20 HECD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1Cc1ccccc1 770157030 MGWFJSWTOGJLNV-HZPDHXFCSA-N 417.531 2.499 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNS(=O)(=O)/C=C\c1ccccc1 771534956 GCGALMKZLCVTDA-PTNGSMBKSA-N 415.515 2.458 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 774765540 AUFAUVMHNDQPCN-UHFFFAOYSA-N 420.557 2.460 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3O)CC2)c1 775638374 BGARMGBLYFSKKZ-UHFFFAOYSA-N 411.867 2.460 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(NCc3cc(OC)ccc3O)CC2)cc1 776069132 KEEIBPLXDNPAFI-UHFFFAOYSA-N 406.504 2.352 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](n4cncn4)C3)cc2F)C[C@@H](C)O1 776854823 ARKQBJSIVBQTOU-HLLBOEOZSA-N 402.474 2.187 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CCCN(Cc2ccccn2)C1=O 784336100 PSPDIACJOVWBGE-NRFANRHFSA-N 405.502 2.448 10 20 HECD O=C(OCCN1CCCC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785411201 DMVBPRNYURCTNR-UHFFFAOYSA-N 410.473 2.034 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1cccnc1N(C)C 787630998 GIAMQKPQMBRJID-UHFFFAOYSA-N 409.534 2.413 10 20 HECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H](C)CO1 803450996 BEVRCPUCFSJLFZ-KGLIPLIRSA-N 411.449 2.009 10 20 HECD Cn1cc(-c2ccccc2CNC(=O)C(=O)NCCCSc2nccs2)cn1 806276731 LCCCECIFOXISTJ-UHFFFAOYSA-N 415.544 2.458 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOC[C@@H]3[C@H]3CCCO3)cc2F)CC1 806749836 GHHMUOFQBIPXBR-NHCUHLMSSA-N 420.529 2.057 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](CO)C3CCCC3)cc2F)C[C@@H](C)O1 810114652 GHNYXWCOCGWOQF-QINHECLXSA-N 407.530 2.196 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C3CC3)C(F)(F)F)CC2)cc1 813837979 CHVKUFJPJPFCHI-QWUACUGRSA-N 411.424 2.357 10 20 HECD Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 914792565 OSXYWLMQOLRWIT-UHFFFAOYSA-N 420.487 2.056 10 20 HECD Cn1cnnc1C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916624878 VTOSMMXPIPCNLB-UHFFFAOYSA-N 400.552 2.458 10 20 HECD O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(N2CCC(CO)CC2)cc1 919969991 NGOPNBWBVOQMNO-UHFFFAOYSA-N 417.456 2.220 10 20 HECD C[C@@H](NC(=O)CSCC(=O)N1CCCCC1)c1ccc(N2CCOCC2)cc1 920887313 CXENFNNWYKNWEU-QGZVFWFLSA-N 405.564 2.446 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc(OC)c1 920924668 CWKBUBRGZPXUEV-OAHLLOKOSA-N 413.474 2.356 10 20 HECD CC[C@@H](C)[C@H](N)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715567 UHYGTSNEZOCKFL-HFVZKWEFSA-N 409.914 2.376 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807998737 NXXFYOSNNCCREL-IKSNEBHTSA-N 410.474 2.420 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1 1823077353 GNRCFQRVJYOYLM-ZDUSSCGKSA-N 403.414 2.414 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCC(F)(F)F)C1 1842801095 FLTHDFKXMUEHOR-UHFFFAOYSA-N 422.407 2.325 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 10393806 IYPIDGPBTAGEKO-UHFFFAOYSA-N 403.504 2.167 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccc(F)cc4)CC3)CC2)cc1 39561494 XSTGMJNMTJSMOA-UHFFFAOYSA-N 412.509 2.305 10 20 HECD COc1ccc(N2CCCN(C(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)CC2)cc1 108689490 QVPOXIWXTZAYGE-KRWDZBQOSA-N 421.501 2.072 10 20 HECD Cn1cc(C(=O)NCC2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cn1 726704948 COTZKMXOCOXPNL-UHFFFAOYSA-N 424.549 2.372 10 20 HECD COC(=O)CSCc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 728760802 IEYNWRITFJXLHD-UHFFFAOYSA-N 402.472 2.396 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)n(C)c1 728979416 HMASLMPWLXSAQH-CYBMUJFWSA-N 409.508 2.261 10 20 HECD CC(=O)Nc1c(C)cccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 729326643 QJPYZPRVSRFIBB-UHFFFAOYSA-N 415.515 2.118 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1 741100086 RTQOLWFJUVXGNF-UHFFFAOYSA-N 406.421 2.038 10 20 HECD CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 743699084 IZGAKULEBWRNPH-NWDGAFQWSA-N 423.425 2.403 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCCCSc2nccs2)c1 749731379 OFRMIZSONPSXJR-UHFFFAOYSA-N 417.520 2.054 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1 753643376 JMVYYTAAZDEHAH-HOTGVXAUSA-N 401.482 2.495 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2c(C)nn(CCOC)c2C)cc1F 754491544 ZNFGAMKQWFXEGI-UHFFFAOYSA-N 419.501 2.387 10 20 HECD CN1CCN(C(=O)[C@@H]2CCc3ccccc3N2Cc2cc3c(cc2O)OCO3)CC1 754745905 FZAZXZXMWAKFJM-IBGZPJMESA-N 409.486 2.216 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)[C@@H](C)C3CCN(C)CC3)CC2)cc1 758414001 KRBRZZVCSWKFQV-IBGZPJMESA-N 417.598 2.189 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)CC2)cc1 769157645 XRGREONCMCHGHJ-FCHUYYIVSA-N 416.566 2.295 10 20 HECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 769561730 BLVAMYGALWWCAB-QHCPKHFHSA-N 407.470 2.354 10 20 HECD CC(C)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774499438 TTXRVLJSLUIHDW-UHFFFAOYSA-N 401.429 2.321 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)Cc4ccccc4F)CC3)cc2)CC1 775664773 PZJAYNTWWIZJMQ-UHFFFAOYSA-N 410.537 2.464 10 20 HECD C[C@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 778528595 DHYNRVMGFSYZHQ-CQSZACIVSA-N 415.469 2.085 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]nc1-c1ccsc1 780405094 NBGPWCNOEBAAMB-UHFFFAOYSA-N 416.528 2.303 10 20 HECD CNC(=O)[C@H]1CN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CCO1 781547356 MXYBRUNKJBAWES-RTBURBONSA-N 421.457 2.181 10 20 HECD CC[C@H]1C[C@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 781776162 FOUBAOFGFBMCFW-AEFFLSMTSA-N 422.497 2.417 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)c2ccc(O)c(O)c2)c(C)c1 781936524 ZUYIFRWEOYBWHW-UHFFFAOYSA-N 421.471 2.118 10 20 HECD CO[C@H]1Cc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2C1 784649915 JHBFVKKOUCUYBX-QFIPXVFZSA-N 423.513 2.234 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(-c4cccc(C)c4)nn3)cc2)CC1 786258598 FOGKSSBLSUSLIC-UHFFFAOYSA-N 418.501 2.174 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cncn3-c3ccccc3)cc2)CC1 786656056 KBOBNJJYYSHINQ-UHFFFAOYSA-N 403.486 2.471 10 20 HECD O=C(NCc1nccs1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793545383 BZTNFIRSORRCQF-LBPRGKRZSA-N 410.446 2.146 10 20 HECD CN(C)c1ccc(CNC(=O)CN[C@H](CO)c2ccc(Br)cc2)cc1 794827812 NOCUKNZIRFRFRR-GOSISDBHSA-N 406.324 2.455 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)[C@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 801546239 KXRQDJKZJDDCGU-HNNXBMFYSA-N 422.551 2.238 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)[C@@H](C)[C@H](C)C(=O)OC)ccc21 802153108 HXDJTDVGUJVZSY-ZFWWWQNUSA-N 424.519 2.162 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1F 803664203 GOWIJQCTABNHCW-CRAIPNDOSA-N 403.454 2.216 10 20 HECD Cc1ccc2[nH]cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c(=O)c2c1 804276505 AESYDUSVJMHDCH-KRWDZBQOSA-N 418.497 2.468 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)c1cccc(F)c1 806275906 ZEJOBYWBQVAYGF-HNNXBMFYSA-N 410.540 2.300 10 20 HECD COc1cnccc1[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807175895 WNNWRDKUKSGYLW-WBVHZDCISA-N 413.474 2.181 10 20 HECD Cc1cnc(S(C)(=O)=O)nc1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 816826103 WNUUBPHWMSZDLI-UHFFFAOYSA-N 402.520 2.451 10 20 HECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1cc(OC)c(OC)cc1O 1236749019 DSXBLCHQENWPAI-HNNXBMFYSA-N 424.494 2.394 10 20 HECD C[C@H](O)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788673680 BXECTFVVMXXDLJ-HNNXBMFYSA-N 420.469 2.294 10 20 HECD Cn1cncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1795207560 MWIBZMRYODOIPF-CLLJXQQHSA-N 404.854 2.050 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc[nH]1)C1=NN(c2ccccc2)C(=O)C1 1798678424 UMHFYXQLHMOWIK-ACHSLPGTSA-N 405.458 2.059 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)C3(F)CCC3)sc2C1)c1cc(O)nc(O)c1 1827418194 CNMWSYNTBWHGCU-JTQLQIEISA-N 406.439 2.067 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(N2C(=O)CCC2=O)c1 7694881 XCLLMAPYLQBMEW-UHFFFAOYSA-N 423.469 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn4ccc(C)cc4n3)CC2)cc1 26174151 UCBSJEQOZQUNJA-UHFFFAOYSA-N 408.458 2.157 10 20 HECD CC(=O)N1CCc2cc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)ccc21 525226281 QWZDXGYXXYFDPZ-UHFFFAOYSA-N 401.488 2.249 10 20 HECD COCCOc1ccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 559827622 VZIAAAWFSVBVFH-UHFFFAOYSA-N 409.486 2.445 10 20 HECD CS(=O)(=O)Nc1cccc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 727466827 JOYPHTSFZKGFFQ-SFHVURJKSA-N 416.547 2.050 10 20 HECD COc1cccc(CNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1O 729556701 HGEKGOGOQDRLLX-UHFFFAOYSA-N 404.854 2.312 10 20 HECD CNC(=O)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 729787281 VMOKBFMHELTIRZ-UHFFFAOYSA-N 424.501 2.057 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@H]1CCOC1 734151253 HCHFFFAVDYKSIG-QGZVFWFLSA-N 419.547 2.283 10 20 HECD CN(CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1[N+](=O)[O-] 743313809 JYEDENFRMRDZLY-UHFFFAOYSA-N 416.453 2.448 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](N4CCCC4)C3)CC2)cc1 743362953 MKFHXANVDCLVGJ-NRFANRHFSA-N 415.582 2.087 10 20 HECD C[C@H](NC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 748532518 FVCYFWVFNBQLCX-NPMXOYFQSA-N 422.485 2.069 10 20 HECD CCCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 749211865 BGHYVZJYAGJQOA-LJQANCHMSA-N 415.582 2.452 10 20 HECD Cc1cc(C(=O)CN2CCOCC23CCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749544316 CWLVLZGNJFWYIT-UHFFFAOYSA-N 417.531 2.179 10 20 HECD COC(=O)c1c(F)cccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 757867514 GWUHNQPXHHAKNC-UHFFFAOYSA-N 422.478 2.270 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3cc(N4CCCC[C@H]4CO)ncn3)cc2)C1 764782719 HZJHAROFGGEXFU-QUCCMNQESA-N 424.549 2.142 10 20 HECD C[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)c(F)c1 765326171 UXSOVIPBOPDVTE-NVXWUHKLSA-N 418.465 2.482 10 20 HECD CCN1C[C@H](C)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H]1C 766252512 GWWJJWYFSVPKTD-CADBVGFASA-N 420.573 2.470 10 20 HECD C[C@H](NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccc(N2CCOCC2)cc1 774498405 OLZAZYXUPLPIIJ-INIZCTEOSA-N 416.566 2.126 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccs3)cc2F)C[C@@H](C)O1 774787288 LBGGASFIHMYNFI-OKILXGFUSA-N 405.495 2.433 10 20 HECD CC[C@@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)ccc1O 775511730 JGBFDGFBTFPZAE-CQSZACIVSA-N 418.313 2.303 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(Br)cn2)cc1 784563311 FJUHTQJVTJCDPU-UHFFFAOYSA-N 408.252 2.471 10 20 HECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 788006593 CSKZVCNYZZFQCP-UHFFFAOYSA-N 416.566 2.254 10 20 HECD O=C(NCCSC(F)(F)F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788527835 LJRPASKXHZJETP-ZDUSSCGKSA-N 406.426 2.269 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1OC 790068554 NQOHPZGWGDJUQS-UHFFFAOYSA-N 415.807 2.340 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2c(O)ccc(Cl)c2F)c1 790960487 VABZMVDBUJZZOT-JTQLQIEISA-N 415.874 2.210 10 20 HECD COCCOC1CCC(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1 793926829 SCYXOMKWZRTTTP-UHFFFAOYSA-N 417.550 2.193 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 795835733 OILOWGVGAPPRBM-JZKQVHKSSA-N 408.470 2.024 10 20 HECD Cc1ccc(-n2cnnc2)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 797836318 JYTFNKMEHJYYMS-SFHVURJKSA-N 418.501 2.207 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)[C@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 801549355 KXNICCZEWIAPJM-OAQYLSRUSA-N 417.506 2.137 10 20 HECD CON(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CC1CCOCC1 801604197 NHKFAGQIVCMJLZ-IAGOWNOFSA-N 423.529 2.346 10 20 HECD CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCO1 802682532 MSTOQXJEMXOCIZ-QGZVFWFLSA-N 419.501 2.468 10 20 HECD CCCCN(C)CC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803664873 QOLHNPKRLPOULP-UHFFFAOYSA-N 406.546 2.478 10 20 HECD COc1ccc(N2CCN(c3cc(S(=O)(=O)N4CCCC4)ccn3)CC2)cc1 804321441 UKPRCFYOBFSYEK-UHFFFAOYSA-N 402.520 2.201 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCCN2CCCCC2=O)cc1 804776640 DWQFYJNILQWDKB-UHFFFAOYSA-N 402.539 2.010 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O 807095087 KBZTZNRFLZDVGA-CGRMTHRGSA-N 401.551 2.465 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1cnn(C)c1 807101285 RFTYZXHHQISCBI-OAQYLSRUSA-N 423.492 2.456 10 20 HECD CC[C@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1nccs1 807256751 SREIWHFHLQYSHY-KRWDZBQOSA-N 402.520 2.458 10 20 HECD CCC1(CC)[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@@H]1OC 809438379 PZRFBKQRKAAWDH-PMACEKPBSA-N 417.550 2.192 10 20 HECD CC(C)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1(CO)CCC1 815250029 PSSFUQJVTWVGAJ-NRFANRHFSA-N 407.530 2.055 10 20 HECD CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(CCOC)C2)sc2c1CC[C@H](C)C2 914460994 ZJKCLLZSXLPBIZ-QWHCGFSZSA-N 408.520 2.483 10 20 HECD Cc1cc(C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c(C)n1-c1ccccn1 920301202 IAAFPURAGKOHJE-INIZCTEOSA-N 409.442 2.388 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)Sc3nnnn3C3CC3)CC2)cc1 1116419431 JVAJJVZFMOQXSY-AWEZNQCLSA-N 402.524 2.236 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(F)c(S(=O)(=O)NC)c3)CC2)cc1 1336535424 WDAWBNSLQNWVRY-UHFFFAOYSA-N 421.494 2.095 10 20 HECD O=C(O)[C@H](Cc1ccc2c(c1)OCCCO2)NCc1ccc(N2CCOCC2)cc1 1343648910 UNPBVIQGXNYDMF-FQEVSTJZSA-N 412.486 2.470 10 20 HECD Cc1n[nH]cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1799381238 NVABFDSUJOUIOL-CLLJXQQHSA-N 404.854 2.348 10 20 HECD O=C(c1cccc2cnccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249488 PAKVLDSEEUBRJM-UHFFFAOYSA-N 404.426 2.172 10 20 HECD CC1(C)CC(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1843442813 ZNQQLDPHLZNSLK-UHFFFAOYSA-N 408.502 2.419 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1ccc(S(N)(=O)=O)cc1 15360396 MINLQDFOIUMMKT-UHFFFAOYSA-N 423.560 2.145 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)COCC(F)(F)F)CC2)cc1 726248451 WMHQCMGLHXBGJP-OAHLLOKOSA-N 418.460 2.084 10 20 HECD NC(=O)c1cccc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 727469046 OWVCQOOKHWXNIB-UHFFFAOYSA-N 420.492 2.331 10 20 HECD CC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@H](C)O1 732207938 DBDORSBFDNTZIR-YJBOKZPZSA-N 419.547 2.424 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3nnc4ccccn34)CC2)cc1 735568369 FBMMVHUDGOJDCQ-UHFFFAOYSA-N 409.494 2.072 10 20 HECD COC[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746756821 LCHOPOHXJFUBPA-LEWJYISDSA-N 424.545 2.445 10 20 HECD CNC(=O)[C@@H](C)CN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747967789 YKMPGZLVVXEGBI-UONOGXRCSA-N 407.470 2.103 10 20 HECD CC(C)(CNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(C)(=O)=O 748965030 SATSJMYILRQFJG-CYBMUJFWSA-N 419.494 2.379 10 20 HECD Cc1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1C(=O)N(C)C 749730782 DUURSCHGEZLVKM-UHFFFAOYSA-N 406.533 2.390 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(CN(C)C(C)C)CC3)CC2)cc1 754029467 IJQJDZHSAYCDIN-QHCPKHFHSA-N 418.626 2.230 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2cccc(I)c2)ccc1O 757658143 WWKPHAGEVLBNHQ-UHFFFAOYSA-N 419.196 2.496 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(C)cc3[N+](=O)[O-])CC2)cc1 758221327 BALJCMKKLLBFTO-GOSISDBHSA-N 401.463 2.474 10 20 HECD COc1cc(N2CCN(C(=O)NCc3c(C)noc3C)CC2)cc(OC)c1OC 759245989 PCYQIQLGSUPTDK-UHFFFAOYSA-N 404.467 2.349 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@H]3CO)cc2)C1 762274202 YQYMSWRWUWHCEV-DENIHFKCSA-N 422.529 2.190 10 20 HECD Cc1cc(NC(=O)CN2CCN(Cc3cccc(Br)c3O)CC2)no1 768226970 DKZBAIIGYREKMC-UHFFFAOYSA-N 409.284 2.207 10 20 HECD O=C(CS(=O)(=O)C1CCCC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915337 KIRZNJZBROYFAV-INIZCTEOSA-N 414.955 2.484 10 20 HECD CCN(CC)c1ccc(CN2CCN(S(=O)(=O)CCCOC)CC2)cc1F 770345997 BORHQVDEUWLUII-UHFFFAOYSA-N 401.548 2.156 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773164473 BBFQLMMQFRBDPM-MRXNPFEDSA-N 404.536 2.400 10 20 HECD CCC(=O)[C@@H]1CCCCN1C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 773538902 QYFMOEOMLOVTEL-DUQGCJEPSA-N 413.518 2.260 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2nnc(S)n2c1 774015669 ZZYNGSGKZOUHEN-UHFFFAOYSA-N 401.467 2.048 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3=CCCCC3)cc2)C1 774685503 IAJAXQQQOGTXHZ-IBGZPJMESA-N 412.534 2.011 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3CC3(Cl)Cl)CC2)cc1 775159378 DUGGJKXGXLVAAU-CYBMUJFWSA-N 400.306 2.044 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4cccc(C)c4)CC3)CC2)cc1 779217341 UJSKWEOKUDNWPP-XMMPIXPASA-N 424.589 2.309 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CN(C)C(=O)c4ccccc43)cc2F)CC1 783323172 ZLFYVWDLRZJXGB-HXUWFJFHSA-N 424.520 2.453 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)[C@@H](C)C[S@](C)=O)c([N+](=O)[O-])c1Br 784384379 BSTJTGIWSQLDKL-GZADNHSOSA-N 410.246 2.477 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccccc1Cl 786681913 JVGNYJQZXWFXAA-UHFFFAOYSA-N 415.921 2.494 10 20 HECD CCCC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 787320978 BMVKEFMNBHUUJC-HXUWFJFHSA-N 414.550 2.010 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3ccnn3)c2C)cc1 787625637 YSZPBWAMEKBZIL-UHFFFAOYSA-N 410.430 2.288 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(CCO)Cc2cccnc2Cl)cc1 788952789 WXCHZZAUDYSDRR-UHFFFAOYSA-N 418.925 2.219 10 20 HECD COc1cc(OC)cc(N2C[C@H](C(=O)NCc3ccc(OC)cc3O)CC2=O)c1 794377051 LDJZUAXZZATJFY-CQSZACIVSA-N 400.431 2.087 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)[C@@H]3OCCc4sccc43)nc12 795481872 RJXYUBMUSOWSLF-DIFFPNOSSA-N 402.476 2.465 10 20 HECD O=C(NC[C@H](CO)[C@@H]1CCOC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 797466764 QTAPMTHDBWZIJL-OAGGEKHMSA-N 413.465 2.201 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 801625751 LILZZJQWOSXUMM-HNNXBMFYSA-N 418.454 2.380 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(OC(C)(C)C)n2)cc1F 803663713 XUIYSHZTLKDWRC-UHFFFAOYSA-N 402.470 2.397 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1F 804853735 UCHUCRMXJUOITB-HKUYNNGSSA-N 404.530 2.231 10 20 HECD CCCN1CCC[C@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 807548900 HFDMQHXLFPKCSQ-KRWDZBQOSA-N 420.554 2.418 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c(O)c1 811484643 GECAABIARANPLD-UHFFFAOYSA-N 418.393 2.014 10 20 HECD CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@H]1CCCO1 812269121 NVRIZUFMGWFBMW-MRXNPFEDSA-N 408.462 2.446 10 20 HECD NC(=O)c1cnc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)s1 824136054 SZTCKUVHJZVGAL-UHFFFAOYSA-N 422.378 2.178 10 20 HECD CN(C)[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cncn1C 857456516 OLWIZTAKCVXBJT-KBXCAEBGSA-N 407.465 2.409 10 20 HECD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1 912559254 WRLSQXNPJFSFAQ-UHFFFAOYSA-N 400.388 2.399 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)CN3CCCCC3)CC2)cc1 916196416 FHSVMEKLRUZDMZ-FQEVSTJZSA-N 417.598 2.381 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C3CCCC3)cc2F)C[C@H](C)O1 917710036 AAUIOKPAMQXKAL-GJZGRUSLSA-N 412.527 2.413 10 20 HECD CCOc1ccc(N2CCN(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1 1116414464 QMJBJWGWPXRNJO-UHFFFAOYSA-N 404.492 2.087 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cnc3c(cnn3C)c2)cc1 1320441319 VZPAQNNZJUXTEB-UHFFFAOYSA-N 411.491 2.080 10 20 HECD CCc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1C 1844579451 FCUHMWFTSSWDAY-UHFFFAOYSA-N 418.881 2.178 10 20 HECD C[C@@H]1NC(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)=NN(c2ccccc2)C1=O 109189890 FPWNULWKXAZSDN-IRXDYDNUSA-N 421.501 2.039 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(-n4cccn4)ccn3)cc2F)CC1 303666709 CIBPTOQAFATQCG-UHFFFAOYSA-N 408.481 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)CN(CCC(N)=O)c3cccc(C)c3)CC2)cc1 726376763 XDLCLHHPRICXQX-UHFFFAOYSA-N 410.518 2.034 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3c4ccccc4C[C@H]3O)CC2)cc1 726848437 PVDRVCLHUUFQRK-PKTZIBPZSA-N 424.545 2.165 10 20 HECD NC(=O)CCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCC3)cc2)c1 733632142 VBJFARCVILNNJC-UHFFFAOYSA-N 409.490 2.214 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1 734017445 IRIWYGCWNVVAFI-ASSNKEHSSA-N 403.479 2.154 10 20 HECD CC(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738889088 SVAXDSNSVXRNPR-UHFFFAOYSA-N 416.503 2.202 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(c4ccccc4)=NO3)CC2)cc1 742919848 KVRPIOQRZAHSTG-QFIPXVFZSA-N 408.502 2.127 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 743888503 VIVRCVNRGUKATN-AWEZNQCLSA-N 418.471 2.387 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccc(C(N)=O)cc1 751464292 CKISFGNJHVESNV-UHFFFAOYSA-N 413.293 2.464 10 20 HECD NC(=O)c1ccc(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)o1 752020973 OBMIXHPLHOBDAI-UHFFFAOYSA-N 408.405 2.448 10 20 HECD CN(CC(=O)N(C1CCCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 756646411 WDBXQYLPYWVMNR-QGZVFWFLSA-N 408.520 2.200 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)Oc3cccnc3)CC2)cc(OC)c1OC 759225176 MFLNQMDSWZDTLC-HNNXBMFYSA-N 401.463 2.224 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)OC[C@H]3CCCCO3)CC2)cc(OC)c1OC 759241568 SKNHBYXFRCOVRR-SJLPKXTDSA-N 422.522 2.335 10 20 HECD COCCNS(=O)(=O)c1cccc(CNCc2cc(Cl)cc(OC)c2O)c1 761205454 DSZGZUWYBBIVOM-UHFFFAOYSA-N 414.911 2.269 10 20 HECD C[C@@H](NCCCN1CCC[C@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765798577 UZLOWROBIASUFE-SJORKVTESA-N 408.974 2.415 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 768254279 DCGVNPUBBGMJDQ-NBOOPKSLSA-N 409.502 2.121 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(Oc4ccccc4)C3)CC2)cc1 778257445 SIEPUECCTJWZSH-QXMHVHEDSA-N 421.497 2.190 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1 778602864 BFLDQOJINQSDPB-SNVBAGLBSA-N 401.394 2.241 10 20 HECD COC(=O)COc1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781045636 MWDWFYXRBBOWOD-UHFFFAOYSA-N 411.458 2.159 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1c2c(nn1C)CCC2 785191733 GJNJDNORGGBFCU-UHFFFAOYSA-N 421.295 2.364 10 20 HECD CNc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1[N+](=O)[O-] 786258279 BFYQIBIPOQUBIX-UHFFFAOYSA-N 411.462 2.235 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(OCCN(C)C)c1)c1ccc(N(C)C)cc1 787178441 WJCCUXRLPXKKMC-KRWDZBQOSA-N 412.534 2.187 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1 788928717 CDXBKSZJAFAXAL-UHFFFAOYSA-N 411.502 2.279 10 20 HECD C[C@H](O)[C@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)Cc1ccccc1 791417262 KIBKQECZZHCKJW-XOBRGWDASA-N 406.504 2.123 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ncccc3Br)cc2)C1 793131600 KHRJHGFNYJCWHW-AWEZNQCLSA-N 417.307 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cncc(OC(C)C)c3)CC2)cc1 801406249 NYJGZINBOVFBKJ-UHFFFAOYSA-N 413.474 2.383 10 20 HECD COCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802528399 YFCATNXYDWNDGY-UHFFFAOYSA-N 422.533 2.383 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)C[C@@H]3CCCOC3)ccc21 803003351 YJXSKWWRNXNRNW-MRXNPFEDSA-N 408.520 2.391 10 20 HECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CC[C@H](C)C1 803303262 JTLDSSOLRUHRFN-UEXGIBASSA-N 417.550 2.364 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCS[C@@H](C(C)C)C3)CC2)cc1 804315073 DUCNQMMNBMRZCI-LJQANCHMSA-N 405.564 2.380 10 20 HECD Cc1ccc(C(=O)N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c(O)c1O 804764594 ZLYNQIXAQRKQDT-OAHLLOKOSA-N 405.495 2.173 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809527180 YZKPXPNYPRIFJV-KBXCAEBGSA-N 415.490 2.425 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3[C@H]4CC[C@H]3CC(=O)C4)cc2F)C[C@H](C)O1 809980435 OASBZWATATZFFI-LAQRGFTBSA-N 403.498 2.251 10 20 HECD CCOC1(C)CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 813594432 JGXYCTPMAYJNGH-SFHVURJKSA-N 402.539 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@@H]4[C@H]5CC[C@@H](C5)[C@H]4C3)CC2)cc1 818440027 RAHMQENWXGQIBY-KRFLELSMSA-N 409.530 2.405 10 20 HECD Cc1cc(C(=O)O)ccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 871823150 GNQRLFLIIKDQQT-UHFFFAOYSA-N 408.451 2.147 10 20 HECD CC(=O)Nc1ccc(F)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919840015 NKDYHOGUZKJCAH-UHFFFAOYSA-N 405.451 2.271 10 20 HECD CN1CCN(c2ccccc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 1322797940 XTGQEWWBKFCRDN-UHFFFAOYSA-N 412.509 2.344 10 20 HECD COC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426860 YCYLKJMLAGYZTA-UHFFFAOYSA-N 413.430 2.194 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccn1 1795001031 VWTHXRGKBFDRGY-BEVBHUTCSA-N 409.442 2.164 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1802223868 YBAWZVDPOQXOMR-SKWUIDRYSA-N 424.501 2.033 10 20 HECD Cc1nscc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1807853824 XHWHGNBNBUHAJX-UHFFFAOYSA-N 416.503 2.416 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)cc1 327692990 TWISKCJIUGYVPR-UHFFFAOYSA-N 404.853 2.211 10 20 HECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1C 532679581 OLRZPKVCMXOLKQ-UHFFFAOYSA-N 407.492 2.462 10 20 HECD CC(C)OC(=O)c1cccc(-c2nnn(CC(=O)NCc3ccc(N(C)C)cc3)n2)c1 727364931 XJVTZYDAFZEBTJ-UHFFFAOYSA-N 422.489 2.288 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1F 728141226 BOLVHSWSSVBPHK-UHFFFAOYSA-N 418.444 2.122 10 20 HECD CC[C@@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 730191385 VRQQHKQKOLICAW-MBFWDRTGSA-N 423.585 2.467 10 20 HECD CCN(CC)c1ccc(CNC(=S)NCc2ccc(S(N)(=O)=O)cc2)cc1F 731317306 CNWXKEFGFHPJSK-UHFFFAOYSA-N 424.567 2.484 10 20 HECD COC(=O)/C=C1\SCC(=O)N1CCCN(Cc1ccccc1O)C[C@H]1CCCO1 731844261 FJIZVJHHHBEMTK-SYERDGIWSA-N 420.531 2.353 10 20 HECD CC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@H](C)O1 732207936 DBDORSBFDNTZIR-MAUKXSAKSA-N 419.547 2.424 10 20 HECD C[C@H]1CC(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 742096292 VUJZEHMYHVGPHG-PBBNAPBQSA-N 423.585 2.467 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3cn4ccccc4n3)CC2)cc1 742948537 XKQFAJVFIYTGPA-UHFFFAOYSA-N 422.533 2.007 10 20 HECD C[C@@H]1COCCN1CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745802372 LKOQZBHFBIFLGG-CVEARBPZSA-N 412.481 2.277 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccccc3OCCC(N)=O)CC2)cc1F 753877901 DQPPBXQSBQQBBI-UHFFFAOYSA-N 416.453 2.443 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(N)nc(Cl)c3)CC2)cc(OC)c1OC 760084161 LENNHILJRMYYEK-UHFFFAOYSA-N 406.870 2.305 10 20 HECD O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NCCc1ccc(O)c(O)c1 762268605 OAQRLKOGJAKHRS-HNNXBMFYSA-N 417.849 2.315 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1 768398586 QAVHSGUYRWFXDT-ACJLOTCBSA-N 423.510 2.244 10 20 HECD CC(C)CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773739544 DEHCFFWVTIUMOH-AWEZNQCLSA-N 406.504 2.393 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3)cc2F)C[C@@H](C)O1 774458154 KGYUESDEGXTSRZ-CALCHBBNSA-N 413.493 2.414 10 20 HECD CCc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786122282 QBLVXHRJGFUIPZ-UHFFFAOYSA-N 401.532 2.396 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1)c1ccc(N(C)C)cc1 788827845 PGKCKYGTBXSSDN-KRWDZBQOSA-N 405.502 2.491 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)CN1CCCC1 789854832 FEPKXANMJHRTNL-UHFFFAOYSA-N 418.607 2.094 10 20 HECD Cn1cc([C@H]2CSCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 790220510 XHMCNKKKRRFRII-LJQANCHMSA-N 419.526 2.396 10 20 HECD CC1(C)CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793733627 NGSUMTHVGLEAHR-KRWDZBQOSA-N 414.550 2.090 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccnc1-n1ccnc1C 793800353 FYSPVNZCQJBFFT-UHFFFAOYSA-N 407.474 2.336 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@]2(CCCOC2)O1 796523532 FAVQJPRHCMXAKP-HRAATJIYSA-N 407.486 2.142 10 20 HECD O=C(NC[C@H](CO)[C@H]1CCOC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 797466765 QTAPMTHDBWZIJL-XHSDSOJGSA-N 413.465 2.201 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1F 804853588 SETRBQJPNATHQC-GOSISDBHSA-N 404.530 2.375 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 804958018 GPTMNXUUUIIMKP-GASCZTMLSA-N 422.526 2.379 10 20 HECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)NCCCSc1nccs1 806279947 FRTKBPSUBQUSAQ-CQSZACIVSA-N 407.517 2.390 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1COC2(CCCCC2)O1 806700810 VVSXPGXLULYTRR-LJQANCHMSA-N 403.523 2.293 10 20 HECD COC1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768196 FEHJSZCDHAYTHW-CQSZACIVSA-N 411.449 2.010 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(F)c1 919729974 JCQBKAXRSWIWJD-UHFFFAOYSA-N 407.467 2.099 10 20 HECD O=C(CNS(=O)(=O)c1ccccc1)N(Cc1ccco1)Cc1ccccc1O 1325903542 NFARSXDPRWHLAK-UHFFFAOYSA-N 400.456 2.493 10 20 HECD O=C(CC1CCC1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1785433909 ANZOJQXLRJURDM-HXUWFJFHSA-N 408.882 2.385 10 20 HECD CC(C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794008394 VRQIXGPVXYCKHW-BEVBHUTCSA-N 418.490 2.270 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)C(F)F)[nH]n1 1823475544 WJDRDAJDTRLVIF-HOSRBBHYSA-N 422.388 2.497 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCS(=O)(=O)c1ccccc1 7228888 HSPNRXNXJQIIIL-UHFFFAOYSA-N 418.515 2.118 10 20 HECD Cn1cc(/C=C\C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)cn1 206127593 HNYDAPOESDNTAV-YVMONPNESA-N 400.504 2.197 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)n(C)c2ccccc12 472798197 WPNPYOCMORDGNR-UHFFFAOYSA-N 402.458 2.381 10 20 HECD COc1ccc(COCCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 727488576 YUVUTIOGAHNWQD-UHFFFAOYSA-N 408.476 2.109 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc4onc(CC)c4c3)nc12 728101673 RSDWSLSKMSUSJA-UHFFFAOYSA-N 411.374 2.067 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 731215059 HDOLOROGLSUMCQ-UHFFFAOYSA-N 418.515 2.439 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)CCO4)cc2)C1 734011381 GYMRNHUGWGLEAA-FQEVSTJZSA-N 422.529 2.365 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1 734017052 YXLKCYIBNGLGRD-MRXNPFEDSA-N 410.426 2.106 10 20 HECD CC[C@H](COC)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 738988927 JHXFETYPKBJWSG-QGZVFWFLSA-N 416.501 2.167 10 20 HECD C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 741015518 BZBGFQKWRSYXPT-BRWVUGGUSA-N 421.513 2.083 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C2CC2)[C@H](C)O)c1C 745742580 AJYJVSRCRPPHLB-HRAATJIYSA-N 412.486 2.404 10 20 HECD C[C@H](CS(C)(=O)=O)N(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905607 OYGRJRUAGJHHOX-ZIAGYGMSSA-N 419.494 2.331 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cn1C 745994592 ILSSKNSLFIPHPG-UHFFFAOYSA-N 421.456 2.465 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 748054403 XMGRSVVMBCJWEX-CQSZACIVSA-N 408.476 2.332 10 20 HECD O=C(CCc1cccc(F)c1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749848987 RKWRIZTYINPEHN-UHFFFAOYSA-N 408.470 2.449 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c1 751108634 PDGVMOXOCWRMPL-UHFFFAOYSA-N 420.487 2.113 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC(C)(C)c3ncc(C)s3)CC2)cc1 754699576 LXNOURBIEISNOT-GOSISDBHSA-N 404.580 2.468 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757248904 SBYKBJRVIHYBOG-UHFFFAOYSA-N 410.396 2.074 10 20 HECD CS(=O)(=O)NCc1ccc(NC(=O)NCCCSc2nccs2)cc1 758610782 NVXSVYMXRUVHMR-UHFFFAOYSA-N 400.551 2.496 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 759590894 BKHHKGCVYUSOLP-INOIBHSTSA-N 401.390 2.393 10 20 HECD CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 765697268 OGQJIQSCFVAHRP-YJBOKZPZSA-N 424.567 2.025 10 20 HECD C[C@H]1CN(C)[C@H](C)CN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 770161569 GPWPVRMGWHVLGG-OLZOCXBDSA-N 409.533 2.419 10 20 HECD Nc1nsc(N2CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)CC2)n1 770301781 CHDSSPYQQMIBSH-UHFFFAOYSA-N 403.512 2.341 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1ccc2c(c1)S(=O)(=O)CC2 772073817 AXSGSJLPCOLWLK-UHFFFAOYSA-N 406.847 2.344 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773854055 AHFKAVZYIAOGLE-OAHLLOKOSA-N 412.490 2.036 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl 774356094 HRDUTAPFFHGRIV-UHFFFAOYSA-N 417.849 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)N(C)CC4)CC2)cc1F 776054676 WZLBHDJYOFLDOU-UHFFFAOYSA-N 412.465 2.114 10 20 HECD CCOC(=O)c1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 778614600 VMEHQBOWIKDOLZ-UHFFFAOYSA-N 422.478 2.318 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O 779484193 ATDAHZUVLFEYIR-OXJNMPFZSA-N 420.531 2.167 10 20 HECD Cc1ccc(CN(CCO)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 783031914 UXAGVEOCNWNJBS-UHFFFAOYSA-N 415.509 2.081 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccccc2F)c2nccn2C)cc1 785605439 PKLMGPSCHQCCSL-IBGZPJMESA-N 409.465 2.147 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1 787298152 JZGKKIFLKCILSO-UHFFFAOYSA-N 413.493 2.336 10 20 HECD CN(Cc1ccccc1)C(=O)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 787754092 KLLUKHIOVWSYIS-UHFFFAOYSA-N 422.529 2.018 10 20 HECD CC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCO1 789823024 CFZPETDAWSBBQL-PONJGIIJSA-N 421.513 2.083 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCS1 789825507 MMGFCIJABVITME-HLLBOEOZSA-N 423.554 2.410 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 791246024 JUQUIUUPFCNCIN-UHFFFAOYSA-N 403.439 2.180 10 20 HECD COc1cc(N2CCN(c3nnc(-c4ccccn4)n3C)CC2)cc(OC)c1OC 800768722 PLZHJKYFLUOSNQ-UHFFFAOYSA-N 410.478 2.230 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOc4ccccc4C3)CC2)cc1 804315778 RQPBONLDSOYHGW-UHFFFAOYSA-N 409.486 2.201 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCN(C)C[C@@H]3C)cc2)CC1 805025664 SVVOAEKRLGXKNN-GHTZIAJQSA-N 400.567 2.338 10 20 HECD CCc1nc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cs1 805192167 AKDOOELTMZDBJX-UHFFFAOYSA-N 402.520 2.069 10 20 HECD Cc1noc(C)c1CO[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806279090 DRVRCNOXMPDOKR-CQSZACIVSA-N 424.548 2.164 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN([C@H](C)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807677168 MDWIPSSKKSJWPM-ZIAGYGMSSA-N 400.445 2.025 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)C1CCN(C(=O)OC)CC1 807832267 KBFHNCVDNAEUSZ-MRXNPFEDSA-N 418.538 2.084 10 20 HECD CCc1nocc1CN(C)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 818555851 WUYLIGUPMZPARD-KTKRTIGZSA-N 412.490 2.109 10 20 HECD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC(CO)CC2)cc1 917085686 WQJJNDWHXANKPO-UHFFFAOYSA-N 420.491 2.063 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2)C1 917833967 FDRRUHYRBVJUCY-HNAYVOBHSA-N 424.476 2.270 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N(CCO)Cc1ccccc1 918219177 GNMWKFIGWPRPHW-UHFFFAOYSA-N 401.482 2.491 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cncc(C(F)(F)F)c2)C1 1844545122 IHADWQQJCQSXHB-UHFFFAOYSA-N 422.363 2.037 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N(C)C 730279217 LNCPZWVZYLOZRU-HXUWFJFHSA-N 414.529 2.145 10 20 HECD Cc1nc2nc(N)nn2c(C)c1CCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735516311 OEALEXJMYMXCGF-KRWDZBQOSA-N 424.505 2.169 10 20 HECD C[C@H]1[C@@H](C)N(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@]1=O 736630295 YWVCVMYHEWSIGP-JFTGJMIGSA-N 410.495 2.242 10 20 HECD O=C(c1ccccc1)c1ccc(O)c(CN2CCN(C(=O)CN3CCCC3)CC2)c1O 738162033 WMOTUUFRRXOVFF-UHFFFAOYSA-N 423.513 2.069 10 20 HECD CC[C@@H](COC)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 738988926 JHXFETYPKBJWSG-KRWDZBQOSA-N 416.501 2.167 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc(C)n4ccccc34)CC2)cc1 741354077 NJOOYEGRHCIMHH-UHFFFAOYSA-N 408.458 2.157 10 20 HECD CN(c1ccc(CNC(=O)NCCS(=O)(=O)NC2CC2)cc1)C1CCCCC1 743346529 BPHHWFLQTBSMPU-UHFFFAOYSA-N 408.568 2.337 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCN1CCO[C@@H](C)C1 745792658 QPBSDMPIQDNFFI-ZDUSSCGKSA-N 400.317 2.407 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1 745823575 WBGCICRBJOJHME-UHFFFAOYSA-N 403.413 2.296 10 20 HECD CCCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746364889 VUCZMEHQWZIOIR-UHFFFAOYSA-N 417.485 2.038 10 20 HECD CNS(=O)(=O)[C@H]1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 750053854 UXCCULTYGBWKAP-SFHVURJKSA-N 409.939 2.440 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]([C@@H]4CCOC4)C3)CC2)cc1 750241260 DMLHKVROYRMATC-WOJBJXKFSA-N 416.566 2.275 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(Br)cn3C)nc12 751640713 GLYKDODBWUWWMB-UHFFFAOYSA-N 423.223 2.070 10 20 HECD CCOCCC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 752211933 MEIOGTSQRXIUIP-SFHVURJKSA-N 402.539 2.394 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@H]3c3noc(C)n3)CC2)cc1 754015059 ZAEHMMOLOVIXMD-FPOVZHCZSA-N 415.538 2.097 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)C(=O)OC4)CC2)cc1F 754039641 BEFSKXYYRDFBCP-UHFFFAOYSA-N 406.435 2.016 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(c4cccnn4)CC3)CC2)cc1F 759633535 VYXYCOFQRFYOKJ-UHFFFAOYSA-N 414.485 2.125 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)NCc1cccc(Br)c1O 766199252 BZRDAGPSMZAADV-UHFFFAOYSA-N 402.314 2.492 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)CC2)cc1 769153503 HWBNZYYHFRPYAC-VXKWHMMOSA-N 416.566 2.341 10 20 HECD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)n1 772773758 DRJSYEGMMBXIAD-ALCCZGGFSA-N 423.429 2.194 10 20 HECD C[C@@H](NC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 773627302 XEWQXXIZPPPPLV-CQSZACIVSA-N 420.491 2.495 10 20 HECD C[C@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 774243997 MODQEDUDAJUINA-HLLBOEOZSA-N 407.942 2.422 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(N3CCCS3(=O)=O)c2)c1O 775069635 RMFGDYGTBQBSKM-UHFFFAOYSA-N 407.448 2.139 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nnc2n1CCCCC2 775222352 DKIJNIWYRGFJJG-UHFFFAOYSA-N 412.538 2.124 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 778462954 MQHYVCGQXBUBIZ-UHFFFAOYSA-N 413.839 2.298 10 20 HECD Cc1cc(Br)cc([C@@H](C)NCCNS(=O)(=O)Cc2ccon2)c1O 779026670 DMGAXAHJSKXBIK-LLVKDONJSA-N 418.313 2.221 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 783316141 IQOOOQVYOBEWPD-UHFFFAOYSA-N 422.485 2.354 10 20 HECD Cc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc2cccnc12 783693302 LJGSTTQLOWQMOA-GXDHUFHOSA-N 407.542 2.294 10 20 HECD O=C(COC(=O)c1cccc(I)c1O)c1ccc(O)c(O)c1 784696104 UAWBZURBHPRGOK-UHFFFAOYSA-N 414.151 2.448 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 785868453 DHZMNFDIHLODIJ-IRXDYDNUSA-N 405.539 2.135 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(Cl)nc3)cc2)CC1 786119662 BDPSMPDAJJXBJR-UHFFFAOYSA-N 422.938 2.023 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(NC(C)=O)cc3)CC2)cc1 786229024 NAHNCHNBRLYCKS-UHFFFAOYSA-N 424.501 2.009 10 20 HECD COc1cccc(OC)c1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786257136 NHNYBAREMFGNQU-UHFFFAOYSA-N 411.502 2.231 10 20 HECD CCOc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788319600 MGOBPWMSAGRJLN-QGZVFWFLSA-N 411.502 2.416 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(Cn2cccn2)cc1)c1ccc(N(C)C)cc1 788465437 XOTXGDGBXRFEKA-QGZVFWFLSA-N 405.502 2.491 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)O1 789835548 PORHZDDRYZIMOJ-NUALHRCUSA-N 421.513 2.128 10 20 HECD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 794243109 FWFHQXMWDORLSZ-BWTSREIZSA-N 401.507 2.252 10 20 HECD COC[C@H](C)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248974 NLCJGORUOZTIIX-YOEHRIQHSA-N 415.556 2.273 10 20 HECD COc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661706 KNLZNLFDGVILKT-UHFFFAOYSA-N 403.454 2.054 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1 804316158 ZLLVOTOWTBBIFQ-UHFFFAOYSA-N 424.545 2.471 10 20 HECD CC(=O)C(=O)COC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 808483599 PBBMZRYHGISLCJ-UHFFFAOYSA-N 423.874 2.232 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3C[C@H](c4ccccc4)OC3=O)cc2)CC1 809793283 BNLFFYRYUDCVRT-FGZHOGPDSA-N 421.497 2.276 10 20 HECD Cc1nccnc1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 818543469 CYLZFKFNPFPSMU-UHFFFAOYSA-N 418.500 2.325 10 20 HECD CCNC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 915777814 BOUPYBOHOIAOBG-UHFFFAOYSA-N 424.501 2.057 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3nc4ccccc4n3C)CC2)cc1 1335880493 CMQUOBBFNMPDPT-ICSRJNTNSA-N 423.561 2.416 10 20 HECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1cccn1 1800719273 GDJDGTAKDCWHJM-MHEUCROKSA-N 418.881 2.461 10 20 HECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c[nH]1 1807995756 IHOGWSQSFKLLTD-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C1=CCCS1 1816720402 QOXPPLUOMXOHQN-JTQLQIEISA-N 418.500 2.196 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C1=CCCS1 1816720403 QOXPPLUOMXOHQN-SNVBAGLBSA-N 418.500 2.196 10 20 HECD O=C(CC1CC1)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817035483 FXUOZNVPNFLSLI-ZDUSSCGKSA-N 421.548 2.062 10 20 HECD Cc1cc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)on1 1841930518 KDXUHWBEWBCVEO-UHFFFAOYSA-N 405.838 2.107 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](n4ccnc4)C3)CC2)cc1 728749425 QOMWOPSGAUZOGU-FQEVSTJZSA-N 412.538 2.060 10 20 HECD C[C@@H](NC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 735748216 CEFRZFAHOBNQQU-CYBMUJFWSA-N 422.482 2.192 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)cc1 737127275 PXOJXQNHIAKKCU-UHFFFAOYSA-N 406.490 2.428 10 20 HECD Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)nc2c1c(=O)n(C)c(=O)n2C 737493269 NBOUADYIRWQKPT-UHFFFAOYSA-N 423.517 2.057 10 20 HECD COC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CCO1 741795175 OEZQCXCWYHEANE-GOSISDBHSA-N 400.475 2.395 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 742267646 YUDRRHPFXPMWPD-UHFFFAOYSA-N 404.488 2.134 10 20 HECD Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 743900503 JMZWQUGTKGAFJH-UHFFFAOYSA-N 414.437 2.412 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H](O)c1ccccc1 746155586 OAKQIEXLVVOMJC-NRFANRHFSA-N 421.476 2.292 10 20 HECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 746173842 WWNIPKKVECETEG-HXUWFJFHSA-N 423.517 2.484 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCN(c4ccc([N+](=O)[O-])nc4)CC3)ccc21 746983275 XLTQYXUPMDQVLS-UHFFFAOYSA-N 410.478 2.404 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 748032243 DXRUTPMTVUWKKY-HSZRJFAPSA-N 422.485 2.102 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CCCN3S(C)(=O)=O)cc2)CC1 753070418 LDQMTDIHSOUSOS-LJQANCHMSA-N 408.568 2.146 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1F 753932102 RKBWTCIXTUWZGA-ZBFHGGJFSA-N 413.515 2.022 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)cc1 754750068 KPIAOWOKSBKAIK-UHFFFAOYSA-N 416.477 2.327 10 20 HECD CN(C)c1noc(-c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 758288633 FCZSKIRKRDXEEE-UHFFFAOYSA-N 405.392 2.217 10 20 HECD COCCC1(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCC1 761443046 QBIHGASCFGDVDM-UHFFFAOYSA-N 422.497 2.419 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2nnc(O)n2c1 762700115 QHQYBUSQZIMDSU-UHFFFAOYSA-N 403.389 2.435 10 20 HECD C[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(-n2cnnn2)c1 765241840 DTBDVUNBOGINLR-APWZRJJASA-N 405.506 2.215 10 20 HECD CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 765982193 IMMGTTMVDZJDKL-INIZCTEOSA-N 419.419 2.106 10 20 HECD C[C@H](c1ccccc1)[C@@H](CO)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 766979233 GMQQAXOSNMFTCP-DYESRHJHSA-N 415.509 2.033 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 767938341 WYRCRBNMLMOHGW-RTWAWAEBSA-N 418.607 2.417 10 20 HECD COc1cccc(CN2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1O 768155181 CRTRVNHHFDBAGG-UHFFFAOYSA-N 421.475 2.124 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ccc(F)cc3C)CC2)cc1 774700603 CQNXOOLAGBCKEV-UHFFFAOYSA-N 420.506 2.406 10 20 HECD COc1ccc(CN2CCN(C(=O)CN[C@H](C)c3cc(OC)ccc3O)CC2)cc1 775373741 VSECMRQRFIXHOH-QGZVFWFLSA-N 413.518 2.404 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)ccc2O)cc1C 775671766 AFVOMTWTGUDKFZ-UHFFFAOYSA-N 400.478 2.272 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C 785599362 BKXUWHIUDOFYKO-FQEVSTJZSA-N 423.492 2.456 10 20 HECD CN(C)CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)(C)C 789860409 LDKVSZVBBMLMGG-IBGZPJMESA-N 420.623 2.339 10 20 HECD Cc1noc([C@@H]2CCCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 796666969 FJTYXYAUFPTJCL-IBGZPJMESA-N 417.485 2.197 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCN1C 806037514 YONOFKVEXAEREZ-HKUYNNGSSA-N 412.534 2.473 10 20 HECD COCCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 806627543 IUCGGXNXEMRZHE-UHFFFAOYSA-N 412.490 2.221 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)N(C)CCO4)cc2)CC1 807355918 BWZNFZRMGMGLQT-UHFFFAOYSA-N 408.502 2.114 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(c2nnc3n2CCCC3)CC1)c1ccc(N(C)C)cc1 807674056 FKZOTKDNXYUEFM-INIZCTEOSA-N 424.549 2.264 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C3CC3)C(C)(C)CO)cc2F)C[C@@H](C)O1 815248529 CETSZNFHZPRHHO-XCGNWRKASA-N 421.557 2.442 10 20 HECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1 915220612 HRFSGMHCWXQVHJ-UHFFFAOYSA-N 423.560 2.016 10 20 HECD NS(=O)(=O)c1cc(NCc2ccc(N3CCC(CO)CC3)cc2)cc([N+](=O)[O-])c1 917391216 XNIAABKVVHGCGY-UHFFFAOYSA-N 420.491 2.063 10 20 HECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)ccc1O 917911613 JCNIBCMXHKQYEW-UHFFFAOYSA-N 408.501 2.122 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1 918305931 OWGDIXSNORABQA-UHFFFAOYSA-N 408.502 2.472 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 918311279 PLZBXXJTVJSQKT-UHFFFAOYSA-N 412.490 2.303 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2CCNS(C)(=O)=O)c(C)n1-c1ccccn1 918640384 UELXSMGHAXLKOD-KRWDZBQOSA-N 404.536 2.423 10 20 HECD O=C(CN1C(=O)NC2(CCCCC2)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 920496178 UARMCRXNUMHWFB-KRWDZBQOSA-N 415.490 2.155 10 20 HECD CCOC(=O)C1=S=c2nc(/C(Cl)=C/c3cccc4nccn34)nc(O)c2=C1C 1319829468 WSGDHOIELSANLU-XFXZXTDPSA-N 414.874 2.471 10 20 HECD COC(=O)CC(C)(C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1340963290 UUOUUYKGQXKLCP-IYBDPMFKSA-N 423.529 2.329 10 20 HECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccn1 1803008441 MGNRKWCINNFZOR-MHEUCROKSA-N 418.881 2.461 10 20 HECD C/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899337 FAYKKCLYYKMWFN-IJJSQOHJSA-N 409.577 2.043 10 20 HECD CNS(=O)(=O)C1CCN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 568794211 NTNFBMDPRVAGOA-UHFFFAOYSA-N 407.536 2.058 10 20 HECD Cc1ccccc1CS(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732216957 CLQAZJVVVBYOHB-GOSISDBHSA-N 401.532 2.316 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 734017033 XWIBCJWEBGNRRK-KSZLIROESA-N 400.475 2.383 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(N)=O)cc2)cc1 740813127 UHTJLVNLJYAAHA-UHFFFAOYSA-N 411.505 2.128 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccccc3OC)CC2)cc1 742947636 KCGOJHJISIZVSS-UHFFFAOYSA-N 412.534 2.368 10 20 HECD O=C(NCCCN1CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745251304 SNMNLMHNRVDSQD-INIZCTEOSA-N 412.481 2.278 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCC1(N2CCOCC2)CCCCC1 746492690 JUKRDCSTHGLHCZ-UHFFFAOYSA-N 416.566 2.103 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(F)c(C)c3)cs2)cn1 753978578 POZGHULWAYEQFK-UHFFFAOYSA-N 410.452 2.428 10 20 HECD NC(=O)c1ccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 754274834 QHZRPEQGNBDRSC-SFHVURJKSA-N 401.894 2.468 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 754772043 KFVKHQOPPPCNTH-BZUAXINKSA-N 403.502 2.140 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c2C)c1 758492779 MHARFRIHQDYPHJ-ZDUSSCGKSA-N 424.544 2.480 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccn(CCc2ccncc2)n1 759022282 KKMZZTHLWKLXEV-UHFFFAOYSA-N 418.501 2.376 10 20 HECD CC1(Cn2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn2)COC1 759113036 BNYACLVUHUVFHI-CQSZACIVSA-N 421.448 2.315 10 20 HECD CCOC(=O)C[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 761604025 WQTXAXNKZFCCGE-NSHDSACASA-N 412.489 2.326 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c(F)c(C(=O)O)c2)cc1 767736681 MHTWYGDIIMEOBF-UHFFFAOYSA-N 422.843 2.350 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3nccs3)cc2F)C[C@H](C)O1 773491109 UNZDNNXSAILFQT-STQMWFEESA-N 407.467 2.369 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H]1COC2(CCCC2)O1 773741784 NZXSBGMXTPBZEC-KRWDZBQOSA-N 407.486 2.272 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC(CO)CC3)cc2Cl)C1 774240720 BRGYZIAFSVKWMD-HNNXBMFYSA-N 407.942 2.423 10 20 HECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1Cc1ccc(N2CCN(C)CC2)cc1 775695421 XGUXUFWTDIKCEJ-QHCPKHFHSA-N 418.545 2.068 10 20 HECD C[C@H](NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 776129123 IUUDVTVEYHRRJL-SFHVURJKSA-N 409.534 2.462 10 20 HECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 777909327 XKNBRJDGTQMUJE-UHFFFAOYSA-N 405.476 2.180 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCc1cnn(-c2ccccc2)c1 786121820 ZTSGCHYDJLONPK-UHFFFAOYSA-N 415.544 2.286 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccn(C2CCN(C)CC2)n1 787454129 HMEICYQYAAFFNW-UHFFFAOYSA-N 412.538 2.203 10 20 HECD COCc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 787522111 YOCXFIWPRWSJSA-UHFFFAOYSA-N 413.543 2.319 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(Br)n3)ccc21 792973546 JEKWRQVCLMKXTD-UHFFFAOYSA-N 403.280 2.481 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CC(=O)N(CN(C)Cc2ccc(N3CCOCC3)cc2)C1 795400343 IYFNBUIVMKQOSC-QHCPKHFHSA-N 417.550 2.350 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1 799776688 UFPDAVDZNWADJZ-UHFFFAOYSA-N 400.497 2.220 10 20 HECD CCC(CC)N(CCOC)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306603 SEKDGNNUXBCTMB-QGZVFWFLSA-N 405.539 2.364 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(CC(F)F)CC2)cc1 803651004 TWOFZEIFWZRPLT-UHFFFAOYSA-N 410.509 2.337 10 20 HECD CN(C)CCN(Cc1ccccc1F)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663137 KHEJCXOFIYCRJB-UHFFFAOYSA-N 418.488 2.237 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H](N(C)Cc4ccccc4)C3)ccc21 803687954 SPJGNSXYKZXASI-JOCHJYFZSA-N 420.557 2.418 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccncc1 805762095 NHIQFLLLMFGZEJ-IBGZPJMESA-N 411.502 2.389 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CCO)c3ccc(Cl)cc3)nc12 805822820 WXIITAGWFPAOIJ-MRXNPFEDSA-N 404.854 2.478 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](CCN(C)C)C(C)(C)C)CC2)cc1 806389561 TYVPZVKTWWOAIR-FQEVSTJZSA-N 418.582 2.217 10 20 HECD CC[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1O 810225701 KJZFTRWWVDLQTM-WBVHZDCISA-N 415.456 2.385 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)CC34CCC(CC3)C4)cc2)C1 812494124 DYPFHPAPZUAKIH-NCYVPVAZSA-N 405.564 2.388 10 20 HECD Cc1c(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1C 813675519 FPFPBFMHUUAQAO-CYBMUJFWSA-N 400.451 2.277 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c1C 816713894 JMTQHXZAUYTQEN-UHFFFAOYSA-N 423.560 2.286 10 20 HECD Cc1nc(C)c(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)o1 1810547467 ZDYMDEAEZJHXPY-UHFFFAOYSA-N 414.462 2.256 10 20 HECD O=C(Cc1ccc2c(c1)CCC2)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249067 SHSHVSGKSQRACJ-UHFFFAOYSA-N 407.470 2.041 10 20 HECD CN(C)c1ccc(CNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1 115236861 YRHOTIBBAVQJJF-IBGZPJMESA-N 417.531 2.140 10 20 HECD CCC(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 303253779 BMJHAFRMWHGXRH-FQEVSTJZSA-N 404.530 2.375 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CNc3ccccc3OC)CC2)cc1 727753395 QCPZKMKMJKWUTI-UHFFFAOYSA-N 412.534 2.444 10 20 HECD CN(CC(=O)N1CCCc2cc(S(=O)(=O)N(C)C)ccc21)Cc1ccccc1O 732203144 QCCHXSSJHACKRX-UHFFFAOYSA-N 417.531 2.054 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C)C[C@H]3C(C)C)CC2)cc1 738970519 QVMGCLHGIYPBRC-QFIPXVFZSA-N 417.598 2.189 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCC[C@]34NC(=O)NC4=O)c2C)cc1 744623928 AUMBGTJNZTWZQB-NYHFZMIOSA-N 410.474 2.211 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1cccs1 745648812 PBXUVDOGKSGQAN-GOSISDBHSA-N 418.494 2.107 10 20 HECD Cc1nnc2n1C[C@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 750731842 WILBVXDBHSZWLV-JKIFEVAISA-N 401.486 2.218 10 20 HECD Cc1cc(C(=O)COC(=O)C(C)(C)NS(C)(=O)=O)c(C)n1-c1cccc(F)c1 751694929 FPASFQYKQZDPQI-UHFFFAOYSA-N 410.467 2.287 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 752341956 JYYJSBUBQYVEIY-ZDUSSCGKSA-N 419.507 2.363 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccccc4OC[C@H]3C)CC2)cc1 754272278 SDDASZFUAHQKKU-DENIHFKCSA-N 411.546 2.461 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3cccc(OC)c3O)cc(C3CC3)nc21 754422747 FSLPUZYKTKAGGY-UHFFFAOYSA-N 410.430 2.039 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1Cc1ccccc1 756767551 XVLNLYGUOXJRTB-UHFFFAOYSA-N 419.485 2.023 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 759496421 GCEVUCSSLDQAJS-UHFFFAOYSA-N 421.494 2.033 10 20 HECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCCCSc2nccs2)C1 759589493 JHLWXJJVILRIHE-UONOGXRCSA-N 400.570 2.198 10 20 HECD COC(=O)[C@]1(C)CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 759810834 SDBFKIYXWNEIDC-MCFFVMPBSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3ccc(Cl)nc3)CC2)cc1 760740469 BVGNAFOUDJDRKM-UHFFFAOYSA-N 417.941 2.408 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(N)(=O)=O)c(C)o1 761751729 AWMZLYJSWJUOTB-UHFFFAOYSA-N 417.281 2.366 10 20 HECD CC(C)CCn1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 766342472 GIEMUMGKMXHOEJ-UHFFFAOYSA-N 413.522 2.363 10 20 HECD CCC[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 770215597 ZJZOLTMEBXRZPI-GXZWQRSESA-N 410.486 2.150 10 20 HECD CCn1ccnc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1=O 773216381 NOHDDCXETKUNIE-UHFFFAOYSA-N 409.469 2.131 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c(F)cc1F 775286939 RDCJNDBKXOPFET-UHFFFAOYSA-N 401.343 2.044 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C(=O)NC(C)(C)C)CC3)CC2)cc1 776132440 PAAXUZQPWSYIEM-UHFFFAOYSA-N 417.554 2.499 10 20 HECD O=C(CN1CCC[C@]12CCOC2=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778248787 YEKWIRXVXJKPRC-HSZRJFAPSA-N 404.422 2.182 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)Oc3ccccc3)CC2)cc1 778277147 AKPNKIIXHCYVCC-HYSAVQALSA-N 423.513 2.484 10 20 HECD COc1cccc(C(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1OC 779506597 QNCYJKICVYGBRJ-CLFYSBASSA-N 412.442 2.113 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(N(C)C)cc1 786374142 HKTXGNFBCRUMRN-KRWDZBQOSA-N 422.529 2.482 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCC=CO3)cc2F)C[C@@H](C)O1 787054003 RNILPXRZQNENKW-SPYBWZPUSA-N 406.454 2.291 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2cc(Cl)ccc2C1 788320314 OWQVBIJMYLQNGZ-UHFFFAOYSA-N 413.905 2.378 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C12CCC2 789854909 HGGDMZJAPGUOQR-RBUKOAKNSA-N 417.575 2.320 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)CN3CCCC3)cc2)CC1 790190411 SHHNPEGNHFVRQQ-LJQANCHMSA-N 400.567 2.387 10 20 HECD CCn1ncnc1CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792835736 NIGZPRFTJJOUTQ-UHFFFAOYSA-N 412.416 2.153 10 20 HECD COC(=O)[C@@H]1[C@H]2CN([C@@H](C)C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)C[C@H]21 794987534 WPHHHUSKAWTXFB-KEHCIXGTSA-N 418.449 2.140 10 20 HECD CCN(CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 804256750 QAIFVXVSNIORET-UHFFFAOYSA-N 406.527 2.084 10 20 HECD COC[C@H](C)n1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)n1 807513376 ZQNGVBPJAUEZHZ-VIFPVBQESA-N 401.250 2.358 10 20 HECD O=C(COC(=O)C[C@H]1CCCC(=O)N1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808685963 TWVNDRZXSKGMKH-CYBMUJFWSA-N 420.421 2.003 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOC2=O)cc1 809426589 QQVJDKRLHTVHQE-UHFFFAOYSA-N 424.501 2.374 10 20 HECD Cc1cc(-c2nnc(N(C)CC(=O)N3CCOCC3)n2C)c(C)n1-c1ccccc1 809838878 DCWMWYAZJYLPHC-UHFFFAOYSA-N 408.506 2.185 10 20 HECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1O 915798049 YTPCTAGRYOGVOV-UHFFFAOYSA-N 421.475 2.124 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccnc3N3CCCC3)cc2)C1 917832486 BMQUUBZXBOKAMD-GOSISDBHSA-N 407.518 2.314 10 20 HECD CN(C)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918311289 PQTPDWCHUXLHRZ-UHFFFAOYSA-N 410.518 2.182 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)NCc3ccco3)cc2F)C[C@@H](C)O1 918632959 GBEZLKAFSTYLIC-GASCZTMLSA-N 418.469 2.148 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1 1324192689 PSPQMYAGKMLSNF-PMACEKPBSA-N 420.575 2.475 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1C[C@@]1(F)Cl 1804291671 TVTKIMADEGMJEI-GTBZPGQXSA-N 424.856 2.379 10 20 HECD CNC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 728516097 OAUVYGOKJBESSL-KBPBESRZSA-N 400.454 2.124 10 20 HECD Cc1cc(C(=O)CN2CCSC[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 738339892 JDOUOYYYXCOLJQ-AWEZNQCLSA-N 407.561 2.362 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCN2CCOCC2)NC(=O)OC(C)(C)C)cc1 742753868 MGKXBUBWEZTZFT-LJQANCHMSA-N 420.554 2.157 10 20 HECD Cc1nc(C)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 743654374 GTNHGAWFLAVPIQ-INIZCTEOSA-N 401.536 2.461 10 20 HECD CCc1ncsc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 750190330 GHQRJCXAMHCOIV-UHFFFAOYSA-N 407.467 2.154 10 20 HECD COC(=O)CN(Cc1cn(Cc2cccnc2)nn1)Cc1cc(Cl)ccc1O 753544174 UVLAHNSLVOWCQW-UHFFFAOYSA-N 401.854 2.256 10 20 HECD CN(C)c1ccc(CN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)C2CC2)cc1 753968798 XTTMWKFYPHWUFR-UHFFFAOYSA-N 420.579 2.383 10 20 HECD C[C@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)cc(F)c1O 756633696 KNRXPDAMPKOAQH-VIFPVBQESA-N 422.276 2.052 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O 757005704 KVJCSMPFDCGHFE-HUUCEWRRSA-N 400.523 2.424 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(F)cc3[N+](=O)[O-])CC2)cc1 758222072 FEJPILIXXGWFQA-QGZVFWFLSA-N 405.426 2.304 10 20 HECD COc1cc(N2CCN(C(=O)NCCC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 759265776 CSWRNCAFDFOXDV-UHFFFAOYSA-N 423.510 2.276 10 20 HECD O=C(CN1CCCC2(C1)OCCO2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761692406 UMQMXQIOBDUDAC-UHFFFAOYSA-N 406.438 2.239 10 20 HECD CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769735678 NGMPBRBAAARZFA-UHFFFAOYSA-N 409.483 2.107 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cn(C)c(Cl)n3)cc2F)C[C@H](C)O1 769894432 YZEWTGKWCFICPC-RYUDHWBXSA-N 416.906 2.305 10 20 HECD COCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 772955622 WDHSAIGDVCWHFK-UHFFFAOYSA-N 411.502 2.297 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)C2CC2)cc1 776076146 JXCJTQGBPMQXRO-LAUBAEHRSA-N 421.563 2.163 10 20 HECD CCC(CC)(CCO)CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778352500 VIOJDYCQDNCHQR-ZHACJKMWSA-N 417.550 2.205 10 20 HECD CO[C@@H](C)CCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782437059 LAMOCJFWIMEWRZ-HRCADAONSA-N 410.486 2.414 10 20 HECD C[C@@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CO1 784281304 FLWYIJIESBMZNQ-ANQUJSFKSA-N 408.470 2.024 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785422918 PQEMLLLIVVLKRV-UHFFFAOYSA-N 410.518 2.163 10 20 HECD Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 786225230 QPRPTVGCYKNIGI-IBGZPJMESA-N 415.509 2.498 10 20 HECD CCC(=O)Nc1cccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 787080270 IXYPHLPNMRKPAY-UHFFFAOYSA-N 408.502 2.350 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@H](C)O[C@H](CO)C3)c2C)cc1 787314226 BFOBGNDAHNSMHG-KXBFYZLASA-N 400.475 2.145 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F 788319524 LKKQORWVWTUWLL-HNNXBMFYSA-N 417.456 2.338 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)nc2ccccc12 788931131 FTSFSIIXIFELMF-UHFFFAOYSA-N 403.486 2.471 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2sccc2C1 789726434 ZFYXMPYYGLXQMC-AWEZNQCLSA-N 418.538 2.132 10 20 HECD CS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789800779 PVFJZTQIAXSVHA-INIZCTEOSA-N 409.527 2.023 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854257 GJJSVIDXPJHUDT-IBGZPJMESA-N 418.607 2.237 10 20 HECD C[C@@H]1OCC[C@]12CN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C[C@@H](C)O2 790666798 VEBWVBHFUBFFSY-VVBPWWLESA-N 421.513 2.265 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(OC)cc2O)ccc1Cl 797390721 OLMSLHKFTNXUCU-UHFFFAOYSA-N 406.822 2.486 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2n1CCCCC2 803663426 YTCHMELDWNAWAB-MRXNPFEDSA-N 416.501 2.093 10 20 HECD O=C(N1CCCC1)N1CCC[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 804190169 QDUVPCVMMNIYPW-MRXNPFEDSA-N 420.897 2.490 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2CCN(C3CC3)CC2)cc1F 804852879 HNUVNKMIZDZGGJ-UHFFFAOYSA-N 404.530 2.279 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](C(C)C)C3)cc2F)CC1 805007705 XZBQQYRDNFWHKV-IBGZPJMESA-N 418.557 2.478 10 20 HECD C[C@]1(c2ccccc2)CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 807291190 ULRHHBHYXRPKJW-XMMPIXPASA-N 405.498 2.453 10 20 HECD CCc1cnc(CCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 807771125 XEGLYPSEXOALSL-UHFFFAOYSA-N 416.547 2.112 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCCN(Cc2c(O)ccc3ccncc23)CC1 835184714 JUOFUECNTLYNSK-UHFFFAOYSA-N 416.503 2.442 10 20 HECD CCC[C@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1=O 917836352 LTGMWAGLXZHKLJ-UHOSZYNNSA-N 414.550 2.042 10 20 HECD NC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 918294754 UYYWXRLEZVOCKZ-UHFFFAOYSA-N 407.426 2.181 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)OC[C@H]3CCCCO3)CC2)cc1 921166908 SDXVQTLAWIWMGP-SIKLNZKXSA-N 419.566 2.298 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)c3cnn(C)c3C)CC2)cc(OC)c1OC 1320154738 YVADMFZQCOCULY-CQSZACIVSA-N 417.510 2.347 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2 1782003971 QMFUMBMFQHQWMJ-SOAGJPPSSA-N 424.856 2.087 10 20 HECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C24CC(C2)C4)C3)=NN1c1ccccc1 1796935441 JUXFYURKFHMYHK-IKKABONKSA-N 406.486 2.218 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccncn1 1800714833 KDWLHEDWYONBKG-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(Cc1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250344 NUFGLCJQCCFZNK-UHFFFAOYSA-N 406.442 2.034 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(C(F)(F)F)ccn2)C1 1844510679 JXZCTIQMUYQKFP-UHFFFAOYSA-N 422.363 2.037 10 20 HECD O=C(c1cc(Cl)ncn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501758 ZUWHQIDMHZIAED-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COc1ccc(N(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)C(C)C)cc1F 725815356 CYLBTQKMNISYKM-UHFFFAOYSA-N 423.510 2.055 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN(CC(F)(F)F)CC1 726235885 IKDAQUPDVHVGQC-UHFFFAOYSA-N 400.445 2.349 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)COCC(F)(F)F)CC2)cc1 726248450 WMHQCMGLHXBGJP-HNNXBMFYSA-N 418.460 2.084 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](n4ccnc4)C3)CC2)cc1 728749427 QOMWOPSGAUZOGU-HXUWFJFHSA-N 412.538 2.060 10 20 HECD O=C(CCNC(=O)N1CCc2ccccc2C1)NCc1ccc(N2CCOCC2)cc1 731869974 FNGSYDLFVWSDIC-UHFFFAOYSA-N 422.529 2.297 10 20 HECD CC(=O)NC(C)(C)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 744934278 JFDWOZUAPLKTAP-LBPRGKRZSA-N 422.437 2.247 10 20 HECD C[C@@H]1C[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C(=O)N1c1cnn(C)c1 745919909 XHZDDXOPXFZDFT-QRWLVFNGSA-N 410.522 2.354 10 20 HECD Cc1nc(-c2ccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2)n[nH]1 746146328 FYMVTJLOUDGQFN-LJQANCHMSA-N 418.501 2.412 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](c3ccccc3)n3cccn3)cc2)C1 747644469 BWMDYGCXTSJJER-IFMALSPDSA-N 417.513 2.491 10 20 HECD CCOC[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 747966863 LBNKLXDTNLMTKM-KRWDZBQOSA-N 419.547 2.283 10 20 HECD O=C(NCc1ccccc1O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 748442884 LMOQQHUYOWMRPQ-UHFFFAOYSA-N 412.490 2.387 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 753092333 BJAABBVUWDDHJQ-FYYLOGMGSA-N 416.566 2.464 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccnc(Br)c3)CC2)cc1 758202043 NFMRKXVMNHJOOL-UHFFFAOYSA-N 419.323 2.405 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(Cl)cc3C(N)=O)CC2)cc1 758222043 DGSBJKZGVMUQNJ-QGZVFWFLSA-N 419.909 2.009 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1S(C)(=O)=O 759017463 VDNYXAIROVOCOP-UHFFFAOYSA-N 413.499 2.030 10 20 HECD COc1cc(N2CCN(C(=O)c3c(C)nn(C)c3Cl)CC2)cc(OC)c1OC 759222857 LWVMSBXWFUWABV-UHFFFAOYSA-N 408.886 2.370 10 20 HECD COC(=O)[C@]1(C)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759810831 SDBFKIYXWNEIDC-DMPWYTOCSA-N 421.513 2.083 10 20 HECD CC(C)N1CCC(O)(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 761645502 ACVGGAPDLWVQJI-GOSISDBHSA-N 404.555 2.119 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)CC2)cc1 761652452 WHVVZPPIQBYAGE-NJYVYQBISA-N 402.539 2.074 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCCN3CCCO[C@H](C)C3)CC2)cc1 764368197 LAXCFJYKHKBJOU-GOSISDBHSA-N 404.555 2.464 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(-c4nc[nH]n4)c3)CC2)cc1 767204974 MIFNDTSLORNPMA-UHFFFAOYSA-N 420.517 2.422 10 20 HECD COCC[C@@]1(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCOC1 770262272 RMFJQXHGPMBVFD-VWKPWSFCSA-N 409.502 2.434 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cn3)cc2F)C[C@H](C)O1 772926276 ABRQLXJHXFCHTA-STQMWFEESA-N 404.417 2.228 10 20 HECD C[C@@H](Nc1cccc(C(=O)NCCC(N)=O)c1)c1ccc(N2CCOCC2)c(F)c1 777677568 VJPCRWGKAJKCRW-OAHLLOKOSA-N 414.481 2.441 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3sc(C)nc3C)CC2)cc1 778290776 XCRNIDKUHDKBGP-HJWRWDBZSA-N 414.531 2.290 10 20 HECD CSc1ccccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 780387812 TUZUDLBSTQYREL-UHFFFAOYSA-N 416.502 2.279 10 20 HECD CCCn1nccc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768459 YJGKFBLHRAKDBE-MRXNPFEDSA-N 419.913 2.371 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1 785295075 QOYZQXYWKVWMPH-ZDUSSCGKSA-N 408.414 2.366 10 20 HECD CC(C)CNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785298754 WVFOUANCOMJGJI-CQSZACIVSA-N 413.474 2.170 10 20 HECD C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785428313 KDTGFKSVIJOOMB-NVXWUHKLSA-N 418.538 2.131 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)cc1 785439765 VKUVSKXVXSYNLC-NRFANRHFSA-N 408.546 2.050 10 20 HECD COc1ccc(/C=C\C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1O 787319146 KVMMDJNCDFDAKK-POHAHGRESA-N 409.486 2.399 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(CN2CCCC2=O)cc1 787430542 YPVKWYRKNXTSFU-UHFFFAOYSA-N 422.529 2.116 10 20 HECD CC1CCN(CCCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 787894046 IGVNYVAFGORELM-UHFFFAOYSA-N 400.567 2.314 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3[C@H]4[C@@H]5C[C@@H]6[C@@H]7C[C@@H]([C@@H]4[C@@H]75)[C@@H]63)nc12 796322721 LRWMPCGDSBUDSE-YANARIQSSA-N 409.442 2.049 10 20 HECD COc1ccc(N2CCN(CCNC3CCN(CC(F)(F)F)CC3)CC2)cc1 800885786 MJTVCJUEWJYWLA-UHFFFAOYSA-N 400.489 2.434 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662896 IWHWCKIXKNJPQJ-CQEAQJRCSA-N 405.514 2.296 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC[C@H]1COC2(CCCC2)O1 806691553 KHMXYKCHTLGBSZ-FQEVSTJZSA-N 415.534 2.437 10 20 HECD CN(C)C(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387712 SOAFJTQTXYXWAO-UHFFFAOYSA-N 420.263 2.111 10 20 HECD COc1c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cccc1C(N)=O 807512821 KWDFBAPINOMQCW-UHFFFAOYSA-N 412.229 2.061 10 20 HECD CN1Cc2ccccc2[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 807677536 WCGCMXBXMOFBGA-FPOVZHCZSA-N 423.513 2.203 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@@H](CC(C)C)C3)CC2)cc1 808074174 PRXJBGVPGAONOT-NQIIRXRSSA-N 417.550 2.444 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3n[nH]c4c(OC)cccc34)CC2)cc1 808675297 CBFZMWPPCIXQEA-UHFFFAOYSA-N 424.457 2.086 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCC[C@@H]1CCO 809558727 ARCADCLVFGCUEG-DOMZBBRYSA-N 413.312 2.171 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1 813513862 UDRPWEQJZSWEIX-HNNXBMFYSA-N 419.499 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4cncc(C)c4)n3)CC2)cc1 813892096 BVWGPJPSLKLZGT-UHFFFAOYSA-N 421.501 2.458 10 20 HECD CCOC(=O)[C@@H](CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)=O 816890937 CPGFPWAESPMJIS-VBQJREDUSA-N 408.470 2.214 10 20 HECD CCOC(=O)NCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915026995 FSQDISBKEUKPII-UHFFFAOYSA-N 424.409 2.080 10 20 HECD Cc1cc(CCNC(=O)N2CCC[C@H](NS(C)(=O)=O)C2)c(C)n1-c1ccccc1 916221533 YWPLPFJJDCKBNS-IBGZPJMESA-N 418.563 2.360 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@H]4CN(c5ccccc5)C[C@@H]4C3)CC2)cc1 917082208 KWJWSOILJWAVEH-SFTDATJTSA-N 420.557 2.412 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 918062901 CXVDRHQYEWLQCT-UHFFFAOYSA-N 412.489 2.410 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(Cn2cncn2)cc1 918303307 BTBVQMXAEZMIJF-UHFFFAOYSA-N 406.490 2.380 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1N(C)C 918309321 WRBBXMIBXGUCOS-UHFFFAOYSA-N 410.518 2.495 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 918373266 UVUNFFXFXOXWJE-CQSZACIVSA-N 401.488 2.166 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cnc4ccccc43)cc2)C1 918674127 WIZXMZWUBXSHSJ-GOSISDBHSA-N 405.502 2.445 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N[C@H](c2ccccc2)C2CC2)c1 920637514 HRUGDMWJMKZDBJ-LJQANCHMSA-N 418.471 2.188 10 20 HECD C[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 140958973 LXYAXGQETDICCX-MRXNPFEDSA-N 417.531 2.487 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCc2c(C)c3ccccc3n2C)CC1 472219987 HBZWTZJGBIVZKZ-UHFFFAOYSA-N 406.552 2.442 10 20 HECD Cc1noc(C)c1S(=O)(=O)NCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 728281944 FWORWSQDDFOACJ-UHFFFAOYSA-N 420.535 2.219 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1 729063674 KLGBCISBJIBCEK-AWEZNQCLSA-N 401.463 2.157 10 20 HECD C[C@H](NC(=O)N1CCN([C@H]2CCCN(C)C2)CC1)c1ccc(N2CCOCC2)cc1 734665489 XMQCOASUHTUQLS-UGKGYDQZSA-N 415.582 2.006 10 20 HECD CCO[C@@H](C)c1noc(CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n1 743814483 MEOPMGAXHPINOL-INIZCTEOSA-N 416.526 2.261 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)NCC1CCC1 745812067 KGKMSMIKFFIFLI-UHFFFAOYSA-N 410.584 2.392 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CN(C)c2ncnc3[nH]cnc23)cc1 751406454 PVXVWQZKNBWCHH-GOSISDBHSA-N 423.521 2.063 10 20 HECD C[S@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 752895260 QPQWILPSNZFRNO-NDEPHWFRSA-N 405.495 2.399 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc1F 753894006 QXQTXUPPLABZHK-HOTGVXAUSA-N 406.502 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc4c(=O)n(C)c(S)nc4c3)CC2)cc1 755099888 NRZOGMGAPKBPHC-UHFFFAOYSA-N 410.499 2.193 10 20 HECD Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 760094949 KFVBNDAJTYWAIB-NRFANRHFSA-N 408.502 2.214 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1C 768499207 QIZVOFWOGCEMBQ-UHFFFAOYSA-N 416.452 2.395 10 20 HECD COc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1F 770731358 NUPSZVIVNOTUMC-AWEZNQCLSA-N 401.438 2.487 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2O)CC1 775639247 QYHZIXDSTRHEIA-UHFFFAOYSA-N 411.867 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 780312525 PJTKNBKPTFDIQB-IYBDPMFKSA-N 409.502 2.122 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 784557567 JXJXDEKESYIPFG-UHFFFAOYSA-N 415.465 2.163 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785433715 OVVAZBKDGUBWOQ-LJQANCHMSA-N 408.546 2.492 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@@H](C2CCOCC2)C1 789861096 POIDTGNOOJHYOR-LJQANCHMSA-N 417.575 2.131 10 20 HECD CCS(=O)(=O)c1ccc(N2CCC(NC(=O)c3cccc(O)c3O)CC2)cc1 790597684 DMKASALRXMZUDE-UHFFFAOYSA-N 404.488 2.290 10 20 HECD COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN(C(=O)c2cccc(O)c2O)CC1 790890896 KOXUZMRFJGFKQP-QGZVFWFLSA-N 404.850 2.423 10 20 HECD CCN(C)Cc1cccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 793867393 KGHGGIZZFNZUOT-UHFFFAOYSA-N 408.546 2.453 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@H]2CCCO[C@H]2C1(C)C)c1ccc(N2CCOCC2)cc1 803309934 DVKBQHPAGMVZAY-YGWPLHOASA-N 415.534 2.020 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)ccc21 803686927 JWBQWCDWHFOURR-WOJBJXKFSA-N 419.529 2.266 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@H]3c3cc[nH]n3)CC2)cc1 804276122 HVHUNHOFKCENCQ-GLCJEOIMSA-N 423.517 2.377 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@@H](CC(C)C)C3)CC2)cc1 804314951 CZDQJLOJUUTXEX-NQIIRXRSSA-N 417.550 2.490 10 20 HECD Cc1ccn(-c2ccccc2CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)n1 807100753 PSCLCOCOAJOGCG-UHFFFAOYSA-N 405.502 2.488 10 20 HECD CCc1nnc(S[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 864238143 VLGCPRKTDOQITO-NSHDSACASA-N 421.482 2.449 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnc(NC(C)=O)s3)CC2)cc1 1260705496 PZAUBGLELFYUNQ-UHFFFAOYSA-N 410.521 2.011 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(Cl)nc1 1796597710 UXBSTRXXHHLMNN-BTTYYORXSA-N 402.838 2.107 10 20 HECD Cc1ccccc1OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599239 IJDWWZYDMIVHBN-BJWYYQGGSA-N 411.458 2.132 10 20 HECD Cc1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285750 BRCDDEUAJMFMKD-ZURAMSNBSA-N 423.469 2.472 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccncc1 1816381508 OIQZKVBHZJDJOU-OAHLLOKOSA-N 408.418 2.231 10 20 HECD COc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843251178 DFWHAQJLSKGOSJ-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1nc(N)sc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501025 QVJVMHPGAXWEJP-UHFFFAOYSA-N 422.894 2.229 10 20 HECD CC(C)(C)c1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)ccn1 1848314474 CUNXAUXFKCXFTR-HOTGVXAUSA-N 410.474 2.315 10 20 HECD CC(C)N1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 727940750 NMLKNFVHEHPOMQ-LJQANCHMSA-N 401.555 2.014 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C 729226396 GLQKIANFIFKQGC-UHFFFAOYSA-N 410.490 2.328 10 20 HECD O=C(CCn1c(=O)nc(O)c2ccccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 731858715 MMEQEFWHDNMJFL-KRWDZBQOSA-N 423.469 2.406 10 20 HECD CCn1cc(CN(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 733795699 HSSQIOOEAGFVQN-IAGOWNOFSA-N 417.529 2.404 10 20 HECD COCc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738895275 IQCKRGGZDFKKTD-UHFFFAOYSA-N 403.504 2.390 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 741093750 VADPVYXDICGTHJ-OKZBNKHCSA-N 410.536 2.439 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1 741145311 RIVXIZRFFYRRIM-GOSISDBHSA-N 421.497 2.299 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc(C)c1F 742029632 OTAAGHCYHBOQGD-UHFFFAOYSA-N 416.452 2.313 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1 744357423 QMOFMIJHPZMRDF-MLCHDBGUSA-N 413.518 2.042 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@]1(O)CCN(Cc2ccccc2)C1 746280271 OMNDAZKWUQUVGP-VWLOTQADSA-N 423.557 2.149 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)ccc21 746811908 SRFFUFLBHICREE-QHCPKHFHSA-N 406.486 2.152 10 20 HECD C[C@@](O)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccco1 751068495 WGCWGCNRXBQDMH-GOSISDBHSA-N 422.484 2.485 10 20 HECD COC(=O)c1cc(NC(=O)CN(C)c2ccc(OC)cc2OC)cc(C(=O)OC)c1 752121850 GSJOTKFKEICNNS-UHFFFAOYSA-N 416.430 2.352 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)CC2)cc1 753926802 WCRDZMZTVMXQCR-RBUKOAKNSA-N 415.582 2.132 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H](CO)C[C@H](O)c3ccccc3)CC2)cc1 754642549 NVLNXBYZONOLPO-UGKGYDQZSA-N 413.518 2.448 10 20 HECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1F 756169100 FUUKSTCMPFISRW-UHFFFAOYSA-N 401.438 2.480 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 758112567 IQMTUOHMCWRAAI-UHFFFAOYSA-N 417.393 2.248 10 20 HECD CC(C)NS(=O)(=O)NCCN[C@@H](C)c1cc(Br)cc(Cl)c1O 760045612 HEZODGRXGTZGMZ-VIFPVBQESA-N 414.753 2.291 10 20 HECD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769716504 KWTFCQDATNZRNI-UHFFFAOYSA-N 405.476 2.463 10 20 HECD Cc1nc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1Br 773722568 MEQWSZNEPSUSHD-SECBINFHSA-N 408.252 2.250 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1C 774124866 FJWOSURREQUECY-UHFFFAOYSA-N 412.490 2.399 10 20 HECD COCc1noc([C@H](C)SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 783907275 WJOIUMYZDZIFRE-AWEZNQCLSA-N 406.508 2.368 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 785870099 NEZBIQOBZRCRSZ-HDICACEKSA-N 418.582 2.105 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1c(C)nn(C)c1C 788353386 GBSCKXWVIYXYMG-UHFFFAOYSA-N 423.311 2.170 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1COC2(CCCCC2)O1 788932587 PDCUGBRPWKNLJK-LJQANCHMSA-N 401.507 2.095 10 20 HECD O=S(=O)(C[C@H]1CCCOC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792757505 MMXRXOYVSKGERO-WMLDXEAASA-N 402.944 2.356 10 20 HECD COC(=O)CCSc1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797389362 CYRZPSLZPKWWLG-UHFFFAOYSA-N 418.471 2.311 10 20 HECD CCc1cnc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803298012 MKGJKEYMYVMRNH-HNNXBMFYSA-N 416.547 2.378 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](Oc3ccncc3)C2)cc1F 804852976 JWZPOMJYGFQWMH-GOSISDBHSA-N 414.481 2.363 10 20 HECD CC[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007907 UOUHEPPRUJSLTR-IEBWSBKVSA-N 404.530 2.279 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)nc3C)cc2)CC1 805073623 QHBYJOROOMXSFF-UHFFFAOYSA-N 422.938 2.190 10 20 HECD O=C1NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2Br)nn1 811689886 ONRYJADTYYQMJF-UVTDQMKNSA-N 410.231 2.491 10 20 HECD CCS(=O)(=O)CC(=O)c1cc(C)n(-c2cc(C(=O)OC)cc(C(=O)OC)c2)c1C 915362829 HXVFTWZPDAISNO-UHFFFAOYSA-N 421.471 2.285 10 20 HECD CNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 918032720 QOKIPSZEUKEHHN-QGZVFWFLSA-N 423.517 2.378 10 20 HECD Cc1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810551217 FDHAISNOPSQFAK-UHFFFAOYSA-N 410.474 2.355 10 20 HECD Cc1noc(C)c1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842412261 XMDBMSQUXGVRSY-UHFFFAOYSA-N 405.838 2.487 10 20 HECD Cc1nn(C)c(C)c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500437 BGZLJFMPOZKTRV-UHFFFAOYSA-N 418.881 2.232 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)C[C@H]2COc3ccccc3O2)n(C)c2ccccc12 579047155 PDJXOOQUSKINIM-INIZCTEOSA-N 407.470 2.401 10 20 HECD O=C(CCN1CCOCC1)Nc1cccc(CNCc2cc3c(cc2O)OCO3)c1 725847017 SAIKTESQZJZSHE-UHFFFAOYSA-N 413.474 2.072 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2ccccc2S(=O)(=O)C(F)F)c(O)c1O 727003933 ITRUVERUBPKLAF-UHFFFAOYSA-N 415.370 2.198 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC(F)(F)F 732673450 IJHKMEAAYGDSFN-UHFFFAOYSA-N 406.424 2.080 10 20 HECD Cc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n(C)n1 737174739 RWGVGPZLMUHDSO-UHFFFAOYSA-N 407.421 2.054 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1 739080172 KOKWZEDXTJFKIY-CABCVRRESA-N 413.474 2.442 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3COc4ccccc4C3)CC2)cc1 742928270 JYSPIJKPNBBDOP-IBGZPJMESA-N 410.518 2.120 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)n1nnc(-c2ccccc2)n1 743315326 SQMQIFLYRYSZSZ-HNNXBMFYSA-N 424.480 2.318 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3nnn(C)c3C)c2C)cc1 745165122 RBNZCDIZFVYRCV-UHFFFAOYSA-N 410.430 2.357 10 20 HECD CN1CCC(=O)Nc2cc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc21 746288889 DSCHGFVDDMXTCU-UHFFFAOYSA-N 421.501 2.419 10 20 HECD CC(C)(C)n1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 746364125 OHQCWCRKXLHJRX-UHFFFAOYSA-N 401.536 2.446 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730840 GLBJAMJVTSFKSR-UHFFFAOYSA-N 408.505 2.236 10 20 HECD CN(Cc1ccc(N(C)C)cc1)CN1C[C@H]2CN(C(=O)OC(C)(C)C)CCN2C1=O 751594547 YEDNCHIOOCINTH-LJQANCHMSA-N 417.554 2.499 10 20 HECD O=C1CC2(CCN(CC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CC2)CN1 752302229 DJTNPHJQMVZOHM-UHFFFAOYSA-N 417.465 2.003 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 758222847 KZNCIFRJKXKRFY-KRWDZBQOSA-N 405.426 2.304 10 20 HECD COC(=O)c1cccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 758575100 CJVWERXOWMZXQA-IBGZPJMESA-N 409.486 2.034 10 20 HECD COc1cc(N2CCN(C(=O)c3csc(NC(C)=O)n3)CC2)cc(OC)c1OC 759238942 DTQMCXCHQNYIRT-UHFFFAOYSA-N 420.491 2.090 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(c4ncc(F)cn4)CC3)CC2)cc1 760108856 JWZXLEIABQTJME-UHFFFAOYSA-N 414.485 2.125 10 20 HECD COc1cc(Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)ccc1[N+](=O)[O-] 762308973 PRHHCXBULOFZRS-UHFFFAOYSA-N 420.403 2.321 10 20 HECD CCOc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 765315373 YSRXWNLPAJOJKA-UHFFFAOYSA-N 404.492 2.037 10 20 HECD C[C@H](NCCS(=O)(=O)NCc1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765350883 OUNRUJCRGTWYDU-KRWDZBQOSA-N 421.538 2.433 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1F 765468641 NMANMISONGNTJS-CQSZACIVSA-N 400.516 2.270 10 20 HECD COc1cccc(S(C)(=O)=O)c1NNC(=S)Nc1cccc(NC(C)=O)c1 767427147 SACFOMUTGWDRMP-UHFFFAOYSA-N 408.505 2.371 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(O)c(O)c2)c1 767785509 OEQVHBXRYCJAFS-UHFFFAOYSA-N 410.467 2.238 10 20 HECD COc1ncc(/C=C\C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)cn1 776307302 VZXDWTDSHZDODX-VJIACCKLSA-N 408.458 2.305 10 20 HECD CCc1cc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)ccc1C 778132621 KHZYATZSYGAINE-UHFFFAOYSA-N 424.545 2.443 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)[C@@H]3CCCOC3)CC2)cc1 780044629 PPOMDPQSCYJDHA-RBUKOAKNSA-N 404.555 2.322 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N(CCNC(C)=O)[C@H](C)C(=O)O)c2C)cc1 781136521 OIRRWVRKAJHZNN-OAHLLOKOSA-N 401.463 2.154 10 20 HECD Cc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 786727232 YXACXVRHJAABQA-FXAWDEMLSA-N 422.529 2.190 10 20 HECD C[C@@H](Cc1ccsc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801969 YAKBEXBNYAJFIY-AWEZNQCLSA-N 405.495 2.087 10 20 HECD C[C@@H]1OCC[C@@]12CN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C[C@@H](C)O2 790666800 VEBWVBHFUBFFSY-ZMPRRUGASA-N 421.513 2.265 10 20 HECD CCN1CCC(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 793813185 HELJWQXBYLVYNB-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc(N2CCOCC2)cc1 796402668 KQJNFLWPBWXVMD-UHFFFAOYSA-N 405.520 2.394 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1 797833928 AGYQXXBZANPNKM-FQEVSTJZSA-N 401.532 2.372 10 20 HECD CCOCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 799558549 LAWKGFIRPIEEEI-HZPDHXFCSA-N 422.497 2.415 10 20 HECD Cc1nc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)sc1S(N)(=O)=O 801667617 QSSTYAIHARXCHO-PHIMTYICSA-N 414.528 2.464 10 20 HECD CN(Cc1cscn1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451767 VREWIWREZAKQJF-UHFFFAOYSA-N 424.473 2.488 10 20 HECD O=C(Nc1nncn1C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 803518476 JXSNXVQYTLBDFK-UHFFFAOYSA-N 405.461 2.433 10 20 HECD COc1ccccc1OCCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685426 GSLHYSFNBYRJTM-UHFFFAOYSA-N 411.502 2.279 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3c3cc[nH]n3)CC2)cc1 804276123 HVHUNHOFKCENCQ-LCCNJJIFSA-N 423.517 2.377 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O 806279531 RGPCWQYLOYZBHQ-OAHLLOKOSA-N 424.592 2.181 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 807290537 YEPWRLDFGNXJJR-HXUWFJFHSA-N 413.518 2.261 10 20 HECD C[S@@](=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385573 NCHOAJVTSZMHSB-XMMPIXPASA-N 411.277 2.147 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc(N(C)C)cc1 807672567 DJUHFIYRTQKBBZ-OHZJNBGDSA-N 401.532 2.326 10 20 HECD Cc1cc(O)c(CNc2cc(C(N)=O)ccc2CN2C(=O)CN(C)C2=O)cc1Cl 864044204 XSZDZXHSMPWGAB-UHFFFAOYSA-N 416.865 2.459 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@H]4CN(c5ccccc5)C[C@H]4C3)CC2)cc1 917082207 KWJWSOILJWAVEH-OYRHEFFESA-N 420.557 2.412 10 20 HECD CC(C)COC[C@H](O)CNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918209351 VTRXQAXIBCLQKW-XYJFISCASA-N 411.518 2.272 10 20 HECD CN1CCC(N2CC[C@@H](N(C)Cc3ccc(N4CCN(C)CC4)c(F)c3)C2)CC1 1261183175 JXCSUEDDSMVGMR-OAQYLSRUSA-N 403.590 2.178 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc4c(=O)n(CC)c(O)nc4c3)CC2)cc1 1324296467 FAUHHMKXKAJLAU-UHFFFAOYSA-N 422.485 2.483 10 20 HECD CN1CCN(c2ccc(CN[C@H](CS(C)(=O)=O)c3ccccc3)cc2F)CC1 1342635970 LXWRAOUFNPCKCY-HXUWFJFHSA-N 405.539 2.453 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cncc(O)c1 1800718997 PWRUFKCTPQNMBZ-BTTYYORXSA-N 417.849 2.417 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccns3)C2)CC1 1807890359 OZVJRGRUICIKTK-UHFFFAOYSA-N 402.476 2.108 10 20 HECD Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994034 MNZBEHSKCVZSLF-BEFAXECRSA-N 422.441 2.423 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C23CC(C(F)(F)F)(C2)C3)C1 1841683705 OYLMXQXDJHOQFQ-UHFFFAOYSA-N 411.380 2.042 10 20 HECD COc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)cc2c1 1844018671 LTHCKUGBDCRMLP-UHFFFAOYSA-N 423.425 2.378 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(-c3cc[nH]n3)cc2)C1 1845447237 BOSTWXINBHLVTP-UHFFFAOYSA-N 419.441 2.014 10 20 HECD COC(=O)NCC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1846512504 QGSFSVROIWTZQL-UHFFFAOYSA-N 424.501 2.267 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CCCn2ccnc2)C1 1846571823 OKCWEMDISFOXBO-UHFFFAOYSA-N 418.881 2.245 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(OC)c(OC)c(OC)c3)CC2)cc1 69449935 FRFNEAIQCBUIHX-UHFFFAOYSA-N 415.490 2.482 10 20 HECD CN1CCCc2cc(CNC(=O)NCc3ccc([C@@]4(C)NC(=O)NC4=O)cc3)ccc21 726250597 ZXEBNKKXIMAFRN-HSZRJFAPSA-N 421.501 2.123 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)OC)c2C)cc1 731178294 MXVNNQXMEJOHQD-UHFFFAOYSA-N 412.489 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)NC3CCCC3)cc2F)C[C@H](C)O1 746725254 DIHKRJPFOCVHOO-GJZGRUSLSA-N 406.502 2.297 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1 749729835 BEKZMFDXCJUSSJ-UHFFFAOYSA-N 424.523 2.356 10 20 HECD Cc1cc(C(=O)CN2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1-c1cccc(F)c1 750056402 KKOXATWAVXHYHH-UHFFFAOYSA-N 409.465 2.498 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(c4cnn(C)c4)C(=O)C3)cc2)CC1 750289110 ZHFKPFDDEFUXCC-UHFFFAOYSA-N 410.522 2.215 10 20 HECD CN1CCN(C(=O)[C@H]2CCc3ccccc3N2Cc2cc3c(cc2O)OCO3)CC1 754745907 FZAZXZXMWAKFJM-LJQANCHMSA-N 409.486 2.216 10 20 HECD O=C(NOCC(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 760142028 OPCVASDDESRQIO-UHFFFAOYSA-N 417.346 2.028 10 20 HECD COCCC1(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC1 761480474 CUDTVBGMMKXWPE-UHFFFAOYSA-N 408.470 2.029 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 765751534 FWPDHJADOSAIIK-CYBMUJFWSA-N 404.264 2.215 10 20 HECD O=c1ccc2cc(S(=O)(=O)NCc3cccc(Br)c3O)ccc2[nH]1 766201389 RWHYXKPJDOEOIP-UHFFFAOYSA-N 409.261 2.475 10 20 HECD COCCCS(=O)(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 767954443 CYZMNZAQQBZDDT-UHFFFAOYSA-N 408.476 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)c4c(C)n[nH]c4C)n3)CC2)cc1 771068627 SBQCVRIRKZTTJX-AWEZNQCLSA-N 424.505 2.461 10 20 HECD COCCNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 772993020 DRKYSYWWKBSKQP-OAHLLOKOSA-N 405.520 2.168 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)cc1 773235257 NOKNKKNXHBWBFC-UHFFFAOYSA-N 421.505 2.380 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc([S@](C)=O)c(F)c3)ccc21 774190540 SMNWIKHRVHHCGU-NDEPHWFRSA-N 403.479 2.200 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](c2nc(-c3nc[nH]n3)no2)C(C)(C)C)c1O 775034523 UJDTWJQCEKOARH-CYBMUJFWSA-N 403.399 2.354 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](n2cncn2)C1 776879540 SUUVWHXNJKLPPC-ZBFHGGJFSA-N 415.453 2.328 10 20 HECD COC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 781523995 QHIQTNCBUNQIIU-UHFFFAOYSA-N 400.406 2.452 10 20 HECD C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424605 RAJGCKLGOSTNPO-DOTOQJQBSA-N 418.538 2.273 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(C(=O)C3CC3)CC2)cc1 786650352 RWDINEFNKSSSGO-UHFFFAOYSA-N 414.550 2.008 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCC2(CC1)OCCO2 787430780 LCAZFHYNMRUIOG-UHFFFAOYSA-N 415.534 2.437 10 20 HECD C[C@H]1CCC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832638 BLRRQDZBMLMJKC-RDJZCZTQSA-N 405.514 2.440 10 20 HECD O=S(=O)(c1ccc(NCc2c(O)ccc(Cl)c2F)nc1)N1CCOCC1 790246535 ZBDJBYDRKCYHNZ-UHFFFAOYSA-N 401.847 2.213 10 20 HECD C[C@H](OC(=O)Cn1cccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792668034 OKAHTJUEMVJOBB-ZDUSSCGKSA-N 403.394 2.229 10 20 HECD O=C(CN1CCOc2cccc(F)c2C1)NCc1ccc(N2CCOCC2)c(F)c1 801583664 JNKIRQRIWYVCCT-UHFFFAOYSA-N 417.456 2.312 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H]1c1cccnc1)c1ccc(N2CCOCC2)cc1 803306690 WGWLYIVGRSTXEI-DYESRHJHSA-N 408.502 2.459 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](C)[C@H]3C)cc2F)CC1 805006657 AMFGCUNDLNUYLV-DLBZAZTESA-N 404.530 2.231 10 20 HECD COc1cc(F)cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 806454221 QEUZEHPEOLJWNH-GOSISDBHSA-N 416.449 2.364 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806953883 KTULCXQCJMGXKO-ILXRZTDVSA-N 411.449 2.057 10 20 HECD CN(Cc1cccnc1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771672 WYAPDIAZCOGVGZ-INIZCTEOSA-N 418.444 2.427 10 20 HECD COC(=O)CNS(=O)(=O)c1cccc(NCc2c(O)ccc(Cl)c2F)c1 809683053 NJYAKPMPMSXSNQ-UHFFFAOYSA-N 402.831 2.248 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H](C4CCC4)C3)cc2)C1 813593839 DDIMOGMUVPRINY-WOJBJXKFSA-N 414.550 2.346 10 20 HECD CN(C)c1noc(CCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 857455308 AANUCSBBGFDKBR-ZDUSSCGKSA-N 409.437 2.455 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)COc3ccc(C=O)cc3)CC2)cc1 917165728 PBIQHGPUSDNSSS-UHFFFAOYSA-N 411.502 2.215 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1nnc2ccccn12 918200798 DOTFKTYUCLBNAI-INIZCTEOSA-N 408.506 2.498 10 20 HECD CCOC(=O)c1ccc(C(=O)N[C@@H](Cc2ccc(O)c(O)c2)C(=O)OCC)cc1 1326071726 OREONVPXLAUGHT-INIZCTEOSA-N 401.415 2.179 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN)C3)cc1 1780988224 UARBYEDMAQQXMU-ZJSXRUAMSA-N 424.545 2.180 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)NC(C)C)c3)CC2)cc1 8028465 WFXDXJBIGOGCTP-UHFFFAOYSA-N 417.531 2.344 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 23745238 JUNABYFMMMCJJS-HNNXBMFYSA-N 405.520 2.087 10 20 HECD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729052551 MMNJQYYYAUFTNA-STQMWFEESA-N 407.492 2.430 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc(F)c(F)cc1F 729785778 KXUDJYDHCLDGEV-UHFFFAOYSA-N 411.355 2.335 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC(N(C)S(C)(=O)=O)CC3)cc2)CC1 731049603 FZVUXHAIWQYMHX-UHFFFAOYSA-N 422.595 2.488 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](NC(C)C)C3)CC2)cc1 732444156 QAIUTSNIKVTKIC-HXUWFJFHSA-N 417.598 2.379 10 20 HECD O=S(=O)(C(F)F)N1CCC(CNCc2ccc(N3CCOCC3)c(F)c2)CC1 732985229 CBGNIEILPIGWHB-UHFFFAOYSA-N 421.485 2.016 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](CO)c1c(F)cccc1F 734659678 CVRFLHHQPVSTAP-QGZVFWFLSA-N 409.408 2.473 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CSc2ccccc21 735651611 PDMDBGYLKLHDCC-GOSISDBHSA-N 402.541 2.427 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)c2cccs2)c(C)n1-c1ccccn1 747450447 SCXODEMMCMQCSE-UHFFFAOYSA-N 404.517 2.259 10 20 HECD C[C@H]1C(=O)Nc2cc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc2N1C 750026078 BJUFFUICAWFZEL-AWEZNQCLSA-N 421.501 2.417 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 751317473 FJUHEPPNAZBIQW-NSHDSACASA-N 423.443 2.014 10 20 HECD Fc1cc(CNc2ncnc3nccnc23)ccc1N1CCN(c2ncccn2)CC1 752634195 CMMKLIBFTCZARX-UHFFFAOYSA-N 417.452 2.288 10 20 HECD COc1ccc(N2CCN(Cn3cc(Br)c([N+](=O)[O-])n3)CC2)cc1F 754013956 PJNWEQXJVLAYKJ-UHFFFAOYSA-N 414.235 2.481 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccc4c3oc(=O)n4C)cc2F)CC1 756971560 CGIYZSZGQFZTMG-UHFFFAOYSA-N 412.465 2.343 10 20 HECD COc1ccc(CN(C)C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 759590609 XIHPBZDGPORJJR-TWGQIWQCSA-N 401.415 2.330 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1(NC(=O)OC(C)(C)C)CC1 761525969 SRIVKOFHISDCDF-UHFFFAOYSA-N 405.495 2.312 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 762092446 UJJUJHQRXOZDGH-FQEVSTJZSA-N 414.550 2.456 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1)c1ccc(N(C)C)cc1 773843895 BGQWHHSVNHRQIV-INIZCTEOSA-N 419.485 2.174 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc(N(C)C)cc1 773847876 UKZMSGYWKIAGIP-CQSZACIVSA-N 419.489 2.422 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCCN1CCc2ccccc21 787689744 UNZAQXNLSRFELA-UHFFFAOYSA-N 404.561 2.311 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(Cn2cccn2)cc1 788465338 VWMJFVFXTMIEJF-UHFFFAOYSA-N 415.544 2.303 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)O2 788931137 FZWIGNOBMJFHPN-GTPZEUEISA-N 415.534 2.341 10 20 HECD CS[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)(C)C 789812179 JOAYGOSWZQBJDV-KRWDZBQOSA-N 411.543 2.172 10 20 HECD COc1ccc(CNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c(O)c1 792759890 GTWBYTVRZLRDDN-LJQANCHMSA-N 403.454 2.413 10 20 HECD Cn1nnc2c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccnc21 801173714 BOQPBDASRGTTSR-CQSZACIVSA-N 400.870 2.117 10 20 HECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(N)=O)C1 802514016 VWFRBBXTCJPATN-QGZVFWFLSA-N 408.506 2.311 10 20 HECD CCOCCN(CC)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450186 DQZVPVOBXSRILA-UHFFFAOYSA-N 413.465 2.258 10 20 HECD COc1ccc(N2CCN(c3ccc(C(C)=O)cc3S(N)(=O)=O)CC2)cc1F 804540441 XEMPMAISNGVXTO-UHFFFAOYSA-N 407.467 2.011 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCNC(=O)C[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 807678784 JPLXBIULLYAZRV-UZLBHIALSA-N 408.502 2.020 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc2[nH]ccc12 808941151 RBFQIBXYBOPGES-LLVKDONJSA-N 411.414 2.052 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@](C)(OC)C4CC4)n3)CC2)cc1 812811288 PTZMMPCOJFPXOS-OAQYLSRUSA-N 400.479 2.241 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 917929242 ASPAUDZZQVOXFA-OAHLLOKOSA-N 421.494 2.015 10 20 HECD Cc1c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cccc1-n1cnnn1 918456354 IZILSTIGRVGGSJ-UHFFFAOYSA-N 419.489 2.166 10 20 HECD CCOc1ccccc1OCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918642500 CCMWGKCMQUFZOA-UHFFFAOYSA-N 418.515 2.015 10 20 HECD CC(C)n1ncc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cnc21 920195220 MVVMCBJIPIHLQK-UHFFFAOYSA-N 422.489 2.104 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(OC)c(OCCO)c3)CC2)cc1 1321174549 OEWVNXDHZUZSJS-UHFFFAOYSA-N 400.475 2.427 10 20 HECD Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995388 YQXJWZUSZFLLNW-MGPUTAFESA-N 421.457 2.158 10 20 HECD CCC(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808468816 YNWOJZPXRQTZQK-VGSWGCGISA-N 419.485 2.290 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)ccc2O)C1 1845518561 CMVFOWVVWGBJCN-UHFFFAOYSA-N 418.833 2.293 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCc4nc(COC)nn4C3)ccc21 467029123 PUIMKFOGMOYKLT-QGZVFWFLSA-N 411.506 2.387 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NCCCN3CCC[C@@H](C(N)=O)C3)ccc21 489953193 ATOMQUHECDAHPE-LJQANCHMSA-N 414.550 2.222 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCC1 729505949 GLSXDTVPEFXMMJ-SFHVURJKSA-N 401.555 2.062 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)NC(C)(C)C)cc2F)CC1 730128531 SSNQSNJBPRSBBQ-UHFFFAOYSA-N 407.534 2.072 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1F 731364420 MOJZHGIABKQGMT-UHFFFAOYSA-N 422.526 2.361 10 20 HECD COc1ccccc1[C@@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 734941905 IYTZVZXHFAIPTG-LJQANCHMSA-N 417.481 2.328 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(C)c(=O)n(C)c2=O)cc1 735051555 NJRKWQMBRDBVQP-UHFFFAOYSA-N 422.485 2.006 10 20 HECD CC(=O)NC[C@H]1CN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCO1 735591635 HALZYGNSSMHGLN-IBGZPJMESA-N 409.446 2.404 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc21 737165259 CXLIVVOWWGQZDV-UHFFFAOYSA-N 421.501 2.320 10 20 HECD COCC(=O)N[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 741187770 GNCRSSUUMAGULG-SFHVURJKSA-N 413.465 2.160 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)o1 748640223 KKBPNTUHSJVYOQ-UHFFFAOYSA-N 422.868 2.282 10 20 HECD CCOC(=O)CC[C@@H]1CCCN(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)C1 752051218 RJUTWWIAHSZIFN-AWEZNQCLSA-N 404.467 2.167 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3c(C)nc4ccccc4c3=O)CC2)cc1F 753738152 MEUJEXQGNWBQIF-UHFFFAOYSA-N 410.449 2.201 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@@H](C)c3nccs3)CC2)cc1 754269186 HNEUGIXHPBZESN-MJGOQNOKSA-N 404.580 2.370 10 20 HECD C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc([N+](=O)[O-])ccc1O 756454140 AVYCNSHDUHOMGX-WFASDCNBSA-N 401.419 2.276 10 20 HECD O=C(O)c1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Br)c1 757657295 SZXNPLTVEMAQPH-UHFFFAOYSA-N 416.205 2.352 10 20 HECD COc1cc(N2CCN(C[C@H](O)COc3ccccc3F)CC2)cc(OC)c1OC 759886685 OVWYCTOVBQXNRK-KRWDZBQOSA-N 420.481 2.413 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COc3cc(C)ccc3F)CC2)cc1 765309663 LMJUKGUCFFEHLQ-UHFFFAOYSA-N 401.482 2.460 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914145 CPXPBTUVCLWWMI-OAHLLOKOSA-N 407.858 2.240 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 772600420 HQDWQYBUMLWJAH-RTBURBONSA-N 410.536 2.315 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](C[C@@H]4CCOC4)C3)CC2)cc1 773704185 XMRNIQXTCYEXEN-UXHICEINSA-N 401.551 2.482 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCCC[C@@H]3O)CC2)cc1 779330133 IWRGQRGNZJVVLY-UGKGYDQZSA-N 418.582 2.400 10 20 HECD COc1cc(CN(C)c2ccc3c(c2)OCO3)ccc1OCC(=O)N1CCOCC1 780778140 CXXIYHAQGZXXGU-UHFFFAOYSA-N 414.458 2.298 10 20 HECD Cc1ccc(C(=O)N2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c(O)c1O 780931450 JPLLXXCKGNICQH-AWEZNQCLSA-N 408.451 2.128 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1 785298804 ZFTNFFCNSBUQDA-GFCCVEGCSA-N 415.421 2.050 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C(=O)OC(C)(C)C 785432406 BRKYUZPYTJMCJK-DOTOQJQBSA-N 418.538 2.273 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c(O)c1 797389472 JVLFBAZWNKECGR-UHFFFAOYSA-N 405.838 2.011 10 20 HECD COc1coc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1=O 798895742 KLKIIJWWIGAORQ-UHFFFAOYSA-N 412.364 2.434 10 20 HECD CC[C@H](C)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CC(=O)OC 799169411 IXQRYUUGCKDANO-GVDBMIGSSA-N 423.529 2.329 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3CCCC34CCOCC4)CC2)cc1 800437516 NOCBMTMUITUOEA-UNMCSNQZSA-N 403.567 2.117 10 20 HECD CCOCCCn1c(C)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802613407 YMCDVQVFGRLMGV-UHFFFAOYSA-N 419.526 2.366 10 20 HECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)NC(=O)OC(C)(C)C 803658831 FAZPCCHBDNRVEM-MRXNPFEDSA-N 424.517 2.173 10 20 HECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@H]1CC[C@H](C)C1 804316372 CKEKMINZKATASN-PXNSSMCTSA-N 417.550 2.444 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)o1 807288575 XXUKGCJRCZEUAI-UHFFFAOYSA-N 410.518 2.171 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NCc2cccc(OC)c2O)s1 807565533 MYZAOUIJMMPZAD-MNOVXSKESA-N 407.496 2.277 10 20 HECD C[C@H]1CSCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768174 DNSITPLNXUFHHL-UONOGXRCSA-N 413.490 2.337 10 20 HECD CCN(CCC1CC1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856237 PZHOFWGQENNMJY-UHFFFAOYSA-N 412.578 2.483 10 20 HECD Cc1cc(-c2csc(NS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)n2)c(C)o1 918195963 GHCVUSUBBCTEDV-UHFFFAOYSA-N 413.502 2.468 10 20 HECD Cc1cc(C(=O)COC(=O)CO[C@H]2CCOC2)c(C)n1-c1ccc2c(c1)OCCO2 1319350131 DPZQGDRHNKWCBH-KRWDZBQOSA-N 415.442 2.397 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(C(=O)OC)cs3)CC2)cc1 1319599394 ZGTWAZGRRDJXTN-UHFFFAOYSA-N 410.517 2.444 10 20 HECD Cc1nc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)no1 1788424313 VRLKBBHNNIXMIJ-UHFFFAOYSA-N 423.429 2.175 10 20 HECD CC(F)(F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931993 YHMNFUQIKZVXHD-YOWGUQMCSA-N 404.417 2.073 10 20 HECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1816528980 QTNWCTJGDLBHKQ-AWEZNQCLSA-N 412.406 2.132 10 20 HECD Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)co1 1817843980 LNURMZNXHVFWMC-CQSZACIVSA-N 412.406 2.132 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831801314 LQUNPSDFPIDQFI-KBXCAEBGSA-N 417.506 2.341 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831801317 LQUNPSDFPIDQFI-RDTXWAMCSA-N 417.506 2.341 10 20 HECD CCn1c(=O)[nH]c2cc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc2c1=O 109180624 GIOLCXHCNPQQQA-OAHLLOKOSA-N 422.485 2.037 10 20 HECD Cc1c(C(=O)N2CCOc3cc(N(C)C)ccc32)nnn1-c1ccc2c(c1)OCCO2 437008198 OIPCFMGNZPKYBK-UHFFFAOYSA-N 421.457 2.452 10 20 HECD Cc1c(CNC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)n(C)c2ccccc12 472182560 NUDBHZJAFZWIHC-UHFFFAOYSA-N 415.515 2.252 10 20 HECD CC(C)N1CC[C@@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1=O 734107232 DGEOIXLHGCFAHV-MRXNPFEDSA-N 421.409 2.109 10 20 HECD O=C(CN1CC[C@@H](CN2CCCCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 743851759 LXYDDDCZDSOWRA-FQEVSTJZSA-N 418.557 2.086 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 751098175 OUGVENGUVACEFI-INIZCTEOSA-N 412.446 2.235 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCOC[C@H]2C[C@H](O)c2cccs2)cc1 753855856 JIWLZYYDOGNBCG-MOPGFXCFSA-N 403.548 2.255 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)c3cn(C)nc3C)CC2)cc(OC)c1OC 759252354 DLOXNPZRNKDWEF-CQSZACIVSA-N 417.510 2.347 10 20 HECD CN1CCN(c2ncccc2CNC(=O)NCCCSc2nccs2)CC1 759575754 OUWWNFRSHCMDII-UHFFFAOYSA-N 406.581 2.272 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)ccc1OCC(=O)O 761286586 MRRQVPJBFCNKTR-UHFFFAOYSA-N 404.488 2.319 10 20 HECD CNS(=O)(=O)c1ccc(N(Cc2ccccc2O)C[C@@H]2CCCO2)c([N+](=O)[O-])c1 762180804 WSHJFIZIJNIZLG-HNNXBMFYSA-N 421.475 2.394 10 20 HECD O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)c1cccc2nonc12 765067453 KHSFULUYOYISJD-UHFFFAOYSA-N 409.427 2.349 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 766334973 DFJJEHWXLOMOAB-UHFFFAOYSA-N 401.463 2.376 10 20 HECD Cn1cnc(-c2ccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc2)n1 779917475 IKQZCNYQIPTAHS-UHFFFAOYSA-N 404.474 2.436 10 20 HECD O=C(NCCc1cscn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 786623025 DYVUSKNLHQZEHY-UHFFFAOYSA-N 424.473 2.188 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(F)(F)c3ncccc3C)CC2)cc1 787249392 YSMCVNSLVZBLBU-UHFFFAOYSA-N 404.461 2.429 10 20 HECD CN(CCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 788323719 OJBGSVXKCCDEEQ-UHFFFAOYSA-N 424.545 2.172 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCOC(C)(C)C)cc2F)C[C@@H](C)O1 789816657 DUIZMUKHFCYJTJ-HZPDHXFCSA-N 423.529 2.329 10 20 HECD CCN(CC)c1ccc(CN(C)CC(=O)c2c(O)nc(=O)n(CC(C)C)c2N)cc1 800710557 UUPQCHOPQFIGTD-UHFFFAOYSA-N 415.538 2.348 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CN1Cc1ccccc1 803688321 OTRSAVSHUDIKOG-AVRDEDQJSA-N 420.557 2.464 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCCCSc2nccs2)C(=O)N1c1ccccc1 806279533 RHKCHFSGJSZOLF-HIFRSBDPSA-N 418.544 2.052 10 20 HECD CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806457021 BUZQBUSPXVNFFC-KRWDZBQOSA-N 422.501 2.473 10 20 HECD CN1C(=O)Cc2cc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)ccc21 807511227 IFKOXYWPSVTJHR-UHFFFAOYSA-N 408.241 2.473 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 810363545 VHZIYIMUZPONOA-UHFFFAOYSA-N 424.207 2.326 10 20 HECD NC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 919969446 YMRWUJTZWYDKFM-NRFANRHFSA-N 410.518 2.311 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4nc(O)oc4c3)CC2)cc1 920615404 DKORWBFDDMOWLW-UHFFFAOYSA-N 411.414 2.048 10 20 HECD CC[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCc1ccccc1 920636816 MUPKKNGFNFFAOJ-QGZVFWFLSA-N 406.460 2.016 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccnc1Cl 1796597696 SIVIFDIKGGJASR-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CCC1)C1=NN(c2ccccc2)C(=O)C1 1803425040 LTEOFTVJJDZQIZ-ACHSLPGTSA-N 412.465 2.310 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808001247 SHHSHLRQFYPHKJ-HEERMSBFSA-N 410.474 2.254 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)C1 1810554621 QFYXVXMBLMBIAH-BMGDILEWSA-N 415.515 2.213 10 20 HECD O=C(C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccco1 1841954102 CDQLICOTTMRFMP-UHFFFAOYSA-N 404.806 2.044 10 20 HECD O=C([C@H]1[C@H]2c3ccccc3S[C@H]21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250184 SSXKCNWLKYPZPE-CEXWTWQISA-N 423.494 2.198 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NCCN2CCN(c3ncccn3)CC2)cc1 57062638 MHVWSERETUNMIX-UHFFFAOYSA-N 404.518 2.436 10 20 HECD CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 726622117 TVLGLBGXHXIOEJ-QFIPXVFZSA-N 411.477 2.381 10 20 HECD COc1ccc(C(=O)NCc2cccc(OC)c2O)cc1S(=O)(=O)NC(C)C 727762630 SBOPNRNMRNYIEH-UHFFFAOYSA-N 408.476 2.026 10 20 HECD Cc1ccc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 728015278 PCGNSCYFVZNQOV-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CC(C)CCS(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729484869 UKYBUODMTCTMMM-UHFFFAOYSA-N 421.542 2.408 10 20 HECD Cc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 729785809 MMFCHHZJPBZFLH-HUUCEWRRSA-N 400.454 2.398 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)cc1F 731364384 ZFSYPSWJRINCCY-INIZCTEOSA-N 419.545 2.166 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1 731979067 FLFHAGOYHZAHDH-OKILXGFUSA-N 408.499 2.355 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCCNC(=O)OC(C)(C)C)CC2)cc1 736314394 ZPCIOXWTPACBKO-UHFFFAOYSA-N 420.554 2.190 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)cc1 746365340 NPLFESSAODDDAE-UHFFFAOYSA-N 406.490 2.428 10 20 HECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 746811879 REJXSFPBMSUPEK-UHFFFAOYSA-N 403.504 2.181 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1F 746978449 PXROJNGZOBYUEX-UHFFFAOYSA-N 402.430 2.227 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(N)=O)o2)NC(=O)OC(C)(C)C)cc1 747420002 OCMUZBOASIHTMK-HNNXBMFYSA-N 416.478 2.440 10 20 HECD O=C(NCc1ccccc1O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1 748349452 GIPSMJHBQUNLIR-HNNXBMFYSA-N 424.906 2.433 10 20 HECD CSc1ccncc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 750253303 MJPKWOYWVMYPDA-UHFFFAOYSA-N 414.531 2.267 10 20 HECD COC(=O)[C@@]1(C)CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 752819165 IRPRBPYROJSASL-QFIPXVFZSA-N 422.393 2.395 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCC[C@@H]3O)CC2)cc1 755053393 JYCCCZIPHYOYKX-NQIIRXRSSA-N 404.555 2.010 10 20 HECD COc1cc(N2CCN([C@@H](C(N)=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 759872076 HMJPAEVOZQPWIC-LJQANCHMSA-N 403.454 2.200 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCSC1 762051678 CJJAXSTYVZJAKY-INIZCTEOSA-N 401.511 2.312 10 20 HECD Cc1cc(NC(=O)CN2CCN(Cc3cc(Br)ccc3O)CC2)no1 768226734 CBOCAGBKCGAQRK-UHFFFAOYSA-N 409.284 2.207 10 20 HECD C[C@@H](NS(=O)(=O)c1cccs1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 771008888 MWDNMMGFINGKQU-ZBFHGGJFSA-N 424.544 2.328 10 20 HECD COCCNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 772993019 DRKYSYWWKBSKQP-HNNXBMFYSA-N 405.520 2.168 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccc(N(C)C)cc1 773856473 INYICKIYQPFGEK-CYBMUJFWSA-N 421.494 2.252 10 20 HECD CCN(CC(=O)NCc1cccs1)C(=O)CN[C@H](C)c1cc(OC)ccc1O 775371079 SOBZUODFWTWCBI-CQSZACIVSA-N 405.520 2.278 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(C)(C)[C@H](O)C(C)C)CC2)cc1 778393677 HXYSJTDKDUNTDU-GMAFFVFYSA-N 417.550 2.059 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc(OC)c(O)c3)CC2)cc1 779222531 QDIQSPMTHBZUME-FQEVSTJZSA-N 415.534 2.024 10 20 HECD COc1ccc(N2CCN(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 783911784 OGXSWRUDBBCEFA-UHFFFAOYSA-N 405.476 2.199 10 20 HECD O=C(OC[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785396171 FNMLLJXJSHVYGA-GFCCVEGCSA-N 422.415 2.295 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CSC[C@@H]3CCCCO3)cc2)CC1 786261395 DMARWKKERVGSAT-FQEVSTJZSA-N 405.564 2.274 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3nc(C)cs3)CC2)cc1 788928131 ABCSMRYZEFOKGX-UHFFFAOYSA-N 415.563 2.263 10 20 HECD O=C(NCC[C@H]1C[C@H]2CC[C@H]1C2)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832647 BQKJUVICGWMSMT-SZMVWBNQSA-N 417.525 2.346 10 20 HECD C[C@H]1CN(c2ccnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2)C[C@H](C)O1 789967817 NYXFSNNBZNTPFY-ROUUACIJSA-N 410.518 2.462 10 20 HECD O=C(c1cccc(O)c1O)N1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1 790616080 YVCXJFZGQJUOSA-UHFFFAOYSA-N 416.908 2.350 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](Oc1ccccc1)C(C)(C)O 795749390 WEUMJMLVLLMSMT-OAQYLSRUSA-N 414.502 2.473 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 795776435 TUOSIRCNLWXMNA-KRWDZBQOSA-N 420.554 2.094 10 20 HECD O=C(CN[C@@H]1CCc2ccccc2OC1)NCc1ccc(N2CCOCC2)c(F)c1 801570336 DSRBXPXGWPVDTF-LJQANCHMSA-N 413.493 2.262 10 20 HECD COC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803678560 DJXSYDNRVUSDBD-QHCPKHFHSA-N 415.534 2.483 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O)c1ccc(N(C)C)cc1 807673925 BQSHEYPOXNTPDQ-UZLBHIALSA-N 414.550 2.370 10 20 HECD CCOc1ccc(NCc2cc(OC)ccc2O)cc1S(=O)(=O)N1CCOCC1 809682689 YVQCXUCLOKDRST-UHFFFAOYSA-N 422.503 2.433 10 20 HECD C[C@H](c1ccccc1)[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 813589549 CFNFIYFALCAYAB-QRWLVFNGSA-N 414.481 2.119 10 20 HECD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ncnc3[nH]cnc23)c(C)n1-c1ccccn1 914903074 DFEIXZVHBVKZDJ-CYBMUJFWSA-N 405.418 2.339 10 20 HECD CCNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918205670 QYOIYWSFLRUZAE-UHFFFAOYSA-N 414.481 2.411 10 20 HECD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)s1 918399160 MRASQOWXZOJNGA-JTQLQIEISA-N 417.534 2.118 10 20 HECD CCN(C(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 920635685 KJXDVMMMACYKFJ-ZDUSSCGKSA-N 406.460 2.362 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)o1 1841705346 DDKTUPUEACOIOS-UHFFFAOYSA-N 406.442 2.198 10 20 HECD Cc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1F 1845500811 RNWLFKXTSHCIOF-UHFFFAOYSA-N 408.817 2.053 10 20 HECD O=C(c1cc2n(n1)CCC2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501446 PKTSERKSHYYGAP-UHFFFAOYSA-N 416.865 2.025 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccc(F)c1 51718110 SNWCHSNHRDDGHA-UHFFFAOYSA-N 418.444 2.364 10 20 HECD C[C@H]1CN(CCCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 140001387 OKVQZFMJQRWEHM-OTWHNJEPSA-N 404.555 2.383 10 20 HECD CCOC(=O)C1=S=C(NC(=O)c2ccc(C(C)=O)o2)C(C(=O)OC(C)(C)C)=C1C 447312640 HHIPSFKLNGGTNE-UHFFFAOYSA-N 421.471 2.482 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)n(C)c2ccccc12 472807570 LCUANHLMAKCLHF-UHFFFAOYSA-N 406.486 2.372 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 727057031 LWZNIZLFFMGHQR-RTBURBONSA-N 413.499 2.048 10 20 HECD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NCc1ccccc1O 727618411 XUXCBRBWBRPNRY-UHFFFAOYSA-N 413.499 2.145 10 20 HECD C[C@H]1[C@@H](C)N(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@]1=O 736630294 YWVCVMYHEWSIGP-MZICGWGFSA-N 410.495 2.242 10 20 HECD CCc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 740277045 XPJNYXTUJISBSU-OKILXGFUSA-N 419.453 2.463 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(-c4cnn(C)c4)c3)nc12 745222942 PYTIXUFLRRZANG-UHFFFAOYSA-N 421.413 2.369 10 20 HECD NS(=O)(=O)c1ccc(F)c(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 745824993 AFROYBIOERUHMU-UHFFFAOYSA-N 407.467 2.057 10 20 HECD Cn1cc([C@H](O)CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 745906365 ZOBLFBWFQGLWGH-RHSMWYFYSA-N 409.437 2.023 10 20 HECD COC(=O)C[C@H]1CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 749466895 XWTVFDCTUFCIQV-CQSZACIVSA-N 406.438 2.428 10 20 HECD Cc1ccccc1CC(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 749908178 SCECJNXFMDNDBY-UHFFFAOYSA-N 408.546 2.064 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3cnc(N(C)C)n3C)cc2F)C[C@@H](C)O1 751784475 YVZMWYOBPOLYQI-HUUCEWRRSA-N 418.517 2.238 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)NCc3ccc(N(C)C)c(F)c3)C2)nc1 753148430 ITLLFNAOLMIZSC-UHFFFAOYSA-N 415.469 2.151 10 20 HECD COc1ccc(N2CCN(CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)CC2)cc1F 754015120 WEXIBSKXRLHBBE-UHFFFAOYSA-N 414.393 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N(C)C)cc3C)CC2)cc1F 754211285 FTULUHGNDXMOIY-UHFFFAOYSA-N 414.481 2.496 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnn(C)c1Br 759633327 ULAGLGMEYVWLHB-UHFFFAOYSA-N 409.284 2.064 10 20 HECD O=C(NCC(F)(F)F)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765040828 KDCCNISVAOZQKH-UHFFFAOYSA-N 400.338 2.316 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765777989 NZBSNINTZXLZMS-KBRIMQKVSA-N 410.465 2.471 10 20 HECD COc1cccc(C[C@@H](C(=O)N[C@@H](C)c2cc(OC)ccc2O)n2nnnc2C)c1 768912136 WDFJNPSBTQMVIG-DJJJIMSYSA-N 411.462 2.366 10 20 HECD COCC[C@]1(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCOC1 770262275 RMFJQXHGPMBVFD-ZOCZFRKYSA-N 409.502 2.434 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](C(=O)N(C)C)O3)cc2)CC1 774715891 LTQFHISMZRCGHN-UXHICEINSA-N 402.539 2.358 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3c3ncc[nH]3)CC2)cc1 778252080 NHICRTXPGHAEEU-SQUSKLHYSA-N 423.517 2.377 10 20 HECD Cc1ccc(C(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c(O)c1O 780944514 BXLSTNQELPDFCD-UHFFFAOYSA-N 404.488 2.130 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)COC(=O)N4)cc2F)C[C@@H](C)O1 784222130 LMYTYYVZIWWEGF-GASCZTMLSA-N 420.485 2.223 10 20 HECD C[C@@H](OC(=O)c1ccn(C)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785688377 NDXPDYDCPXUMAR-GFCCVEGCSA-N 403.394 2.380 10 20 HECD CC(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789800950 XEDCPTPIXKCTLZ-UHFFFAOYSA-N 420.510 2.175 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC4CC4)C3)cc2F)C[C@H](C)O1 789830322 NXIGUDPWZXZPGO-GJZGRUSLSA-N 404.486 2.161 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1 789862861 BMMVCSMXBFXWHY-UHFFFAOYSA-N 417.531 2.282 10 20 HECD CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 799184279 BTMXOFUIEPMUTF-UHFFFAOYSA-N 405.505 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)N3CCc4cc(F)ccc43)CC2)cc1F 802559959 INKFUSPJGMLTEV-UHFFFAOYSA-N 401.413 2.211 10 20 HECD Cc1nc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 804961035 GBTDZCFTSRTDDU-HNNXBMFYSA-N 422.938 2.224 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)c1 806278001 MUQGMBFZCMQEFY-UHFFFAOYSA-N 420.560 2.099 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 806512846 VMRMKJPGMKZIKW-WBVHZDCISA-N 401.429 2.226 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(c2cc(F)ccc2F)CC1 807099177 MTGPYPNMGJIGKE-UHFFFAOYSA-N 416.472 2.304 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCO1 808085157 IKLHBQWZZAVFGA-HBFSDRIKSA-N 404.507 2.220 10 20 HECD CN(Cc1ccccc1O)c1nnc([C@H]2CCS(=O)(=O)C2)n1C[C@@H]1CCCCO1 812439068 UHKZXUBKRUGLBB-IRXDYDNUSA-N 420.535 2.091 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cnn(C)c2I)c1 815835042 IRKPLZDNBOOYLK-QMMMGPOBSA-N 401.204 2.230 10 20 HECD C[C@H](C(=O)N1CCN(c2ccccn2)CC1)N(C)Cc1ccc(N2CCOCC2)cc1 857758578 LHFHMJURGVWLMT-HXUWFJFHSA-N 423.561 2.087 10 20 HECD O=S(=O)(Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCCCC2)cc1 906275160 PBXHPWSDFIKWOX-UHFFFAOYSA-N 424.500 2.391 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)o2)c(C)n1-c1ccccc1 915037656 ZCKRYRWROXATLY-UHFFFAOYSA-N 402.428 2.374 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2ccc(N(C)C)cc2)CC1 1117758304 MHFZOLVJCYGVPC-SFHVURJKSA-N 412.486 2.486 10 20 HECD Cc1cc(C(=O)COC(=O)CO[C@@H]2CCOC2)c(C)n1-c1ccc2c(c1)OCCO2 1319350132 DPZQGDRHNKWCBH-QGZVFWFLSA-N 415.442 2.397 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(-c2ccc(C)cc2)c1C 1320394130 OMDWJGDLHZLVGV-KRWDZBQOSA-N 424.457 2.200 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)C(F)F)CCC2)cc1 1792313789 GQAUXGZKZSENTD-UHFFFAOYSA-N 413.471 2.246 10 20 HECD C[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1822180360 UYFNNYWDNNKSJS-ZANVPECISA-N 408.842 2.161 10 20 HECD Cc1ccc2c(c1)C(=O)N(CC(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)C2=O 145594400 USLCYYQMLBALOU-MRXNPFEDSA-N 407.470 2.305 10 20 HECD COC(=O)c1ccccc1-c1ccc(/C=C2\SC(=S)N(CC(N)=O)C2=O)o1 727176338 JXLKSDCCRMBFTN-ZSOIEALJSA-N 402.453 2.420 10 20 HECD COc1ccc(OCCCS(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 727352470 GBZKLZPMARFIDQ-UHFFFAOYSA-N 414.505 2.278 10 20 HECD CCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 727484125 WBRIMJUVMJETEC-SFHVURJKSA-N 409.527 2.105 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCn2cnnc2C1 732044000 VNCFAVCPRJKBAY-UKTHLTGXSA-N 419.557 2.363 10 20 HECD CC(=O)NC[C@@H]1CN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCO1 735591636 HALZYGNSSMHGLN-LJQANCHMSA-N 409.446 2.404 10 20 HECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 740491274 KKFYTXPKBNLZCG-STQMWFEESA-N 404.442 2.245 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1(C)C 745694566 HXTBMXVFUTXWRR-RADWXHQJSA-N 402.539 2.391 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 745784566 XXCPYXOBISZWEV-KNQAVFIVSA-N 404.555 2.320 10 20 HECD Cc1cc(NC(=O)C(=O)NCCCSc2nccs2)n(C2CCOCC2)n1 746431542 BEAZIAJZQHXGND-UHFFFAOYSA-N 409.537 2.237 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)ccc21 746812710 JIYNKPRHXKRLPM-UHFFFAOYSA-N 410.430 2.019 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnn(C4CCOCC4)c3)CC2)cc1 749921224 YEQYPWQNHAZXRH-UHFFFAOYSA-N 420.535 2.144 10 20 HECD C[C@H](Sc1nnnn1C1CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752150976 DBXQETFREAWXJT-BBRMVZONSA-N 403.508 2.402 10 20 HECD CCS(=O)(=O)N1CCC(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 754679032 QHVJYGVCRBKSRM-UHFFFAOYSA-N 404.536 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSC[C@@H](C)C3)CC2)cc1 754746051 SUGUJDJXMWZPNG-QWPQOLDESA-N 403.548 2.112 10 20 HECD CC(=O)c1cccc(OC[C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755302456 BWWFXOBTYCUWDH-OAQYLSRUSA-N 412.486 2.376 10 20 HECD COC(=O)C12CCC(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)(CC1)C2 758118249 JNBBNHZFMJTNJE-UIFUMHDPSA-N 413.518 2.128 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)c3nnc(C)s3)CC2)cc1 759316125 YRERQUUTRWZMQU-OAHLLOKOSA-N 418.567 2.428 10 20 HECD COC(=O)c1ccsc1N1CC[C@@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 759589932 VGCSNWOIMHVNSY-UYWPIULCSA-N 403.412 2.308 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@@]34CCOC4)cc2F)C[C@@H](C)O1 764642609 LZDCGJSPOWBUFT-ZXHZAXBBSA-N 420.481 2.025 10 20 HECD C[C@@H](NC(=O)NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773615948 ZXDQSRXJSRMUCG-CZUORRHYSA-N 411.549 2.009 10 20 HECD COC(=O)CN1CCN(c2ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)cc2)CC1 779482421 FBQZONOYEDMJQV-OQFOIZHKSA-N 411.458 2.045 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](Cc1ccccc1)C(=O)O 780608631 KRTNDXXOGHZSFD-LJQANCHMSA-N 415.465 2.282 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCC(=O)[C@@H](C)C3(C)C)nc12 781312488 GCGVOEYLSBMSJV-BXUZGUMPSA-N 403.435 2.296 10 20 HECD CC(C)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782728371 CQSBOJIUZUIMRK-UHFFFAOYSA-N 407.444 2.072 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3OCO4)CC2)cc1 782829525 XUYDVWDDVUFVOW-MDZDMXLPSA-N 409.442 2.267 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CCN(C2CC2)C1 788805432 LIZJROFDBFEFMQ-CYBMUJFWSA-N 424.339 2.104 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1 788929600 WUXABLDOAQQYGB-IBGZPJMESA-N 416.566 2.160 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c(O)c1 794381829 OWMDCJVHHDPAGR-UHFFFAOYSA-N 419.231 2.076 10 20 HECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806234401 KZGLSBQGOOIUSH-PXNSSMCTSA-N 424.501 2.192 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@H](c2cccc(O)c2)C1 806276444 DIZYHSVOHHWJHX-HNNXBMFYSA-N 407.517 2.047 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@@H](C)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807677134 MDWIPSSKKSJWPM-KBPBESRZSA-N 400.445 2.025 10 20 HECD COCC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccco1 807899484 STPWZOGYRTWGNF-MSOLQXFVSA-N 416.474 2.387 10 20 HECD CC(=O)NCC[C@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 808219695 XJNFBALPENFMIF-LJQANCHMSA-N 417.550 2.165 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)C(=O)OC4)cc2)C1 808887064 JNHWVVDELGFCGD-HNNXBMFYSA-N 408.458 2.380 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)c1 812715215 FOFLWPMJQORNOF-OAQYLSRUSA-N 418.515 2.221 10 20 HECD Cc1ccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c(Br)c1 813310486 ABABGUWCKPJFQA-UHFFFAOYSA-N 410.293 2.218 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-n4cccn4)nc3)CC2)cc1 826534793 ZQGYAWLIBIHLJF-UHFFFAOYSA-N 420.517 2.218 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 916233610 DMRULZFHOAEOBH-JOCHJYFZSA-N 421.545 2.341 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1cc(C(N)=O)c2ccccc21 917392456 YDKJPLYBJSBWHH-UHFFFAOYSA-N 406.486 2.235 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccccc3CN3CCOCC3)CC2)cc1 917828867 USNXDGVLZWMOBQ-UHFFFAOYSA-N 424.545 2.288 10 20 HECD CC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 918188706 WBOAUOXHHORURY-GASCZTMLSA-N 406.502 2.249 10 20 HECD O=C(Nc1cccnc1-n1cccn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918298102 XVONETVVBAIXDH-KRWDZBQOSA-N 421.457 2.119 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1ccccc1)N(C)CC 1116591797 JSBQIWBYTWSLGV-FXAWDEMLSA-N 400.475 2.381 10 20 HECD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1336704974 BEZFKYJZLVRCCD-QGZVFWFLSA-N 424.906 2.160 10 20 HECD O=C(CC(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817102139 OADCWHFLGNYXTA-LLVKDONJSA-N 413.356 2.474 10 20 HECD Cc1cccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc12 1843249549 XGYLMNUELSZKCJ-UHFFFAOYSA-N 406.442 2.413 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2CCC(=O)N2)C3)cc1 1845398428 MDWFLQXSMLLZGI-FQEVSTJZSA-N 420.513 2.190 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cccc(OCCN(C)C)c2)n(C)c2ccccc12 550913236 KENQNTADXQDKSD-UHFFFAOYSA-N 422.529 2.360 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN1C(=O)OCC(F)(F)F 727798457 APARCEVWQNLCLY-MRXNPFEDSA-N 415.412 2.303 10 20 HECD COc1cccc(CNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c1O 729859345 PREFWVTWNQPLBQ-UHFFFAOYSA-N 414.277 2.497 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCCCCC3)cc2)C1 735583498 YQKMVOWGBJIETC-GOSISDBHSA-N 402.539 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)C)nn3C)CC2)cc1 747004707 JOQBKNXFQCQUTE-UHFFFAOYSA-N 400.479 2.058 10 20 HECD O=C(NCCCNC(=O)c1cccs1)NCc1ccc(N2CCOCC2)c(F)c1 748824439 DJEVYFYCFQNBQY-UHFFFAOYSA-N 420.510 2.343 10 20 HECD Cc1ncoc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 750928157 JJEWSEZDXCLBFQ-CHWSQXEVSA-N 405.426 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)COC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1F 753737139 ABONLOYAXWDXML-UHFFFAOYSA-N 423.485 2.119 10 20 HECD Nc1ccc(N(C(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)C2CCCCC2)cc1 756191202 ZNLUDUZRGACGPL-UHFFFAOYSA-N 416.503 2.221 10 20 HECD COc1cc(N2CCN(CN3C(=O)C(=O)c4ccccc43)CC2)cc(OC)c1OC 758965754 UTXWTSLCSOTPGX-UHFFFAOYSA-N 411.458 2.021 10 20 HECD COc1cc(N2CCN(C(=O)c3ccnc(-n4cccn4)c3)CC2)cc(OC)c1OC 759238357 GTNYIPMHFMBYPP-UHFFFAOYSA-N 423.473 2.256 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)cc1 759719850 PJXDGXKSPJUIHY-UHFFFAOYSA-N 417.531 2.158 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2cncn2)cc1 765979164 JAIFMXQZRNNWRN-KRWDZBQOSA-N 411.531 2.353 10 20 HECD CCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769783075 COIPINMGGONRDF-AWEZNQCLSA-N 406.460 2.066 10 20 HECD O=C(Nc1ccc(F)cn1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 773670280 RDYGCVJRFMOJPQ-HNNXBMFYSA-N 406.845 2.299 10 20 HECD O=C(NCc1cccnc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774122667 HPEFFOCKPCMDGA-OAHLLOKOSA-N 404.417 2.084 10 20 HECD COc1cccc(CNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)c1O 774770352 KUUWWUMDESUUEO-UHFFFAOYSA-N 419.908 2.077 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1 774780231 LEQBLFNFRWHLMY-QFIPXVFZSA-N 424.545 2.199 10 20 HECD Cc1ccc(C(=O)Nc2cccc(OCc3nc(N)nc(N(C)C)n3)c2)c(O)c1O 780926552 JLGHIKDVQFPMBL-UHFFFAOYSA-N 410.434 2.071 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)N1CCc2ccc(Br)cc21 785298585 WMOJXTIADZYFTH-LLVKDONJSA-N 419.275 2.497 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)c1 787831984 JLTLZJHUOVLLMV-HNNXBMFYSA-N 402.831 2.020 10 20 HECD Cc1nc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789371629 ZOLJSAHDDXBLGX-UHFFFAOYSA-N 406.845 2.274 10 20 HECD O=C(COC(=O)[C@@H](O)c1cccnc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954879 ZZEYKFGBLLJFST-FQEVSTJZSA-N 416.389 2.072 10 20 HECD COC(=O)C(C)(C)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 805768154 SZGAIUKDNRRPRV-UHFFFAOYSA-N 423.510 2.133 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCc2c(cnn2-c2ccccc2)C1 807098070 VNTVQPSDSWKNOP-UHFFFAOYSA-N 417.513 2.448 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1 807292769 YCQPCMKISCMUPC-VQTJNVASSA-N 409.486 2.387 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1 808079149 QKHDQJNOAYWGSZ-PXNSSMCTSA-N 417.550 2.444 10 20 HECD CC(C)O[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1(C)C 809438192 KXZNXCSBWWPMDF-UXHICEINSA-N 417.550 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cn5c(n4)CCCC5)n3)CC2)cc1 809464712 LAJBUPIZBWLAFG-UHFFFAOYSA-N 422.489 2.169 10 20 HECD CN(C)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442449 IHSBPPWHTSNBFX-UHFFFAOYSA-N 424.545 2.212 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3Cl)cc2)C1 918464439 VWCJRDGNUISYQL-HNNXBMFYSA-N 414.893 2.297 10 20 HECD O=C(CCN1C(=O)COc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 919969609 AJZWIPDOSKLLPS-UHFFFAOYSA-N 423.513 2.327 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)CC2)cc1 1319600996 DHTCLSXNARHHBS-UHFFFAOYSA-N 413.499 2.438 10 20 HECD CC/C=C(\C)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1784902865 QHMGHEGKSSBIDM-PITQSHOHSA-N 416.474 2.003 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2cnccc2n1 1796601184 CGEISYAHWTUMDE-MUJYYYPQSA-N 419.441 2.002 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1CCC=CO1 1804286151 MSUHMOZFYYDRKA-MXJZGFGZSA-N 414.458 2.148 10 20 HECD CC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816721925 VQUVRJVGBXAKRS-CYBMUJFWSA-N 406.826 2.369 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)N3CCc4sccc4C3)nnc2n1 54846051 LQOHHJXHBQSFKC-UHFFFAOYSA-N 418.552 2.121 10 20 HECD C[C@@H](NC(=O)NCCNC(=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 140922775 WGAROHHHPSPDEO-MRXNPFEDSA-N 414.481 2.453 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 437023590 ITWJHGMKSRGROE-HNNXBMFYSA-N 423.469 2.302 10 20 HECD Cc1cc(C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1ccc(C(C)C)cc1 726372283 NXVBPKKBVFLCSO-UHFFFAOYSA-N 404.536 2.179 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 726563142 WZQHFBGOEFZGIQ-UHFFFAOYSA-N 422.485 2.146 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 727056754 BEZHOSNYWSKXAE-GOSISDBHSA-N 418.515 2.182 10 20 HECD O=S(=O)(N[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)c1cccc(F)c1 729468901 SNBRAEOCVFHZBE-OAHLLOKOSA-N 408.451 2.203 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(F)c1 729666195 QWDMFGBVAAKMRW-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CCOC(=O)C1CCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730132331 BRTIPTYFUYQSAS-UHFFFAOYSA-N 420.529 2.452 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCCCSc1nccs1 733972482 RZNDRMCZHOWUNN-UHFFFAOYSA-N 418.548 2.133 10 20 HECD O=C(NCC[S@@](=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 735096136 VWSOGUDNHFLTFD-GDLZYMKVSA-N 419.522 2.410 10 20 HECD O=C(CSCC(=O)N(Cc1ccco1)Cc1ccccc1O)N1CCOCC1 743430859 OGPQQZZCZHQSGL-UHFFFAOYSA-N 404.488 2.106 10 20 HECD COc1cc(CNC(=O)CN2CCOc3cc(N(C)C)ccc32)cc(OC)c1OC 746497450 NSKFBUMWLGEQJD-UHFFFAOYSA-N 415.490 2.294 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)cs2)cc1 749154952 QVZGHQCKFMSASQ-UHFFFAOYSA-N 418.518 2.487 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H]2C[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 752142908 RYDDTCLZOCYLCZ-YJBOKZPZSA-N 419.547 2.160 10 20 HECD Cc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 752383166 XFZOIZUKCJNZEN-RYUDHWBXSA-N 406.483 2.459 10 20 HECD COc1ccc(N2CCN(Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)CC2)cc1F 754015126 WHUKDZFTZPBLNE-UHFFFAOYSA-N 402.382 2.430 10 20 HECD Cc1cc(C(=O)COC(=O)c2cnn(C)c2N)c(C)n1-c1ccc2c(c1)OCCO2 754534590 FAVNRLSKIIRBTI-UHFFFAOYSA-N 410.430 2.221 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1 757879473 KTAAUSGMUVNNRH-VJAMOUOBSA-N 403.479 2.325 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1S(C)(=O)=O 759014335 PTGSGUQOXGHSRQ-UHFFFAOYSA-N 416.499 2.238 10 20 HECD CCC1(CC)[C@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1OC 759599765 HHLPOEHLTBNUHS-WOJBJXKFSA-N 407.530 2.462 10 20 HECD Cc1cnoc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 768605770 JAEKBFMUXYHJGY-UHFFFAOYSA-N 417.443 2.078 10 20 HECD C[C@@H](NC(=O)N1CCN([C@H](C)C(=O)N2CCCC2)CC1)c1ccc(N(C)C)cc1 773613345 QBKNHPZSVCBFAN-QZTJIDSGSA-N 401.555 2.152 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(C(=O)OC)n(C)c2)cc1 774122133 BENZCHSFDZJRMT-UHFFFAOYSA-N 400.479 2.255 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C[C@@H](O)C(F)(F)F 774770327 BPSFFXZDLDEIQR-OAHLLOKOSA-N 406.360 2.256 10 20 HECD C[C@@H](NCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 775835221 SMWLQHWAXALPSW-UZLBHIALSA-N 407.580 2.362 10 20 HECD CSc1nnc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 782653844 QGOHQYIFXAJSJR-UHFFFAOYSA-N 411.528 2.360 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1N1CCOCC1 783303432 MEOALSACACGHPR-UHFFFAOYSA-N 410.518 2.495 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)Cc1ccccc1 785529247 WEUWFOMTTXLVGU-UHFFFAOYSA-N 408.546 2.324 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(C(F)(F)F)cc1 785605627 QGLPXHVSXLEQIC-UHFFFAOYSA-N 421.419 2.475 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)CC1 786655105 DCJLHPRNFOQOIA-UHFFFAOYSA-N 400.410 2.332 10 20 HECD O=C(NCCCN1CCc2ccccc21)C(=O)NCc1ccc(N2CCCC2)cc1 787686752 GDSPONARCGNMKT-UHFFFAOYSA-N 406.530 2.472 10 20 HECD C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840613 KWFGUNIHWVIOAU-VCBZYWHSSA-N 405.514 2.344 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2c(O)ccc(Cl)c2F)C1=O 792173425 HPEWLKGEWUSCOR-UHFFFAOYSA-N 420.828 2.290 10 20 HECD CC(=O)NC[C@@H]1CCn2ncc(C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c2C1 792780663 IVFRORAJCLDHCM-GOSISDBHSA-N 409.534 2.452 10 20 HECD CC(C)[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 794829789 GXOVREHONKLYHS-BFUOFWGJSA-N 416.482 2.172 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)c2ccnn2C)NC(=O)OC(C)(C)C)cc1 795248692 JNEIRJFXWLTMFS-INIZCTEOSA-N 423.539 2.030 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)n1 804644275 FVUDQEKTHHYFFJ-UHFFFAOYSA-N 413.434 2.057 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@@H](C)N1CCOCC1 804774041 ALNGGEHCZVDJFM-QZTJIDSGSA-N 417.550 2.279 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(OC(F)F)cn1 806277723 GCDMSVSSJGXPJD-UHFFFAOYSA-N 402.448 2.054 10 20 HECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCN(Cc2ccccc2)C1 806280037 IDVPJFUSQJIMEW-KRWDZBQOSA-N 418.588 2.474 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC1CCC(O)(c2cccnc2)CC1 807289198 LOMWQARQNJHLRV-UHFFFAOYSA-N 420.513 2.021 10 20 HECD CN(C)CC1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCCC1 807856567 TVOJCHIPRSMZNI-LJQANCHMSA-N 417.550 2.138 10 20 HECD CN(C)c1noc(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 812068038 VRWSNOXTRMDRBY-LBPRGKRZSA-N 410.425 2.205 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC(C)(C)C)o3)CC2)cc1 915060017 QUPQYUWQJZZNCY-UHFFFAOYSA-N 421.519 2.327 10 20 HECD COc1cc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)ccc1OCC(N)=O 917253851 FLGLHYOZWLZHQP-UHFFFAOYSA-N 408.458 2.292 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 917822140 FVTUWFHYJGWLCV-HXUWFJFHSA-N 423.579 2.328 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cnc4n(c3=O)CCS4)cc2F)C[C@@H](C)O1 918635712 YEALYZJXDVAICZ-CHWSQXEVSA-N 418.494 2.032 10 20 HECD CC(=O)N1C[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)Oc2ccccc21 919968837 LVAIVWUDGJBUAK-HSZRJFAPSA-N 423.513 2.326 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)OC)c1 1320274948 UXWKKCGKGVMDHK-HNNXBMFYSA-N 402.403 2.180 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993736 MZUBUXGAETXXDG-YONMQOAISA-N 408.458 2.174 10 20 HECD Cc1n[nH]c(C)c1CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1845269276 UYAHWGYUOSNQHC-UHFFFAOYSA-N 418.881 2.151 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H]2CNC(=O)C2)C3)cc1 1845399295 LJICPYDNVFHJBI-LJQANCHMSA-N 420.513 2.047 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCc4nc(COC)nn4C3)ccc21 467029122 PUIMKFOGMOYKLT-KRWDZBQOSA-N 411.506 2.387 10 20 HECD O=S(=O)(c1cccc2nsnc12)N(CCN1CCOCC1)c1ccccc1 523311950 TVAJUESICKBITK-UHFFFAOYSA-N 404.517 2.219 10 20 HECD CN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCS(=O)(=O)C1 726722954 ZEVRQIVPCQYLKS-HNNXBMFYSA-N 417.478 2.085 10 20 HECD Cc1cc(C(=O)CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C)n1-c1ccccc1 727296083 BHNKXULMXIKTMV-HXUWFJFHSA-N 415.559 2.082 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1nn(-c2ccc(F)cc2)ccc1=O 731615783 KIWDRNNEKUDDGX-UHFFFAOYSA-N 408.433 2.138 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 734017031 XWIBCJWEBGNRRK-BZSNNMDCSA-N 400.475 2.383 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC[C@@H](OCCO)C2)c([N+](=O)[O-])c1Br 734484840 JQESHSPZGYUTAY-SECBINFHSA-N 420.216 2.252 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCCN(C)C3)CC2)cc1 734655159 KCEUQXWFZZBDCM-FQEVSTJZSA-N 417.598 2.191 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(S(N)(=O)=O)c2cccnc12 736599777 QODISERUHGKYKI-UHFFFAOYSA-N 412.515 2.355 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1 739080174 KOKWZEDXTJFKIY-HUUCEWRRSA-N 413.474 2.442 10 20 HECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 740916078 UWCYMOCGVCCSHE-GOSISDBHSA-N 405.502 2.240 10 20 HECD C=CC(=O)NCc1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742916825 PQJSPUKTZDTPME-UHFFFAOYSA-N 422.529 2.049 10 20 HECD CN(CCN1CCOCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904147 MMECSYILZPRIMJ-INIZCTEOSA-N 412.481 2.230 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(CC(F)(F)F)C1 747310828 WVTHRSZTSHWHJU-INIZCTEOSA-N 400.445 2.301 10 20 HECD O=C(NCc1ccccc1O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 748352829 GFPOOJXRHBMOJP-UHFFFAOYSA-N 410.442 2.388 10 20 HECD CN(CC(=O)NCC(=O)Nc1ccccc1Br)c1ccc2c(c1)OCO2 756655377 QPAJQJVYTKGSFU-UHFFFAOYSA-N 420.263 2.369 10 20 HECD CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 760681311 XADOQCBVVPOIFM-UHFFFAOYSA-N 407.486 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 764681648 DTGIQFNEICKVKK-GQIGUUNPSA-N 423.529 2.416 10 20 HECD C[C@@H](CC(=O)N(C)c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765979235 JWTZUBOUWDQMAM-SFHVURJKSA-N 415.559 2.453 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CCC(=O)N1CCN(c2ncccn2)CC1 767932070 HOTVQLWJDPYLHG-UHFFFAOYSA-N 411.506 2.050 10 20 HECD C[C@@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)c1ccc(N(C)C)cc1 773016971 FHOYLULQDJRXQJ-OAHLLOKOSA-N 404.511 2.009 10 20 HECD Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc(S(=O)(=O)N(C)C)c1C 773740380 LINMKEJMQZZMCJ-CYBMUJFWSA-N 406.504 2.326 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 773849575 WDAZVSBHNMYKKJ-MRXNPFEDSA-N 424.501 2.041 10 20 HECD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)ccc1OC1CCOCC1 774362219 LRHCRKDAHFGUAU-UHFFFAOYSA-N 414.458 2.261 10 20 HECD COc1ccccc1OCCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 774807437 JGXMZVSUOZFZJH-UHFFFAOYSA-N 411.502 2.447 10 20 HECD COCC[C@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 779987963 JECRSEDNPMZZFX-FQEVSTJZSA-N 416.522 2.487 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C3CCN(C4CC4)CC3)CC2)cc1 782053876 YXIFQGHTUQJUDJ-UHFFFAOYSA-N 400.567 2.198 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1F 782538511 VSQRGTUQPAWVSN-UHFFFAOYSA-N 408.499 2.141 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4c(Cl)cccc4c3=O)CC2)cc1 783140220 NGNWHJZNTDSNJE-UHFFFAOYSA-N 412.877 2.407 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 786742712 XEFPZUSRVMYXEC-ZDUSSCGKSA-N 410.496 2.223 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCS(=O)(=O)c2ccccc21 791031595 FZCCJRKXLVYXJM-IBGZPJMESA-N 400.500 2.101 10 20 HECD COC(=O)[C@@H](C)S(=O)(=O)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 797291765 PRESWNPEKCTJHI-CYBMUJFWSA-N 412.895 2.298 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1 797630694 MNLLMLLCPQCFSE-LBPRGKRZSA-N 405.476 2.291 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662895 IWHWCKIXKNJPQJ-CAUGKJMWSA-N 405.514 2.296 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[C@H](C)C1 805092036 VUOHFXFHJZANRO-GOSISDBHSA-N 422.595 2.488 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 807100607 LHDCURUNOPNEAT-NQIIRXRSSA-N 408.546 2.456 10 20 HECD COC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@@H]1CCCO1 809451994 DKWWMHPWUDADCX-QUCCMNQESA-N 404.507 2.364 10 20 HECD COCC[C@@H]1COCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 812887061 PUXAWTPZFIRCQS-OAHLLOKOSA-N 408.454 2.138 10 20 HECD CCn1ccc(=O)n(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c1=O 913545651 SIFNMPYHMZGAMV-UHFFFAOYSA-N 409.442 2.092 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(S(C)(=O)=O)cc1 916567786 OKQRXDAFSRKYDK-UHFFFAOYSA-N 417.531 2.268 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 917821382 DPLOJUFFRXGVAV-FFZOFVMBSA-N 413.518 2.298 10 20 HECD O=C(Nc1ccc(-n2cccn2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918296454 KFYUQAMXXOFTAR-SFHVURJKSA-N 421.457 2.119 10 20 HECD Cc1nn(C)c2ncc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc12 918439158 UIUJCCDKJIJWEM-UHFFFAOYSA-N 424.530 2.085 10 20 HECD COc1cc(C)c(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 919808989 RSGBADFVDWIEBL-UHFFFAOYSA-N 408.476 2.362 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3c(CC)nn(C)c3CC)CC2)cc1 1336289109 BIBBWSABXNZDED-UHFFFAOYSA-N 406.552 2.455 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)CC1CCCCC1 1342435482 VMSKBCCTARQKCE-PBHICJAKSA-N 420.506 2.163 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CC1)C2 1796597690 QRUYIFBTLOAMJV-BCDXTJNWSA-N 407.470 2.476 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808001252 SHHSHLRQFYPHKJ-XQSDOELASA-N 410.474 2.254 10 20 HECD CCO/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822606264 KMUZIUJAKPOQKG-IZPAUZPXSA-N 401.423 2.072 10 20 HECD C[C@H]1Oc2ccccc2N(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 26077617 RIVDZMYDSBAJKE-QGZVFWFLSA-N 409.486 2.296 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CC[C@@H](C(F)(F)F)NC1=O 195683681 LFCRQUZLFCUGGL-CABCVRRESA-N 401.454 2.313 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](CO)Cc1c[nH]c2ccccc12 729599390 GVITZOMFTLEBOT-IBGZPJMESA-N 408.502 2.407 10 20 HECD CN(C)C(=O)CN1CCC(NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 731762005 VFCXLODNIHMCRI-UHFFFAOYSA-N 415.582 2.371 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccccc1N1CCOC1=O 737099059 CQMFRBVALYEIBQ-UHFFFAOYSA-N 408.458 2.498 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccccc3N3CCOC3=O)ccc21 737168109 YLPMNGCVIIJVHJ-UHFFFAOYSA-N 408.458 2.281 10 20 HECD CC[C@H](COC)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 738548782 MVDZTIGOTLDBCE-GFCCVEGCSA-N 423.447 2.256 10 20 HECD CC(=O)c1cc(Cl)cc(CN(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c1O 750045947 YULZUOBUUDSYMH-JKSUJKDBSA-N 401.912 2.416 10 20 HECD CNS(=O)(=O)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)C1 750200325 BNXGYJHXQKCCFI-QGZVFWFLSA-N 407.511 2.348 10 20 HECD COCCN(CC(=O)NC[C@@H]1Cc2ccccc2O1)c1ccc(OC)c(OC)c1 751481010 DWYUTRCFZSHEPT-SFHVURJKSA-N 400.475 2.277 10 20 HECD COc1cc(N2CCN(C(=O)NCCOc3cccnc3)CC2)cc(OC)c1OC 759261408 DVJNTOWDJBWIEK-UHFFFAOYSA-N 416.478 2.018 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](C)N(C)C3CC3)CC2)cc(OC)c1OC 759281590 IIZKVSYJASMUSC-OAHLLOKOSA-N 406.527 2.027 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCC[C@H]3OC)CC2)cc(OC)c1OC 759297009 HGOSLHRTZMJXII-DOTOQJQBSA-N 407.511 2.359 10 20 HECD CCCc1c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cnn1-c1cc(C)ccn1 761070187 JCDJDKBLUAYJOY-UHFFFAOYSA-N 423.473 2.237 10 20 HECD COCCn1c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2ccccc21 768497896 CXRZXZVBSHCOHQ-UHFFFAOYSA-N 404.448 2.012 10 20 HECD CN(C)c1ncncc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 769699847 PQYBOYLNGQEXPO-UHFFFAOYSA-N 417.381 2.479 10 20 HECD COC(=O)c1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 772907758 VLUWKXQYAMMJRD-UHFFFAOYSA-N 419.428 2.316 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3COC4(CCCC4)O3)cc2F)CC1 773740223 JSTGKWRDKXWLLN-SFHVURJKSA-N 420.529 2.453 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 773740484 PIVUKUMRSYEATI-FUHWJXTLSA-N 412.486 2.463 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1cccc(Cl)c1 773769189 QKMRCMJVPVEXKX-GFCCVEGCSA-N 412.895 2.167 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)n([C@@H](C)C4CC4)n3)nc12 777188220 SZICUIYHHZESIX-LBPRGKRZSA-N 413.434 2.445 10 20 HECD CN(C)c1ccc([C@H](CN[C@H]2CCCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 777302440 PPCLDQXUYBBQHW-WMZOPIPTSA-N 411.568 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](OC)c3ccccc3)CC2)cc1 778228949 TWYUUQCMNNPCOM-CHHLAKQQSA-N 423.513 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc4n[nH]c(C)c4c3)CC2)cc1 778245956 NCVGHOVNZSHCPV-FPLPWBNLSA-N 420.473 2.118 10 20 HECD CC[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 778306366 XMNIFOIACUAGKD-GEPASTNRSA-N 415.534 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)c3ccc4c(c3)OCO4)CC2)cc1 778395657 RLNQDHPHJBRPAL-MDZDMXLPSA-N 423.469 2.292 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cc1 785443560 NINKEHMQGDPIGM-UHFFFAOYSA-N 408.546 2.492 10 20 HECD CCNC(=O)c1ccc(CNC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)cc1 787185348 RUMOHOUYSOVYRN-UHFFFAOYSA-N 410.518 2.167 10 20 HECD CC(C)C[C@@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859719 FWZVJBQPALHNST-JOCHJYFZSA-N 419.591 2.256 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N(CCCO)Cc1ccccn1 792882415 QYUNYKXZLKNWGS-UHFFFAOYSA-N 402.470 2.152 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOC[C@H]1C1CC1 803450874 SQALSHAZHWIERJ-SFHVURJKSA-N 423.460 2.010 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ccccn3)CC2)cc1F 804853232 UNPOPFSBUDLLGY-UHFFFAOYSA-N 413.497 2.032 10 20 HECD O=C(NCCC1(O)CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805772621 LXBVDMJZEJATFN-OAHLLOKOSA-N 413.465 2.488 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3[C@H]3CCCO3)cc2)C1 806494723 VUSFPPJZIWSRRE-YZGWKJHDSA-N 400.523 2.241 10 20 HECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)o1 807289183 LKFXUBWGCYZFPV-HXUWFJFHSA-N 409.486 2.435 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(N(C)C)cc1 807671690 SCUIUBMWZNPIPS-RHSMWYFYSA-N 410.522 2.332 10 20 HECD COC(=O)[C@@H]1[C@H]2CN(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C[C@H]21 813662198 VHUWONVMCZRJBM-KKBVYLPWSA-N 409.433 2.317 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917087454 YUOCFMMORWLNQA-UHFFFAOYSA-N 424.454 2.091 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(OC)cc(OC)c3)CC2)cc1 918460982 LUXZJZSVXYDXNX-UHFFFAOYSA-N 413.474 2.390 10 20 HECD C[C@@H]1CCCN(C(=O)CCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 1122406905 MPZGONHZFDPABL-GOSISDBHSA-N 402.539 2.313 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 1347358252 JFPJCJQCZCVZJM-UHFFFAOYSA-N 418.515 2.264 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCCCC1)C2)c1cc(O)nc(O)c1 1777847539 DUJURKJCJMFYSS-VGOFRKELSA-N 417.506 2.201 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1=CCCC1 1806213145 IMYJMWZGVZLHEN-UZLBHIALSA-N 408.458 2.318 10 20 HECD O=C(Cc1ccncc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428414 XGEZVEVDBDAGOS-LJQANCHMSA-N 424.501 2.364 10 20 HECD Cc1ocnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829432717 ZPCSFKWRHSWQPM-INIZCTEOSA-N 414.462 2.336 10 20 HECD CC[C@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730122304 CXDWYLVGWBKLHX-HOTGVXAUSA-N 407.534 2.070 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1F 731408643 TYEQAOMHZACCMM-UHFFFAOYSA-N 404.417 2.165 10 20 HECD Cc1nnc2ccc(NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)nn12 731662253 HEMGUCFOXZLRDW-UHFFFAOYSA-N 419.468 2.301 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)CCO1 737167443 SRCXXJGIGNVLCJ-HNNXBMFYSA-N 414.481 2.372 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc(F)c(F)c(F)c1 741427387 OUHKWVHTXZVONG-UHFFFAOYSA-N 411.355 2.335 10 20 HECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cc2NC1=O 743958293 QELXOLUBHUILNJ-LBPRGKRZSA-N 409.442 2.245 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3cccc(OC)c3O)C2)c1 748660351 FQHCQWAPSAWQGA-HNNXBMFYSA-N 401.463 2.496 10 20 HECD COC(=O)C[C@@H]1CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749465924 LFBGZUXPZPJNSR-HNNXBMFYSA-N 406.438 2.428 10 20 HECD CC(=O)OC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 753185458 UUEVDWPZBGSBPS-HZPDHXFCSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4ccc(F)cc43)CC2)cc1 754060767 IMSYXSJDGWBMFD-LJQANCHMSA-N 401.482 2.216 10 20 HECD COc1ccccc1COC[C@@H](O)COc1ccc(N2CCN(C(C)=O)CC2)cc1 755302658 GFRFVZSZQWFINI-OAQYLSRUSA-N 414.502 2.320 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@H]([C@H]4CCCO4)C3)cc2F)CC1 757200001 KWWJFZAGOSJXSJ-NHCUHLMSSA-N 420.529 2.057 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C)[nH]c2C(=O)OC)cc1F 759373507 DHUSXELEKJQLTE-UHFFFAOYSA-N 404.442 2.350 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc([S@@](C)=O)cc3)CC2)cc(OC)c1OC 759406941 YYVDZUKDTYTHPV-GDLZYMKVSA-N 418.515 2.412 10 20 HECD CCCOc1cccnc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 760146811 BLTLCFJEEDMCKR-UHFFFAOYSA-N 403.504 2.035 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCOC2(CCOCC2)C1 769201910 WRHCTLWLFLPJJI-LJQANCHMSA-N 403.523 2.393 10 20 HECD COc1cccc(CNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c1O 769508267 UKMLEOHMNHYWDT-UHFFFAOYSA-N 408.451 2.254 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnc([C@H](C)O)s3)CC2)cc1 773731342 BCFOQKHTNRITOG-HNNXBMFYSA-N 404.536 2.147 10 20 HECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1F 774104190 PEUONNMRWMDNHI-NDEPHWFRSA-N 403.479 2.418 10 20 HECD Cc1nc2ccccc2n1CCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 775109324 RPOWSMFYRIYSMV-UHFFFAOYSA-N 411.481 2.373 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)N(C)CC2)c1ccc(N2CCOCC2)cc1 776042253 PJELLWDXWPYPDY-INIZCTEOSA-N 408.502 2.331 10 20 HECD CCOc1ncccc1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778240078 ZWKIPUXPOJXWIL-ZHACJKMWSA-N 424.501 2.010 10 20 HECD Cc1cc(C2CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n[nH]1 782496987 KFBCIFYFYQAXMA-UHFFFAOYSA-N 415.513 2.190 10 20 HECD COc1cccc([C@H](C)N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 785421467 CMTFDBHKHTVYJJ-SFHVURJKSA-N 424.545 2.283 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCCc2nc3c(s2)CCCC3)cc1 785429275 YVPOPYJEWVKQFZ-UHFFFAOYSA-N 400.548 2.453 10 20 HECD COCCOc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 787989574 FOIBYDPXZGWWPH-UHFFFAOYSA-N 411.502 2.027 10 20 HECD CC(C)(C)CCCCNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793725744 RVEPGDAFMBIZSF-SFHVURJKSA-N 416.566 2.337 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)ccc(F)c3N)CC2)cc1 798679351 REHQFJWIAJOCCW-UHFFFAOYSA-N 405.401 2.061 10 20 HECD C[C@H](CN1CCCC1=O)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 803120066 JIGXCJGRNWYFEC-MRXNPFEDSA-N 401.507 2.181 10 20 HECD CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803679681 VEFUIQWGIFJLCW-SFTDATJTSA-N 417.550 2.382 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCN(C)C3)cc2)CC1 805024547 JPAPGBMXSTZVEJ-HXUWFJFHSA-N 400.567 2.339 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(N2CCOC2=O)cc1 806276837 LMDDPPWPHYUBKL-UHFFFAOYSA-N 420.516 2.015 10 20 HECD NC(=O)c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)ccc1F 807513946 ZLOKNEGMQGZFQJ-UHFFFAOYSA-N 400.193 2.192 10 20 HECD O=C(NCCC[C@@H]1CCCCO1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807994835 VBWHGDRPMXDONO-OALUTQOASA-N 404.507 2.365 10 20 HECD COCc1cncc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)c1 809464198 BUDLYDZAQHZIKR-UHFFFAOYSA-N 423.473 2.178 10 20 HECD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918643733 NTJDVHCHIYOKLT-BJMVGYQFSA-N 415.471 2.159 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(N3CCCC3)cc2)SC1=S 1318188914 DFOGPDRAJOIDRS-QINSGFPZSA-N 411.574 2.037 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)O[C@H]1CCN(C3CC3)C1=O)c2[N+](=O)[O-] 1318991724 RVJGDSAUJLCSFO-INIZCTEOSA-N 420.377 2.290 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(C2CCCCC2)C1 1320399882 VBWWFODALHSJAP-AEFFLSMTSA-N 404.507 2.343 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)NC=O)C3)cc1 1800514155 SXTXNRGRYCKTRB-CMCXCUNFSA-N 422.529 2.480 10 20 HECD COCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811803385 INAYTXQXCIJGKR-UGSOOPFHSA-N 419.865 2.112 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccns2)CC1 1825679495 UNIJAFMTBZIAGG-OAHLLOKOSA-N 416.503 2.496 10 20 HECD COc1ccc(-c2noc(CN3CCN(Cc4cc5c(cc4O)OCO5)CC3)n2)cc1 23269837 QVYWVNGTRNCUQX-UHFFFAOYSA-N 424.457 2.497 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)cnc4ccccc43)cc2F)C[C@@H](C)O1 108291576 GMKOZOOAISCOMN-IYBDPMFKSA-N 424.476 2.466 10 20 HECD CCN1CCN(CCCCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 139991108 YYNLRERYNIDUPI-FQEVSTJZSA-N 417.598 2.301 10 20 HECD CS(=O)(=O)N1CCC(CNC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 726251584 KUUXYGVRZKSBFX-UHFFFAOYSA-N 421.519 2.369 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1 729053565 NHEOJFFBKSTJQQ-LAJNKCICSA-N 412.446 2.016 10 20 HECD COCCN(C(C)=O)c1nc(CN2CCN(c3ccc(OC)cc3)CC2)cs1 733793804 YXMMESMKOIXMEO-UHFFFAOYSA-N 404.536 2.473 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NC(=O)Cc2ccccc2)c1 734014971 PRKBLOJRFXLQCE-GOSISDBHSA-N 402.516 2.498 10 20 HECD C[S@](=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 735574966 SFSVJLYHCPXCTG-OFJJUDJNSA-N 414.531 2.447 10 20 HECD COc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(NS(C)(=O)=O)c1OC 742494990 HNILQVBCGDVZBY-UHFFFAOYSA-N 421.519 2.414 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)n(C)c1 746805271 NVPHTFHJFFKSHR-UHFFFAOYSA-N 410.515 2.191 10 20 HECD C[C@H](NCC1(O)CCS(=O)(=O)CC1)c1cc(Br)cc(Cl)c1O 756606071 KWWPDNLBNGICGG-VIFPVBQESA-N 412.733 2.398 10 20 HECD CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 758654364 QEDXJMRLEADPDI-UHFFFAOYSA-N 402.516 2.419 10 20 HECD CCOC(=O)c1cnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1C 758942236 SUWLDMFSRHEPGF-UHFFFAOYSA-N 416.478 2.314 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@]12CCCO2 759318201 HMTXLGHMQYLPJD-VWPQPMDRSA-N 421.513 2.313 10 20 HECD CCN(CC)C(=O)COc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765046646 FZGMAXOTLWUDDO-UHFFFAOYSA-N 404.448 2.271 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)ccc21 765111296 RZOWGFNPSRVBLU-UHFFFAOYSA-N 411.527 2.383 10 20 HECD Cc1cc(C(=O)CN2CCN3C(=O)CC[C@H]3C2)c(C)n1-c1ccc2c(c1)OCCO2 766273398 XOJDVHDBHAKGDV-SFHVURJKSA-N 409.486 2.355 10 20 HECD C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NCCc1ccc(O)c(O)c1 768900323 FLLHCBJFOYYDHZ-VIFPVBQESA-N 413.293 2.399 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@]4(C3)OCc3ccccc34)CC2)cc1 770677034 UFAXERCJOJVRFV-XMMPIXPASA-N 407.514 2.475 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(C)cccc3F)CC2)cc1 772663622 QMXUBWRKJXOAPH-UHFFFAOYSA-N 407.511 2.243 10 20 HECD CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362830 FPIHXTFXGCAARC-UHFFFAOYSA-N 405.838 2.397 10 20 HECD CCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774363870 ZCKHDRLVRSIUQN-UHFFFAOYSA-N 413.493 2.452 10 20 HECD C[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(S(N)(=O)=O)c1 774390521 BBPPGXJZMZHVCW-CQSZACIVSA-N 407.511 2.285 10 20 HECD C[C@@H](CCc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 775217969 FJEWOIXZCAJADV-HNNXBMFYSA-N 403.454 2.009 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2nnc3n2CCCCC3)cc1 775226645 WMVZEHPNWRDKSY-UHFFFAOYSA-N 412.538 2.126 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCc2ccccc2CN2CCCC2=O)c1 775369992 DOJSLDOCKLHYRA-MRXNPFEDSA-N 411.502 2.490 10 20 HECD CN1CCC(O)(CNCc2cc(Br)cc(Br)c2O)CC1 776214423 OYIFPENLGAXRCZ-UHFFFAOYSA-N 408.134 2.464 10 20 HECD C[C@H](NS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc(N(C)C)cc1 780849940 WJUUECJAYACFDO-AWEZNQCLSA-N 423.560 2.233 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 786981945 RWXFHIRSFPFQOW-CQSZACIVSA-N 403.429 2.295 10 20 HECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1OC 787298056 HOOQLTVGMYWAHJ-UHFFFAOYSA-N 415.490 2.019 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)cc(Br)c1F 787532751 HHYDXHKYLDLONR-UHFFFAOYSA-N 415.190 2.436 10 20 HECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N(C)c1ccccc1 787636962 JIROCQBAMVLVQE-LJQANCHMSA-N 424.545 2.123 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nncn2-c2ccccc2)cc1 788977343 JJTXXDVGFJESFZ-UHFFFAOYSA-N 406.490 2.046 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cn(C)nc3-c3ccoc3)CC2)cc1 789916718 MIGNFIGTWVVVSJ-UHFFFAOYSA-N 409.490 2.241 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCC(O)CC1 792079783 WGRWBQJTTZTTTO-UHFFFAOYSA-N 413.497 2.110 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c(O)c1 794378988 LMXRPIJVIIBLKS-ZDUSSCGKSA-N 423.447 2.070 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c(C)nn(C(C)C)c3C)nc12 795893366 IFCLCZJZRQZXGJ-UHFFFAOYSA-N 415.450 2.292 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c(O)c1 797389422 HEQRTPSYFRLPFX-UHFFFAOYSA-N 400.435 2.058 10 20 HECD COCCn1c(-c2cccn2C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802480079 LBVDJQOSZKWGOB-UHFFFAOYSA-N 414.485 2.404 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1F 803663989 CYZLWOJETXFKBP-LJQANCHMSA-N 412.509 2.289 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCN(C)CC(F)(F)F)cc2)CC1 804137988 LLNOQMFUFSBWIW-UHFFFAOYSA-N 414.472 2.149 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1O 810328640 WJPYDMHWGMOBKS-UHFFFAOYSA-N 419.286 2.302 10 20 HECD O=C1CC[C@@](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)(c2ccccc2)CN1 816891072 HSBBHIXBDXXOFK-QHCPKHFHSA-N 411.477 2.127 10 20 HECD CC(C)(C)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917834945 VASJQOVUAOUZPF-MJGOQNOKSA-N 414.550 2.042 10 20 HECD CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 917926465 FQJJHQLGBLAGPR-QGZVFWFLSA-N 409.552 2.237 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)c[nH]3)cc2)C1 918373264 UTSAKOXQMAXQPI-ZDUSSCGKSA-N 405.296 2.409 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)cc([N+](=O)[O-])c3)nc12 920904237 CHIKADLSLGUWKL-UHFFFAOYSA-N 400.347 2.185 10 20 HECD CC(C)=CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1780654636 NSLFCPFVYSLAID-VGOFRKELSA-N 417.506 2.367 10 20 HECD CO[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792316089 OIMBXYLHPZMRDR-LBPRGKRZSA-N 421.544 2.016 10 20 HECD Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992142 VMGLDXYTATZSAZ-FOIQADDNSA-N 421.457 2.158 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)[C@@H]3C=CCN3)C2)CC1 1810809423 FHGLYXYOLRIFFG-INIZCTEOSA-N 419.909 2.124 10 20 HECD Cc1cc(C(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c(C)n1-c1ccccn1 106073086 SGTNGJSZSQJIBI-UHFFFAOYSA-N 409.534 2.259 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccnc(-n3cccn3)c2)n(C)c2ccccc12 576415428 BRGIUVHYYHGCFS-UHFFFAOYSA-N 402.458 2.000 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCCN(c3nccs3)CC2)n(C)c2ccccc12 673314305 CSBGINXGQILKEM-UHFFFAOYSA-N 411.531 2.298 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccnc1N1CCOCC1 729523542 PVPHJALZELPMEZ-UHFFFAOYSA-N 410.518 2.057 10 20 HECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N(C)C)cc1 731497042 SQEMLQMJTJHRGG-FQEVSTJZSA-N 406.490 2.091 10 20 HECD Cc1nn(C)cc1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733607104 CSVBQLVWPUCVLM-UHFFFAOYSA-N 403.394 2.299 10 20 HECD O=C(C[C@@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799610 LUMHVISYKLQIQZ-KBPBESRZSA-N 402.463 2.198 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1 743890782 YFCCWCHFMHSWIT-UHFFFAOYSA-N 424.501 2.485 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCc2ccccc21 746878238 SZDQEMTWBAHTHU-FXAWDEMLSA-N 406.530 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 749513360 DHKOEVCDJBKDFP-CVDCTZTESA-N 412.578 2.293 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)cc1F 749984914 BCWRBAROMULYKS-GOSISDBHSA-N 406.483 2.018 10 20 HECD COCCCOc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 750726756 XIMCHFHIDGTPLA-UHFFFAOYSA-N 403.454 2.403 10 20 HECD CC1(C)NC(=O)N(CCCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 751294405 NJVCWYITAYPXNY-INIZCTEOSA-N 403.479 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3cn(-c4ccccc4)nn3)CC2)cc1F 755219653 HFGVIISDACYEOL-UHFFFAOYSA-N 410.453 2.447 10 20 HECD CCOC(=O)N1CCC(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)CC1 756337309 RYESRDSMZFTCSM-LJQANCHMSA-N 419.522 2.110 10 20 HECD COc1cc(N2CCN(C(=O)CCCNC(=O)C(C)(C)C)CC2)cc(OC)c1OC 759221927 UYAZGHZEPDFPDR-UHFFFAOYSA-N 421.538 2.304 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2coc(S(N)(=O)=O)c2)cc1 763633880 XVSYEEIMCVEBSN-UHFFFAOYSA-N 403.460 2.429 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 769385722 SQOZVSQXAUZTLG-QZTJIDSGSA-N 402.539 2.487 10 20 HECD Cc1cc(C(=O)N2CCN(c3nccn4cnnc34)[C@H](C)C2)c(C)n1-c1ccccn1 771659070 OZROECFRJVWRLJ-MRXNPFEDSA-N 416.489 2.278 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccoc3)cc2F)C[C@@H](C)O1 772575395 YUFRDYUROAASSL-GASCZTMLSA-N 404.438 2.434 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](Cc2ccccc2)CN2CCOCC2)c1O 775027489 GXFLAKHVHQXYDP-GOSISDBHSA-N 401.463 2.342 10 20 HECD CCCN(C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCS(=O)(=O)C1 776040232 ASMSBVVLUFITQQ-SFHVURJKSA-N 409.552 2.273 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](OCC4CC4)C3)CC2)cc1 778174381 RWHIFGXHMAUKBO-GMAHTHKFSA-N 403.567 2.069 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(S(C)(=O)=O)ccc3C)c2)CC1 781048374 VRXWPAAEWWIZSY-UHFFFAOYSA-N 415.515 2.319 10 20 HECD COCCCN(CCO)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 782958267 DCLDKUWNVWNZHL-UHFFFAOYSA-N 401.454 2.297 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)Cc2cccc(F)c2)cc1)C1=S=CC=C1 785241632 VVYZDQRLCHJGNM-UHFFFAOYSA-N 418.471 2.302 10 20 HECD COc1ccc(OC)c([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 785501688 RWSFYYCQCQYEQC-CYBMUJFWSA-N 403.454 2.403 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccnc(N2CCCCC2)c1 786469779 YJWVVSRJEICGHI-UHFFFAOYSA-N 419.529 2.381 10 20 HECD C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccc(N2CCOCC2)cc1 787063957 IROHRQXTWLGBLQ-OALUTQOASA-N 416.566 2.479 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1)CC(F)F 788318552 DOODMURGKVFGIR-UHFFFAOYSA-N 417.456 2.433 10 20 HECD Cc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789825498 MILGPHMWRCMDPS-IYBDPMFKSA-N 414.481 2.075 10 20 HECD CS(=O)(=O)CC[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 789905824 RTLCENJTGFYADE-OAQYLSRUSA-N 416.543 2.358 10 20 HECD O=C(Cn1ccc2ccccc2c1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 790551879 QFJUJDOURSRJRB-UHFFFAOYSA-N 409.461 2.418 10 20 HECD CC[C@@](C)(OC)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 795015462 RWKILPYYBAOGFS-OAQYLSRUSA-N 401.486 2.374 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC(C)(C)c3c(C)noc3C)CC2)cc1 796664477 XKCBVVIXMYSSSY-IBGZPJMESA-N 402.539 2.308 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCN3CCCc4ccccc43)ccc21 803687206 XRBNOLBTCNPIKF-UHFFFAOYSA-N 406.530 2.254 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)[C@@H]1CCCN(C(=O)OC)C1 808033162 IEAWDKFPKGVZIM-HZPDHXFCSA-N 405.495 2.114 10 20 HECD CN(C)c1ccc([C@H](CNC2CCS(=O)(=O)CC2)NC(=O)OC(C)(C)C)cc1 812842761 SIBXLIZPGLSNNV-SFHVURJKSA-N 411.568 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1 916688484 ZYCDBTCFOVDADW-UHFFFAOYSA-N 423.473 2.101 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(OCC(=O)O)cc1)c1ccc(N2CCOCC2)cc1 920865838 OQTHTNGJOMPIMC-HNNXBMFYSA-N 420.487 2.026 10 20 HECD Cc1ncnc(O)c1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1317921148 STINNCYGFPJBNR-KBPBESRZSA-N 402.470 2.492 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncn1-c1ccc(F)cc1 1320387958 ZPBIPMYJHXEWFF-INIZCTEOSA-N 413.405 2.327 10 20 HECD Cc1ccn(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1794426973 HOGALIPZHVFTSX-QDMKHBRRSA-N 418.881 2.208 10 20 HECD Cc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932525 GYJJTBCBNBXECZ-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Cc1ocnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934688 PAXLKPZTEGOOBV-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1F)c1cc(O)nc(O)c1 1804098493 GXJRFAOIYYHTRE-MUJYYYPQSA-N 417.412 2.266 10 20 HECD CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 23199816 RQAQMJVZRVMXMC-INIZCTEOSA-N 415.465 2.469 10 20 HECD C[C@@H](NC(=O)Cn1nc(-c2ccccc2)oc1=O)c1ccc(N2CCOCC2)cc1 115952567 WQBUVCKTMCMUQV-MRXNPFEDSA-N 408.458 2.217 10 20 HECD OC[C@H]1CCCN(c2cc(NCc3ccc(N4CCC(O)CC4)c(F)c3)ncn2)C1 301222309 BFJNYUNABCOIAZ-KRWDZBQOSA-N 415.513 2.398 10 20 HECD Cc1n[nH]c(-c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)n1 303840079 LVNWJONRDIYMRH-UHFFFAOYSA-N 404.474 2.417 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)[C@H]2CCCN(c3cccnn3)C2)n(C)c2ccccc12 515324586 SFBUHKGYAIBQRM-KRWDZBQOSA-N 420.517 2.020 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1O 727761363 WVVOHCYYJAFLIV-QGZVFWFLSA-N 404.488 2.260 10 20 HECD Cn1cc(CN2CCN(Cc3c(O)ccc(C(=O)c4ccccc4)c3O)CC2)cn1 729988277 HIWITMCEQFWLDV-UHFFFAOYSA-N 406.486 2.380 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCn3c(Cc4ccccc4)nnc3C2)cc1 741796352 ZCHUPYMALNRLIS-UHFFFAOYSA-N 404.518 2.067 10 20 HECD O=C(COCC(=O)N(Cc1ccco1)Cc1ccccc1O)NCc1cccnc1 752089437 WDHJWCYPXPWWJY-UHFFFAOYSA-N 409.442 2.242 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCc2ccc3c(c2)CCCN3C)cn1 753447661 XZXBHIMLBVHCNY-AFJIDDCJSA-N 415.563 2.301 10 20 HECD Cn1ccnc1[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 756690737 XFSRYRRLQMHRNB-INIZCTEOSA-N 401.486 2.219 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nc2ccccn2c1=O 761752253 GCIIYCOYPQCMQP-UHFFFAOYSA-N 405.252 2.013 10 20 HECD COCCOc1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765927540 SKDWTGFRWRLXMU-UHFFFAOYSA-N 423.263 2.435 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1CCC(NC(=O)OC(C)(C)C)CC1 769245792 MDOIMFAPDIUUAL-UHFFFAOYSA-N 418.538 2.467 10 20 HECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2C)C1=O 771265252 CVFIDLJQONXTCO-QHCPKHFHSA-N 424.501 2.153 10 20 HECD Cc1ccc(S(N)(=O)=O)cc1NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 771791286 LPGAYPDKCIWVSS-UHFFFAOYSA-N 416.547 2.312 10 20 HECD CCn1nccc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 775025908 ZBIQHIGUUZBKIQ-HUUCEWRRSA-N 418.469 2.129 10 20 HECD C[C@@H](NCC(=O)NC[C@@H]1COc2ccccc2O1)c1ccc(N2CCOCC2)cc1 775255467 QZTCJJNYFAQKAX-YLJYHZDGSA-N 411.502 2.130 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)Oc3ccccc3)CC2)cc1 778277148 AKPNKIIXHCYVCC-JXOMPUQVSA-N 423.513 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccn(CC(F)F)n3)CC2)cc1 778306172 PVCZKYWQCNOEMX-VOTSOKGWSA-N 419.432 2.000 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn([C@H](C)COC)n2)cc1F 778607805 RSFFUHVWOOCOJE-CQSZACIVSA-N 405.474 2.331 10 20 HECD NC(=O)[C@H]1CCCC[C@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782539506 KPZKDDUOJDMOTB-DOTOQJQBSA-N 405.454 2.034 10 20 HECD CC(C)COCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 785550658 LTNDGYKJOVBYHH-IAGOWNOFSA-N 423.529 2.234 10 20 HECD Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 786224502 JYHQDZLNUGXDFK-RTWAWAEBSA-N 424.545 2.100 10 20 HECD CC(C)CN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 786330076 BOZOLAIHNYDOEH-HXUWFJFHSA-N 417.550 2.136 10 20 HECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)CC1 788968567 VTYGRONNCLRUBJ-UHFFFAOYSA-N 416.566 2.256 10 20 HECD CC(C)C[C@]1(CO)CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 789514251 SBMLHDZLWIVDGX-QFIPXVFZSA-N 407.530 2.152 10 20 HECD CC(=O)N1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 795784204 LVAUQGYLYDCIDV-OAHLLOKOSA-N 419.481 2.343 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)CC2)cc(OC)c1OC 797985853 CHCJGPQCBPOMJJ-WKILWMFISA-N 420.506 2.340 10 20 HECD CC(C)C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803297685 CXGRSAVAFANRSM-HFSMHLIXSA-N 417.550 2.410 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCC[C@@H]1c1ncc[nH]1)c1ccc(N2CCOCC2)cc1 803307178 XUXKIBATVCXZAZ-VQIMIIECSA-N 411.506 2.177 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOC2(CCC2)C1 803448923 IGAHLRBDPNVVFG-UHFFFAOYSA-N 423.460 2.155 10 20 HECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)o1 803662716 MCHYBMUVGUBQPF-GOSISDBHSA-N 403.454 2.263 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nc3cc(Cl)ccc3n2C)cc1F 803663829 BSDOSPZCUIHQBM-UHFFFAOYSA-N 417.872 2.364 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCOC2(CCCC2)C1 808109761 DNLZTVOHGDSRQA-LJQANCHMSA-N 415.534 2.090 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@H](c4ccccc4)OC3=O)cc2)C1 809617364 OJSIXVTYXIBQBC-HLAWJBBLSA-N 421.497 2.309 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(C(=O)O)c(F)c1 871792603 FTEVZIZCXZSDJK-UHFFFAOYSA-N 408.451 2.181 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918664987 KWDHQPGAJKFLIH-UHFFFAOYSA-N 417.531 2.346 10 20 HECD Cc1c([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1C 1254665879 VBICSDDUABGBSU-XHSDSOJGSA-N 417.529 2.448 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OCC)c(OC)c1 1320148203 PYPNEJRPOYKAAU-HNNXBMFYSA-N 403.431 2.409 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCC(F)(F)F)c1cc(O)nc(O)c1 1793979033 VCCVBHOTTOWIRZ-CLLJXQQHSA-N 401.385 2.477 10 20 HECD Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807994035 MNZBEHSKCVZSLF-DNVCBOLYSA-N 422.441 2.423 10 20 HECD CCc1ccnc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1843199379 OPBWLDWBIMSARQ-FNORWQNLSA-N 423.469 2.291 10 20 HECD Cc1ncc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441785 UHQQRKXYLAEIKZ-UHFFFAOYSA-N 423.498 2.061 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nc1C 1847033806 FPZQOCDCRNPEOU-RMKNXTFCSA-N 423.469 2.346 10 20 HECD CN1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847579368 PJOYQQMKFIRFPP-JYJNAYRXSA-N 407.898 2.051 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3c(C)cc(C)cc3C)CC2)cc1 56966421 LQQRTMCINBUCRV-UHFFFAOYSA-N 424.545 2.497 10 20 HECD O=C(Nc1nc2c(s1)COCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735584554 MKJDHSSJSCQURR-CQSZACIVSA-N 417.487 2.068 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccccc2O)ccc1Br 751148980 GGRDOSPRATWPNO-UHFFFAOYSA-N 400.250 2.420 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1 753640250 MSQBLKFGCBOZIK-TZMCWYRMSA-N 410.517 2.060 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)CC2)cc1 759259767 PMSRKFHPYYGSSY-UHFFFAOYSA-N 413.499 2.484 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 759887801 XILKPXSUGOXVIW-CALCHBBNSA-N 405.539 2.339 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc([C@H]4CCCO4)s3)nc12 760667971 FSMHWWSWXVAAID-GFCCVEGCSA-N 418.431 2.277 10 20 HECD Cc1cc(C(=O)CN2CCN3C(=O)OC[C@@H]3C2)c(C)n1-c1ccc2c(c1)OCCO2 763714682 MARIPHSGDQZUGP-KRWDZBQOSA-N 411.458 2.184 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1SCCO 765474632 YIFCSFQRWFUDKE-UHFFFAOYSA-N 417.487 2.446 10 20 HECD O=C(CN1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1)Nc1ccccc1Cl 768440816 FAJCGPWOUJSTMT-LJQANCHMSA-N 417.893 2.228 10 20 HECD Cn1cc(C(=O)NCC2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)cn1 769229621 PHRMLYAJXFSSEA-UHFFFAOYSA-N 415.513 2.038 10 20 HECD COc1cc(CNc2ccc3c(c2)ncn3C)ccc1OCC(=O)N1CCOCC1 770588761 LFLFMYZZISREPS-UHFFFAOYSA-N 410.474 2.432 10 20 HECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773749989 SOGBJFIQOYLKOO-SNVBAGLBSA-N 403.826 2.097 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCCCC1 774886853 BGOACUDGUAPCEW-UHFFFAOYSA-N 418.607 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOCC34CCCC4)CC2)cc1 778410596 NFJYVDRTUROSIL-HJWRWDBZSA-N 413.518 2.072 10 20 HECD CNC(=O)[C@H]1CN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CCO1 781547354 MXYBRUNKJBAWES-RBUKOAKNSA-N 421.457 2.181 10 20 HECD Cc1cc(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n[nH]1 784068942 CNYWPEBIVDQCIP-UHFFFAOYSA-N 416.501 2.162 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C 785296299 CJIKMQNUMLUVMU-NSHDSACASA-N 419.865 2.139 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(N(C)C)cc1 785572742 AAXVXSWHSHASJG-XMSQKQJNSA-N 424.545 2.120 10 20 HECD Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 785706829 XRCZVPRAWCHHOG-UHFFFAOYSA-N 417.456 2.167 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3N)cc2F)CC1 786914949 KBQBONCULICKHC-UHFFFAOYSA-N 401.442 2.388 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C(=O)N1c1ccccc1 788911553 PHKXUXANRAJAGP-UTKZUKDTSA-N 420.513 2.213 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCO[C@]3(CCSC3)C2)cc1 788975555 QTZUHUHCVGIEMR-LAUBAEHRSA-N 405.564 2.320 10 20 HECD COc1cccc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1O 790848740 NFYVOYIFTGISNA-UHFFFAOYSA-N 411.392 2.313 10 20 HECD CCCCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)C 793735891 ZIEUPLYKZZEMLQ-LJQANCHMSA-N 416.566 2.432 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C 796322712 JQEMEMDPLRTOFS-UHFFFAOYSA-N 403.504 2.351 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCC3(OCCO)CCOCC3)cc2)CC1 800705166 JOSVUPXFPQCSME-UHFFFAOYSA-N 405.539 2.280 10 20 HECD CCOCCC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 804318863 DXPNHJYDQGUVEU-UHFFFAOYSA-N 403.523 2.103 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCCN2C2CC2)cc1F 804854718 JASFSQDAXYYPEL-GOSISDBHSA-N 404.530 2.421 10 20 HECD COCc1cnc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 806597756 KVLSHEBEJPDLCK-AWEZNQCLSA-N 403.508 2.313 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCN(CC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673918 BMMAJHURHOUZLM-AWEZNQCLSA-N 400.445 2.026 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(N(C)C)cc1 807674682 PEERIEWQAGEETB-SFHVURJKSA-N 424.545 2.425 10 20 HECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807679277 PLBZZSLREIGORR-RYRKJORJSA-N 418.538 2.303 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3cnc(C(F)F)cc3=O)cc2F)C[C@@H](C)O1 813579341 ABFYAOPGBSOZOA-CHWSQXEVSA-N 424.423 2.250 10 20 HECD COCc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc(C(=O)OC)c1 815500064 QMMWZSFFYLOEGO-UHFFFAOYSA-N 413.474 2.249 10 20 HECD CCn1nncc1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815526215 KUKURYQTDMHUBJ-LBPRGKRZSA-N 418.409 2.257 10 20 HECD COc1ccc(N2CCCN(C(=O)NC[C@H](C(C)C)N3CCN(C)CC3)CC2)cc1 918065053 OHKPPPKKGAWBQO-JOCHJYFZSA-N 417.598 2.189 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1nnc2n1CCCCC2 918186706 GWQYCYQERDHFMW-UHFFFAOYSA-N 416.501 2.104 10 20 HECD Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)n1 1805688840 GJWDASPRBHDKMM-UHFFFAOYSA-N 424.501 2.284 10 20 HECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c[nH]1 1807995755 IHOGWSQSFKLLTD-QRWLVFNGSA-N 421.457 2.158 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)n1cccc1 1847037896 YMOZBRUQXXMREK-PMGBHYCQSA-N 411.458 2.083 10 20 HECD O=C(NCCCSc1nccs1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 733974888 OLWLXIHNPNDWSW-UHFFFAOYSA-N 403.489 2.201 10 20 HECD CN(C)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1c(F)cccc1F 734551087 HBDFFFWSCGSLLE-OAHLLOKOSA-N 413.446 2.075 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(-n2cccn2)c1 735037562 QSEPNGOLHPHMOD-UHFFFAOYSA-N 410.499 2.037 10 20 HECD CN1CCN(CCCCNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 737065303 QQFZOPYJXPGYNY-FQEVSTJZSA-N 404.555 2.110 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1O 737286347 VXPVSFPSFBHJEQ-UHFFFAOYSA-N 411.458 2.282 10 20 HECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740610040 RXKCWCQVFFNGCB-UHFFFAOYSA-N 418.475 2.406 10 20 HECD CC(C)[C@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)N1C[C@H](C)O[C@H](C)C1 741021296 OTFHNJVVAWEYFG-KGVIQGDOSA-N 419.566 2.388 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(F)cc3)cc2F)CC1 742068606 GYKSJOSPAYTCLN-UHFFFAOYSA-N 416.472 2.039 10 20 HECD CC(C)C[C@@H](CCO)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745699952 ZHRKROIEGOEOKB-RTBURBONSA-N 404.555 2.232 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccccc1N1CCOCC1 747124220 NERCGSBSLOSFEQ-UHFFFAOYSA-N 415.515 2.010 10 20 HECD C[C@@H](c1ccccc1)[C@](C)(O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 747364111 NAMWKEYFGNIDHY-JTSKRJEESA-N 416.543 2.092 10 20 HECD Cc1cncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 751010023 BPKULRQBBKKQQA-GJZGRUSLSA-N 400.454 2.398 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)C3CCCCC3)cc2)C1 751097136 HGPVRZPFTWYQOO-IBGZPJMESA-N 414.550 2.091 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)CC(C)(C)C)cc2F)C[C@@H](C)O1 751767479 VJHQRMDLFKGIHK-ZRGWGRIASA-N 424.513 2.396 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)S(=O)(=O)c3ccc(F)cc3)CC2)cc1F 753737744 DCYWSVKPPAEUMD-AWEZNQCLSA-N 424.469 2.484 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 768254278 DCGVNPUBBGMJDQ-LISAXSMJSA-N 409.502 2.121 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cnn(-c2ccccc2)c1 768712421 DQIBRHNAHATLRX-UHFFFAOYSA-N 419.485 2.306 10 20 HECD O=C(NCCc1ccco1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 775113125 GEHLTFGLSFFJGM-AWEZNQCLSA-N 407.417 2.325 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 776074389 XUHIZMMQKMLEBS-NQIIRXRSSA-N 423.579 2.411 10 20 HECD CC(C)(C)NS(=O)(=O)c1ccccc1NS(=O)(=O)c1cccc2nonc12 780715955 MMAFPXNLAWSJEB-UHFFFAOYSA-N 410.477 2.100 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)Cc1ccccc1 785529777 XXJYVPBSPKCICP-UHFFFAOYSA-N 400.498 2.146 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(OCC3CC3)cc2)SC1=S 790109073 YRQOQBYSLLYALS-XNTDXEJSSA-N 412.558 2.226 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 790139941 XFBHLGMWXDPAIO-QGZVFWFLSA-N 417.462 2.174 10 20 HECD C[C@H]1CCC[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793727026 VHSLHNJMUQJDBF-AOIWGVFYSA-N 414.550 2.042 10 20 HECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 799263712 ZNCDQBOZVSPGSJ-LLVKDONJSA-N 403.391 2.091 10 20 HECD CS(=O)(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 800700719 PKGRWUQCHFXYEO-SFHVURJKSA-N 411.593 2.349 10 20 HECD COCCO[C@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 800849852 ITVASOALQOJCLT-NRFANRHFSA-N 406.523 2.054 10 20 HECD CCCCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803620620 ABDVZOXHENCTGO-FQEVSTJZSA-N 400.567 2.456 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1F 803661237 UTFPYQHSKVKNCU-UHFFFAOYSA-N 404.461 2.025 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1nc(C(F)(F)F)cs1 807155262 SMZDDRNQHNPOHD-UHFFFAOYSA-N 410.421 2.471 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387489 LNFQBJIDSNOWIC-UHFFFAOYSA-N 406.236 2.368 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCO[C@@]2(CCOC2)C1 808115038 MGABDYJPRDVSPD-CVDCTZTESA-N 415.534 2.090 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(Cc2cccc(Br)c2O)CC1 809729773 ZFPFYPVFRJYMLH-KRWDZBQOSA-N 404.308 2.499 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NCc1cc(OC)ccc1O 815835490 VKMBUQDDGAENBH-HSZRJFAPSA-N 423.469 2.406 10 20 HECD Cc1cc(-c2nnc(CNS(=O)(=O)c3cn(C)cn3)o2)c(C)n1-c1ccccc1 1257653045 ZFSSCTVCQXJUOO-UHFFFAOYSA-N 412.475 2.356 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@H](CO)CC1CCOCC1 1343835639 MHWUNJSZYHGWSS-LJQANCHMSA-N 407.580 2.464 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1cc(O)nc(O)c1 1817844574 DYJAIRYGSXGDRE-MRXNPFEDSA-N 422.445 2.160 10 20 HECD O=C(c1ccns1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426705 AUMLHYRSPFEPNG-HNNXBMFYSA-N 416.503 2.496 10 20 HECD O=C([C@H]1C[C@@H]1c1ccc(F)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248780 MIKJHCZKLGOPAZ-SJORKVTESA-N 411.433 2.253 10 20 HECD CCn1c(=O)n(CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc21 27006725 VMSWTFDCNHWQQG-UHFFFAOYSA-N 424.501 2.091 10 20 HECD CCCNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 60750573 VWKYXWXQGLBPCG-UHFFFAOYSA-N 408.502 2.464 10 20 HECD CC(C)NS(=O)(=O)c1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437015534 GZLHZSRLUMNXAL-UHFFFAOYSA-N 403.504 2.479 10 20 HECD Cc1ccc([C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)o1 725902113 HJJRQEVOMUGCAR-INIZCTEOSA-N 407.492 2.232 10 20 HECD COc1cccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1O 729860236 USUIUTJKHFGBPI-IBGZPJMESA-N 405.454 2.453 10 20 HECD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)NCc1ccc(CN2CCOCC2)cc1 732352825 IHCUSTFODAXTRI-CQSZACIVSA-N 404.488 2.148 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H](N2CCCCC2=O)C1 732823383 RMASLDACZPMTLR-GOSISDBHSA-N 418.513 2.349 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 741079651 MQKJDKQUGLNYJH-UYAOXDASSA-N 423.579 2.050 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CNC(=O)CC3CCCCC3)CC2)cc1 748728163 NYKKERRSYWFCHZ-UHFFFAOYSA-N 416.566 2.020 10 20 HECD Cc1cc(C(=O)CN(C)[C@H](CO)C(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749467285 XJWRQMPGWMIQRI-HXUWFJFHSA-N 421.563 2.263 10 20 HECD CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 749555633 RNLAJHUCAPRTHF-WSTZPKSXSA-N 401.555 2.060 10 20 HECD CCCOC(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751061613 XQSWYLKJAFOWEY-UHFFFAOYSA-N 412.489 2.328 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])nc12 752553739 KHADBFOYXKRDAT-UHFFFAOYSA-N 418.337 2.324 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(N4CCNC4=O)ccc3F)CC2)cc1F 753738239 HHNDDJHAAGMEEZ-UHFFFAOYSA-N 416.428 2.465 10 20 HECD COC(=O)c1cc2c(cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OCO2 753841079 KYAKAZOZGREXQA-LBPRGKRZSA-N 413.430 2.084 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 754133379 HXYUXCNEIOUPHV-LAUBAEHRSA-N 414.506 2.437 10 20 HECD CN(Cc1cc(Br)cn1C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 759098991 NOJUPMVPVGSQQZ-UHFFFAOYSA-N 416.297 2.137 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC(=O)N2CCC(O)CC2)cc1 765479476 IQCUUKYDVIFPBC-OAQYLSRUSA-N 417.550 2.024 10 20 HECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1C 767237834 UCJRBLIASPFVNS-KBPBESRZSA-N 410.515 2.443 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)c2)CC1 770148961 UDDBVDDDUFZZAX-IBGZPJMESA-N 420.513 2.286 10 20 HECD COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773768421 VERFRWHYRINABJ-ZIAGYGMSSA-N 407.488 2.264 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CN3CCCC3=O)c3ccccc3)nc12 774914820 RJSKIHOZVXMUBN-GOSISDBHSA-N 423.473 2.065 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)cc1 775096017 LEZAHUMEICCVCJ-IBGZPJMESA-N 402.926 2.441 10 20 HECD C[C@H](CCc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 775217972 FJEWOIXZCAJADV-OAHLLOKOSA-N 403.454 2.009 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(C)C[C@@H]1CNC(=O)OC(C)(C)C 775434847 IOGWIUIIBSKTHA-IBGZPJMESA-N 419.570 2.411 10 20 HECD COc1ccc(N2CCN(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F 784162639 VEBLZLUQALTWKM-UHFFFAOYSA-N 423.466 2.338 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCCN3C(=O)C(C)C)cc2)CC1 786656631 PIKGNAXPDHLLEK-OAQYLSRUSA-N 414.550 2.008 10 20 HECD O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ccc(N2CC=CC2)cc1 787720386 WSFDKTLZSVQNIC-UHFFFAOYSA-N 418.541 2.244 10 20 HECD CC[S@@](=O)CC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787947713 HCXKQIDDCHBYLI-WUTCKBNWSA-N 413.451 2.101 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccccc1 788931341 DMQBTWSMNVWTLC-FCHUYYIVSA-N 406.530 2.465 10 20 HECD C[C@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(N(C)C)cc1 789707008 VQIJJDFVTHXOSA-KRWDZBQOSA-N 418.607 2.408 10 20 HECD COc1cncc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 791697970 YUMIQQICWLALQF-UHFFFAOYSA-N 417.377 2.056 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793685293 HGROMURLHLHHAB-ZWKOTPCHSA-N 411.502 2.284 10 20 HECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cc(Cl)cc(C(C)=O)c2O)CC1 796571108 XDXPCFZOUXUGLG-UHFFFAOYSA-N 417.911 2.191 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@]3(CO)CCCc4ccccc43)CC2)cc1 799336682 OVOWXDISYRAKSX-XMMPIXPASA-N 409.530 2.158 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451258 IATWDXKZHDCWHA-HIFRSBDPSA-N 411.449 2.057 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@H](c4cccc(F)c4)C3)ccc21 803688716 ZNVMBPJNQPYTLL-NRFANRHFSA-N 411.477 2.424 10 20 HECD CCO[C@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C12CCC2 804318377 JESFBEMINZFDPX-PMACEKPBSA-N 415.534 2.244 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)cc1 804967201 KNBKGTPVMIOZLE-SFHVURJKSA-N 410.584 2.346 10 20 HECD C[C@@H](OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1nncn1C 805337319 OEDKAIBIWISDOW-SNVBAGLBSA-N 406.354 2.417 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1F 806879025 RTDACWBTXYTTGX-UHFFFAOYSA-N 406.483 2.497 10 20 HECD CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCOC(C)(C)C1 810042680 FACHUJUKSLOEHJ-RTWAWAEBSA-N 405.583 2.458 10 20 HECD O=C(CN1CCC(F)(F)[C@H](CO)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 812859718 KJRJCLJXLSWGPK-ZDUSSCGKSA-N 414.408 2.350 10 20 HECD NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1[N+](=O)[O-] 813685371 WUHVROBBGMMMGO-UHFFFAOYSA-N 420.230 2.185 10 20 HECD COCCNS(=O)(=O)c1cccc(CNCc2cc(Cl)c(F)cc2O)c1 816552116 BEXMXSGMLCWZDM-UHFFFAOYSA-N 402.875 2.399 10 20 HECD Cc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918462979 FNRZUJHGHCTFAW-GOSISDBHSA-N 408.502 2.260 10 20 HECD Nc1nc2nc(CSc3ncc(-c4ccccc4)n3C[C@H]3CCCO3)cc(=O)n2[nH]1 920245358 JTRWBWLYEBAEFY-OAHLLOKOSA-N 423.502 2.335 10 20 HECD CNC(=O)Cc1ccccc1NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1319030497 VQOVRQZAUKDTIT-UHFFFAOYSA-N 400.454 2.477 10 20 HECD O=C(CNc1ccc(Cl)cc1C(=O)c1ccccc1F)N[C@H]1CCS(=O)(=O)C1 1321221228 MYZHSTPYZJGNMC-ZDUSSCGKSA-N 424.881 2.425 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCCC[C@H]3C(=O)OC)CC2)cc1 1338267181 GODODJMNNRVGJM-RTBURBONSA-N 410.536 2.269 10 20 HECD Cc1cc(F)cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796602384 CLZAOGICDQYKJA-BCDXTJNWSA-N 413.449 2.435 10 20 HECD C/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1825037951 IXNVQTAXJVGRKM-ZABGRMTBSA-N 423.498 2.424 10 20 HECD Cc1c(NS(=O)(=O)c2cccc3nsnc23)cccc1S(=O)(=O)NC1CC1 610124395 ZBKPXEHHMFTBFM-UHFFFAOYSA-N 424.529 2.241 10 20 HECD COCC[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 725899589 LVTCTUJXGXPUCE-LBPRGKRZSA-N 423.447 2.256 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@]1(O)CCN(Cc2ccccc2)C1 735854880 SZMAXNUCDPENQS-QHCPKHFHSA-N 411.571 2.493 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnc(C(C)(C)C)nc3)CC2)cc1 737140275 WKSWZKRTAXFBDI-UHFFFAOYSA-N 411.506 2.460 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1 739078133 BRDDZRDJFRKJKU-OAHLLOKOSA-N 415.490 2.466 10 20 HECD CCOC(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 739079706 IHJXDZPPTJENFN-UHFFFAOYSA-N 409.486 2.430 10 20 HECD CS(=O)(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)c1 740904104 RAQBRDXGNKFEQR-UHFFFAOYSA-N 400.504 2.434 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 742952907 UFWUIJJEYDCIFC-UHFFFAOYSA-N 419.478 2.372 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 745863111 RAIMKVRNNJGDRU-PZJWPPBQSA-N 418.582 2.356 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)NCCC(=O)OC 749703610 SHJHDOQISIFXRD-UHFFFAOYSA-N 405.476 2.113 10 20 HECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2NC1=O 749731570 TVXMGQAUEMTMHT-SNVBAGLBSA-N 406.489 2.100 10 20 HECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(C)c1F 751212395 FSORPXSXKJTWOV-UHFFFAOYSA-N 412.508 2.478 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)cn3)cc2F)C[C@H](C)O1 751828460 WQNHJPMZEZDQNP-KBPBESRZSA-N 419.428 2.447 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc(C(=O)O)c2F)cc1 753774323 FCZHTBUJFOYBKL-UHFFFAOYSA-N 416.452 2.395 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@H](Cc4ccccc4)C3=O)CC2)cc1F 754015814 ZSFOFNQFDHBHSK-LJQANCHMSA-N 412.465 2.077 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(OC(C)(C)C)CC3)CC2)cc1 754060808 JXXZKXYOGZUUSV-HXUWFJFHSA-N 405.583 2.458 10 20 HECD COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN(C)c1ccc2c(c1)OCO2 756653372 IAXQPMHLFNBCBN-GOSISDBHSA-N 409.442 2.233 10 20 HECD COc1cc(N2CCN(c3ccccc3S(C)(=O)=O)CC2)cc(OC)c1OC 758933065 YWJIKTNKCQWRNO-UHFFFAOYSA-N 406.504 2.443 10 20 HECD COc1ccc(N2CCCN(C(=O)NCCCN3CCCO[C@@H](C)C3)CC2)cc1 764585168 UDYQUFHHLFXRLM-IBGZPJMESA-N 404.555 2.418 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@]34CCOC4)cc2F)C[C@@H](C)O1 764642602 LZDCGJSPOWBUFT-RYUMIWLPSA-N 420.481 2.025 10 20 HECD CC1CCC(NS(=O)(=O)CC(=O)NCc2cccc(Br)c2O)CC1 765747080 KZESAYAJBNAERC-UHFFFAOYSA-N 419.341 2.269 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(-c4nc[nH]n4)c3)cc2)C1 767299008 PAXBEUMWBBSDBJ-SFHVURJKSA-N 404.474 2.103 10 20 HECD CCn1cc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)nc1C 768011004 IAMRVFUCVUIYRL-UHFFFAOYSA-N 416.492 2.111 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@H]2C(=O)N2CCOCC2)c1O 769309781 BFZSRJFRYZMBLP-HNNXBMFYSA-N 413.312 2.377 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(/C=C\C4CCOCC4)n3)CC2)cc1 771064391 AXTKKKQIKYNDAK-UQCOIBPSSA-N 412.490 2.409 10 20 HECD Cc1cc(Br)cc(CN2CCN(c3ncnc4c3cnn4C)CC2)c1O 775647999 LPYPZWUTJUFEFG-UHFFFAOYSA-N 417.311 2.462 10 20 HECD COc1ccc(S(=O)(=O)N2CC(NCc3cc(Cl)cc(OC)c3O)C2)cc1 779170625 DNDOUGNRQXAFRJ-UHFFFAOYSA-N 412.895 2.226 10 20 HECD Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 782835995 HPOGTRVFTAZUAQ-UHFFFAOYSA-N 418.475 2.460 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cc1 785428844 TVQSHPJEFKCWGT-LJQANCHMSA-N 409.465 2.147 10 20 HECD Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 786225231 QPRPTVGCYKNIGI-LJQANCHMSA-N 415.509 2.498 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1 787636299 HEPFJOOZSWBTSK-OAQYLSRUSA-N 412.509 2.461 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c(O)c1 797390736 PBCYYYVACAIUEL-UHFFFAOYSA-N 406.442 2.330 10 20 HECD CCOC(=O)[C@@]1(COC)CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 798386472 RZQQKBFNCGXJCX-QFIPXVFZSA-N 419.522 2.025 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H](OC(F)F)C3)CC2)cc1 804316812 KGQSFNUBFWVLRD-QGZVFWFLSA-N 411.449 2.010 10 20 HECD CN(C[C@H]1COc2ccccc2O1)C(=O)C(=O)NCCCSc1nccs1 806276121 IDYLDWBULCHBNE-ZDUSSCGKSA-N 407.517 2.040 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C 807099929 HNSRNWHRWGRDFZ-XMSQKQJNSA-N 408.546 2.314 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1ccc(N(C)C)cc1 807670951 JWGGTNOSMRCCDH-DLBZAZTESA-N 416.566 2.331 10 20 HECD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)N(C)c2cccc(Cl)c2)c1 808489535 UNIFFQOYAGUPCB-UHFFFAOYSA-N 409.847 2.480 10 20 HECD CCNC(=O)C1(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CCC1 809728385 VKWFRMHPVAIBKW-UHFFFAOYSA-N 415.534 2.476 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ncnn1-c1ccccc1 809867239 HYONOFSQASMKFT-UHFFFAOYSA-N 407.474 2.418 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccncc4c3=O)cc2F)C[C@@H](C)O1 810009177 RRGCMFACRRNMNP-IYBDPMFKSA-N 424.476 2.466 10 20 HECD CCn1nc(C)c(CC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1C 814103868 YBICDNPORHAYCT-UHFFFAOYSA-N 413.566 2.399 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(OCC(N)=O)cc1 918310786 PIXBAUXNTPXMDJ-UHFFFAOYSA-N 424.501 2.138 10 20 HECD C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1=O 919970346 WPFIWSPCWYRYLE-QGZVFWFLSA-N 423.513 2.326 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)OC[C@@H]3CCCCO3)CC2)cc1 921166907 SDXVQTLAWIWMGP-KNQAVFIVSA-N 419.566 2.298 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccc2)c1C 1116592216 QRKUZTQDFFPYRT-SFHVURJKSA-N 409.442 2.496 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccnn1C[C@@H]1CCOC1 1320542601 AXYLKIFRUOHXAY-IBGZPJMESA-N 413.522 2.450 10 20 HECD CCOC(=O)C1=S=c2nc(/C(Cl)=C/c3ccc(C(=O)OC)o3)nc(O)c2=C1C 1322223593 WFGLTSYIHXSCJZ-YFHOEESVSA-N 422.846 2.202 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccccc3)c3cnn(C)c3)nc12 1323729198 LETKXHGTYDLUID-LJQANCHMSA-N 406.446 2.224 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)Cc3nnc4n3CCC4)cc2F)C[C@H](C)O1 1337618936 FPVFSXAWRHEHFU-GJZGRUSLSA-N 416.501 2.319 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817847259 RBYSQMOSXVKQRK-AWEZNQCLSA-N 414.397 2.303 10 20 HECD Cc1n[nH]cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829740869 HJTKIXLRXNHJLD-KRWDZBQOSA-N 413.478 2.071 10 20 HECD COC(=O)c1cc(NS(=O)(=O)c2cccc3nsnc23)c(C)c([N+](=O)[O-])c1 579424817 VCSOTPCRGWMPGN-UHFFFAOYSA-N 408.417 2.495 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC(c4nc(=N)n(C)[nH]4)CC3)ccc21 684852029 GTBUFKXFCFFRGV-UHFFFAOYSA-N 410.522 2.465 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCN(CC(C)C)CC3)cc2F)CC1 730134127 OKOCSQUJQXRFQC-UHFFFAOYSA-N 405.562 2.451 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C)cc2)CC1 731017118 WSEVNVOAGAQDIM-UHFFFAOYSA-N 407.474 2.200 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc4c(c3)CCC4)CC2)cc1 732923067 KYPOKRYQEMZGNC-UHFFFAOYSA-N 415.559 2.284 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1n[nH]cc1Br 738477445 NJSKNTFWFXWMDJ-UHFFFAOYSA-N 422.327 2.380 10 20 HECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)ccc21 741097736 XNJCYPCHYDCSFQ-UHFFFAOYSA-N 404.470 2.227 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(CN2CCCC2=O)cc1 741100276 XELHUDCLCVNEHJ-UHFFFAOYSA-N 418.497 2.440 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1 742278587 GLXPGUUKMQFHRA-UHFFFAOYSA-N 400.508 2.202 10 20 HECD O=C(CCc1ccc(F)cc1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 751642746 GEKVCFGJRINSEV-UHFFFAOYSA-N 408.470 2.449 10 20 HECD C[C@@H]1NC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NN(c2ccccc2)C1=O 752149430 MHBOHCPTWBQWNA-LPHOPBHVSA-N 422.485 2.238 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C(C)(C)CN(C)C)CC2)cc1 754357790 XMURBMCZGFGQQM-LJQANCHMSA-N 419.614 2.483 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3nnnc3/C=C\c3ccccc3)CC2)cc1 758220866 CGMMVHAXOXXQSC-HEEFDWFXSA-N 420.517 2.035 10 20 HECD Cc1nn(C)c(C)c1OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 758423902 VMAYRRQQEDGCMH-KBPBESRZSA-N 404.486 2.485 10 20 HECD COC(=O)c1cn(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(C)n1 760183942 XYZXJJYZJZDGML-UHFFFAOYSA-N 403.394 2.392 10 20 HECD O=C(NCCc1cn2c(n1)SCC2)NCc1ccc(N2CCOCC2)c(F)c1 767302691 GCKPFFUFJHMOMB-UHFFFAOYSA-N 405.499 2.006 10 20 HECD NC(=O)COc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 768913018 URFPPUQRMSMBTD-QGZVFWFLSA-N 417.893 2.304 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)N(C)C(C)C)ccc2F)c1 769529726 OHVNEGNPDLEDEV-UHFFFAOYSA-N 410.467 2.499 10 20 HECD COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 771234384 JXQPZNPFHWIWAE-QHCPKHFHSA-N 424.501 2.153 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)[C@H](C)[C@@H]3C)cc2F)C[C@@H](C)O1 771457713 ASUJHSUQBOUGNM-XDNAFOTISA-N 406.546 2.080 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 776040498 DLCSUEDVMFXGTQ-XLIONFOSSA-N 409.552 2.068 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 778081365 ITCSGJXMLDISQD-AWEZNQCLSA-N 411.549 2.090 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@@H](C(C)C)C3)CC2)cc1 779329991 HYFBXOMGXWRHKL-OAQYLSRUSA-N 404.555 2.274 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CC1(O)CCOCC1 781967191 WGDJSSMVIXSGLD-OAHLLOKOSA-N 422.481 2.262 10 20 HECD CCOC(=O)c1ccc(N2CC(NCc3ccc(N4CCOCC4)c(F)c3)C2)nc1 784624786 HMFHAMPUJLCALK-UHFFFAOYSA-N 414.481 2.212 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccnc(N3CCCCC3)c2)cc1F 786466790 XHAWSHONIMQIFP-UHFFFAOYSA-N 413.497 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 786759110 YKMHTTOJSOLHCB-UHFFFAOYSA-N 407.474 2.218 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCCCSc1nccs1 787518043 PFYINMXZUMDNNB-UHFFFAOYSA-N 419.532 2.218 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 787734636 CHYWIZCFGKUCNW-NRFANRHFSA-N 422.529 2.191 10 20 HECD O=S(=O)(c1cccc(NCc2ccc(N3CCOCC3)cc2)c1)N1CCOCC1 787765641 AXGUUBYLGAQWKW-UHFFFAOYSA-N 417.531 2.156 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 788269252 JLCDVXIOPSNARI-HNNXBMFYSA-N 422.501 2.024 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788324075 ROZJTVNWDQLCNC-UHFFFAOYSA-N 424.545 2.302 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 788977589 QZYRBASVEPPVQF-QGZVFWFLSA-N 418.538 2.275 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1c1ccc(OC(F)(F)F)cc1 790460155 INYNSWJTUMTGPF-AEFFLSMTSA-N 424.375 2.390 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@]2(CCO[C@@H]2C)O1 790503019 ZBJMPSLHSAHZFD-ZOCZFRKYSA-N 407.486 2.140 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(Cl)cc(F)c3N)nc12 791479991 UKYMDARJVPCUTQ-UHFFFAOYSA-N 408.773 2.343 10 20 HECD COCCOC1CCC(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 793247907 UPLGWACJWQCSRL-UHFFFAOYSA-N 419.566 2.155 10 20 HECD CCN(CCc1ccccn1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803302692 SQFPIVRUJHZEPO-SFHVURJKSA-N 410.518 2.187 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1 813667049 RSCJOVUZVVMZMY-UHFFFAOYSA-N 422.438 2.075 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CN(c2ccc(Br)cc2)C1=O 817028988 UGJGZBGQCAPEIH-UCEWNTHNSA-N 403.232 2.405 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918692246 ZCUFZCTZGJWGQR-FQEVSTJZSA-N 423.579 2.076 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccnc2N2CCCCC2)c1 921085132 ADZHMRLZGSTGJX-UHFFFAOYSA-N 404.492 2.079 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H](C)C(=O)NCC(F)(F)F)CC2)cc1 1318339226 UVJJLYXDEOOPBB-LBPRGKRZSA-N 402.417 2.030 10 20 HECD Cn1cc(N2CC[C@@H](NC(=O)NCc3ccc(N4CCSCC4)cc3)C2)cn1 1328687336 QWBVXIJNHMNNLW-QGZVFWFLSA-N 400.552 2.051 10 20 HECD C/C=C(/C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821902720 IHLIJQUTAVMPPH-BXVXIVLCSA-N 421.548 2.228 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccsc2)C1 1842379895 WFYFEVPLQXXAMI-UHFFFAOYSA-N 408.483 2.358 10 20 HECD O=C(c1ncccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250123 NVCPVXUTPGEJRZ-UHFFFAOYSA-N 422.363 2.037 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(OCCN3CCOCC3)c2)cc1 65014992 AFDHXJDQOJEPIU-UHFFFAOYSA-N 412.534 2.463 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCOCC1 65548411 XTWQDBSOXUXEJO-UHFFFAOYSA-N 424.545 2.355 10 20 HECD CCOC(Cn1cc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)nn1)OCC 109709069 LWVNJZYEJFYVHT-UHFFFAOYSA-N 417.510 2.038 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1 726560863 SZGVAMLEOJGCFR-UHFFFAOYSA-N 422.485 2.146 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCn2cnnc2C1 732043999 VNCFAVCPRJKBAY-LCYFTJDESA-N 419.557 2.363 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 735745411 HVZVLAWSOCHBTM-INIZCTEOSA-N 405.476 2.253 10 20 HECD NS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c2ncccc12 736591909 MDAJGZZJCVMBMC-UHFFFAOYSA-N 416.478 2.470 10 20 HECD CCN(C1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1)S(C)(=O)=O 740919241 JMSDQQRWWQFLBB-UHFFFAOYSA-N 406.552 2.018 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1 741072871 JZHSISSCAUDLAJ-UHFFFAOYSA-N 405.476 2.472 10 20 HECD CN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccc(N2CCCCC2)cc1 741711735 NLEJMFKHBFBQFX-UHFFFAOYSA-N 416.547 2.395 10 20 HECD CNC(=O)[C@@H](C)CN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747967784 YKMPGZLVVXEGBI-KBPBESRZSA-N 407.470 2.103 10 20 HECD O=C(NCC1(CO)CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 749210249 XAFYRJYZZPWYRO-OAHLLOKOSA-N 413.465 2.345 10 20 HECD CS(=O)(=O)NCc1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)o1 754018761 TUXZYCDUDBEWFU-UHFFFAOYSA-N 404.444 2.470 10 20 HECD CN1Cc2ccccc2[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 757629926 RGAHDRPYSISQGH-KNQAVFIVSA-N 421.545 2.374 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCc3ccc(OC)c(F)c3)CC2)cc1 758209315 KAHPQWASHKNNNQ-IBGZPJMESA-N 403.498 2.116 10 20 HECD CSCC[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 767774128 KHFZOOPSKRBDCG-BZUAXINKSA-N 420.531 2.053 10 20 HECD COc1ccc(N2CCCN(C(=O)NCCc3cn4c(n3)SCC4)CC2)cc1 767939463 CLBFIWMNYXJTOT-UHFFFAOYSA-N 401.536 2.462 10 20 HECD COCCc1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)n(C)n1 768716646 YPOACRFLNCUMDE-UHFFFAOYSA-N 412.446 2.075 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc([S@](C)=O)cc3)nc12 775618976 KSJPWUSXEMNZSU-JNFKXCBWSA-N 402.476 2.200 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](OC)C(C)(C)C)CC2)cc1 778295894 XQTDBFFRGYCRKP-OEIFXAAASA-N 403.523 2.077 10 20 HECD CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779519332 KMRCIGVFRIYEFK-CSKARUKUSA-N 411.502 2.400 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CC1(O)CCOCC1 781965739 AJCFMMZXGHPALT-HNNXBMFYSA-N 422.481 2.262 10 20 HECD COCCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397884 LOKGIYZPSKQHJT-UHFFFAOYSA-N 410.404 2.295 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc(OC)c1OC 787323971 RADWMAINOOZLOE-HOTGVXAUSA-N 419.522 2.056 10 20 HECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCCCC1 788311035 OZXRKJQGTWNBRM-UHFFFAOYSA-N 417.550 2.243 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2CCC(OC)CC2)cc1 788967379 YBHUEQICHRCIJF-UHFFFAOYSA-N 418.582 2.155 10 20 HECD CC(C)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCS1 789853883 AQBIGYJZPJNAFY-SFHVURJKSA-N 407.605 2.456 10 20 HECD COc1ccc(CNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c(O)c1 792833332 YNQTYYQMYVVGPY-UHFFFAOYSA-N 402.470 2.161 10 20 HECD COCn1nccc1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 795119671 NWOSVESVINYSGG-CYBMUJFWSA-N 416.450 2.036 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)c(Br)c1 802721251 UHBUPYIEGIQTCN-UHFFFAOYSA-N 406.279 2.359 10 20 HECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290128 QCDIUHBDFSVULN-LJAQVGFWSA-N 411.527 2.075 10 20 HECD CCc1ccc(S(=O)(=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 808051026 XQXUBVASXAFPNA-UHFFFAOYSA-N 402.516 2.380 10 20 HECD COc1ccc(C[C@](C)(O)CNCc2ccc([N+](=O)[O-])c(OC)c2O)cc1OC 811516442 UNZCCMMZCDTDHR-FQEVSTJZSA-N 406.435 2.410 10 20 HECD Cn1cc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)c(C(F)F)n1 812219861 RGFRAINABAFEOT-XFXZXTDPSA-N 402.492 2.281 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 918463558 KQXDIUBNCHZULT-MRXNPFEDSA-N 412.465 2.091 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)cc2Cl)cc1 1344453365 QSDAVSMRJZZCTJ-UHFFFAOYSA-N 411.292 2.065 10 20 HECD Cc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)s1 1810543112 WKTCLHVWABDMEN-UHFFFAOYSA-N 416.503 2.416 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnco2)CC1 1824732652 JVOUSAPOTFLEJL-OAHLLOKOSA-N 400.435 2.028 10 20 HECD O=C(c1[nH]cc2c1CCC2)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038147 AZUHSSXVGQHNHY-SOFGYWHQSA-N 423.469 2.151 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CC=CCC2)=NN1c1ccccc1 1847506795 QGMIJYCGHCEPPB-UXPWSPDFSA-N 406.486 2.337 10 20 HECD COC(=O)c1cc(NC(=O)CN(C)c2ccc(OC)c(OC)c2)cc(C(=O)OC)c1 140271711 JTDAMOGMCHGGTN-UHFFFAOYSA-N 416.430 2.352 10 20 HECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 729352561 RJJAYPQEMPGEKH-IBGZPJMESA-N 423.517 2.147 10 20 HECD CC[C@]1(C)NC(=O)N(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 730971628 ZLIVSHVQKRBMAC-FQEVSTJZSA-N 424.448 2.094 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 734407424 UVMRDHUQPCIBEG-UHFFFAOYSA-N 413.499 2.298 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](c4nnc5ccccn45)C3)nc12 738317782 NSNNIAFRZJYJJN-CQSZACIVSA-N 421.461 2.034 10 20 HECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 741097061 KAZDVXNRKUIWJL-UHFFFAOYSA-N 402.458 2.207 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 741648486 JUHNDSYEOMDZCG-UHFFFAOYSA-N 418.880 2.299 10 20 HECD COc1cc(Br)c(NC(=O)C(=O)NCc2ccccc2O)cc1OC 748482298 RXTMZGIEZTYTDB-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 748961869 XHVZXBOWCRETAK-FPOVZHCZSA-N 417.598 2.331 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C3=Cc4cccc(OC)c4OC3)CC2)cc1 750730730 LQGTYJAIWQBOHY-UHFFFAOYSA-N 423.513 2.418 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@@H](OC)C3(C)C)CC2)cc1 753349076 IUOQYDHXOYSABC-VQTJNVASSA-N 404.555 2.320 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2 753635662 GSZZODWNBSMRFR-AWEZNQCLSA-N 403.500 2.498 10 20 HECD CCN(CC)CCNC(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 753923454 JFUCMYOPCRNOJO-UHFFFAOYSA-N 417.491 2.095 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCC2CCN(S(=O)(=O)CC)CC2)cc1 754160094 QIHHKAZBFPNYJQ-UHFFFAOYSA-N 410.584 2.394 10 20 HECD COC(=O)c1ccccc1N(C)C(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 754180190 RXSRTZKSEQMFFW-UHFFFAOYSA-N 415.465 2.406 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)n3nnnc3C(C)(C)C)cc2F)CC1 758094284 BOFFZQUIJISZLR-OAHLLOKOSA-N 417.533 2.129 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)c3ccccc3OC)CC2)cc1 760478664 ZHNSKCQRNKLYIU-UHFFFAOYSA-N 411.502 2.215 10 20 HECD CN1C(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)[C@H]1Cc1ccccc1 761128925 ZTNFDLQTPQMSGO-TZIWHRDSSA-N 420.513 2.394 10 20 HECD COC(=O)C1CCC2(CC1)NC(=O)N(C1CCN(c3ccc(OC)cc3)CC1)C2=O 761224563 XTQLVVAUMQWFOZ-UHFFFAOYSA-N 415.490 2.318 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(OC)c(I)n2)c1 761979819 IMXKQLFFUNWGIL-UHFFFAOYSA-N 414.199 2.339 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3cc4c5c(c3)CC(=O)N5CCC4)n2)cn1 764947503 AGFQHCWBVOFCMH-UHFFFAOYSA-N 415.500 2.180 10 20 HECD C[C@@H](NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 765519551 YOQGOSJNKHRMOV-HXUWFJFHSA-N 423.561 2.308 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN([C@H]2CCC[C@@H]2O)CC1 765531990 AWAVWKWWYBZTOW-HOTGVXAUSA-N 412.328 2.332 10 20 HECD COC(=O)c1sccc1S(=O)(=O)NCc1cccc(Br)c1O 766199568 FBRJWJPFKCKJFG-UHFFFAOYSA-N 406.279 2.481 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1CS(C)(=O)=O)c1ccc(N(C)C)cc1 773845009 FTTCTLVEXYOESJ-CQSZACIVSA-N 403.504 2.113 10 20 HECD CCCCCOC1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 774179332 NGWCMYXUQIFYGO-GOSISDBHSA-N 402.539 2.489 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@H](n4cncn4)C3)cc2F)C[C@@H](C)O1 776854824 ARKQBJSIVBQTOU-INMHGKMJSA-N 402.474 2.187 10 20 HECD O=C(CN1CCC[C@@H](OCC2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 778177153 PJDMRJUZMSIANG-LJQANCHMSA-N 405.514 2.170 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCC(Oc3cncc(Cl)n3)CC2)cc1 778185683 ODKWSCVUKXWQLT-UHFFFAOYSA-N 403.914 2.356 10 20 HECD CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 779335485 DLTQYNASALQTBE-SFHLNBCPSA-N 413.566 2.014 10 20 HECD Cc1cc(C(=O)NC[C@H]2CC(C(N)=O)=NO2)c(C)n1-c1cccc(Br)c1 787929160 HREHFZWVOACOQG-CQSZACIVSA-N 419.279 2.217 10 20 HECD CN(CCc1ccccc1F)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800300 SWCPZPMDXSRTFO-UHFFFAOYSA-N 417.456 2.119 10 20 HECD CC(C)(C)N1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 793736839 CTQANOXMEVXRIP-LJQANCHMSA-N 417.550 2.279 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@H]3CC(C)(C)OC3=O)cc2F)C[C@@H](C)O1 795649785 FJKSEVGYMXGDSP-KHYOSLBOSA-N 421.513 2.081 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc2c1CCO2 797670424 CTYULGANFZMEKK-UHFFFAOYSA-N 401.488 2.178 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](C)N1CCc2ccccc2C1 803882395 WQAPXRXXPICOBX-SFHVURJKSA-N 408.546 2.240 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(C)c4ccccc4C3)CC2)cc1 804318909 VIAHQMAUEPWAQU-UHFFFAOYSA-N 422.529 2.259 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCC(=O)OC(C)(C)C)cc2)CC1 804905511 WMPNHNMEWRZEDP-UHFFFAOYSA-N 403.523 2.387 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807674159 HGMULMHCRBNAJK-UWJYYQICSA-N 422.529 2.237 10 20 HECD CCC[C@@]1(CO)CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 811995695 VKRTWTJLHUUPRP-HSZRJFAPSA-N 418.582 2.401 10 20 HECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C[C@@H]1CCOC1 917064738 CPMJRVODQBTABB-LNLFQRSKSA-N 407.530 2.414 10 20 HECD CC(C)N(CCCNC(=O)CSc1ncc(-c2ccccc2)n1C)S(C)(=O)=O 917192445 JUFLUQPMLRLKSJ-UHFFFAOYSA-N 424.592 2.356 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccccc3NS(C)(=O)=O)CC2)cc1 918369858 XSNFIWRZIMPIGR-UHFFFAOYSA-N 403.504 2.419 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3cccc(F)c3)cc2)C1 921122482 JWULYMZKIKXQPR-FXAWDEMLSA-N 414.481 2.060 10 20 HECD CN1CCN(CC2(C)CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)CC1 1116590376 RTVCZFUUMGCLLL-UHFFFAOYSA-N 417.617 2.427 10 20 HECD NC(=O)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 1263064506 CXLMDZRBOZQLHY-SFHVURJKSA-N 402.882 2.202 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 10962642 DAKQEZBSMKNFJH-UHFFFAOYSA-N 414.531 2.133 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3cc(Br)ccc3=O)CC2)cc1 110358096 JDDNMROMFWNXCH-UHFFFAOYSA-N 420.307 2.405 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)cc1 728949131 NTPCGJXAZINSMG-KRWDZBQOSA-N 401.555 2.027 10 20 HECD COc1cccc(CNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1O 729859445 QPXREHPABSRTDT-UHFFFAOYSA-N 404.488 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@@](C)(CC(C)C)C3=O)CC2)cc1 740873123 QFEITUSFXIVRJH-JOCHJYFZSA-N 401.507 2.155 10 20 HECD COc1cc(C(=O)NCc2ccc(N(C)C)cc2C)cc(NS(C)(=O)=O)c1OC 742682125 FPJTXGJYRUVRQZ-UHFFFAOYSA-N 421.519 2.380 10 20 HECD COc1cccc(CNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1O 743332878 HXBBAQCSGMLHRJ-LLVKDONJSA-N 402.476 2.092 10 20 HECD C[C@@H]1Cc2cc(S(=O)(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc2O1 751213320 PUKVBNNTSMKJAR-CQSZACIVSA-N 422.528 2.046 10 20 HECD COc1ccc(N2CCN(C(=O)NCCN3C(=O)Cc4ccccc43)CC2)cc1F 753894523 KBKFRKLAQJXJDR-UHFFFAOYSA-N 412.465 2.255 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](CO)CC(F)(F)F)cc2F)CC1 757642486 SPZVXUTZCUHPBD-CQSZACIVSA-N 406.424 2.080 10 20 HECD COc1cc(N2CCN(C(=O)NCc3cncc(C)c3)CC2)cc(OC)c1OC 759291224 VUGLPRSTMKIMHV-UHFFFAOYSA-N 400.479 2.448 10 20 HECD CCN(CC)S(=O)(=O)c1cc(NS(=O)(=O)c2cccc3nonc23)ccc1C 765014155 KIHREPYLNOTKLY-UHFFFAOYSA-N 424.504 2.363 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CCC(N)=O)CC3)cc2F)CC1 768069398 QPPJOSSTYGTEFI-UHFFFAOYSA-N 419.545 2.155 10 20 HECD O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768876053 CAOHKRLZSDDXCB-UHFFFAOYSA-N 416.503 2.451 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)n1 769024601 OBHGJHPYEXRRFQ-UHFFFAOYSA-N 421.545 2.485 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1)c1ccc(N(C)C)cc1 773848168 UUJBASIDJLDHIX-OAHLLOKOSA-N 411.506 2.069 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 775374109 XBXQAZIJGSSIFD-QPJJXVBHSA-N 406.435 2.106 10 20 HECD Cc1cccc2c(=O)c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c[nH]c12 776120307 WGBLKFWRYPLIBI-KRWDZBQOSA-N 418.497 2.468 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 785298623 WYHFXUPBFCVWHZ-LBPRGKRZSA-N 421.457 2.446 10 20 HECD COc1ccccc1[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nccn1C 785439940 XTRUTAPKKLQHSQ-FQEVSTJZSA-N 421.501 2.017 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ccnc3[C@@H](O)c3ccc(F)cc3)CC2)cc1 786762488 WUCZWUNIXXIVCC-QFIPXVFZSA-N 424.476 2.461 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cc4ccccc4nc3O)cc2)CC1 787321966 LFLOHXHZYHJFAC-UHFFFAOYSA-N 418.497 2.468 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CSc3nc(C)cc(C)n3)cc2)CC1 787323755 ZEUCFPSEKBQVIA-UHFFFAOYSA-N 413.547 2.170 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCN(C2CCC2)C1 803663131 KDOBERMXLMDTLG-RDJZCZTQSA-N 404.530 2.277 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCCCSc1nccs1 806282733 RQDHKBPYQYXSJB-DOTOQJQBSA-N 418.588 2.378 10 20 HECD CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 809785878 GIIAJMABCXNLSN-ZDUSSCGKSA-N 415.512 2.191 10 20 HECD CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 810354538 AJIDSQYQHBGSEA-UHFFFAOYSA-N 412.446 2.249 10 20 HECD CCOC1(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCC1 818261092 CXXDGTHWJZWIJS-ZHACJKMWSA-N 415.534 2.366 10 20 HECD NS(=O)(=O)c1ccc(NCc2ccc(N3CCSCC3)cc2)cc1[N+](=O)[O-] 864003105 CRVQAVISQASRKA-UHFFFAOYSA-N 408.505 2.408 10 20 HECD CCn1c(=O)c2ccccc2n(CC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1=O 914439881 PCKJIKRVTLLQJF-UHFFFAOYSA-N 420.513 2.440 10 20 HECD COc1ccc(N2CCCN(C(=O)Cn3nnc(-c4ccc(C)cc4)n3)CC2)cc1 917822237 FLMNLJWZXFZVTL-UHFFFAOYSA-N 406.490 2.396 10 20 HECD Cc1ccn2cc(CNC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)nc2c1 919653756 CBJJVHVWODSCQC-GOSISDBHSA-N 420.517 2.344 10 20 HECD COc1ccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 920994996 PJSZUFZVODETOL-UHFFFAOYSA-N 405.545 2.417 10 20 HECD O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)C1=S=C(NC(=O)C2CC2)C=C1 1533767570 UCQYQCKCDQYCGQ-SANMLTNESA-N 402.419 2.384 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1ccco1)CCO2 1782004921 QCKUOLXBHUXFOZ-IBGZPJMESA-N 406.822 2.102 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ccn1)c1cc(O)nc(O)c1 1798731340 AVOONCGYILNRSB-BTTYYORXSA-N 402.838 2.107 10 20 HECD Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cn1 1807193421 ANDODCASEJFQQL-UHFFFAOYSA-N 424.501 2.284 10 20 HECD Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807993779 LPBXAMGNLZNSAL-MGPUTAFESA-N 421.457 2.158 10 20 HECD Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807994036 MNZBEHSKCVZSLF-HNAYVOBHSA-N 422.441 2.423 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826841852 NVKFYANBGQYFRL-NQYLQCIDSA-N 418.538 2.100 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(Cl)cc3)C2=O)cc1 7229996 ZGIYVDNZHINNQO-OAQYLSRUSA-N 414.893 2.489 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CN(C)C3=O)c2C)cc1F 19113476 NJVXOVMVONTXCE-UHFFFAOYSA-N 415.421 2.162 10 20 HECD COc1ccc(N2CCN(C(=O)CN(Cc3ccc(C(N)=O)cc3)C3CC3)CC2)cc1 46569482 SXIIJTQZMHOMLL-UHFFFAOYSA-N 422.529 2.107 10 20 HECD CCN(CC)C(=O)N1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 65698487 TUDDMASFRDLYPH-SFHVURJKSA-N 417.554 2.373 10 20 HECD C[C@@H](NC(=O)NC[C@@H](O)COc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 139994068 TYYZWZVVDALQGM-OXQOHEQNSA-N 417.481 2.462 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 141690956 DKMURZGIOODROE-HNNXBMFYSA-N 413.474 2.356 10 20 HECD COc1cccc(CNCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1O 725849110 HNYAJIMZJSMSRY-KRWDZBQOSA-N 406.504 2.148 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccccc3Cl)cc2)CC1 726977187 YBHAGQZQOZRKFA-UHFFFAOYSA-N 414.936 2.053 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c1 734014950 NYYDCENLRFHTRP-CQSZACIVSA-N 424.544 2.488 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)c1 734062772 NPBPEKJBAKPFGA-UHFFFAOYSA-N 415.446 2.204 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)NCc1cc(OC)ccc1O 734072538 FWDOAOYBMLGRRL-UHFFFAOYSA-N 408.838 2.334 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC(CNC(=O)c2cnn(C)c2)CC1 734687501 DWHAERZPTHTMLU-UHFFFAOYSA-N 412.538 2.146 10 20 HECD CCO[C@@H](C)c1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 742560419 GGZJGPRRQQGAMS-AWEZNQCLSA-N 423.560 2.405 10 20 HECD O=C(C[C@@H]1C=CS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800338 IXBASKLVOHIRCE-UONOGXRCSA-N 400.447 2.321 10 20 HECD CCN(Cc1nc(CS(C)(=O)=O)no1)Cc1cc(Br)ccc1O 743871149 SEKACTQMCXFANJ-UHFFFAOYSA-N 404.286 2.104 10 20 HECD CCOc1ccc(N(CC)CC(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 744391942 QMKWILRTXBXOIW-AZUAARDMSA-N 424.563 2.106 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(OCC4CC4)CC3)cc2)C1 745691368 JPEFLOLBLVFPIZ-IBGZPJMESA-N 414.550 2.489 10 20 HECD CC(C)N(C)C(=O)C1CCN(C(=O)CN2CCOc3cc(N(C)C)ccc32)CC1 746492201 CRJNWYHDYFPPHJ-UHFFFAOYSA-N 402.539 2.057 10 20 HECD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccccc1O 748354938 PVSAOWVDIJKQNU-INIZCTEOSA-N 403.460 2.468 10 20 HECD O=C(CN1CCC(c2nc[nH]n2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 751500876 PHJMHLPJDDEBSU-UHFFFAOYSA-N 415.453 2.398 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 753446260 JMFOZAWGFVAUGV-KWMCUTETSA-N 407.515 2.123 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(C(F)(F)F)CC3)CC2)cc1 754049741 KPLVPEFDTYLXDM-GOSISDBHSA-N 401.473 2.452 10 20 HECD CNC(=O)COc1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761063000 UTCKUWMRNGEJEH-UHFFFAOYSA-N 417.849 2.135 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCC[C@H]1N1CCOCC1 763586081 FXCUYPJXLVNOEJ-TZIWHRDSSA-N 420.529 2.105 10 20 HECD COc1ccc(Cl)cc1S(=O)(=O)N1CCN(C(=O)c2cc(O)cs2)CC1 768293306 YMKXXAKTQVVYGF-UHFFFAOYSA-N 416.908 2.262 10 20 HECD CCOC(=O)CNC(=O)C1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 772166500 UKLXTIPWPHVEJK-UHFFFAOYSA-N 412.490 2.021 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)[C@@H]2CCCN(C(=O)C3CCCC3)C2)cc1F 781524196 SGOAYQUBIOIRQV-QGZVFWFLSA-N 411.543 2.492 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccs1 789798414 HLSQDPZNXRABSN-UHFFFAOYSA-N 419.522 2.434 10 20 HECD C[C@@H](C1CCN(C)CC1)N(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864425 OFDDTCMWYUNHCQ-KRWDZBQOSA-N 418.607 2.045 10 20 HECD COC(=O)[C@@H]1[C@H]2CN(CC(=O)c3cc(C)n(-c4ccc5c(c4)OCCO5)c3C)C[C@H]21 794986035 IWGWJIAWDOPCDA-OEWRPIJISA-N 410.470 2.399 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1F 796767232 CQAYXSXPNLYIMV-UHFFFAOYSA-N 409.364 2.211 10 20 HECD CCOC1CC(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 805638113 CSYAQXSRMXPXHS-QEFXCSQDSA-N 422.497 2.414 10 20 HECD COC1CCC(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 806944479 WMJJIGSYWKMPFB-NKELODKYSA-N 404.507 2.221 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807676484 GYYUXVBGEWUWEP-SJORKVTESA-N 402.539 2.085 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@](CO)(Cc4ccccc4)C3)nc12 812872946 WVAATBWPOOEHMV-HSZRJFAPSA-N 424.501 2.429 10 20 HECD CC(C)C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 916590507 IFRKPZGKPVFLLI-BZUAXINKSA-N 415.442 2.190 10 20 HECD Cc1nc(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)sc1C 920638355 XQWNJPCOZYFNLL-VIFPVBQESA-N 413.477 2.021 10 20 HECD CCNC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920922329 CYMJUTJOZDHDQL-INIZCTEOSA-N 424.501 2.089 10 20 HECD CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)CCC1 1778889890 UBEWTCUHNIXBGM-OPAMFIHVSA-N 417.506 2.201 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)F)C2)c1cc(O)c(O)c(Cl)c1 1781121102 DIOPKLQWMWXKKQ-FZKQIMNGSA-N 418.824 2.144 10 20 HECD CC(C)(F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243437 MZAUMAWNJFQQCP-WBIUFABUSA-N 414.861 2.093 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnc2ccccc2n1 1796601327 VBTVAJHVOIMQES-QDMKHBRRSA-N 419.441 2.002 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993733 MZUBUXGAETXXDG-IKSNEBHTSA-N 408.458 2.174 10 20 HECD O=C(Cc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248748 KADFOOQFESTUNW-UHFFFAOYSA-N 419.840 2.345 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnnn2C)cc1 1848280812 FLVAUKAKJRPNCQ-PMACEKPBSA-N 418.501 2.352 10 20 HECD C[C@H](NC(=O)c1ccccc1OCC(=O)N(C)C)c1ccc(N2CCOCC2)cc1 145570182 WONBSKYTNSPIBL-KRWDZBQOSA-N 411.502 2.481 10 20 HECD Cc1ccc(C(=O)OCC(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c(O)c1O 727004507 WUBBMCXOLFROER-AWEZNQCLSA-N 418.490 2.060 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(OC(F)F)c2)SC1=S 727176197 HNTPXTIRTVMBHY-DHZHZOJOSA-N 408.473 2.038 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1 729064433 RATUDAKUOFPKIA-JTQLQIEISA-N 401.394 2.241 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1 729064689 VPGHGJNHCZXBOF-CQSZACIVSA-N 401.463 2.157 10 20 HECD O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc2c(c1)C(=O)NC2=O 729527141 BAUCGYDNSCERBA-UHFFFAOYSA-N 404.470 2.355 10 20 HECD CC1CCN(c2ccc(CNC(=O)C3=CN4CCS(=O)(=O)N=C4C=C3)cc2)CC1 731016223 HBPYEHVOULCPKE-UHFFFAOYSA-N 414.531 2.037 10 20 HECD CCN(CC)c1ccc(CNCc2ccccc2S(=O)(=O)N(C)CCO)cc1 733333758 VAOJMUZBJMCRBQ-UHFFFAOYSA-N 405.564 2.435 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)ccc1Cl 734702093 UQGXMHKVVGOWBS-UHFFFAOYSA-N 402.882 2.329 10 20 HECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2c(O)cccc2Cl)CC1 735087166 XMVKELDWQUHQAQ-UHFFFAOYSA-N 409.939 2.272 10 20 HECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NCCCSc1nccs1 735315478 PVIXCFAVPASQOP-UHFFFAOYSA-N 415.562 2.249 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 741211127 JFNCNSFGOFTPLD-QHCPKHFHSA-N 409.530 2.383 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3n[nH]c(C)c3Br)CC2)cc1 742916747 LFEZUXUSZRFBNI-UHFFFAOYSA-N 422.327 2.041 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(F)c1 743958115 LREJNDFCMANKRY-UHFFFAOYSA-N 400.406 2.452 10 20 HECD CCN(CC)[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 745690507 CHUIPSFUZRZTAH-ICSRJNTNSA-N 401.555 2.014 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 753042190 KXKBTYHHOQITLF-HUUCEWRRSA-N 415.531 2.015 10 20 HECD COC(=O)c1cccc(N2CC(=O)N(CN(C)Cc3ccc(N(C)C)cc3)C2=O)c1 759723606 IXHZSGSBAGAPHP-UHFFFAOYSA-N 410.474 2.397 10 20 HECD CCOC(=O)[C@@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 765102091 MXRVDYCTJRUSDS-QGZVFWFLSA-N 404.507 2.202 10 20 HECD CCS(=O)(=O)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 767780730 JRUVMBLGSXNUSU-MRXNPFEDSA-N 409.552 2.193 10 20 HECD COc1cc(O)c(CN2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1OC 768441458 IYKOAFRFLIOFQM-UHFFFAOYSA-N 406.504 2.057 10 20 HECD COc1cccc(CN2CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)c1O 769192663 PLUDOPQOEMSAGI-INIZCTEOSA-N 407.511 2.254 10 20 HECD C[C@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 773105294 VIMPTPWLNUJJDJ-LSDHHAIUSA-N 401.960 2.109 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 775157234 SDNCJJNFLOTEGI-UHFFFAOYSA-N 422.533 2.171 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 775258096 QHMJHGJBISXRFV-CMKODMSKSA-N 417.550 2.364 10 20 HECD COc1cccc(CN2CCC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c1O 777223308 TUNLTQQBIWKAJG-KRWDZBQOSA-N 419.522 2.445 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cn4c(n3)CCCC4)n2)o1 779791197 HCQWQYAJUKLFKP-UHFFFAOYSA-N 421.504 2.373 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1 785424884 WFEKQTAJJNRXMU-SFHVURJKSA-N 414.575 2.459 10 20 HECD COC(=O)c1scc(C)c1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 785488080 HNPYULXYPPOUFU-UHFFFAOYSA-N 410.517 2.158 10 20 HECD C[C@H](O)CN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](C)CO 785871093 XPXUQCNUOCCVAN-SOUVJXGZSA-N 401.454 2.030 10 20 HECD C[C@@H](NC(=O)N(C)Cc1ncnn1CC(F)F)c1ccc(N2CCOCC2)cc1 787062398 BTESOLNKLQOHSG-CQSZACIVSA-N 408.453 2.282 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(Cc2ccccn2)CC1 787145103 VYJIYUFHMCEEQQ-UHFFFAOYSA-N 423.561 2.277 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)cc1 788950071 CTABOQCNZNMWPA-NRFANRHFSA-N 422.529 2.413 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 788951678 QZYRBASVEPPVQF-KRWDZBQOSA-N 418.538 2.275 10 20 HECD Cc1ccc(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 789800226 MLVJYDIIJHWEIP-CQSZACIVSA-N 419.522 2.396 10 20 HECD COc1ccc([C@H](CNC(=O)c2c(F)ccc(O)c2O)N2CCOCC2)cc1OC 790069394 AXSYDHQIWLKMTR-HNNXBMFYSA-N 420.437 2.057 10 20 HECD CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCN(C)CC3)cc1)CC2 792176728 JRVCFJPMNGWSFL-UHFFFAOYSA-N 414.575 2.299 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N(CCCO)Cc1ccccn1 792881095 GWSSNYUFTLHQRT-UHFFFAOYSA-N 416.497 2.276 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(COC)ccc2OC)cc1 795300086 QLUFUGINBBXBGS-UHFFFAOYSA-N 414.505 2.404 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 801547975 ICRXHIKQLKCGAF-LFGUQSLTSA-N 400.475 2.073 10 20 HECD CCOc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1OC 803663310 MSCZZUPLFYMTDJ-UHFFFAOYSA-N 403.454 2.232 10 20 HECD CC(C)Nc1nc(NCCO)nc(N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 804378648 ZVRPFQKNNJFCQV-HNNXBMFYSA-N 401.515 2.106 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnc(Cl)c(F)c1 805013287 YYVZBUCTSGAVLM-UHFFFAOYSA-N 417.865 2.453 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1nc(C(F)(F)F)cs1 807097457 PGQBFVMXICDYFB-UHFFFAOYSA-N 400.426 2.469 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809531927 MIPJMWLBRBBRMW-OAHLLOKOSA-N 414.506 2.006 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1c(CC)nn(C)c1OC 809660551 QYDSOYXHEFHJGJ-UHFFFAOYSA-N 402.495 2.142 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2nccnc2c1 918310676 NNNUGNZZVXESHG-UHFFFAOYSA-N 405.458 2.064 10 20 HECD COCCN1C(=O)/C(=C/Nc2ccc3nc(SC)sc3c2)C(=O)NC1=S 920977811 ONNAJFNNNGHXKT-CSKARUKUSA-N 408.530 2.204 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nc2n(c1=O)CCCCC2 1318777698 BIBWXVFFJKDNGW-UHFFFAOYSA-N 423.311 2.288 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCCCO1 1814505068 IJWKLJZKNSTWPJ-CABCVRRESA-N 415.450 2.091 10 20 HECD CC(C)(C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824134531 QLYGQJZCDJCLTQ-QFBILLFUSA-N 419.522 2.133 10 20 HECD O=C(C1CCSCC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037796 RRXCRTBQCFKUAA-HWKANZROSA-N 418.515 2.163 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)N1CCOc2cc(N(C)C)ccc21 437011535 WLEXPKDBHJCGFZ-UHFFFAOYSA-N 405.458 2.174 10 20 HECD CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)N3CCOCC3)no2)C1 567962305 CIUPMYJDZPKAQS-UHFFFAOYSA-N 423.517 2.240 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)NCc2cccc(OC)c2O)cc1 727761383 ZLHBFFSRYLKPPA-UHFFFAOYSA-N 400.460 2.273 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)N(C)Cc2ccccc2O)c1 732202897 INOMDUGSKZECFF-CYBMUJFWSA-N 400.431 2.424 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)Nc1ccccc1 732591347 BZFHRRMHKNSPRL-FUHWJXTLSA-N 423.517 2.215 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@@H]3CCCC[C@@H]3C)CC2)cc1 733571762 PGROVPPAIUCEKM-FXAWDEMLSA-N 404.507 2.482 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)c1ccc(F)cc1 734943282 XIBSWHIBCXXRGA-LJQANCHMSA-N 405.445 2.459 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](O)C3CCOCC3)cc2F)C[C@@H](C)O1 736653244 LUZZDAQKSJYWRS-QEEYODRMSA-N 409.502 2.026 10 20 HECD CS(=O)(=O)c1ccc(OCCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 746516755 WLQWOOXYWCOUON-UHFFFAOYSA-N 418.515 2.012 10 20 HECD O=C(CCCn1ccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 748630417 JVIJDUOLTFZFIW-UHFFFAOYSA-N 423.496 2.235 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2cc(OC)ccc2O)cc([N+](=O)[O-])c1C 751415791 XQZXYKDYRVAKDQ-UHFFFAOYSA-N 424.431 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(C=O)cc3[N+](=O)[O-])CC2)cc1F 753742016 LJFYQUATGFGCGH-UHFFFAOYSA-N 417.393 2.283 10 20 HECD COc1cc(N2CCN(Cn3cc(Br)cn3)CC2)cc(OC)c1OC 758964720 OAUUCUQBTFZAOO-UHFFFAOYSA-N 411.300 2.451 10 20 HECD C[C@@H](NC(=O)NCCCSc1nccs1)c1cccc(S(N)(=O)=O)c1 759546241 LYCPRHQUQFWMIR-LLVKDONJSA-N 400.551 2.333 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CC[C@@H]3CCCO3)cc2F)C[C@@H](C)O1 760535829 CSGWSNJVDPSREY-INMHGKMJSA-N 400.516 2.428 10 20 HECD Cc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1C(N)=O 768015292 FOJAOBJJAHGAPM-UHFFFAOYSA-N 416.547 2.425 10 20 HECD C[C@@]1(c2cccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2)NC(=O)NC1=O 769038115 BARXEHRNQJXKFL-JPYJTQIMSA-N 423.469 2.268 10 20 HECD Cc1ccc(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)cc1S(N)(=O)=O 771792145 WUBXSCPIHQMWFL-UHFFFAOYSA-N 416.547 2.312 10 20 HECD C[C@@H](NC(=O)NCCS(=O)(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 773621928 PXHZOBAGEGBHQF-MRXNPFEDSA-N 404.536 2.232 10 20 HECD Oc1c(F)cc(Cl)cc1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 775714816 UMIGFUQBVHFJML-UHFFFAOYSA-N 407.877 2.134 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(C(F)(F)F)nc3)cc2)C1 777577803 TZBCPSVNVBUTAO-CYBMUJFWSA-N 407.396 2.127 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@](C)(O)c3ccccc3)CC2)cc1 778335338 DXISLVKDOXJZFX-HSZRJFAPSA-N 412.486 2.185 10 20 HECD Cn1cc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C(F)(F)F)n1 782814020 LNDFWPSGNIJAIT-ZDUSSCGKSA-N 424.427 2.462 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C 787639353 OMLMZKLBOOVZCE-HXUWFJFHSA-N 400.498 2.235 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCCO[C@H](c2ccccc2)C1 788310070 HXQUUNZUXNIHHF-QFIPXVFZSA-N 423.513 2.130 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Br)c(OC)c2)c(O)c1 797388847 BZFPBWQCNVWMIY-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CN(C[C@@H]1CCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450887 SYGYHEQSOJSVAI-KRWDZBQOSA-N 411.449 2.010 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@]4(C3)OCc3ccccc34)ccc21 803687654 OQUUZGGDZWQMOS-DEOSSOPVSA-N 405.498 2.343 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3cccc(OC)c3F)nc12 803727521 SUBOIHYGOIHQIW-UHFFFAOYSA-N 417.393 2.435 10 20 HECD O=C(NCCCSc1nccs1)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1 806959077 QBJWQAAJWKTRJX-ZDUSSCGKSA-N 418.610 2.129 10 20 HECD O=C(N[C@@H]1CCc2ccccc2OC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807695368 NKGHNAVWWDIXAW-UXHICEINSA-N 424.497 2.410 10 20 HECD COC(=O)Cc1sc(NS(=O)(=O)c2cn(C)nc2C)nc1-c1ccccc1 808528474 CTBJTHZLSWBLKF-UHFFFAOYSA-N 406.489 2.368 10 20 HECD CO[C@@H]1CCC[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 814563489 YSUGUQBICFJGHD-DLBZAZTESA-N 408.470 2.027 10 20 HECD CCO[C@@H]1C[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917305917 UTBREQTZDSFENT-GTACMHHNSA-N 408.470 2.024 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nnc2ccccn12 918202996 RFPMUYOREOHCRT-AWEZNQCLSA-N 412.469 2.390 10 20 HECD CN1CCN(C(=O)CCNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 918420872 XQJLPLMYIWHYNF-UHFFFAOYSA-N 422.489 2.321 10 20 HECD C[C@@H](NC(=O)N1CCN(C(=O)C(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 920871668 MXDQNQACOYBMKV-QGZVFWFLSA-N 402.539 2.484 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)CC2)cc1 1319624314 GDHQXYSUXPWUSY-UHFFFAOYSA-N 407.470 2.420 10 20 HECD CCOc1ccc(N2CCN([C@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 1324102241 PZYXCPWCYZQZEY-HXUWFJFHSA-N 423.561 2.340 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1CC=CCC1 1792882251 DIQORJWXESLLCN-LJGDNWOOSA-N 420.893 2.311 10 20 HECD Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805612010 PBBVWGNHJLNDNH-MGPUTAFESA-N 422.441 2.423 10 20 HECD C/C=C/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728636 JYBFFQCODKWEGT-GSTVFTAWSA-N 400.460 2.307 10 20 HECD C[C@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841525729 SFYRQYVWKLFRJU-AWEZNQCLSA-N 413.499 2.491 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)Cc3ccccc3F)CC2)cc1 11900624 LIMJYMUSVRNEMY-UHFFFAOYSA-N 407.511 2.076 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)NCCC3=CCCCC3)nnc2n1 49513438 UZNOMHWPRWSFIN-UHFFFAOYSA-N 404.544 2.482 10 20 HECD COc1ccc(N2CCC(NC(=O)CN3C(=O)NC4(CCCCC4)C3=O)CC2)cc1 110359337 JFSKYRJLZVLKRI-UHFFFAOYSA-N 414.506 2.035 10 20 HECD Cc1c(CNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)n(C)c2ccccc12 461965461 NHGCWGRKDDONLR-UHFFFAOYSA-N 407.517 2.150 10 20 HECD CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 727145571 DOAGFAHQVNSNJM-QGZVFWFLSA-N 407.536 2.449 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)Cc1ccccc1 731281103 SJSRJHBWJDMTRP-UHFFFAOYSA-N 405.520 2.433 10 20 HECD O=C(Cc1cccc(F)c1)NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 731859414 VICVTVJDRUWEQF-LJQANCHMSA-N 400.450 2.398 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)C(C)(C)C)cc2F)C[C@@H](C)O1 732715845 LBULGJJJXNWTHL-KSMMKXTCSA-N 410.486 2.006 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)NCc2ccc(N(C)C)cc2C)cc1 734468091 KTUVVAILJRVKMQ-UHFFFAOYSA-N 411.502 2.465 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cn1 742284107 RGVZASNSKJUQPP-UHFFFAOYSA-N 420.535 2.304 10 20 HECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cc2NC1=O 743958292 QELXOLUBHUILNJ-GFCCVEGCSA-N 409.442 2.245 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccco1 746757922 SBSJNASVUMTONO-AEFFLSMTSA-N 400.479 2.168 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3cccc(OC)c3O)C2)c1 748660353 FQHCQWAPSAWQGA-OAHLLOKOSA-N 401.463 2.496 10 20 HECD CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 749343739 HCBQZWCHQQKNQG-UHFFFAOYSA-N 406.527 2.219 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCn3cccc3)cc2F)C[C@@H](C)O1 750943420 NDUSATNVIDCDCQ-IAGOWNOFSA-N 417.481 2.491 10 20 HECD Cn1nnc2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cnc21 755528598 FOLGYTNSNOLUFI-HNNXBMFYSA-N 400.870 2.117 10 20 HECD CN1CCCc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc21 757874709 SRYIRHCSBNPEQR-UHFFFAOYSA-N 401.532 2.384 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccccc3C[S@](C)=O)CC2)cc1 762529513 XCHVLLXRHQFNAS-NDEPHWFRSA-N 401.532 2.334 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)NCc2cccc(Br)c2O)C1 765453874 PYGRGJZGEQJERH-AWEZNQCLSA-N 400.317 2.311 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc(O)c3)cc2F)C[C@@H](C)O1 769688222 IMXZBZAYBSVARV-HUUCEWRRSA-N 415.465 2.191 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@H](COC(C)C)C3)cc2F)CC1 771319407 IWZPJEOCLYNFLR-LJQANCHMSA-N 422.545 2.303 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)cc1)c1ccc(N(C)C)cc1 773846578 MRTOJZZUDKNWSW-AWEZNQCLSA-N 403.504 2.113 10 20 HECD CC(=O)C[C@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773883455 RATUJBPOFXDIBL-AWEZNQCLSA-N 424.500 2.075 10 20 HECD CCn1c(N)c(C(=O)CN(C)c2ccc(OCc3ccccc3)cc2)c(O)nc1=O 781960400 HUZWWNCBUDFTPC-UHFFFAOYSA-N 408.458 2.449 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 785432324 ANAWOTNQHWBHQA-DLBZAZTESA-N 418.538 2.321 10 20 HECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1 787911281 ACWJLZAZMIWCRW-HOTGVXAUSA-N 417.481 2.316 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1 788270828 KGRIKQLCSROPAM-KRWDZBQOSA-N 418.538 2.193 10 20 HECD CN(CCCOc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311201 ROQZRRBEPSKFFJ-UHFFFAOYSA-N 411.502 2.067 10 20 HECD Cc1cccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C(C)C 788333996 UWOJRVFRBLKEPP-FQEVSTJZSA-N 410.518 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3cc(OC)c(O)c(OC)c3)CC2)cc1F 789978050 PCHUTWUUGQCQOE-UHFFFAOYSA-N 404.438 2.448 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(c4c[nH]nc4C)CC3)CC2)cc1 792925188 IRPHLHUCDHMVCU-OAQYLSRUSA-N 413.566 2.089 10 20 HECD CCN(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccco1 793848087 SBLVDNFCRTWIEW-GOSISDBHSA-N 404.486 2.300 10 20 HECD CCOC(=O)CN(Cc1cc(O)n2ncc(C(=O)OCC)c2n1)c1ccc(C)cc1 799198126 BSFDWVPHZGMGGF-UHFFFAOYSA-N 412.446 2.490 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCS(=O)(=O)CCc2ccccc2)c1 800059874 DZUUMUPQSBWZDA-OAHLLOKOSA-N 406.504 2.419 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](CN4CCOCC4)C3)CC2)cc1 800705457 WYJNAEFYMKAXFU-IBGZPJMESA-N 416.566 2.418 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)C1Cc2ccccc2C1)c1ccc(N2CCOCC2)cc1 803298210 RFXDGEJUELSEHC-QGZVFWFLSA-N 407.514 2.326 10 20 HECD COCC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)c1ccco1 804317502 FYVWAYWKGSXYHC-IBGZPJMESA-N 415.490 2.267 10 20 HECD COCCc1ccnc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 806659471 WPNLZJBHZNLPME-UHFFFAOYSA-N 413.522 2.223 10 20 HECD COc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc([N+](=O)[O-])c(OC)c1O 809680134 QJFIEELWLCBBHA-UHFFFAOYSA-N 411.436 2.180 10 20 HECD COCCN(C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)[C@H]1CCS(=O)(=O)C1 812206611 HHACPMBEOPVQCP-SFHVURJKSA-N 420.531 2.378 10 20 HECD Cc1cc(Cn2nnc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2C)on1 815860590 RXVVFAYQIMUBPN-QGZVFWFLSA-N 411.462 2.458 10 20 HECD Cc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)cc1C(C)C 917444709 YQJZMOHNRBFCAA-UHFFFAOYSA-N 421.519 2.022 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)C4CC4)CC3)cc2F)C[C@@H](C)O1 918219643 DCABKRXDKZBCIJ-IYBDPMFKSA-N 418.513 2.203 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 918462962 FAZOCTNUNAFGSU-GOSISDBHSA-N 408.502 2.260 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(NC(=O)C2CC2)cc1 1320142964 PBYICWACVHJJDK-KRWDZBQOSA-N 412.442 2.351 10 20 HECD COC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)CC(C)C 1340273780 PMQWLYMCUHOUGS-IRXDYDNUSA-N 423.529 2.187 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(C(=O)OC)oc3C)CC2)cc1 1341343560 UDWVNMLENGAFJC-UHFFFAOYSA-N 408.476 2.284 10 20 HECD CC(C)CN1C(=O)/C(=C\Nc2cccc(Cl)c2N2CCOCC2)C(=O)NC1=S 10352821 ZAWGVOCMEOWHLK-RAXLEYEMSA-N 422.938 2.372 10 20 HECD COc1ccc(N2CCN(C(=O)CONC(=O)C(C)(C)c3ccccc3)CC2)cc1 111041204 IGCSMSIHADJEDV-UHFFFAOYSA-N 411.502 2.369 10 20 HECD CN(C)c1ccc(CNCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1 237128755 SHHDZXRPJFRZAU-HXUWFJFHSA-N 403.548 2.500 10 20 HECD CC(C)C(=O)N1CCC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 303035598 VBQMUXHASDUZOD-UHFFFAOYSA-N 405.514 2.298 10 20 HECD Cc1c(CNC(=O)C(=O)NCC2(N(C)C)Cc3ccccc3C2)n(C)c2ccccc12 506439735 RUQQFLAOFOMXAG-UHFFFAOYSA-N 418.541 2.318 10 20 HECD COC(=O)/C=C1/SCC(=O)N1CCCN(Cc1ccccc1O)C[C@H]1CCCO1 731844262 FJIZVJHHHBEMTK-XNHPLOEXSA-N 420.531 2.353 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCn1ccccc1=O)c2[N+](=O)[O-] 733386777 VRCLFYIEPMAUFD-UHFFFAOYSA-N 418.361 2.389 10 20 HECD O=C(Nc1ccn(-c2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 733851027 VZEFVAJMGYMJES-SFHVURJKSA-N 421.457 2.119 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(-c4ccccn4)no3)cc2)C1 746146682 IXOLKQWMMQNMSV-INIZCTEOSA-N 405.458 2.368 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 747750425 AGABJAFEBSURNN-UHFFFAOYSA-N 409.449 2.362 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)nc12 749845176 PFLLYXSKOCQLPX-CQSZACIVSA-N 419.482 2.053 10 20 HECD CO[C@H](C)c1noc(CN2CCCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n1 749989629 JTCGCPODZTVABM-MRXNPFEDSA-N 416.526 2.261 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCCS2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750897343 ZMBZHCRKNODJRK-GOSISDBHSA-N 422.528 2.363 10 20 HECD CCN1C(=O)[C@@H]2CN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CCN2C1=O 752510804 ZANRHVXGBMQDSJ-IBGZPJMESA-N 410.474 2.211 10 20 HECD COc1ccc(N2CCN(C(=O)NC[C@H](C(C)C)N3CCOCC3)CC2)cc1F 753834767 VNSIZTZPCHQDHP-LJQANCHMSA-N 408.518 2.023 10 20 HECD COCc1cccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754218251 XJOOXZNLOYNIQA-UHFFFAOYSA-N 401.438 2.268 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2c(C)nn(CCOC)c2C)cc1 754483924 PYJBWWRJSNCAJF-UHFFFAOYSA-N 401.511 2.247 10 20 HECD CCn1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C 754488066 DOUQSWRRNPMYHC-UHFFFAOYSA-N 401.536 2.328 10 20 HECD COc1ccc(OC(F)F)c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 757425430 KQMSLTSEXOHSSI-UHFFFAOYSA-N 416.402 2.304 10 20 HECD COc1cc(N2CCN(C(=O)c3cnc4n[nH]c(C)c4c3)CC2)cc(OC)c1OC 760085424 RDFJABBBYVCMLY-UHFFFAOYSA-N 411.462 2.255 10 20 HECD Cc1nc2ncnn2c(C)c1CCC(=O)NCc1cccc(Br)c1O 765754291 UYEIJRSISUTKEE-UHFFFAOYSA-N 404.268 2.458 10 20 HECD COCCCOCCN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 773743586 ZZPNMSPITVGYCA-UHFFFAOYSA-N 410.470 2.385 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCc4ccccc4C3)CC2)cc1 775123747 WEGJUFQURLGYSN-HXUWFJFHSA-N 407.514 2.454 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 776078620 ZXQNHFYYEISNCL-WIYYLYMNSA-N 423.579 2.409 10 20 HECD CCN(Cc1ccccn1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778314318 PTQQKZUYQFGWOA-VAWYXSNFSA-N 408.502 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCOC(C)(C)C)CC2)cc1 778388494 GBYFSJHFTIHRST-ZHACJKMWSA-N 403.523 2.174 10 20 HECD CC(C)(C)OC(=O)CNC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 784998033 HUJMVFJWLOFXMT-UHFFFAOYSA-N 423.421 2.077 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1 785297730 RVWULHIFHLBUSH-JTQLQIEISA-N 413.352 2.120 10 20 HECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785298151 WCAZWIMYCXUVRX-NSHDSACASA-N 404.394 2.100 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1 785526648 GJAUDISZIRYMMR-MOPGFXCFSA-N 416.566 2.018 10 20 HECD O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NCc1ccc(N2CCCC2)cc1 787868316 BKONPUJQFIZJDW-UHFFFAOYSA-N 408.462 2.299 10 20 HECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)Cc2ccccc21 788323589 LZUOYKHUFNLLEK-UHFFFAOYSA-N 407.514 2.459 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(CC3CC3)CC2)cc1F 788459892 MQUMCDUBJKJALH-UHFFFAOYSA-N 404.530 2.279 10 20 HECD COCn1nc(C)c(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c1C 789738122 QPOUXWACVKMHRG-UHFFFAOYSA-N 418.523 2.215 10 20 HECD COc1cc(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1O 789880751 IKLZZJGWYSXQKP-UHFFFAOYSA-N 400.475 2.447 10 20 HECD C[C@H]1CN(C(=O)c2ccc(CNC(=O)c3c(F)ccc(O)c3O)cc2)C[C@@H](C)O1 790068854 FVIRYXXUSVDJGJ-BETUJISGSA-N 402.422 2.416 10 20 HECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N(C)C)cc3C)cc2CC1 790192269 VKZSWOLOULGIQV-UHFFFAOYSA-N 415.559 2.487 10 20 HECD COC[C@H](C)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248972 NLCJGORUOZTIIX-WMLDXEAASA-N 415.556 2.273 10 20 HECD CON(C)S(=O)(=O)c1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 797609874 CJKVKQOBAXOECG-GFCCVEGCSA-N 409.464 2.032 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)cc1F 804850993 WZJDOSTYEDBLEI-KRWDZBQOSA-N 415.513 2.113 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 807481158 IICIUKQRLMIHFT-KDOFPFPSSA-N 418.538 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@H]4CCC(=O)[C@H]4C)n3)CC2)cc1 809464990 OGYVOGMFZQYRHW-HOTGVXAUSA-N 412.490 2.127 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 810044052 LMVIPRDOYOSDNQ-MRXNPFEDSA-N 418.515 2.278 10 20 HECD CO[C@H]1CCC[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 814563517 YSUGUQBICFJGHD-IRXDYDNUSA-N 408.470 2.027 10 20 HECD O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)c(F)c1 917706664 FSKLAFQBRWNZSL-UHFFFAOYSA-N 424.469 2.282 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCCOC)nc1 918307289 RGJWCTVUQSAGNU-UHFFFAOYSA-N 400.479 2.160 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2-n2cncn2)C2CC2)cc1 918456557 LRJYJEKWVVGMNN-UHFFFAOYSA-N 404.474 2.463 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cccc4c3COC4=O)CC2)cc1 918728252 JECZZZDBYFJHEE-UHFFFAOYSA-N 402.472 2.267 10 20 HECD COCc1ccc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 920256254 VQXLFBOVIVIOSX-QXMHVHEDSA-N 423.513 2.363 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccccc1N1CCCC1=O 1115898104 DTVRQUFDULSSRW-UHFFFAOYSA-N 413.499 2.301 10 20 HECD CCOc1ccc(N2CCN(CC(=O)Nc3nc(CC(=O)OC)cs3)CC2)cc1 1320255718 XCIAECUEWRZYLM-UHFFFAOYSA-N 418.519 2.018 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccn(-c4ccncc4)n3)cc2F)CC1 1326415620 OKUFIHLGOGZDEN-UHFFFAOYSA-N 408.481 2.478 10 20 HECD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cn1 1796598787 IIFBSUPZOPBHGQ-BCDXTJNWSA-N 410.474 2.081 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCOC1)c1cc(O)c(O)c(Cl)c1 1804279746 WAXUOJWIEZWULN-REBRKWNGSA-N 408.882 2.430 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)on1 1817843965 KYKYGSCPGDXEEY-CYBMUJFWSA-N 412.406 2.132 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)C(F)(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826392826 CNSGVJKSMZMAOH-ZETCQYMHSA-N 418.809 2.007 10 20 HECD CCc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)no1 1844525930 GREBVFUZWVOGPS-UHFFFAOYSA-N 405.838 2.432 10 20 HECD COc1ccc(NS(=O)(=O)c2cccc3nsnc23)c(C(=O)NC2CC2)c1 520729764 YVCHOOJAXLZJSJ-UHFFFAOYSA-N 404.473 2.393 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCOC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 731682815 XRFUKJMCWNUQBQ-JZXOWHBKSA-N 409.502 2.292 10 20 HECD CN(C)C(=O)CN1CCC(NC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 731761922 OIDODUHYEHSCEE-UHFFFAOYSA-N 414.506 2.250 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl 732892784 IDUQMZDCKXCMAZ-UHFFFAOYSA-N 402.838 2.172 10 20 HECD CNC(=O)C1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1 742751800 WTOLSLVRYPDNFX-QGZVFWFLSA-N 418.538 2.351 10 20 HECD CCc1cnc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 743567267 OBGYMMABDCWGSG-UHFFFAOYSA-N 403.552 2.336 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(CCO)CCCC3)cc2)C1 745691112 HFSGRLOVJQDJKL-GOSISDBHSA-N 402.539 2.130 10 20 HECD O=C(NC[C@@H](O)COCC1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903005 AUEJYSGGPGAUJN-NVXWUHKLSA-N 413.465 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H]3C(=O)OC(C)(C)C)CC2)cc1 748832036 CUFUNGIGSKQBDG-IBGZPJMESA-N 403.523 2.150 10 20 HECD C[C@@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405125 CBSFTOLPQRXHMT-OAHLLOKOSA-N 405.514 2.488 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CO[C@@H]3CCOC3)cc2F)C[C@H](C)O1 753857635 NRAIJDCOPVTJMG-MUQADHOPSA-N 409.502 2.433 10 20 HECD COc1cc(N2CCN(C(=O)NCCCN3CCCC3)CC2)cc(OC)c1OC 758828755 FMKVYKYJZBMPCC-UHFFFAOYSA-N 406.527 2.030 10 20 HECD COc1cc(Cl)cc(CN2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c1O 761184087 PRRGQZKXBPIVPU-UHFFFAOYSA-N 420.922 2.441 10 20 HECD COCCOCCN(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769976932 IWPFRHJAVXETCN-UHFFFAOYSA-N 422.503 2.069 10 20 HECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1c(O)ccc2c1CCCC2 775201277 IURJYDZBUZJLHB-UHFFFAOYSA-N 403.504 2.226 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3Cc4ccccc4O3)CC2)cc1 778237426 PCPWWOXVZFQEKH-RQWLHQTBSA-N 421.497 2.020 10 20 HECD CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 779331445 FYTXVRCLJJWXBT-FXAWDEMLSA-N 404.530 2.413 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 780822296 ZLZNPJMHUIFJCP-INMHGKMJSA-N 418.513 2.249 10 20 HECD O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCOCC2)cc1 784736641 NPJJVDBHVAONEA-UHFFFAOYSA-N 402.516 2.120 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCNC(=O)OC(C)(C)C 786716176 IVSYOZJZUDZDCR-UHFFFAOYSA-N 418.538 2.276 10 20 HECD C[C@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313053 OQJFIYAPNKWXBV-DEOSSOPVSA-N 407.514 2.330 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(-c4ncnn4C)c3)CC2)cc1 790133542 CIDQDIKCNJHHIH-FQEVSTJZSA-N 423.517 2.053 10 20 HECD CS[C@@H]1CCCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803300449 SAQHGKQEBKIUJU-QFBILLFUSA-N 405.564 2.445 10 20 HECD COCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 803301806 ZEOMPPRNRWAJTI-LPHOPBHVSA-N 415.490 2.187 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CCC[C@@H]1OC 804109669 NQLDAWZTKFZKLM-WBMJQRKESA-N 413.312 2.435 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1C(=O)O 806634086 IMGRAVBFFMNEJZ-UHFFFAOYSA-N 420.415 2.495 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 808346869 RISOUQPSNQTBTJ-CTNGQTDRSA-N 417.550 2.015 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)cc3F)cc2)CC1 813531674 LPIAFCCXJWHQFE-HXUWFJFHSA-N 419.884 2.497 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1 814266967 JIULLJNZLGAACY-UHFFFAOYSA-N 415.515 2.248 10 20 HECD COc1ccc(O)c(CNC[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1 816550445 RDPFJFQZOXLOCC-OAHLLOKOSA-N 407.511 2.254 10 20 HECD CN(C)c1ccc(CN(C(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)C2CC2)cc1 914438343 RKJSSISQULCITM-NRFANRHFSA-N 405.502 2.364 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917913531 JUAYXBYBLOEPTR-UHFFFAOYSA-N 419.572 2.354 10 20 HECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1 917926799 JYBUVKZLRZBBFZ-UHFFFAOYSA-N 401.488 2.437 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COc4ccccc4C3)cc2)C1 918117375 DAJMOSBKDNTWAT-UYAOXDASSA-N 422.529 2.439 10 20 HECD C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[C@@H]1N1CCN(C)CC1 1319827984 BOLHSFDHXJRPFJ-UGKGYDQZSA-N 403.590 2.035 10 20 HECD Cc1nc(C)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)o1 1845501740 XNZAIHUBHXCRJL-UHFFFAOYSA-N 405.838 2.487 10 20 HECD COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 530616495 VSAFAQMKQCNOQM-UHFFFAOYSA-N 406.460 2.136 10 20 HECD COC(=O)c1ccc(F)cc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 727440309 MYCLSXVVQFNLAX-UHFFFAOYSA-N 408.451 2.132 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 730172877 ABMSIGDHNVLPFL-INIZCTEOSA-N 415.440 2.471 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 733648230 SLZMZKXBSQXKQT-RRFJBIMHSA-N 415.531 2.062 10 20 HECD NS(=O)(=O)Cc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 735517296 JIWGQEQRRLIFMA-SFHVURJKSA-N 404.488 2.002 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2nc(S)oc2c1 746136424 RHTDQQNBBBICQR-UHFFFAOYSA-N 417.512 2.281 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)N3CCc4ccccc43)CC2)cc1 747164827 PMKZWPBACQCYDX-LJQANCHMSA-N 408.546 2.385 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1 753645803 XTIYIVWVFRBQMP-CQSZACIVSA-N 424.494 2.385 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](c4ccco4)C3)cc2)C1 753928304 FZZUROMJFYRNLE-XLIONFOSSA-N 412.490 2.264 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCCn3c(C)nc4ccccc43)CC2)cc1 758213698 DHMJNXCGOQZYSW-NRFANRHFSA-N 423.561 2.126 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)cc(OC)c1OC 760097321 QHABJIMDJBWHRS-IAGOWNOFSA-N 418.538 2.171 10 20 HECD Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NCCc1ccc(O)c(O)c1 762264484 ZWDFHAQUERWZNK-UHFFFAOYSA-N 406.504 2.456 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCO1 764237296 UVOQOGBFXYLLGQ-IBGZPJMESA-N 418.582 2.195 10 20 HECD COc1cc(OC)cc(-n2nnnc2CN(C)Cc2ccc(N3CCOCC3)cc2)c1 770289272 QQWRQWNPWHUFIL-UHFFFAOYSA-N 424.505 2.148 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc([C@H](C)O)cc3)CC2)cc1 778307291 PUEXTIHBSJUUJR-JYBLJSLWSA-N 423.513 2.270 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)COC(=O)N4)cc2F)C[C@@H](C)O1 784222136 LMYTYYVZIWWEGF-HUUCEWRRSA-N 420.485 2.223 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 784768402 XINNQGIDTMEYJR-INIZCTEOSA-N 419.913 2.115 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nnnn1C1CCCCC1 787675472 QTRAHQIFSREYSM-NSHDSACASA-N 409.468 2.173 10 20 HECD CC(C)(C)[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 790666428 PXPYGMMFCKTNSD-HKUYNNGSSA-N 402.539 2.345 10 20 HECD COc1ccc(CNC(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)c(O)c1 797611790 AOGNSLJJUQZGQP-UHFFFAOYSA-N 421.475 2.172 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCCc4nc(C)ncc43)CC2)cc1 804319344 OOQGYGJTOQCJBA-NRFANRHFSA-N 423.517 2.072 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12 806278803 YEIGMCSZZPFMBS-IBGZPJMESA-N 403.529 2.400 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 806281075 MOGHEONBXCVDFC-CYBMUJFWSA-N 413.565 2.179 10 20 HECD CC1(C)C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(C)(C)O1 806952095 VJKAHURNBCFJQF-FUHWJXTLSA-N 404.507 2.362 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(Cc2ccccc2)CC1 807095823 FLPCRHOJWFODDL-UHFFFAOYSA-N 408.546 2.412 10 20 HECD Cc1nc(C)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 807354172 GPWVVKIBCFHSSQ-MRXNPFEDSA-N 403.504 2.290 10 20 HECD CC1(C)CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769256 DUHFCBSSFBXDRI-AWEZNQCLSA-N 411.449 2.010 10 20 HECD CCOC1CC(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 809810017 IHVFHCICYCNVFE-CUYAVPTFSA-N 404.507 2.221 10 20 HECD CCOC(=O)c1cc(COC)cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 817012737 HOZUOVPFLQNHHR-UHFFFAOYSA-N 422.459 2.339 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)OCCO4)cc2)C1 918001427 MUDFVMKMWFERQM-SFHVURJKSA-N 424.501 2.159 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)Nc1cccnc1 918278094 RXHWJWMGICWKBP-UHFFFAOYSA-N 408.380 2.192 10 20 HECD O=C(Nc1c(Cl)ccc2nonc12)C1CCN(S(=O)(=O)c2cccnc2)CC1 1116836406 AAWQXLDTRNPAPY-UHFFFAOYSA-N 421.866 2.311 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007302 BOOVITBCZIUZSA-TVNIXMEMSA-N 408.882 2.241 10 20 HECD CCN(C)[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1801222990 PQKPNHVKNOMXAP-REBRKWNGSA-N 409.914 2.343 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)(Cl)Cl)c1cc(O)nc(O)c1 1801738751 JYQISNBCJRGABM-ILWJIGKKSA-N 408.669 2.115 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848463 LHLUVTVWWKQZBI-JTQLQIEISA-N 415.784 2.353 10 20 HECD Cn1cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825760074 AEMMVOWQHQDJFL-KRWDZBQOSA-N 412.490 2.378 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(N4CCCS4(=O)=O)c3)CC2)cc1 15731565 RYPSRXXXULUNJR-UHFFFAOYSA-N 415.515 2.198 10 20 HECD Cc1c(NS(=O)(=O)c2cccc3nsnc23)cccc1C(=O)N1CCOCC1 57122105 BZBPUPYHGMJKNL-UHFFFAOYSA-N 418.500 2.273 10 20 HECD COc1ccc(N2CCCN(C(=O)Cn3cc(Br)ccc3=O)CC2)cc1 108428284 LPPZXZKKPJCDGR-UHFFFAOYSA-N 420.307 2.358 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Nc2ccc3c(c2)CCC3)c1 138526248 OHBLWZSPGYKXST-UHFFFAOYSA-N 404.444 2.048 10 20 HECD Cc1cc(C)c(N)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 726216035 ZEPZQXDFDXZVHF-UHFFFAOYSA-N 415.465 2.335 10 20 HECD CN(C)c1ccc(/C=C2/N=C(c3cccc(S(=O)(=O)N(C)C)c3)OC2=O)cc1F 727657812 APRCRDCOCFJBOY-GZTJUZNOSA-N 417.462 2.487 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](n4ccnc4)C3)cc2)C1 728747459 NYVIXDWWWWJVQL-AZUAARDMSA-N 410.522 2.132 10 20 HECD Cn1cc(CN2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)cn1 730064549 GYUWLFJLTDYEGU-UHFFFAOYSA-N 414.579 2.001 10 20 HECD CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 730075838 NKQCURNCRLBMAL-KRWDZBQOSA-N 409.527 2.226 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(S(=O)(=O)c2ccccc2)CC1 731340224 CWLWZXXGIXFMJX-UHFFFAOYSA-N 414.527 2.488 10 20 HECD C[C@H]1CCC[C@@H](OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 733020785 HQAQQBJFVLEYKC-FUHWJXTLSA-N 422.497 2.417 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CN1C(=O)NC2(CCCC2)C1=O 743809072 MJHHYQYXHHMNBT-UHFFFAOYSA-N 424.295 2.368 10 20 HECD Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)n1 747011689 GXYMHABNTYRFAY-UHFFFAOYSA-N 410.453 2.344 10 20 HECD CNS(=O)(=O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCC(C)CC2)cc1 749569136 NCEMZJXVMGMAMF-LJQANCHMSA-N 408.568 2.146 10 20 HECD CSCCNC(=S)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752743480 UBSOGICKBISXLE-UHFFFAOYSA-N 420.583 2.269 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCCCS1(=O)=O 753487795 OOYOOQNHQAJAOU-MRXNPFEDSA-N 420.453 2.126 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4c(cccc4OC)C3)CC2)cc1 754268003 CROAQFSMOXZCBS-OAQYLSRUSA-N 411.546 2.245 10 20 HECD O=C(Cc1csc(NC(=O)c2cccc(O)c2)n1)NCCc1ccc(O)c(O)c1 762260886 BKUZUFRQEZODRY-UHFFFAOYSA-N 413.455 2.414 10 20 HECD Cc1cc(CC(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c(C)n1-c1ccc(Cl)cc1 764511872 CGZNBGOCKPEJDO-KRWDZBQOSA-N 400.866 2.053 10 20 HECD CCN1CCC[C@H]1CN1C[C@H](C(=O)NCc2cccc(Br)c2O)CC1=O 765728333 HVLUZRNOXZNUBH-CABCVRRESA-N 424.339 2.104 10 20 HECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N(C)C)c(F)c1 767175016 RRXXWHXDDOZOSO-UHFFFAOYSA-N 407.511 2.157 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(c3cc(OC)c(OC)cc3[N+](=O)[O-])CC2)n1 767459346 ZXKLYWPKQRYALP-UHFFFAOYSA-N 405.411 2.291 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCN(C)C2=O)c(C)n1-c1ccc2c(c1)OCCO2 772538279 YSOBSSCXHRGCMJ-INIZCTEOSA-N 412.442 2.070 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc(N(C)C)cc1 773844865 CZNOPTBEVNXTKL-OAHLLOKOSA-N 422.485 2.218 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H]1OC 776118484 QBHAVOCVJVLGOK-RJISSLQISA-N 409.502 2.431 10 20 HECD CCO[C@H]1COCC[C@@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 776482478 OODOEBNGPBGYBN-HKUYNNGSSA-N 408.454 2.184 10 20 HECD O=C(CN1CCC[C@]12CCOC2=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778244763 JWFQWWJIZNTKIX-HSZRJFAPSA-N 404.422 2.182 10 20 HECD COc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)nn1C 782424001 UUEXNXVSRZOMLG-UHFFFAOYSA-N 411.462 2.255 10 20 HECD Cc1nc2ccccc2n1CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 785495271 FIWIUICUEWRKEU-UHFFFAOYSA-N 405.502 2.160 10 20 HECD CC1CCN([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C(C)C)CC1 787614153 CUPXVIZYYXKDCH-FQEVSTJZSA-N 406.546 2.381 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(Cn2cccn2)c1 793808520 BWWRLMYKPXHNQZ-UHFFFAOYSA-N 415.544 2.303 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c(O)c1 794376189 DIUHOKSQHYVSGQ-JOCHJYFZSA-N 409.442 2.016 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)COc3cc(Br)ccc32)c(O)c1 794387414 HFZDXMFADFHUCT-UHFFFAOYSA-N 421.247 2.205 10 20 HECD COC(=O)[C@@H]1[C@H]2CN([C@H](C)C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)C[C@H]21 794987531 WPHHHUSKAWTXFB-AFLPVOFRSA-N 418.449 2.140 10 20 HECD COc1ccc(CNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c(O)c1 797629861 VIEQTINCAXVFQS-UHFFFAOYSA-N 405.476 2.472 10 20 HECD COCCC1(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCC1 803305338 LJMYQYPGZDJRMB-QGZVFWFLSA-N 403.523 2.023 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1F 806039865 BIVHDCPNTPRFEU-UHFFFAOYSA-N 400.498 2.228 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674603 NPRXODYCACAOPM-HNNXBMFYSA-N 406.527 2.255 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807674798 QZYHTHKQYYZCGZ-OAHLLOKOSA-N 404.511 2.009 10 20 HECD O=S(=O)(CC[C@@H]1CCOC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815016884 BRGXPERCUHWVMF-WMLDXEAASA-N 402.944 2.356 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCS(=O)(=NS(C)(=O)=O)CC1 820261963 SCHLSORHYUZVCM-UHFFFAOYSA-N 415.562 2.039 10 20 HECD CS(=O)(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 916626447 ZAHBYEMYFSMFOT-QGZVFWFLSA-N 411.593 2.206 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COc4ccccc4C3)cc2)C1 918117372 DAJMOSBKDNTWAT-AZUAARDMSA-N 422.529 2.439 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2ccnc2)cc1 918340467 PBFVRJLTXQHMSZ-UHFFFAOYSA-N 410.499 2.037 10 20 HECD CN(C)c1ccc(CNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1 920019237 LURYFSFTMKFYOT-XEGHISHKSA-N 420.513 2.172 10 20 HECD COc1ccc(CCNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 920254139 LBQIWQIXSWTZCU-QXMHVHEDSA-N 423.513 2.268 10 20 HECD COCCn1cnnc1SCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 22037782 CHMQPKBYRWTGPJ-UHFFFAOYSA-N 422.466 2.431 10 20 HECD CCOC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730194475 JCXCNAUDBMYEEH-GOSISDBHSA-N 420.529 2.452 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)Nc3ccccc3)cc2F)CC1 730235013 IVKLMJYFUOVZEE-UHFFFAOYSA-N 413.497 2.406 10 20 HECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)cc1 732525674 AWOWFEBSQILSRM-UHFFFAOYSA-N 409.533 2.338 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1 734065677 ABGAYNVMTNEFCU-UHFFFAOYSA-N 407.492 2.087 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 738500196 KWOWMIDHTFQLPT-KDOFPFPSSA-N 413.522 2.424 10 20 HECD CCCNC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097880 ZXEFWFRJPRRLHF-UHFFFAOYSA-N 406.486 2.458 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)CCN4C(C)=O)CC2)cc1 742920633 LNTYXYQZQQVLAR-UHFFFAOYSA-N 422.529 2.156 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 747310829 WVTHRSZTSHWHJU-MRXNPFEDSA-N 400.445 2.301 10 20 HECD Cc1noc(C2CC2)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 751705405 RDPBMTVUAKVUBQ-UHFFFAOYSA-N 417.437 2.309 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3c3noc(C)n3)CC2)cc1 754015061 ZAEHMMOLOVIXMD-PZJWPPBQSA-N 415.538 2.097 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1 754596254 GFHTXXOHIUTDOK-FQEVSTJZSA-N 412.490 2.149 10 20 HECD CCOC(=O)c1cn(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1C 758965708 UBIUKNAKNZFNAY-UHFFFAOYSA-N 418.494 2.174 10 20 HECD CN(C)C(=O)c1ccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 761532341 ASBIEZHGDMKMDR-UHFFFAOYSA-N 402.432 2.183 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O 761995324 LPTVHWRICINGRU-UHFFFAOYSA-N 414.867 2.498 10 20 HECD O=S(=O)(NCc1cccc(Br)c1O)c1cnn(CC(F)(F)F)c1 766202299 ZMJLONFYAVNSBN-UHFFFAOYSA-N 414.203 2.392 10 20 HECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 767389492 SXXJLGFRTDYYSC-UHFFFAOYSA-N 406.504 2.376 10 20 HECD COc1cc(O)c(CN2CCN(CCNC(=O)c3ccccc3F)CC2)cc1OC 768450146 IFTHWNPBMGBQAI-UHFFFAOYSA-N 417.481 2.096 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3C(C)(C)C)CC2)cc1F 772241104 DXVQQWYKCCTWMX-UHFFFAOYSA-N 403.458 2.073 10 20 HECD CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)O1 775453312 BDYJIZAVVZJTNB-QFBILLFUSA-N 401.463 2.333 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc4c(cc3F)NC(=O)CC4)CC2)cc1 777624538 RGXFUAOHMLOELZ-UHFFFAOYSA-N 412.465 2.480 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCCN(S(=O)(=O)c2ccccc2)CC1 779501637 XWJGABOOVFKOTH-NTMALXAHSA-N 402.472 2.034 10 20 HECD CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)/C=C\c1ccc(O)c(O)c1 779507066 VYYIMEJNVLFBTH-NTMALXAHSA-N 405.472 2.442 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cn4c(n3)CCCC4)cc2F)C[C@H](C)O1 779877085 BPRSAUNPVKTGLA-GJZGRUSLSA-N 422.526 2.451 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CC1(O)CCOCC1 781967189 WGDJSSMVIXSGLD-HNNXBMFYSA-N 422.481 2.262 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](OC)(C(F)(F)F)C3)nc12 781984754 KVUJUUNLZMCJPB-MRXNPFEDSA-N 402.373 2.155 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2ccc(=O)n(C)c2)cc1 782424024 VTRQYDBPNZBZGG-UHFFFAOYSA-N 408.458 2.212 10 20 HECD CCOCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400432 ZCEWDFYKHWBZNE-UHFFFAOYSA-N 410.404 2.295 10 20 HECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785424394 OOACULDBIKDKQA-SFHVURJKSA-N 410.518 2.020 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC(C)(C)O1 785864000 HKKDPHDWQWPFPU-KRWDZBQOSA-N 402.539 2.487 10 20 HECD CCS[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319156 AZISYPMAHJBTNA-HKUYNNGSSA-N 405.564 2.320 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)cc1 788976827 HGVXGIXLQNVBMH-IBGZPJMESA-N 423.561 2.449 10 20 HECD CCc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789800147 MBEJUACSEKNNDH-UHFFFAOYSA-N 413.493 2.200 10 20 HECD CCCC[C@H](COC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789823019 CEUIHUOLCRQGEW-XYJFISCASA-N 423.529 2.377 10 20 HECD CC(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789863786 HRFVLTQESUIUPQ-UHFFFAOYSA-N 405.564 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSCC[C@H]3C)CC2)cc1 791897541 QVLKRJNBGXRCHD-ZPUOCTKUSA-N 403.548 2.254 10 20 HECD COc1ccc(CNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c(O)c1 792860410 SXUZFVZIFMNZJQ-LJQANCHMSA-N 403.454 2.413 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2cccc(CS(N)(=O)=O)c2)cc1 799885967 QSIPWUWEPLLKRK-UHFFFAOYSA-N 404.536 2.321 10 20 HECD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 808854845 MLKNYUYVEZMVFP-IBGZPJMESA-N 412.578 2.483 10 20 HECD CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H]1CC(C)(C)OC1=O 817073335 KVCXNZDEZQYWHI-ZDUSSCGKSA-N 424.500 2.421 10 20 HECD COC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920866121 XAEFNZSKHDPRCH-MRXNPFEDSA-N 418.515 2.490 10 20 HECD Cc1c(F)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1N 1796600620 VAWNSGJRXFJMSC-BTTYYORXSA-N 414.437 2.088 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C2CC2)[C@@H]1c1cccnc1 1814165957 MQNFTRNPCGYBCA-ASZUZNPLSA-N 423.469 2.328 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCC1)CC2)c1cc(O)nc(O)c1 1816722013 AFDWJXDKNBPWLT-LBPRGKRZSA-N 402.476 2.365 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CCC1)CC2)c1cc(O)nc(O)c1 1816727928 CBMIRABMFVRSJQ-SNVBAGLBSA-N 406.439 2.067 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)OC)c2)cc1 139804553 XVZRLVDEINAIDC-UHFFFAOYSA-N 412.489 2.426 10 20 HECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CCCC3)cc2)C1 726097113 DVRXCESZSILIPU-IEBWSBKVSA-N 402.539 2.360 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(-c2ncon2)cc1)c1ccc(N2CCOCC2)cc1 727039231 ULDSTMRMJULAQE-HNNXBMFYSA-N 421.457 2.389 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 729535261 OIKSPSYPRDXJRV-QEWYBTABSA-N 420.531 2.485 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cn3c(C)c(C)sc3=O)cc2F)CC1 730193590 NEZRIWYNGDKSED-UHFFFAOYSA-N 406.527 2.124 10 20 HECD CCc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1[N+](=O)[O-] 746589564 MGGHLXVLPWUYEZ-UHFFFAOYSA-N 417.487 2.322 10 20 HECD Cc1nc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1-c1n[nH]c(C(F)(F)F)n1 747201779 ILIDFADVRJBICP-UHFFFAOYSA-N 408.388 2.051 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]([C@@H]4CCOC4)C3)CC2)cc1 750241259 DMLHKVROYRMATC-VQTJNVASSA-N 416.566 2.275 10 20 HECD NC(=O)C1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCCCC1 750602225 XEXNECBTQVMHDK-UHFFFAOYSA-N 405.454 2.178 10 20 HECD O=S(=O)(NCc1ccccc1O)c1cc2c(cc1Br)OCCO2 751151782 XSTMZIYMBWGWTO-UHFFFAOYSA-N 400.250 2.404 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)c1 751319029 QZCRQQIKSRCAAP-ZDUSSCGKSA-N 413.517 2.461 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](N4CCCC4)CC3)CC2)cc1 754043668 UGWQSWUPCYQCJU-GMAHTHKFSA-N 416.610 2.128 10 20 HECD O=C(CN1CC[C@H](N2CCCC2=O)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761121772 YWRGYFAZPUFJBX-INIZCTEOSA-N 417.465 2.097 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@@H](c4cccc(O)c4)C3=O)cc2F)CC1 761283576 SLGGGOTYESZTLX-FQEVSTJZSA-N 412.465 2.466 10 20 HECD Cc1c(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cnn1-c1ccccn1 764528893 WWWSACMWCSDAAO-UHFFFAOYSA-N 401.477 2.234 10 20 HECD CC1(C)C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C(=O)O1 765142428 LROZSNUHBKSROG-LBPRGKRZSA-N 410.473 2.078 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1[N+](=O)[O-] 765925702 JUQOQBAQXWVVLT-UHFFFAOYSA-N 424.207 2.326 10 20 HECD NS(=O)(=O)c1ccc(N2CCN(Cc3cc4c(cc3O)CCCC4)CC2)cc1 768439281 JWTDBCKWAXXTJE-UHFFFAOYSA-N 401.532 2.241 10 20 HECD COC(=O)c1ccc2c(c1)CN(CC(=O)N1CCN(c3ccc(OC)cc3)CC1)CC2 771451249 APJKMFGIUBAKED-UHFFFAOYSA-N 423.513 2.189 10 20 HECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)/C=C\c1ccc(O)c(O)c1 779483036 XMEYLJPDSLFEDT-YWEYNIOJSA-N 411.458 2.146 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O 784026677 XYORALZSNSGUOH-UHFFFAOYSA-N 423.469 2.419 10 20 HECD CCS[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785444679 UJZWDXWEBMIKRI-CYBMUJFWSA-N 405.524 2.225 10 20 HECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 785596993 CGQQGHATQIAYCX-NRFANRHFSA-N 415.497 2.318 10 20 HECD CN(C)CCCNS(=O)(=O)c1ccc(N(C)Cc2ccccc2O)c([N+](=O)[O-])c1 786793634 QIWUTYFXHYAUEA-UHFFFAOYSA-N 422.507 2.167 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 787558269 HAKDGDZRXYSLMN-OAHLLOKOSA-N 409.490 2.407 10 20 HECD COC1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 788462375 YZEXVBSLADGFHA-UHFFFAOYSA-N 405.520 2.035 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)OC(C)(C)C3)cc2F)C[C@@H](C)O1 789811751 HANVGHAYADWBLA-XHSDSOJGSA-N 421.513 2.081 10 20 HECD CCn1ncc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c(C)nc21 799319207 CLZCLQRBFFFFSF-QGZVFWFLSA-N 420.517 2.391 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)[C@H]1CCCN(C(=O)OC)C1 808030555 ZKWJMAASYUTYKS-WMZOPIPTSA-N 418.538 2.084 10 20 HECD COCC[C@H]1COCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 812887237 RNNVZDQZFJYKJY-INIZCTEOSA-N 408.454 2.138 10 20 HECD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1C 815636356 TWGHMTIGTNCULN-LBPRGKRZSA-N 404.902 2.268 10 20 HECD Cc1c(C(=O)O)cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 871822501 YVDCEQCYTXDAEO-UHFFFAOYSA-N 408.451 2.147 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CO[C@@H]3CCOC3)c2C)cc1 1318918692 AUJWLXCBYXXDKU-GOSISDBHSA-N 415.442 2.412 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 1319624712 VTRLBNBPQBSFLY-BGYRXZFFSA-N 413.518 2.299 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC(=O)N1CCCC1 1322460013 JNYVKVGVUXEKLK-KAMYIIQDSA-N 423.585 2.468 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NC[C@H]3COc4ccccc4O3)CC2)cc1 1324604526 JQWLDNLSMOQJLL-FQEVSTJZSA-N 411.502 2.164 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1822641657 FSQUHYSMXDBOPA-UYKLKCEZSA-N 402.476 2.221 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1 1823819140 UWNBGWXGDPHSQV-MSOLQXFVSA-N 417.506 2.295 10 20 HECD COC(=O)c1sccc1NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 11193332 MYSDTLBTMNWFPT-UHFFFAOYSA-N 403.504 2.442 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1NC(C)=O 60749336 SRPYWLMOIVTJHJ-UHFFFAOYSA-N 410.474 2.291 10 20 HECD O=C1C[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CN1CC(F)(F)F 97576262 GGTFXZSNELGVNL-GJZGRUSLSA-N 400.397 2.311 10 20 HECD CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730192616 INQPSSZWJAXCHC-FQEVSTJZSA-N 404.530 2.375 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C(C)(C)C)C3)cc2F)CC1 730194231 BTWPESCZVSBLDS-KRWDZBQOSA-N 404.530 2.231 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1F 731408885 YTJMUJNNYZWEFO-UHFFFAOYSA-N 400.454 2.334 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(C)(=O)=O)o3)cc2F)C[C@H](C)O1 733098223 XTTWDGMPYPKVJZ-STQMWFEESA-N 410.467 2.366 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1 734687225 ORHUEEAYXSALPK-LJQANCHMSA-N 415.582 2.289 10 20 HECD COc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1N1CCOC1=O 743266470 NYIUNNCGKYFCPY-UHFFFAOYSA-N 406.445 2.457 10 20 HECD CCC1(O)CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 743855724 XSCCPVYLNJWNKV-CALCHBBNSA-N 407.530 2.292 10 20 HECD Cc1cc(C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c(C)n1-c1ccc(F)cc1 744461476 FSZQZVNBHDSBOV-UHFFFAOYSA-N 420.466 2.102 10 20 HECD C[C@@]1(C2CC2)NC(=O)N(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 751303156 UTJJHGCZERBNNB-NRFANRHFSA-N 404.430 2.055 10 20 HECD COC(=O)Cc1csc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)n1 753840610 PYZSOBBSMDXXTJ-UHFFFAOYSA-N 408.455 2.360 10 20 HECD C[C@@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756440051 COOJRRUXFJFUBH-HKUYNNGSSA-N 415.559 2.340 10 20 HECD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1cccc(Br)c1O)C2=O 765752495 WZRKGRIWAYGDBF-ADLMAVQZSA-N 424.295 2.272 10 20 HECD CCN1CCN(CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 771057315 HXFPJKOQHVNJMM-IBGZPJMESA-N 408.974 2.154 10 20 HECD CC[C@H]1CN([C@@H](CC)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 774015061 WRWIWNYLUXQFER-ICSRJNTNSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc(F)ccc3OC)CC2)cc1 775108288 HNNZMLLSMUUOGB-UHFFFAOYSA-N 416.449 2.277 10 20 HECD Cc1cc(CNC(=O)NCc2c(O)ccc3c2CCCC3)ccc1S(N)(=O)=O 775220351 BKDPPTXZBRIKHS-UHFFFAOYSA-N 403.504 2.226 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCO[C@H](C(C)C)C3)CC2)cc1 778418365 DLLJJLSIYKDABB-LDRMICATSA-N 415.534 2.220 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccn2c(O)nnc12 780985906 VHLUZBUKCPWBLM-CQSZACIVSA-N 401.854 2.188 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cnn1-c1ccccc1F 785298664 YAXMAXIFYMEXDZ-GFCCVEGCSA-N 412.421 2.417 10 20 HECD C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785428322 KDTGFKSVIJOOMB-RDJZCZTQSA-N 418.538 2.131 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCc3c(ncn3-c3ccccc3)C2)cc1 785433540 MZBPLCVDFRHLTC-UHFFFAOYSA-N 403.486 2.139 10 20 HECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 786334854 DMHZPBVNHCRNFN-UHFFFAOYSA-N 402.458 2.113 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)cc1F 786753785 PQIRSAHSGZPZBA-UHFFFAOYSA-N 400.429 2.487 10 20 HECD CC(C)[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1nnc2ccccn12 788909220 DTJKIXJTQWIXMJ-FQEVSTJZSA-N 420.517 2.459 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCS(=O)(=O)c2ccccc21 790292184 NBIVYMQAXPRLCH-KRWDZBQOSA-N 418.490 2.240 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnn3-c3ccccc3)nc12 795756750 AUPIDANITFXBJL-UHFFFAOYSA-N 407.386 2.154 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCc4cc(C)ccc4O3)nc12 796301507 WYKILRPLUFGVLF-KRWDZBQOSA-N 411.414 2.357 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(Cl)cc(C(N)=O)c3)CC2)cc1 798429935 SQCCSEJUOXBQLZ-UHFFFAOYSA-N 423.922 2.349 10 20 HECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)no1 803305903 OCHZNBWWZNLSHM-JXFKEZNVSA-N 412.490 2.361 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2ccccc2C1 803664651 PIAJTEZSMJDQGM-MRXNPFEDSA-N 412.509 2.071 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(N2CCCC2)n1 803689611 VCTSAZZKESBOMN-UHFFFAOYSA-N 421.545 2.305 10 20 HECD CCSCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805009842 OWEJCVKNKIGAFL-MRXNPFEDSA-N 424.586 2.232 10 20 HECD Cc1cc(C(=O)NCCOCCS(N)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 808118797 RXFBLJFZBHBPGD-UHFFFAOYSA-N 407.536 2.252 10 20 HECD CC(=O)C(=O)COC(=O)c1cc(Br)ccc1I 808483785 WRYNTEJYVYMJHU-UHFFFAOYSA-N 410.989 2.369 10 20 HECD CC(=O)Nc1cccc(NC(=S)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1 812262040 UWECUBHIUORJDA-UHFFFAOYSA-N 407.521 2.209 10 20 HECD COc1cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)sc1S(N)(=O)=O 813684972 ZGIZMIFNIDEYOX-UHFFFAOYSA-N 411.288 2.347 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(-c4ncc[nH]4)c3)cc2)C1 814338740 WJSYMBHOVHOJBA-KRWDZBQOSA-N 404.474 2.103 10 20 HECD CCOc1cc2c(cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)O[C@H](C)C2 919807834 HJMVDMMJWAOBIJ-GFCCVEGCSA-N 420.487 2.416 10 20 HECD COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(Br)cc(Br)c1O 1320989996 WAAJTVXRQXMIQK-ONGXEEELSA-N 409.074 2.025 10 20 HECD C/C=C/C=C\C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008743 JNJGOZZTFSNKQT-RCULGURQSA-N 406.866 2.327 10 20 HECD CC(=O)N/C(C)=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719071 SJSTWSPVCXWRAO-SWPZASQDSA-N 421.881 2.043 10 20 HECD C[C@@H](CN)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814749614 BIADTFSGYWXMDQ-WCBMZHEXSA-N 424.910 2.028 10 20 HECD O=C([C@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428961 MOWRWPFOMVYGHE-FUHWJXTLSA-N 417.506 2.153 10 20 HECD Cc1ccc(C)c(OCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843249085 UTMGWYZXDAGMBS-UHFFFAOYSA-N 411.458 2.006 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(c3ccccc3)CCC1)C2 1843251133 YSFUMGFVBDSSAQ-UHFFFAOYSA-N 407.470 2.432 10 20 HECD CC(=O)NC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 51278726 PMDRZODAJQELJG-GASCZTMLSA-N 406.502 2.249 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)NCc3c(C)c4ccccc4n3C)CC2)nn1 472229019 HYGAKCACZOMVNI-UHFFFAOYSA-N 410.478 2.412 10 20 HECD CNC(=O)Cn1ccc2ccc(NS(=O)(=O)c3cccc4nsnc34)cc21 607882027 MLIUUBBIQIZUDR-UHFFFAOYSA-N 401.473 2.193 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(N)c([N+](=O)[O-])c1 727767458 CXXAHURGLLVGCF-OAHLLOKOSA-N 411.462 2.117 10 20 HECD Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 728302598 UWSDCWSYPPSNPH-KRWDZBQOSA-N 421.497 2.475 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)c1 728979957 RTGHZZPWEZVRFO-CYBMUJFWSA-N 420.487 2.149 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)CC(=O)N3CCCC3)cc2F)C[C@@H](C)O1 729224935 AKSNVIOPVSEZHE-HZPDHXFCSA-N 406.502 2.203 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1CCN(CC(F)(F)F)C1=O 732571472 DKHBZHZROHPHKV-HNNXBMFYSA-N 416.469 2.202 10 20 HECD COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 734073701 VMHZQYYWAGOFHF-UHFFFAOYSA-N 416.430 2.230 10 20 HECD COc1ccnc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 734771244 RNPVBFDNTVBMKP-UHFFFAOYSA-N 422.464 2.276 10 20 HECD CCOc1ccc(N(C)CC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1 739922581 MWRVYEINTVTJCN-CQSZACIVSA-N 403.504 2.147 10 20 HECD NC(=O)c1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1Cl 743956849 XIRIGRAMOBOXHU-UHFFFAOYSA-N 401.850 2.278 10 20 HECD Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nc2nc(O)nc(O)c12 746167264 DCCIRMXYIAIKBR-CYBMUJFWSA-N 409.446 2.072 10 20 HECD CN1CCCc2cc(CNC(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)ccc21 753150006 OZXNHYQCOOIVPA-FQEVSTJZSA-N 407.518 2.454 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cc(-n4cnnn4)ccc3F)CC2)cc1F 753886621 XWOOQPXWHVOKGS-UHFFFAOYSA-N 415.404 2.303 10 20 HECD Cn1nnc2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 754321205 UVZCVAOUZVFVOD-ZDUSSCGKSA-N 402.405 2.364 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 755345813 OKKDRTHOKDYPQX-UHFFFAOYSA-N 414.462 2.164 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3ccc([N+](=O)[O-])cn3)CC2)cc1 758223198 NQIUVDWIYBICGN-KRWDZBQOSA-N 404.492 2.274 10 20 HECD C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758390335 VMVYPPYKGIGWFC-PXNSSMCTSA-N 415.582 2.260 10 20 HECD O=C(COC(=O)[C@@H]1C[C@]12CCOC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764640452 QKGKDSCAVYRTTN-MBSDFSHPSA-N 405.406 2.370 10 20 HECD C[C@H](O)CNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 769083029 LSUQPVVYYGVUTC-DAVUEJTQSA-N 415.334 2.147 10 20 HECD COc1ccc(Cl)cc1N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)CC1=O 770625646 RJIOEJAWBMPADN-CYBMUJFWSA-N 404.850 2.472 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCCCSc2nccs2)s1 772617320 BYNHGZVMDXYQKA-UHFFFAOYSA-N 420.607 2.273 10 20 HECD O=C(CNc1cccc2c1OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 772904023 KWLJURCZHHRMJP-UHFFFAOYSA-N 401.438 2.162 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)Cc2ccc(N3CCN(C)CC3)cc2)cc1 775724097 JPGBMHPHESDJLF-UHFFFAOYSA-N 416.591 2.157 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 778296149 ZGUDIKIVOQLFDC-XICFVGIFSA-N 415.534 2.220 10 20 HECD C[C@H](NC(=O)N1CCC(CC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)cc1 781370219 CXPKFVAXKVOQTN-KRWDZBQOSA-N 402.539 2.484 10 20 HECD Cc1cnc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 782104378 FHOHLJBUYZSQQX-VXGBXAGGSA-N 406.483 2.459 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1 785296276 CEJCBBNHHYVTCK-CQSZACIVSA-N 411.458 2.020 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CN(C)C(=O)c2ccccc21 787105058 UGYWETKQKKGLFK-FQEVSTJZSA-N 409.486 2.124 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(N3CCOC3=O)c2)cc1 788977852 NGJUQFVXYWJFNI-UHFFFAOYSA-N 424.501 2.422 10 20 HECD CCCN(C)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789862576 WRYMVVZLFCKAMO-LJQANCHMSA-N 418.607 2.046 10 20 HECD CN1CCCc2cc(CNC(=O)[C@](C)(O)Cn3cc(C(F)(F)F)ccc3=O)ccc21 792103063 FDHKPJFNVORKPG-HXUWFJFHSA-N 423.435 2.317 10 20 HECD CCCN1CCC(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 793825186 NAXBFKLNNGUCJC-UHFFFAOYSA-N 416.566 2.018 10 20 HECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1 795728692 UHMQGNVTERILSD-UHFFFAOYSA-N 413.536 2.338 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c(O)c1 797390798 SGLVHWVKUYQIPS-UHFFFAOYSA-N 420.425 2.303 10 20 HECD CCn1ncc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1C(F)(F)F 799253427 SKYVUVNVTZJLEH-VIFPVBQESA-N 400.357 2.452 10 20 HECD O=C(Nc1cncc(F)c1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 799262510 WYILHTNTVHVJBT-OAHLLOKOSA-N 406.845 2.299 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCSC(C)(C)CC1)c1ccc(N2CCOCC2)cc1 803307829 NQFIATTYOSKHNU-MRXNPFEDSA-N 405.564 2.445 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)nc2ccccc12 803687263 YZWAGCJLZQJKRX-UHFFFAOYSA-N 403.486 2.253 10 20 HECD O=C(NC[C@H]1CCC=CO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805512603 ZWXIWZXTLDULTK-RHSMWYFYSA-N 409.433 2.182 10 20 HECD CSC[C@H](C)NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807263054 FQXIDMTXSQJVQU-QWHCGFSZSA-N 401.479 2.241 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCN(Cc2ccccc2)CC1 807289393 SPUGIAVPITWYQP-UHFFFAOYSA-N 418.541 2.414 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1Cc1ccccc1 807290412 ISJTWOZVNVEPDM-DENIHFKCSA-N 418.541 2.458 10 20 HECD CN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852812 YCISFVMENZTVHE-UHFFFAOYSA-N 410.518 2.086 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H](c4ccccc4)OC3=O)cc2)CC1 809793282 BNLFFYRYUDCVRT-FCHUYYIVSA-N 421.497 2.276 10 20 HECD CN(C)c1ccc(CNC(=O)c2c(I)cnn2C)cc1F 814108742 WGVXZMXVXDLNQE-UHFFFAOYSA-N 402.211 2.160 10 20 HECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N(Cc1ccccc1O)C[C@H]1CCCO1 819427208 JFMWVZKRMAVOOJ-CQSZACIVSA-N 403.460 2.344 10 20 HECD Cc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1-n1cnnn1 915345795 JQTTYBMTHNEFFB-UHFFFAOYSA-N 407.478 2.471 10 20 HECD O=C(CNC(=O)c1cccc(Br)c1)OCC(=O)c1ccc(O)c(O)c1 916590742 KJPUGWHFWUVNHY-UHFFFAOYSA-N 408.204 2.016 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)Cl)CC2)c1cc(O)nc(O)c1 1816728857 XJGGAGIKFUOQBY-SSDOTTSWSA-N 418.809 2.007 10 20 HECD Cc1cnc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1842330126 GDGZFXOXZHJRLD-UHFFFAOYSA-N 423.498 2.061 10 20 HECD C[C@@H](OC(=O)c1cnccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 5469827 PHDBMYMRDCCCRE-GFCCVEGCSA-N 401.378 2.436 10 20 HECD Cc1c(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cccc1-n1cnnn1 527170991 QVGJQIQWCXNVSA-UHFFFAOYSA-N 403.446 2.026 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc(N(C)C)c3)CC2)cc1 726249011 SZIBRDDLAVWBDX-UHFFFAOYSA-N 411.550 2.383 10 20 HECD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NCc1ccccc1O 726294267 UJNPAAPJWXZVFL-UHFFFAOYSA-N 413.499 2.145 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2CCN(S(C)(=O)=O)CC2)cc1 728839748 ZDSJWIKFWVKLAE-UHFFFAOYSA-N 421.485 2.315 10 20 HECD COc1ccc(N2CCN(C(=O)CONC(=O)c3c(F)cccc3Cl)CC2)cc1 728911792 KWADDZNNDVYURS-UHFFFAOYSA-N 421.856 2.498 10 20 HECD C[C@H]1CN(C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 729599302 FGJPXGTVMRUNHB-XQBPLPMBSA-N 416.566 2.306 10 20 HECD COc1ccsc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 730057433 FZEYZWZAEITCFC-UHFFFAOYSA-N 408.451 2.206 10 20 HECD COC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 734169929 FXSOEGFSNQFEBF-UHFFFAOYSA-N 405.426 2.166 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 734407548 BKNYSMYJQVYFBQ-UHFFFAOYSA-N 402.476 2.477 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 742054617 BRKLKVYRCCUXKK-HXUWFJFHSA-N 408.502 2.087 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)ncn4C)CC2)cc1 743902686 AQHIOAPGXFPFQA-UHFFFAOYSA-N 407.474 2.306 10 20 HECD Cc1cc(CS(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)on1 749170839 QSPBXBXHQBIDMM-UHFFFAOYSA-N 419.425 2.458 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)ncn4C)CC2)cc1 753463087 XINLIHFHMXSSCT-UHFFFAOYSA-N 408.458 2.088 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1F 753740533 QKYXFZWNQFPSSM-HSZRJFAPSA-N 413.493 2.120 10 20 HECD COc1cc(N2CCN(C(=O)NCCCCn3ccnc3)CC2)cc(OC)c1OC 759242766 QJFGXSNWGLGEDI-UHFFFAOYSA-N 417.510 2.221 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)Nc1ccccc1S(C)(=O)=O 759594065 FHBARIGAOGJDSY-OANVXVOSSA-N 405.428 2.085 10 20 HECD COc1ccccc1NCC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760088145 SZOKUXJXXXVOBO-UHFFFAOYSA-N 415.490 2.482 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 761612109 CGRWSTYDNNIEQP-UHFFFAOYSA-N 407.492 2.493 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1noc(-c2ccccc2)n1 764625933 OJIJIAYCCGGPGJ-LLVKDONJSA-N 402.432 2.305 10 20 HECD Cc1cc(C(=O)N2CCN(C(=O)CO)CC2)c(C)n1-c1ccc(Br)cc1 765273727 SGUOUPKXDIEREZ-UHFFFAOYSA-N 420.307 2.133 10 20 HECD COc1cccc(O)c1CN1CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C1 769192033 GTWUFOUGINDXHG-HNNXBMFYSA-N 407.511 2.254 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773856560 JCPCRUANGJPBGO-AWEZNQCLSA-N 412.490 2.279 10 20 HECD Cc1cn2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc2n1 774118112 SINHSIQAFYPBAB-SFHVURJKSA-N 408.458 2.495 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC[C@@H]3C)cc2F)CC1 774748453 BHPBBYXENWAPOZ-LPHOPBHVSA-N 404.530 2.279 10 20 HECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 776854800 AHMILACXWMQELV-UHFFFAOYSA-N 415.412 2.294 10 20 HECD CC(=O)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)nc1C 777127589 FFYDQPKYQIQDLU-UHFFFAOYSA-N 415.515 2.066 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc(CNS(C)(=O)=O)cc1 782570432 JUCGONQNULCOCD-UHFFFAOYSA-N 404.492 2.233 10 20 HECD COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC 785483279 OPQIBPTVIYSKKY-CQSZACIVSA-N 415.490 2.272 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CS4)cc2)CC1 786260440 WKSAFZKQADFDEA-UHFFFAOYSA-N 424.526 2.329 10 20 HECD C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788311220 RXKAVFXPYHIKBA-LAUBAEHRSA-N 408.502 2.144 10 20 HECD COc1c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cccc1[N+](=O)[O-] 793925114 MWJXLTNFLMUZSK-UHFFFAOYSA-N 412.446 2.202 10 20 HECD COc1ccc(CNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c(O)c1 794381360 OZXOGZLJYUOUJT-UHFFFAOYSA-N 418.515 2.264 10 20 HECD Cn1ccc(CCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 795799960 VDTWZBFGDAEXPX-UHFFFAOYSA-N 417.421 2.310 10 20 HECD C[C@H](O)C[C@H]1CCCCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796386628 YBCJHRXYCWZGFM-PKOBYXMFSA-N 407.530 2.294 10 20 HECD Cn1nnc2c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccnc21 801173713 BOQPBDASRGTTSR-AWEZNQCLSA-N 400.870 2.117 10 20 HECD CCOC1CC2(CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)C1 806495024 BBJSYGZSUYUIQC-QRGRWYIGSA-N 414.550 2.489 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 807172401 CHPDWHOWPGSJLW-UHFFFAOYSA-N 424.461 2.202 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)C1 813837394 KTUSUWKHONGWHD-WVRJYTFGSA-N 417.506 2.265 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)cc1 918308906 CCNFXAXDDCDPRP-UHFFFAOYSA-N 421.505 2.414 10 20 HECD CN(C)C(=O)COc1ccccc1/C=C1/SC(=S)N(CCCC(=O)O)C1=O 920396884 BXKZLDVZFMPZMI-GXDHUFHOSA-N 408.501 2.220 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1323237425 AKUVIEBANXNZLV-KRWDZBQOSA-N 408.502 2.494 10 20 HECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 1323829676 LLCQWYMNAHBARS-PBHICJAKSA-N 404.536 2.425 10 20 HECD Cc1cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccn1 1794179817 QKVGNBCEHOZJSS-BCDXTJNWSA-N 410.474 2.081 10 20 HECD CCCc1onc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1797084020 ZFNAHEJQQOVTHQ-QDMKHBRRSA-N 414.462 2.307 10 20 HECD Cc1nocc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816522503 WJXYKAGHAITHIS-AWEZNQCLSA-N 412.406 2.132 10 20 HECD O=C(c1ccsc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038764 BHXCWRSAKNSAHD-HWKANZROSA-N 400.456 2.395 10 20 HECD N#Cc1ccsc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 52223264 VRKSASXRJCOYRP-UHFFFAOYSA-N 403.435 2.069 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 141691603 QATKXDVHRWWOET-HNNXBMFYSA-N 410.474 2.298 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCCC3)C2)n(C)c2ccccc12 570080393 RBJCXPMAZXNRJM-GOSISDBHSA-N 424.545 2.400 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 729526826 HNHNWMUJIAYBPM-CQSZACIVSA-N 409.490 2.308 10 20 HECD COc1ccc(N2CCC(NC(=O)Cc3c(C)nc4[nH]n(C)c(=O)c4c3C)CC2)cc1 730283210 GCAJTJOLBPSDFQ-UHFFFAOYSA-N 423.517 2.215 10 20 HECD COc1ccc(O)c(CNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 734065758 DAMZHPLXWVBWTM-UHFFFAOYSA-N 422.526 2.143 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCOc3ccccc3OC)CC2)cc1 742916778 MGLGVRRMKMJPMQ-UHFFFAOYSA-N 413.518 2.411 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1 743914349 RWOMMCXFCSQKIR-UHFFFAOYSA-N 409.490 2.236 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCC[C@@H](O)C3)CC2)cc1 745348036 AQMWYKINHATLHG-UYAOXDASSA-N 404.555 2.058 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(CC(=O)N(C)C)CC1 745811872 GCVCALISQFDHOF-UHFFFAOYSA-N 403.571 2.225 10 20 HECD C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1)n1cccn1 748481711 LZVMFIJTLFYZBP-AWEZNQCLSA-N 407.430 2.043 10 20 HECD Cc1ncoc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 750928158 JJEWSEZDXCLBFQ-STQMWFEESA-N 405.426 2.209 10 20 HECD C[C@H](CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccncc1 754946926 KDEYQLACSRMYDG-MRXNPFEDSA-N 415.465 2.411 10 20 HECD C[C@@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(F)cc1O 756712399 PRPBVWDBQUUMFD-NVXWUHKLSA-N 401.486 2.478 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1cccc(S(=O)(=O)N(C)C)c1 759697008 OMFGCSAVUOFZPX-UHFFFAOYSA-N 403.548 2.406 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccnc12 763997230 JOHCIFSFBCCSTE-OAHLLOKOSA-N 423.473 2.234 10 20 HECD CCOC(=O)[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 767025955 AZQDJMLUWQXHGV-TWOQFEAHSA-N 421.513 2.083 10 20 HECD COC(=O)C1(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCCC1 767642376 RMDCMYRUUIMWCO-UHFFFAOYSA-N 421.513 2.134 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1OC 768451073 LSKLURBSGHVIIN-WMZOPIPTSA-N 405.539 2.222 10 20 HECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c(O)c1O 770466716 NTSTVXYEAKWLGE-UHFFFAOYSA-N 410.879 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ncc(Cl)s3)CC2)cc1 773986550 CBCPYYXRGRQPRL-AREMUKBSSA-N 413.952 2.403 10 20 HECD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 779499277 MFIKUSPZBWNFFC-NTMALXAHSA-N 404.488 2.255 10 20 HECD COc1cccc(C(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c1OC 780917443 IIKJIYYXYYMTBA-UHFFFAOYSA-N 400.431 2.022 10 20 HECD CCOC(=O)NCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785670949 YFACAWOSHUSHSE-GFCCVEGCSA-N 424.409 2.078 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1c1ccc(OC(F)(F)F)cc1 790460158 INYNSWJTUMTGPF-FUHWJXTLSA-N 424.375 2.390 10 20 HECD COCCCOC1(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCC1 791348184 OCYQJAQXCDKVTJ-UHFFFAOYSA-N 401.481 2.286 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@](C)(O)Cn1c(C)cccc1=O 792226417 SHIBJAHBAJWHCV-LJQANCHMSA-N 423.307 2.425 10 20 HECD Cn1nccc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 800998888 NLOWRUHGYXYJKJ-QGZVFWFLSA-N 401.486 2.485 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)cc1F 804853450 YDGHWYPMORHXMD-WJONJSRFSA-N 421.513 2.083 10 20 HECD COC[C@@]1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 813513729 RSRAZJIDUCGCFQ-SPLOXXLWSA-N 408.495 2.419 10 20 HECD O=S(=O)(CCN[C@@H](CCc1ccccc1)c1ccccc1O)N1CCOCC1 815591658 NMRVBFDYJCZUBY-FQEVSTJZSA-N 404.532 2.318 10 20 HECD CN(C)CCn1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 857473073 SSCDAZHQPXROPT-KRWDZBQOSA-N 405.930 2.198 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C/C=C\c4ccccc4)CC3)nc12 916980958 IKKDSEZOSDELKW-TWGQIWQCSA-N 421.501 2.443 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H](C(=O)NC3CC3)c3ccccc3)cc2)C1 917940809 OLXQRWQTNKGTBZ-DENIHFKCSA-N 406.530 2.498 10 20 HECD O=C(NCCN1C(=O)c2ccccc2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 919787936 ACELWMOBMVSNIB-QGZVFWFLSA-N 423.469 2.379 10 20 HECD CC(=O)N1C[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)Oc2ccccc21 919968839 LVAIVWUDGJBUAK-QHCPKHFHSA-N 423.513 2.326 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)OC[C@@H]3CCCCO3)CC2)cc1 921166909 SDXVQTLAWIWMGP-UGKGYDQZSA-N 419.566 2.298 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cncc(OCC(F)F)c3)cc2)C1 1319287199 PWNINSCRHFHAOT-OAHLLOKOSA-N 418.444 2.357 10 20 HECD Cc1onc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)c1C 1847935420 WKUMIQQKEFZNRA-KBPBESRZSA-N 405.838 2.485 10 20 HECD CCn1cc(NC(=S)NCCCN2CCN(c3ccc(OC)cc3)CC2)cn1 726121818 GJAHSEPVPPRYCI-UHFFFAOYSA-N 402.568 2.410 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN(C)C(=O)c1cccs1 726996459 KNKZQTDSZYBKAL-UHFFFAOYSA-N 403.504 2.088 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4ncc[nH]4)C3)cc2)C1 727941055 QUYCDFUBGIBZAV-MSOLQXFVSA-N 410.522 2.201 10 20 HECD C[C@H](NC(=O)COCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 732553610 PHNTZSYEBZHSJH-INIZCTEOSA-N 407.511 2.242 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN([C@H]4CCCN(C)C4)CC3)CC2)cc1 734667228 VZIWGNGKSIPZLN-NRFANRHFSA-N 415.582 2.085 10 20 HECD CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 741090795 OQMYIESGMYMTNK-IBGZPJMESA-N 406.552 2.066 10 20 HECD O=C(COC(=O)CCCc1ccccn1)NCc1ccc(N2CCOCC2)c(F)c1 741337580 NFUZDPKPSLJGQM-UHFFFAOYSA-N 415.465 2.240 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C[C@@H]3CCOC3)C3CC3)CC2)cc1 743363980 ZHOWNUXZWSXYBR-SFHVURJKSA-N 402.539 2.028 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1O 748046926 XNKPNDZHFZOXQU-UHFFFAOYSA-N 406.479 2.382 10 20 HECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 749185480 FDTFOQUBZLMZTP-INIZCTEOSA-N 418.563 2.051 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751044041 PCBKVSROPQRESQ-HNNXBMFYSA-N 404.488 2.349 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 752657203 YJILIRFLXPNBSC-UHFFFAOYSA-N 410.430 2.306 10 20 HECD CNC(=O)CCCN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753206181 CJDBWMBZERFQFZ-AWEZNQCLSA-N 407.470 2.247 10 20 HECD Cc1cc(C(=O)CN2CC(C)(C)OC[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 753834802 UBXSXVLXNWBJFE-HNNXBMFYSA-N 419.547 2.424 10 20 HECD COCC[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccco1 754461304 WIJVPKQZGQFVEC-GOSISDBHSA-N 405.470 2.239 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)OC[C@H]3CCCCO3)CC2)cc(OC)c1OC 759241565 SKNHBYXFRCOVRR-FUHWJXTLSA-N 422.522 2.335 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ncccc3F)CC2)cc(OC)c1OC 760125343 CIWNWJNMJKNNMH-UHFFFAOYSA-N 404.442 2.278 10 20 HECD Cn1ccc(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 760656405 NKYNTXVTLAZCEG-UHFFFAOYSA-N 404.382 2.076 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1F 760678797 SFVHCCHJZNHLPC-OAHLLOKOSA-N 418.473 2.207 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)c(OC)c2)cc1 767452320 XNHPTDADJQVPBQ-UHFFFAOYSA-N 405.885 2.306 10 20 HECD Cn1cnnc1[C@H]1CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767758389 ZNIULIKBQMQXBB-GOSISDBHSA-N 415.453 2.366 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc4c(c3)NC(=O)CO4)cc2F)C[C@H](C)O1 770676242 NJDNLEBAAZNBCN-STQMWFEESA-N 414.437 2.095 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1)c1ccc(N(C)C)cc1 773844135 CINLECDMQIYJEG-QGZVFWFLSA-N 409.534 2.320 10 20 HECD Cc1csc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 774125167 ARROZZZTHQBOGT-ZDUSSCGKSA-N 424.473 2.454 10 20 HECD Cc1sc2ncc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(=O)n2c1C 775665077 WQFDFMLMGCODHW-UHFFFAOYSA-N 416.478 2.279 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1)c1ccc(N2CCOCC2)cc1 782782321 DCGQJMTWCITIJM-OAHLLOKOSA-N 420.473 2.124 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 784024608 QMVBKOKWKOZVPY-UHFFFAOYSA-N 420.469 2.426 10 20 HECD Cc1cc(C(=O)CN2CCSC[C@H]2CO)c(C)n1-c1ccc2c(c1)OCCO2 784241090 LZMJNNLAEIAHGL-QGZVFWFLSA-N 402.516 2.458 10 20 HECD C[C@H]1C[C@H](C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840614 KWFGUNIHWVIOAU-ZRGWGRIASA-N 405.514 2.344 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4ccccc4c(=O)o3)cc2)C1 797711898 DBLJFFPDRFWJHS-KRWDZBQOSA-N 405.454 2.425 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](CCO)Cc1ccccc1 799553877 WGZKRKXOBKVQOV-IBGZPJMESA-N 401.482 2.455 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCc1ncnn1CCF)c2[N+](=O)[O-] 801193790 CZYSSXWKPPKDIF-UHFFFAOYSA-N 424.344 2.288 10 20 HECD C[C@H](CCN(C)C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 803201232 ORJQYJGSTSJPJJ-QGZVFWFLSA-N 400.523 2.331 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CN(C)Cc2ccccc21)c1ccc(N2CCOCC2)cc1 803303162 YHXQFZMDTMKOAI-VGOFRKELSA-N 422.529 2.003 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCC12CCOCC2)c1ccc(N2CCOCC2)cc1 803304580 ZQYWQXUWLGCFLJ-YLJYHZDGSA-N 415.534 2.166 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccccc3F)C2)cc1F 803663540 RRPUOJCWYFPTTH-LJQANCHMSA-N 403.429 2.247 10 20 HECD CC[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663610 UWPDAYJEEKVXQB-GOSISDBHSA-N 401.482 2.308 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCCN(c2ccccc2)C1 806426914 RGAIHDCZVIPQCJ-HXUWFJFHSA-N 404.514 2.464 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cc(COC(C)(C)C)on1 807101282 WBCVIQWWFQNPNG-UHFFFAOYSA-N 402.495 2.297 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287960 QFLOYOBPLBGSSE-HSZRJFAPSA-N 413.518 2.117 10 20 HECD CC[C@@H](CSC)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807911849 CIEQMACVWSEALU-IBGZPJMESA-N 418.607 2.093 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ncccc2F)C1 807912253 HLCMPQWIXBPGKR-KRWDZBQOSA-N 414.481 2.450 10 20 HECD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1 808489307 LOHNTQZREGJWPE-CYBMUJFWSA-N 401.440 2.141 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)cn1C 808526154 MTNNAQHHWDSPLN-UHFFFAOYSA-N 420.472 2.090 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)n1 815499484 DMUVISYXHFPOHN-UHFFFAOYSA-N 418.519 2.223 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NCc1ccc(OC)cc1O 816550950 JICZNQKYTSMTSO-HSZRJFAPSA-N 423.469 2.406 10 20 HECD C[C@H](Sc1nncn1C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917709581 PLJIJCMUAOEUOE-MCIONIFRSA-N 407.515 2.365 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(S(N)(=O)=O)ccc3Cl)CC2)cc1 918368643 APWMSAJCOGUYJM-UHFFFAOYSA-N 423.922 2.349 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1781071896 LOWZRYBLYKAKFT-CFGAKRJMSA-N 408.882 2.241 10 20 HECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c[nH]1 1818327861 BDLPBSJPMAYVDI-HNNXBMFYSA-N 410.434 2.472 10 20 HECD CCC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1825094510 BDOITOWNWMWLCZ-VIFPVBQESA-N 423.878 2.413 10 20 HECD CC/C=C(\C)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988104 DWRZCPJGYXOPJM-SYZQJQIISA-N 416.522 2.034 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)C1 1841270371 DJTGZQGQRCIWCX-QZTJIDSGSA-N 406.486 2.029 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2ncnn2C)C3)cc1 1845398167 GYIJBJMWJUXXTB-UHFFFAOYSA-N 418.501 2.353 10 20 HECD C[C@@H](NC(=O)NC[C@H](O)COc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 65698474 TYYZWZVVDALQGM-UZLBHIALSA-N 417.481 2.462 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccccc1 303429954 DFNVDQOFGPFYAO-OAHLLOKOSA-N 400.454 2.489 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCSC[C@@H]2c2cnn(C)c2)n(C)c2ccccc12 578341757 ASCCQKQFYBVAHO-LJQANCHMSA-N 411.531 2.153 10 20 HECD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2O1 732478538 GLOBFXYQTDYTNW-QGZVFWFLSA-N 409.486 2.296 10 20 HECD O=C(CC1CCOCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 735251393 UROQPJZPQJIACS-UHFFFAOYSA-N 413.497 2.375 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@@]12CCc1ccccc12 743313044 JEMNBFCRDDIRAW-JTHBVZDNSA-N 410.539 2.442 10 20 HECD C[C@@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)Cc1ccccc1 746694177 PYGUVAABLYBFSM-HNNXBMFYSA-N 405.520 2.404 10 20 HECD CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 750275048 ATOIYKCASALGBM-KRWDZBQOSA-N 415.475 2.191 10 20 HECD CCN(CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 750853148 GGLYXMLNBCILFC-UHFFFAOYSA-N 412.513 2.043 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N(C)C)cc2C)cn1 753521452 FRUUTZVQERAXHO-GDJIYFAZSA-N 403.552 2.293 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1nccs1 754310886 YNILTIQIMNFYND-ZBFHGGJFSA-N 401.536 2.448 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3nnnc3/C=C/c3ccccc3)CC2)cc1 758220867 CGMMVHAXOXXQSC-JYNAJPCDSA-N 420.517 2.035 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccn(CCc4ccncc4)n3)ccc21 759029140 AFZGFOBHQUYSLG-UHFFFAOYSA-N 418.501 2.158 10 20 HECD Cn1nc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 759355659 GIAKWMUKQVDHIY-QGZVFWFLSA-N 420.517 2.274 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N(C)C[C@@H]1COc2ccccc2O1 759594730 IDWKAINFTHOHDW-SLLMGYAOSA-N 413.426 2.341 10 20 HECD COc1cccc(CNS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)c1O 767792830 KHINWERKLFULDY-CYBMUJFWSA-N 411.451 2.434 10 20 HECD COc1cc(O)c(CN2CCCN(Cc3nc([C@@H](C)OC)no3)CC2)cc1OC 768463809 MOCKTMZAVSDLJH-CQSZACIVSA-N 406.483 2.208 10 20 HECD C[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Cl)c(Cl)cc1O 774250050 BAYIZCOWPYHAQM-CHWSQXEVSA-N 402.322 2.283 10 20 HECD NC(=O)c1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 778387978 TXZMAUYUZHPPGK-XFFZJAGNSA-N 421.529 2.190 10 20 HECD COc1c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cccc1C(N)=O 783315944 JAOAAQJSTLYEEZ-UHFFFAOYSA-N 412.490 2.236 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784222576 SYXKNRFHHHGRFQ-AWEZNQCLSA-N 409.435 2.240 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(N2CCOCC2)ccn1 784462737 ZYHTXTDRXXNOKD-UHFFFAOYSA-N 419.865 2.093 10 20 HECD Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296847 JMJNCAKXHKSUHC-ZDUSSCGKSA-N 413.430 2.049 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nccn2CCc2ccccc2)cc1 785421495 DAHQUTJZGNXXAR-UHFFFAOYSA-N 405.502 2.124 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)c3ccccc3Cl)cc2)CC1 787317951 BIHKGNGTSPNBBR-HXUWFJFHSA-N 401.894 2.358 10 20 HECD COCCN(C(=O)CSc1ncc(C(C)(C)C)s1)[C@H]1CCS(=O)(=O)C1 789930120 QRZDUPNPLQAZEH-LBPRGKRZSA-N 406.595 2.195 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1 797531987 BQOCGWYFOVWPGB-HNNXBMFYSA-N 413.474 2.362 10 20 HECD COCCN1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 798213966 YMGWELJDLWZMJF-MRXNPFEDSA-N 421.497 2.053 10 20 HECD CC(C)O[C@@H]1C[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803307124 WEHOKVKKTWODOX-LSTHTHJFSA-N 417.550 2.409 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2ccccc21 803913880 NZQLQNPRGXEWLZ-GOSISDBHSA-N 404.514 2.246 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C3CCN(C)CC3)C2)cc1F 804851427 BSLKNBBSCOKDQN-IBGZPJMESA-N 418.557 2.478 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)C2CCCCC2)CC1)c1ccc(N(C)C)cc1 807675675 ZPMQFJLWEXFEGT-KRWDZBQOSA-N 414.550 2.181 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1COc2ccccc2[C@H]1O 812009394 PDUOQMUXLWXPEK-GHTZIAJQSA-N 415.465 2.081 10 20 HECD CCn1c(O)nnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917185468 ZMLFBBFODPHBPF-STQMWFEESA-N 423.514 2.165 10 20 HECD C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1320397249 CXBBAPHWSXRLLN-KSSFIOAISA-N 424.453 2.203 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)NC=O)C3)cc1 1800514154 SXTXNRGRYCKTRB-BZNRXQDOSA-N 422.529 2.480 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1C[C@]1(F)Cl 1804291676 TVTKIMADEGMJEI-YKHWISPQSA-N 424.856 2.379 10 20 HECD C[C@H](NC(=O)NCCNC(=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 140922570 WGAROHHHPSPDEO-INIZCTEOSA-N 414.481 2.453 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(C)c(C(N)=O)c3)CC2)cc1 727594907 QNQQSXTXWKJDEA-UHFFFAOYSA-N 411.506 2.046 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4cnccn4)n3)cc2)C1 728245343 SLRQZEYOFXQUPJ-HNNXBMFYSA-N 422.514 2.232 10 20 HECD CCS(=O)(=O)N[C@@H](CCSC)C(=O)NCc1ccc(N2CCCCC2)cc1 730537369 JVBJTYMXZJHJBJ-SFHVURJKSA-N 413.609 2.354 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)cc1F 731405802 OJYGVFUPLUVQAY-FQEVSTJZSA-N 421.561 2.414 10 20 HECD COC(=O)CN(CC(=O)Nc1ccc2c(c1)OCCO2)Cc1cc(Cl)ccc1O 732203316 XAEDCSQFJQBTMM-UHFFFAOYSA-N 420.849 2.431 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(OC)ccc3[N+](=O)[O-])CC2)cc1 742917173 SDHPTSWQNBLDKC-UHFFFAOYSA-N 414.462 2.164 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3cc(C(N)=O)c[nH]3)c2C)cc1 750422318 WREUVUFWLOXVDQ-UHFFFAOYSA-N 423.425 2.347 10 20 HECD O=C(COC(=O)CCc1ccncn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 755651004 LMKLRHINYKAGKX-UHFFFAOYSA-N 415.405 2.367 10 20 HECD COC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CCS(=O)(=O)CC1 757036143 YODBYJBWLKKUGL-UHFFFAOYSA-N 422.478 2.083 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(C)n3C3CC3)CC2)cc1 758194317 XEEKGJQCEQVQKN-GOSISDBHSA-N 403.552 2.205 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1Cc1cccnc1N1CCOCC1 760998540 FYLGSPWHWAMLAO-UHFFFAOYSA-N 416.865 2.242 10 20 HECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 761057908 NWCQBRPESAIOLY-NSHDSACASA-N 424.450 2.149 10 20 HECD CCN(CC(=O)N(C)C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764190980 BZECEYXLGWRYSJ-AWEZNQCLSA-N 407.470 2.199 10 20 HECD C[C@@H](Sc1n[nH]c(CO)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767081736 OXSLBUIVEJZIKP-SNVBAGLBSA-N 408.439 2.192 10 20 HECD CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccc4c(c3)CCCN4C)ccc21 767752420 VRAQXQCQJKGVMJ-UHFFFAOYSA-N 401.488 2.475 10 20 HECD NC(=O)COc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768910866 APUICEIBMSKWQK-QGZVFWFLSA-N 417.893 2.304 10 20 HECD Cc1cc(C(=O)N2CCN(c3nccn4cnnc34)[C@@H](C)C2)c(C)n1-c1ccccn1 771659069 OZROECFRJVWRLJ-INIZCTEOSA-N 416.489 2.278 10 20 HECD C[C@@H](NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 773375266 JDIXBEVTGYXJRT-GFCCVEGCSA-N 422.473 2.427 10 20 HECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)ccc21 774363944 ZWVSZBVOEORFIJ-UHFFFAOYSA-N 411.458 2.084 10 20 HECD COc1ccccc1[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N1CCCC1 774919135 POOZWKYTNNYMRJ-NRFANRHFSA-N 424.545 2.331 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(c4cn[nH]c4)CC3)CC2)cc1 778285918 QUNCZGHNLGWEJL-SREVYHEPSA-N 423.517 2.029 10 20 HECD O=[N+]([O-])c1ccc2ncnc(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2c1 782136474 RWEUIIWYFQPSRI-UHFFFAOYSA-N 413.459 2.385 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 788324034 QIAGONAYFWJXAA-UHFFFAOYSA-N 411.502 2.115 10 20 HECD COC(=O)[C@@H]1C[C@H](O)CN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 788604800 VVDSODHDXNIOME-YJBOKZPZSA-N 422.428 2.486 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@@H]21 788920961 SUKGUNGCHFEHJG-IHEQNBGGSA-N 415.509 2.219 10 20 HECD O=C(NCCc1ccn(-c2ccccc2)n1)C(=O)NCc1ccc(N2CCCC2)cc1 788930691 UXVUVNRKPRIWRZ-UHFFFAOYSA-N 417.513 2.448 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3COCCN3C3CCCC3)cc2F)CC1 793455350 CQPLNKZYCRUQEM-JOCHJYFZSA-N 418.557 2.227 10 20 HECD COC(=O)c1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1C(=O)OC 797631425 RBHBVTTXNKLMMO-NSHDSACASA-N 402.403 2.424 10 20 HECD COc1cc(N2CCN(c3nnc(-c4cccnc4)n3C)CC2)cc(OC)c1OC 800767275 VEAZBPHRZVCVQV-UHFFFAOYSA-N 410.478 2.230 10 20 HECD CCCN1CCC(N(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803299653 NEYIQSWBCBPXFD-GOSISDBHSA-N 416.566 2.033 10 20 HECD CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NCc2ccc(N(C)C)cc2)CC1 806324132 ALDFOYZYFHNIHG-INIZCTEOSA-N 410.584 2.344 10 20 HECD C[C@H](NC(=O)C(=O)N1CCO[C@H](COc2ccccc2)C1)c1ccc(N(C)C)cc1 807673487 UMUQTBCWUYXISL-UWJYYQICSA-N 411.502 2.236 10 20 HECD NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1ccc(N3CCOCC3)c(F)c1)CCC2 810211899 XPMNGWCZBJHSTD-HXUWFJFHSA-N 419.522 2.477 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1O 810328347 MGUFEZVCQPGXIT-UHFFFAOYSA-N 406.504 2.229 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C3CC3)C(F)(F)F)CC2)cc1 813837977 CHVKUFJPJPFCHI-CSHXORCISA-N 411.424 2.357 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 917271998 ZAVYHHODKLSVJA-NRFANRHFSA-N 416.449 2.209 10 20 HECD O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969751 YHIWTHHDEVJMAD-FQEVSTJZSA-N 413.449 2.193 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1 920482555 SLEOGYXOZQHUFM-UHFFFAOYSA-N 415.449 2.253 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(-n4cncn4)cc3)CC2)cc1 1122401980 IGLKJWQQJFCNDI-UHFFFAOYSA-N 421.505 2.220 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]4OCCC[C@H]4C3)CC2)cc1 1319263013 QAPOFYVOAKHFOU-SIKLNZKXSA-N 416.566 2.418 10 20 HECD C/C(=C/C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)C(=O)O 1788429332 HLSNGVLRKLCNQF-XFXZXTDPSA-N 411.414 2.271 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3ccncn3)cc2)CCC1)c1cc(O)nc(O)c1 1788696840 FKLWDUPHXVBJHP-UHFFFAOYSA-N 405.414 2.344 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808001249 SHHSHLRQFYPHKJ-LSXYAIFWSA-N 410.474 2.254 10 20 HECD COc1ccc(OCC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 11853473 UEACEXSPUAOKNY-UHFFFAOYSA-N 413.518 2.411 10 20 HECD C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 109190403 RKRLMRDNAWIGGO-HNNXBMFYSA-N 412.446 2.039 10 20 HECD CN(Cc1ccccc1O)C(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1 725886620 ILODJMBAJLZBBC-UHFFFAOYSA-N 406.489 2.260 10 20 HECD COCCN1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726721452 DZNWVHPPJWWUPF-UHFFFAOYSA-N 412.481 2.230 10 20 HECD CCN1C(=O)c2ccc(C(=O)N[C@H](C)c3cc(OC)ccc3O)cc2S1(=O)=O 728981469 AZEQRPPDLGGFCN-LLVKDONJSA-N 404.444 2.056 10 20 HECD COc1cccc(CNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1O 729549653 OZDZXVXPFDAGOH-UHFFFAOYSA-N 422.507 2.039 10 20 HECD COCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 731977357 IZYLYVGCPRXAQT-IBGZPJMESA-N 411.502 2.344 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]1(O)CCN(Cc2ccccc2)C1 733887830 UVVYLMAMZASEFQ-XMMPIXPASA-N 409.530 2.119 10 20 HECD COc1ccc(O)c(CNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1 734015339 HSWIUZWTDQRRSI-UHFFFAOYSA-N 418.515 2.264 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 734405138 DQEXZZZHXWBOCH-UHFFFAOYSA-N 417.531 2.012 10 20 HECD C[C@H](NC(=O)N1CCO[C@@H](C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 746755546 FMYUADKEHMVXAI-QFBILLFUSA-N 419.522 2.336 10 20 HECD CC1(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)OCCO1 759265618 AKWHDDMNBGXWOV-UHFFFAOYSA-N 410.382 2.253 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N(C)C)CC3)cc2F)C[C@@H](C)O1 759978428 VKKKKQDXTBKLGK-WSTZPKSXSA-N 420.573 2.472 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)CC2)cc1 765320162 GEGBYNYDPPUEAH-DENIHFKCSA-N 416.566 2.464 10 20 HECD NC(=O)CCC1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 767773406 BPKJWOVMIZICEQ-UHFFFAOYSA-N 419.481 2.378 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCCS1(=O)=O 773408104 QESUGKLQBBIDCB-WBVHZDCISA-N 400.928 2.094 10 20 HECD CN(Cc1ccncc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774229118 MFLHVXFQCLOGRB-MRXNPFEDSA-N 418.444 2.427 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c(Br)o1 776434376 CSMMLHDFQWDICP-UHFFFAOYSA-N 420.193 2.033 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](n2cncn2)C1 776879538 SUUVWHXNJKLPPC-HOCLYGCPSA-N 415.453 2.328 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)Cc1ccccc1 785528235 OUWKABDSZKJUJE-UHFFFAOYSA-N 406.530 2.317 10 20 HECD CN(C)Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1Br 786312112 QOEFMTJNCYPWJJ-UHFFFAOYSA-N 406.280 2.471 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)[C@@H](C)c3ccc(C)cc3)cc2)CC1 787318410 DOJJVYVMQWVEHM-MBSDFSHPSA-N 409.530 2.444 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1F 789482860 QQXJIABITIZNME-UHFFFAOYSA-N 412.465 2.446 10 20 HECD CCSCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789836708 VPUUOGGEEWQRCQ-GASCZTMLSA-N 411.543 2.315 10 20 HECD C[C@H]1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789836760 WENADCOQZZHHBR-DOTOQJQBSA-N 405.514 2.346 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ncccn2)C1 790254576 KOSLPKGVHUPYQY-IBGZPJMESA-N 424.549 2.065 10 20 HECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 790908298 NKPNGDUPFRTRFT-KRWDZBQOSA-N 411.506 2.169 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nnc(SC)s2)cc1F 804852436 IDVRTXXNCKDORO-UHFFFAOYSA-N 411.528 2.178 10 20 HECD CC1(C)C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(C)(C)O1 806952097 VJKAHURNBCFJQF-WMZOPIPTSA-N 404.507 2.362 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)n(-c2ncccn2)n1 807513277 XNRJOUODIKRRSD-UHFFFAOYSA-N 421.244 2.238 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(Br)cc(F)c3=O)CC2)cc1 809972885 OKXPIDKJZFQZTR-UHFFFAOYSA-N 424.270 2.107 10 20 HECD CSC1(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN(C)CC1 811864034 KITDVKPUCJTBTK-UHFFFAOYSA-N 410.559 2.289 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@]34CCC(=O)N3CCS4)cc2F)C[C@@H](C)O1 917709817 GEQWHTQMDZSQTP-ARGWCVDVSA-N 407.511 2.121 10 20 HECD CN(C)C(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918028377 WGQLAXXTHIGEBE-GOSISDBHSA-N 423.517 2.412 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1ccc(F)c(F)c1 920637329 FNUQVYWPYLUBHQ-VIFPVBQESA-N 414.386 2.226 10 20 HECD COc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@H]43)CC2)cc1 921302282 ZNYSJHPQQGPGCK-WSTZPKSXSA-N 418.563 2.070 10 20 HECD CCn1cc(N2C(=O)/C(=C\c3ccc(OC)c(OCC(N)=O)c3)SC2=S)cn1 1318148756 UKVOSSNHVDLHJW-VIZOYTHASA-N 418.500 2.182 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CO[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 1318924420 UATYXWUEENSCMT-MSOLQXFVSA-N 407.511 2.240 10 20 HECD CNc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 1324945050 MPJABFNSEKGISB-UHFFFAOYSA-N 411.462 2.235 10 20 HECD CCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1800507762 NAZDJISJTHVMDA-YWVIFJGQSA-N 410.898 2.391 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c[nH]1)C1=NN(c2ccccc2)C(=O)C1 1802038865 OSIUNBUJQZRCDT-ACHSLPGTSA-N 423.448 2.199 10 20 HECD CC1=CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CC1 1804333251 KAYAWPBHBJANKD-LVQVYYBASA-N 421.588 2.231 10 20 HECD CN(C)CC(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809167888 SCWSSQAVEUYSNT-UHFFFAOYSA-N 409.914 2.158 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CCOCC2)CC1 1826579170 HPBGXXXUBSVHOY-GOSISDBHSA-N 417.506 2.153 10 20 HECD Cn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827426751 FCFGPWAUBFKQQK-GOSISDBHSA-N 412.490 2.378 10 20 HECD O=C(c1cc(C(F)(F)F)ccn1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250149 PJZFFIVWZGROKD-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(C)n1 1847038218 FLDQUTOXGRCBAR-RMKNXTFCSA-N 423.469 2.346 10 20 HECD CSc1nc(C)c(CCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(=O)[nH]1 9975434 LIXDZIGWYWAPEE-UHFFFAOYSA-N 416.547 2.228 10 20 HECD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437028155 WUUKVQAELRVSCE-HNNXBMFYSA-N 403.504 2.153 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)CC2)cc1 726563374 IULLTSSHFWSUPG-KRWDZBQOSA-N 408.502 2.224 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1 732892824 JXCFJDXQVCONQH-UHFFFAOYSA-N 415.881 2.191 10 20 HECD O=C(NCCCSc1nccs1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 733879116 KLOPKLGHUWHVQU-UHFFFAOYSA-N 423.541 2.362 10 20 HECD CC(C)Oc1cccc([C@@H](O)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 735122120 PUVQAGNGCDBDJT-SFHVURJKSA-N 408.476 2.014 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 736068737 AMSXDACGOQJLDW-UHFFFAOYSA-N 423.878 2.413 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[S@](=O)[C@H](C)[C@@H]3C)cc2F)CC1 737050403 RMAQQHYDSKVPKJ-JMLKKNOCSA-N 410.559 2.019 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc3cc(F)ccc3o2)SC1=S 743282205 JQAFXMRRNSCUIA-MDWZMJQESA-N 400.478 2.322 10 20 HECD COc1cccc(C[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)n2nnnc2C)c1 746805287 PBNXRPTYSRHVDC-HXUWFJFHSA-N 412.469 2.295 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 750861477 GGARCGIZKWPHPJ-UHFFFAOYSA-N 418.515 2.466 10 20 HECD CCOC(=O)N1CCN(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)CC1 751355352 DCEARMSBOQTAOO-UHFFFAOYSA-N 411.524 2.156 10 20 HECD CC(=O)OC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 753185516 UUEVDWPZBGSBPS-IYBDPMFKSA-N 421.513 2.083 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N(C)C)cc2C)cn1 753521453 FRUUTZVQERAXHO-HMILPKGGSA-N 403.552 2.293 10 20 HECD COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 755397656 PVYPHDGIUQMJRH-UHFFFAOYSA-N 412.446 2.202 10 20 HECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NCCCSc1nccs1)C2=O 756991236 YZFNKSKSAWCFGL-STQMWFEESA-N 410.565 2.488 10 20 HECD CCNc1nc(C)c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 759250150 MDUIPQWANHHABF-UHFFFAOYSA-N 403.552 2.444 10 20 HECD COc1cc(N2CCN([C@@H](C)C(=O)N3CCC(C)CC3)CC2)cc(OC)c1OC 759886681 OVLMVPQMWNPPIF-KRWDZBQOSA-N 405.539 2.481 10 20 HECD C[C@H](CC(=O)N1CCCCCC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980898 UULQCOOUFNDVNM-GOSISDBHSA-N 407.580 2.192 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)N(C)C[C@H]3C)cc2F)C[C@@H](C)O1 768769326 FWEYXHITBMUPRI-XWTMOSNGSA-N 406.546 2.080 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)Nc2cc(-n3cnnn3)ccc2Cl)c1 775375642 NZZAPZLCMHHLCX-NSHDSACASA-N 402.842 2.319 10 20 HECD C[C@@H]1C[C@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 776306262 NBRGXQVBIHJANR-SJLPKXTDSA-N 413.497 2.374 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(OCC(F)F)ccn3)cc2)C1 777950091 GHMXVXKHDXGAOI-HNNXBMFYSA-N 418.444 2.357 10 20 HECD NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C/c3ccc(O)c(O)c3)c2)C1 779516039 WIOCMJSRGBAXLU-QRBZPYHOSA-N 409.486 2.125 10 20 HECD Cn1cc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)c(=O)n(C)c1=O 780774199 HXNXPTYRDLXNLC-UHFFFAOYSA-N 414.506 2.062 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4CCCO4)CC3)cc2)C1 784477908 IFUGHKSFBVFCAS-FPOVZHCZSA-N 414.550 2.489 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1N1CCCC1 788311613 XPRLESVKRRGPOS-UHFFFAOYSA-N 422.529 2.056 10 20 HECD CC(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 788882748 ZZSFRGQMDAAWBH-UHFFFAOYSA-N 411.506 2.248 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3C[C@H](C)O)CC2)cc1 791166653 ZVYMWTPBYXCXRY-SFWXYKJNSA-N 415.534 2.052 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccc(Cn4cccn4)c3)ccc21 793816264 ZEMLXBQAOSNLHX-UHFFFAOYSA-N 417.513 2.246 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCC(O)CC3)cc2F)C[C@@H](C)O1 795644726 CCEPDQKSEFKVOK-RCDYEMGKSA-N 422.497 2.150 10 20 HECD C[C@H](NS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1)c1ccc(N2CCOCC2)cc1 798430991 ATGMZLXIQKEVBE-ZDUSSCGKSA-N 423.922 2.315 10 20 HECD C[C@@H]1CCNC(=O)[C@H]1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 799428877 RFFGWHGPKUUCHL-KKTVAQFNSA-N 423.585 2.370 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCOC[C@H]2CCCO2)cc1)C1CCCCC1 803559056 ONJRCFYECQJSGV-OAQYLSRUSA-N 417.550 2.384 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 806164513 VOVCZIKZSQFUEV-INIZCTEOSA-N 415.544 2.496 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(N2CCCC2)nc1 807387246 FROZSXHVVCJTCU-UHFFFAOYSA-N 419.279 2.405 10 20 HECD Fc1cc(CNC(=S)NC2CCC2)ccc1N1CCN(c2ncccn2)CC1 814195148 JWEBUJGBHRRFSF-UHFFFAOYSA-N 400.527 2.459 10 20 HECD O=C(Nc1ccc2nccnc2c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918297925 VBYZLGRYPYMWIV-QGZVFWFLSA-N 406.442 2.482 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cc3)cc2)C1 918463027 GVCJDUXLMOLNLW-OAHLLOKOSA-N 414.893 2.297 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 918463188 IGPXOAXKQVVNNA-MRXNPFEDSA-N 412.465 2.091 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(CC(C)C)c1CC 1320519825 NHYYLHPACCPEKD-INIZCTEOSA-N 403.479 2.417 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3nc(-c4ccccc4)oc3=O)CC2)cc1 1323193336 OPBJYFLDUSLRAH-UHFFFAOYSA-N 408.458 2.251 10 20 HECD O=C(/C=C/C1CC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003146 DBXVMELJVGVYBZ-YADGQWAMSA-N 406.866 2.161 10 20 HECD O=C(Cc1ccc2c(c1)CCC2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598921 LLSLMKIMJXHFBN-ACDBMABISA-N 421.497 2.476 10 20 HECD Cc1[nH]ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1797128070 IBCJLZKFZSQMMX-VBUUOAMHSA-N 419.485 2.368 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)o1 1843441176 QLDXETOOMXIVNZ-UHFFFAOYSA-N 406.442 2.198 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(CN2C(=O)CCC2=O)cc1 10907430 QKXWXGCDRIBIOF-UHFFFAOYSA-N 421.497 2.444 10 20 HECD Cc1onc(-c2cccnc2)c1C(=O)N1CCc2ccc(S(=O)(=O)N(C)C)cc21 512960411 AVBWQRFYCPLUKB-UHFFFAOYSA-N 412.471 2.498 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1 726186269 CAHLDWCFFRPZOX-IBGZPJMESA-N 413.497 2.404 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cc(-n2cnnn2)ccc1F 728119857 USCVTEXCFWGSJD-UHFFFAOYSA-N 415.404 2.099 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCN3CCC[C@H](C)C3)cc2F)CC1 730116436 CSEPCQLCYYZLOT-SFHVURJKSA-N 405.562 2.499 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccnc3-n3cccn3)cc2F)CC1 730192484 BMQLSFQFDMODRY-UHFFFAOYSA-N 408.481 2.478 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCc3nc(C4CC4)no3)cc2)C1 739701630 WJQOWCFMPYYLJP-KRWDZBQOSA-N 411.506 2.288 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(Cl)nc3)CC2)cc1 743363968 YVVHQOGAQRJPRB-UHFFFAOYSA-N 403.914 2.365 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCCN1CCC[C@@H](C(N)=O)C1 745831992 ZAZVJYSVTAFFSJ-HXUWFJFHSA-N 415.582 2.406 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3csc(N(C)C)n3)cc2F)CC1 747507815 NDSJAMAGMSUWRN-UHFFFAOYSA-N 420.558 2.490 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 751271356 UCCKNSGXCKVUSM-UHFFFAOYSA-N 405.841 2.421 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccccc2CN2CCOCC2)c(OC)c1 752123476 CNGWRZPIAGAUQO-UHFFFAOYSA-N 413.518 2.289 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](c4cccs4)C3=O)CC2)cc1 761183805 KKQIYDIWXBMPDO-SFHVURJKSA-N 400.504 2.172 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccn(Cc2ccncc2)n1 768017441 ZYMBFTKRFFWUQY-UHFFFAOYSA-N 404.474 2.182 10 20 HECD CN(C)CCNC(=O)C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769160478 HFDRCVIOISXXSU-UHFFFAOYSA-N 417.554 2.475 10 20 HECD CO[C@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 769884889 DDBOCPNWVBAHFG-IBGZPJMESA-N 401.486 2.230 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)CC2)cc1 774498291 MQJPLHWXDJCNLI-UHFFFAOYSA-N 416.566 2.159 10 20 HECD CCn1cc(-c2n[nH]cc2C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 778871692 OGLRZXZOXRHNOQ-UHFFFAOYSA-N 408.506 2.432 10 20 HECD Cn1cnc(-c2ccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2)n1 779855565 WCNDARXYBGLHFC-LJQANCHMSA-N 418.501 2.114 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786121222 FCYKSFOVFIWTEW-UHFFFAOYSA-N 415.515 2.036 10 20 HECD CN(C)c1ncccc1CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 787631411 LHONYKMNSPFYHN-UHFFFAOYSA-N 408.458 2.291 10 20 HECD CCS[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324612 WLUGDAASRMFTGQ-OALUTQOASA-N 405.564 2.320 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1 788951295 PGOFWOOKNSCILB-UHFFFAOYSA-N 424.545 2.210 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(C)ccc3OC)CC2)cc1 789373527 YJMJNEVWPMULBN-UHFFFAOYSA-N 411.502 2.414 10 20 HECD CC1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCS1 789801822 VKMMEWNLTXGRCX-UHFFFAOYSA-N 409.527 2.023 10 20 HECD CSCCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789827446 SRLPEWCBSDBMTM-GASCZTMLSA-N 411.543 2.267 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)c4ccccc43)CC2)cc1 790113552 VEWSJFFKDUYGFS-LJQANCHMSA-N 400.500 2.305 10 20 HECD CC[C@H](C)NC(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 793663155 DHRNUHBIZQUSEG-KRWDZBQOSA-N 416.566 2.493 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)c3ccc(S(C)(=O)=O)nc3)cc2)CC1 795102558 XVVRKUIKLBWCAU-UHFFFAOYSA-N 423.560 2.200 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 797611424 QIPLNFWLIXYQAB-CYBMUJFWSA-N 405.476 2.390 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)NCCCn1nc2n(c1=O)CCCC2 802004065 FAPAUGIGHWLRGH-UHFFFAOYSA-N 401.511 2.489 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1F 802554473 YMAFLPXEOBKPGU-VIFPVBQESA-N 408.357 2.282 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H]1c1ccncc1)c1ccc(N2CCOCC2)cc1 803300626 VBGZRNATNQPNGX-UTKZUKDTSA-N 408.502 2.459 10 20 HECD Cc1csc([C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 803304066 COKCJRDWPMJXEK-ZBFHGGJFSA-N 416.547 2.385 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F 808113917 LYQWGPUMEBYPMR-UHFFFAOYSA-N 409.844 2.398 10 20 HECD COCC[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 813042164 HGIAGBSBWVHYKL-XYJFISCASA-N 409.502 2.386 10 20 HECD C[C@H](CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](C)CO)c1ccccc1 813672214 XIHLUSPGTTVDTB-CABCVRRESA-N 406.504 2.390 10 20 HECD CC(C)CN1C(=O)/C(=C/NNc2ncnc3c2oc2ccccc23)C(=O)NC1=S 814317914 SPNHGHBTAARLRH-KPKJPENVSA-N 410.459 2.076 10 20 HECD COCCn1nnc2c1CCN(Cc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)C2 816636674 DVJOVOGAYILAIY-UHFFFAOYSA-N 400.483 2.381 10 20 HECD O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)N1CCN(c2cnccn2)CC1 915217207 PKFBXFOXERMSBL-UHFFFAOYSA-N 421.423 2.477 10 20 HECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)c1O 915811641 LWUQUCHUZFRBIU-UHFFFAOYSA-N 412.458 2.494 10 20 HECD CC(C)n1nnnc1SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917200958 VWFKKKNGGQAGMW-ZIAGYGMSSA-N 422.530 2.415 10 20 HECD CCOC(=O)c1[nH]c(C)c(C(=O)N[C@@H](Cc2ccc(O)c(O)c2)C(=O)OCC)c1C 1320387449 UTUCCCDBEJLLEW-AWEZNQCLSA-N 418.446 2.124 10 20 HECD CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)no1 1795306832 GVRBBGRQUXYETC-BTTYYORXSA-N 400.435 2.170 10 20 HECD O=C(/C=C/C1CC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1803183269 KIHILQPESBBBFT-KYNLDRKZSA-N 408.458 2.174 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc3cnccc3c2)C1 1843731543 GRKDZZFLSRGSCI-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(CCC(F)(F)F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039222 TWEBVVJHPYCRTG-HWKANZROSA-N 414.380 2.363 10 20 HECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN2CCCc3cc(OC)ccc32)C1=O 28623656 NHAJPFCKDMBPLC-QHCPKHFHSA-N 422.485 2.336 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CC[C@H](C(F)(F)F)NC1=O 195683682 LFCRQUZLFCUGGL-LSDHHAIUSA-N 401.454 2.313 10 20 HECD COc1ccc([C@H](CNCc2cc([N+](=O)[O-])ccc2O)N2CCOCC2)cc1OC 725842034 XYKLPBUXJGEACP-SFHVURJKSA-N 417.462 2.481 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCN1C(=O)Cc2ccccc21 725874813 JPAQULGTXGFRTB-UHFFFAOYSA-N 408.502 2.254 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CN(C)C(=O)OC(C)(C)C)CC2)cc1 727753394 QAYZSCNXEUFPAK-UHFFFAOYSA-N 420.554 2.190 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)c1ccccc1 732757019 FAYUJYABBLORFJ-KRWDZBQOSA-N 414.527 2.447 10 20 HECD COc1ccc(O)c(CNC(=O)NCCNC(=O)c2cccc(Br)c2)c1 734069990 VYHJDYBOZLFJMV-UHFFFAOYSA-N 422.279 2.393 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]4CC[C@@H](C3)N4C)CC2)cc1 745348102 BIDQKPNCLQHYGV-CTNGQTDRSA-N 415.582 2.085 10 20 HECD C[C@H](NC(=O)N(CCO)CCOCC(F)(F)F)c1ccc(N2CCOCC2)cc1 745779817 QMILRRZVFKOGLV-HNNXBMFYSA-N 419.444 2.167 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1 745977888 DWFIOGZOMPTSDM-UHFFFAOYSA-N 402.425 2.086 10 20 HECD CCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C)c1ccc(OC)cc1 746108999 HHXRAHKVLOBVOD-AWEZNQCLSA-N 403.504 2.147 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(C)(C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 748961338 RLJSSLLGVPRMOJ-ZIAGYGMSSA-N 415.531 2.062 10 20 HECD CC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCOCC3)cc2)=NN1c1ccccc1 750866475 GFGRBDPQODJRCX-JOCHJYFZSA-N 406.486 2.363 10 20 HECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 752809950 ZZZCLJJCTPIDSR-VDGAXYAQSA-N 413.518 2.045 10 20 HECD CCNC(=O)C1(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CCC1 753310345 JKWIXUYNTPCJFD-UHFFFAOYSA-N 419.545 2.073 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)[C@@H](C)CS(C)(=O)=O)c2C)cc1 754653218 POPAFAROXGOVEN-HNNXBMFYSA-N 420.531 2.428 10 20 HECD COC(=O)c1cc(F)ccc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 758300788 RGSSCQICDRGAJB-AWEZNQCLSA-N 422.478 2.488 10 20 HECD COc1cc(N2CCN(C(=O)c3cnn(C)c3C3CC3)CC2)cc(OC)c1OC 759223671 UFALVIDLRBLNQZ-UHFFFAOYSA-N 400.479 2.286 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCN(c2ccccc2F)CC1 759593009 IBGJULMLRXZBKC-SOFGYWHQSA-N 400.406 2.142 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)NC(=O)C3CCCC3)CC2)cc(OC)c1OC 760084663 ORVQAXMBHZENLR-HNNXBMFYSA-N 419.522 2.056 10 20 HECD COC(=O)Cc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772874533 DTFDEUYPLGDASE-UHFFFAOYSA-N 416.449 2.073 10 20 HECD Cc1csc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 774146894 MDOIHZPULCKQRW-ZIAGYGMSSA-N 420.510 2.137 10 20 HECD CCOc1ncccc1NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778234103 JYFPYKAJACIYLF-KHPPLWFESA-N 410.474 2.332 10 20 HECD COCc1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 778612082 ROSYUNNHHQJFTM-QGZVFWFLSA-N 417.531 2.013 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c[nH]c4cccc(OC)c34)nc12 778867677 PCGJZBZZKMSDDO-UHFFFAOYSA-N 424.413 2.387 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cccc1N1CCOC1=O 785293998 ISPDWWOYEPABGH-GFCCVEGCSA-N 413.430 2.049 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CN3CCCCCC3)CC2)cc1 785422075 HGWIQMNLUMALCA-UHFFFAOYSA-N 400.567 2.483 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCNC(=O)c1ccc(C)c(F)c1 786656924 OXJAVPQOYAZEOX-UHFFFAOYSA-N 415.465 2.125 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C2 786674928 SBQHUVSMCZOPHL-GOSISDBHSA-N 407.518 2.016 10 20 HECD CCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323984 OORUGMBLFGATQW-UHFFFAOYSA-N 411.502 2.163 10 20 HECD CCc1nc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)sc1C 789379244 VPJIQMJCHVSHGU-UHFFFAOYSA-N 420.510 2.369 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1C(N)=O 789434769 GMBGNMPERGVWQZ-UHFFFAOYSA-N 416.453 2.033 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)S[C@@H](C)C3)cc2F)C[C@@H](C)O1 789828967 ZQQHGYSQPCTYKG-FZKCQIBNSA-N 423.554 2.408 10 20 HECD CSCC[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840155 FTLDYLOWCRKQJQ-CQSZACIVSA-N 411.543 2.003 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCC[C@@H]1c1ncc[nH]1 789859360 CDHUCASCLFDHGO-GOSISDBHSA-N 413.547 2.333 10 20 HECD COCc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 795761378 PFYXKQDHYQTQAT-UHFFFAOYSA-N 406.504 2.361 10 20 HECD O=S1(=O)C=C[C@H](N(c2ccccc2)S(=O)(=O)c2cccc3nsnc23)C1 799185970 VNKFNNCIWTZXQX-ZDUSSCGKSA-N 407.498 2.197 10 20 HECD CC(C)O[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803307126 WEHOKVKKTWODOX-PWIZWCRZSA-N 417.550 2.409 10 20 HECD CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2cc(OC)c(OC)cc2O)CC1 809786074 ODADWBNXZYIMAD-AWEZNQCLSA-N 400.541 2.291 10 20 HECD CN(C/C=C/C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CC(F)(F)F 814588853 XQACVOXNSYTGKM-LLCTXKFZSA-N 412.456 2.055 10 20 HECD C[C@@H]1[C@H](N(C)C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816767491 ZVJMAHOMDIMHOQ-IUODEOHRSA-N 409.533 2.419 10 20 HECD CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 816922107 RBLXJELNCZOYNM-QFBILLFUSA-N 410.536 2.006 10 20 HECD C[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)Nc1ncccn1 913223987 HRMUZDVJFBFJMN-NSHDSACASA-N 416.393 2.018 10 20 HECD CCOC(=O)N1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918220203 ICLLBUANXRLVJD-HZPDHXFCSA-N 422.501 2.423 10 20 HECD CCS(=O)(=O)c1cccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 1116090023 APUWYWSRVSFRDH-UHFFFAOYSA-N 417.531 2.250 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 1116741850 XKCWVDGZFCYZRW-UHFFFAOYSA-N 419.459 2.460 10 20 HECD CC(C)[C@]1(CO)CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 1324148645 XFWMKIPGIHZOEM-IEGUWTFLSA-N 421.557 2.396 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnc(OC2CCC2)c1 1331196372 MHBBJXWIZKOEIK-UHFFFAOYSA-N 415.515 2.178 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1=CCCC1 1806213143 IMYJMWZGVZLHEN-OXQOHEQNSA-N 408.458 2.318 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)n1cccc1 1843442455 NYKCHHKSMMSDCO-QGZVFWFLSA-N 419.485 2.045 10 20 HECD Cc1cc(O)c(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1C 28940937 IDLQVTJFZQSYEG-UHFFFAOYSA-N 405.476 2.424 10 20 HECD CCN(CCNC(=O)C(=O)NCc1c(C)c2ccccc2n1C)CCC(F)(F)F 568131893 WGZQDBVTLWHAPB-UHFFFAOYSA-N 412.456 2.493 10 20 HECD Cc1ccc(C(=O)N2CCOCC2)cc1NS(=O)(=O)c1cccc2nsnc12 605653766 LINMRMQQXRLQIX-UHFFFAOYSA-N 418.500 2.273 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H](N4CCCC4=O)C3)CC2)cc1 732459382 PWOUBYSASLUEHB-IBGZPJMESA-N 400.523 2.460 10 20 HECD C[C@@H]1CCCC[C@@H]1OCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 733567994 JLXAORZHBBYYMM-UZLBHIALSA-N 422.497 2.417 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(N(C)C)CCOCC3)cc2F)C[C@H](C)O1 733847733 HLYMZWBZVUCHDU-IRXDYDNUSA-N 422.545 2.349 10 20 HECD Cc1ccc(NC(=O)CN(C)C(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 741735128 HMSFGKXKXLSASB-UHFFFAOYSA-N 424.545 2.361 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCc3nc4ccccc4[nH]3)CC2)cc1 742927753 YUBLJIPAUNHJGL-UHFFFAOYSA-N 407.518 2.443 10 20 HECD O=C(NCCCn1ccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748014936 YWCDLOXLJIQPKP-UHFFFAOYSA-N 406.489 2.271 10 20 HECD COc1ccc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 749176338 SISPYHNAJJLJLC-GOSISDBHSA-N 411.506 2.134 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc([N+](=O)[O-])ccc1O 756573498 KEWPEKMROZOJNW-CQSZACIVSA-N 405.476 2.386 10 20 HECD CNC(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 756685345 QEOSEVNRAFJVQQ-DAYGRLMNSA-N 408.518 2.399 10 20 HECD NC(=O)c1cc(CNCc2cc(Br)cc(Br)c2O)on1 757907187 TVIKWJNPJWGENV-UHFFFAOYSA-N 405.046 2.294 10 20 HECD COc1cc(N2CCN(C(=O)CCCn3ccccc3=O)CC2)cc(OC)c1OC 759221306 OXLZWJBCHCVTFP-UHFFFAOYSA-N 415.490 2.003 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)CN(CCc4ccccc4)C3=O)cc2)C1 761118628 IEOXWJXMYRCSTF-FQEVSTJZSA-N 420.513 2.395 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2c(c1)COC2 768944114 XXKVSVDRVYNXOB-UHFFFAOYSA-N 409.486 2.180 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc([N+](=O)[O-])cnc1O 771054995 AWLIEKTVJBGITP-CYBMUJFWSA-N 406.826 2.449 10 20 HECD CCN(Cc1ccc2c(c1)OCCO2)C(=O)COC(=O)c1ccc(C)c(O)c1O 773410276 WIYCNMOGWRSTGO-UHFFFAOYSA-N 401.415 2.383 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(N2CCOCC2)cc1 774778794 FIPPOVMGAZTBBI-AVRDEDQJSA-N 424.545 2.120 10 20 HECD C[C@@H](NC(=O)N1CCC(C(=O)N2CCN(C)CC2)CC1)c1ccc(N(C)C)cc1 776242771 BBXFRJOLDBSIQJ-QGZVFWFLSA-N 401.555 2.009 10 20 HECD COC(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)on1 777796883 HSKUZOKWXNQGOH-UHFFFAOYSA-N 413.352 2.247 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 779481678 QZCIEGHUUGVTMS-CLFYSBASSA-N 416.499 2.328 10 20 HECD CCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 781277087 VQRFXWXDJBFYNG-UHFFFAOYSA-N 415.515 2.401 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(OCC(F)(F)F)nc1 787277801 MGSKHNOQBUITMP-UHFFFAOYSA-N 424.423 2.364 10 20 HECD CCCCN(CCOC)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789820363 PYYVXNKQHMRTSG-IRXDYDNUSA-N 423.529 2.331 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4ccc(F)nc4)CC3)nc12 792384916 LGWJTEHGWVMYAB-UHFFFAOYSA-N 415.425 2.189 10 20 HECD Cc1nn(CCS(C)(=O)=O)c(C)c1CN(Cc1ccccc1O)C[C@H]1CCCO1 797972053 KIUAKQZIROFAEH-LJQANCHMSA-N 421.563 2.431 10 20 HECD CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCO1 802684867 DXBIWHNXRMXORV-HXUWFJFHSA-N 415.538 2.467 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)O2 806706273 IBRVWEANAUFSHB-ABWCKGHESA-N 403.523 2.368 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N(CCO)[C@@H]1CCc2ccccc21 807292174 NJRKMHZXLNZATK-JOCHJYFZSA-N 405.498 2.187 10 20 HECD C[C@H](NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807677427 OPYIHIVMUMRLMR-AWEZNQCLSA-N 414.472 2.320 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 807749546 VJDDHTBKFQXPPS-GHTZIAJQSA-N 408.546 2.490 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 808224286 RJHQMZNZTMTLGA-HXUWFJFHSA-N 423.513 2.438 10 20 HECD C[C@@H](c1ccccc1)[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 813589550 CFNFIYFALCAYAB-YWZLYKJASA-N 414.481 2.119 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2Cn2cncn2)cc1 918433893 IVGYXCAKKSINCR-UHFFFAOYSA-N 406.490 2.428 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)cc1 919722663 PFLUMHMEGCRDIQ-UHFFFAOYSA-N 406.460 2.043 10 20 HECD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)nc1 1794362345 QHDACULYEGDJTF-BCDXTJNWSA-N 410.474 2.081 10 20 HECD CC(C)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727972 DGZBHLXROCYHDN-MJRJWQSSSA-N 402.476 2.387 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1 1828375737 YPBBBTYMJHMLOT-GJZGRUSLSA-N 409.433 2.381 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cccc(Cl)c2)C1 1844904351 HDZDNUCKANGHGC-UHFFFAOYSA-N 423.947 2.017 10 20 HECD Cc1noc(C)c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500777 NSOWXZXIKZFHDE-UHFFFAOYSA-N 405.838 2.487 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccs1 740472861 FLZVMDVRAMYXKN-HRAATJIYSA-N 416.547 2.157 10 20 HECD O=C(CNC(=O)NCc1ccco1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800388 JQVQPRUIMLTCMY-CQSZACIVSA-N 422.432 2.465 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC(C(=O)NCC(F)(F)F)CC2)cc1F 746975738 NNXYVBABRVPMAP-UHFFFAOYSA-N 404.408 2.492 10 20 HECD C[C@H](NC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 748532520 FVCYFWVFNBQLCX-WNSKOXEYSA-N 422.485 2.069 10 20 HECD O=C(CCn1nc(O)c2ccccc2c1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751295293 YCODYYFQZNVNQI-QGZVFWFLSA-N 423.469 2.406 10 20 HECD COc1ccc(N(C)CC(=O)NCC2(N3CCOCC3)CCCCC2)c(OC)c1 752116992 ZVQQONSRQKZVMX-UHFFFAOYSA-N 405.539 2.291 10 20 HECD COC(=O)[C@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 755131880 PNSDRWTWAZHXTL-OAQYLSRUSA-N 403.523 2.055 10 20 HECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2ccc3c(c2)CCCN3C)cc1 759378580 ILELDBVYHXISBE-UHFFFAOYSA-N 401.532 2.226 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NC(=O)NC12CC3CC(CC(C3)C1)C2 759588077 HNIYNDVYOFYIRX-DUXPYHPUSA-N 414.458 2.449 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3cc(C)cn(C)c3=O)CC2)cc1 766195794 SOIQLVKYYZLNLQ-UHFFFAOYSA-N 413.522 2.036 10 20 HECD O=S(=O)(NCc1cccc(Br)c1O)c1cccc2c1OCCO2 766200837 ONTCHFMYPNTNPC-UHFFFAOYSA-N 400.250 2.404 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O 766810014 MBTHXNNMBWFOEH-UHFFFAOYSA-N 411.911 2.057 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1O 769506956 CZJIYTFPUQALQK-UHFFFAOYSA-N 418.393 2.014 10 20 HECD CN(CC(=O)NCCc1ccc(O)c(O)c1)C(=O)c1ccc(Br)s1 770624129 BZJPMQCXKWPNPJ-UHFFFAOYSA-N 413.293 2.353 10 20 HECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1F 774274096 YFSIEAYZEGZMHU-MUUNZHRXSA-N 401.463 2.194 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CO)c3ccccc3)cc2F)C[C@@H](C)O1 782053642 TZHQNEWOOKRSPA-FVJLSDCUSA-N 415.509 2.379 10 20 HECD Cc1cc(-c2nnc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)o2)c(C)o1 783150035 AJAKFMIGHZJUIO-UHFFFAOYSA-N 407.404 2.381 10 20 HECD O=S(=O)(NCc1ccccc1O)c1cccc(S(=O)(=O)N2CCCCCC2)c1 790850835 CTKSIPIMQLDFKC-UHFFFAOYSA-N 424.544 2.435 10 20 HECD CCC(CC)CN(CC)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793733294 LYNAXQPHKWZRFB-IBGZPJMESA-N 416.566 2.289 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@H]1c1ccc(F)cc1 798277970 VCSCEGQTBAWURA-VQTJNVASSA-N 402.491 2.480 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCNS(=O)(=O)c2ccc(F)cc2F)c1 799725428 GWVQNUVEQWLJLT-LLVKDONJSA-N 414.430 2.086 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385949 WUSBTNFVXUMFBS-UHFFFAOYSA-N 413.249 2.258 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](COC)C(C)C 807451253 QAVPLASHVLEHHO-AWEZNQCLSA-N 401.301 2.290 10 20 HECD C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 813636673 CALGGWOMRCBZJP-LBPRGKRZSA-N 419.507 2.230 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C)c4nccn4c3)CC2)cc1 818045965 XAPFLEVKSNNXTB-FPLPWBNLSA-N 419.485 2.495 10 20 HECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 915778223 HLCCZSIDFSZRGV-UHFFFAOYSA-N 404.474 2.337 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](CO)Cc1ccccc1 918208758 RBAUBSDELZXJOX-IBGZPJMESA-N 415.509 2.437 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnc4n[nH]c(C)c4c3)CC2)cc1 918210161 SOLXGZPLBHRETN-UHFFFAOYSA-N 408.506 2.217 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(Cc2ccncc2)CC1 918225018 ZVRWYXKWAIWSSC-UHFFFAOYSA-N 413.497 2.085 10 20 HECD Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918372820 QEYDXORBYWXGOS-IBGZPJMESA-N 422.529 2.051 10 20 HECD COCCN1C(=O)/C(=C/Nc2ccc(OCc3ccccc3)cc2)C(=O)NC1=S 920976076 FXPZQRBAIBJPLX-QGOAFFKASA-N 411.483 2.451 10 20 HECD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C)n1 1796602453 KALATDJEEFDGHE-REPLKXPHSA-N 424.501 2.389 10 20 HECD COc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799016485 TULPWBYSYGFKRJ-CLLJXQQHSA-N 403.460 2.129 10 20 HECD CC(=O)NCCC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845399359 TUFSZPDSOSRTPY-UHFFFAOYSA-N 422.529 2.437 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Cl)c(N)c3)CC2)cc1 3555539 XVSKVMPSAZLPKZ-UHFFFAOYSA-N 403.866 2.436 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(=O)[nH]c4ccccc34)CC2)cc1 24088793 AFCIXCKXDGVRMS-UHFFFAOYSA-N 420.513 2.479 10 20 HECD CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 27213780 CWZUMDWGGKCBLF-STZFKDTASA-N 409.486 2.431 10 20 HECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)nn1 472807539 IPSMILRHJROQTE-UHFFFAOYSA-N 417.473 2.334 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1F 729853576 BHCKUSIISXGPCP-INIZCTEOSA-N 405.495 2.314 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](C4OCCO4)C3)cc2F)CC1 730134064 LYIVOSHRTIGTAM-GOSISDBHSA-N 420.529 2.262 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 734065852 JZJWMAZCZLSKDY-JOCHJYFZSA-N 401.482 2.494 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n(C)n1 737159302 WNZMCDZUINQRIX-INIZCTEOSA-N 413.522 2.271 10 20 HECD COCCNS(=O)(=O)c1ccc(NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 743213418 ZKGKCNLQSUBNQF-CYBMUJFWSA-N 423.491 2.208 10 20 HECD Cc1nsc(N2CCCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)n1 743560495 SYLPACCRBITVBD-UHFFFAOYSA-N 416.551 2.105 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc(C(=O)OC)cc3)cs2)cn1 747750988 GPDUNINBNOFVRI-UHFFFAOYSA-N 422.488 2.240 10 20 HECD CN1CCCc2cc(CNC(=O)CNS(=O)(=O)c3ccc(Cl)s3)ccc21 749849553 AFERLTLMSLGKHP-UHFFFAOYSA-N 413.952 2.379 10 20 HECD COC(=O)c1c(C)cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 751013310 FTKGALOABKNNPI-UHFFFAOYSA-N 422.478 2.236 10 20 HECD C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(C)C1CC1 751060321 JZCLPZPYXAPNJJ-LBPRGKRZSA-N 409.533 2.467 10 20 HECD CC1(C)NC(=O)N(CCCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 751294411 NJVCWYITAYPXNY-MRXNPFEDSA-N 403.479 2.010 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)N(C)Cc1ccccc1O 753834611 MBGOHHIHJYEPBK-XTBFLFJDSA-N 410.392 2.336 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccccc3-c3nnco3)CC2)cc1 758230124 GVZQUCRXWKASOJ-SFHVURJKSA-N 410.474 2.307 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCNC(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 761217473 XDGBBROEJJIHAX-OAHLLOKOSA-N 412.442 2.117 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cc1 768010096 WTQKMGPITPOEDH-UHFFFAOYSA-N 408.462 2.124 10 20 HECD O=C(Cc1cccc(F)c1)N1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768462738 CPJGBOBDXBLZQN-FQEVSTJZSA-N 400.450 2.234 10 20 HECD CCC[C@]1(CO)CCCN1C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 768975229 LJTCOWKAKZUTEP-DJYGDJEFSA-N 415.534 2.054 10 20 HECD COc1ccc(N2C[C@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)c(OC)c1 773741767 XRUVKSKUOCVKRO-UKRRQHHQSA-N 414.458 2.215 10 20 HECD COC(=O)CCN1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H](C)C1 774683571 PGUFCMRNRPQCMJ-QGZVFWFLSA-N 420.579 2.019 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1O 775023936 OFNHWVOWZXBIOH-ROUUACIJSA-N 401.463 2.282 10 20 HECD C[C@@](O)(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 777747529 FCPFYGYOLOTDQP-YADARESESA-N 424.545 2.485 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl 778917093 WBAJSNQZBWLNBI-UHFFFAOYSA-N 410.879 2.466 10 20 HECD NC(=O)[C@@H]1CCCC[C@@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782539512 KPZKDDUOJDMOTB-WBVHZDCISA-N 405.454 2.034 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1c(C)c(C)nn1C 785193369 XZFVMNKRBKZVEE-UHFFFAOYSA-N 409.284 2.492 10 20 HECD CC[C@@H]1Oc2cc([C@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)cc3)ccc2NC1=O 785438346 CLUZPONBCBQOIV-LIRRHRJNSA-N 424.501 2.356 10 20 HECD O=C(NCc1ccc(F)cc1F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786981974 SUHOXWBSQPVTLF-KRWDZBQOSA-N 404.413 2.494 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCCO1 789825647 NIRJXRCJNADYLM-JZXOWHBKSA-N 421.513 2.083 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC[C@H]1C 789840478 JHVUYKIUFZNCFM-VYDXJSESSA-N 405.514 2.344 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(C(=O)O)c(C)c3)c2)CC1 795350503 PJMVPYPIEKFDAT-UHFFFAOYSA-N 417.487 2.163 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccccc4O[C@H](C)C3)CC2)cc1 795411086 AGZNXNGNINADED-DENIHFKCSA-N 411.546 2.461 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccccc2O)c(Br)c1 801691932 XVAVDZYPJWVTSR-UHFFFAOYSA-N 420.306 2.037 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C)c2ccccc2C1)c1ccc(N2CCOCC2)cc1 803307393 CZTUGUTWHXNKSF-SFHVURJKSA-N 422.529 2.179 10 20 HECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 803978269 PDOYEPHREOEHAB-SFHVURJKSA-N 404.514 2.246 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@H](CC(C)C)C3)CC2)cc1 804314954 CZDQJLOJUUTXEX-WIYYLYMNSA-N 417.550 2.490 10 20 HECD CCCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804853477 QODFVNOMOJDIBY-SFHVURJKSA-N 406.546 2.478 10 20 HECD COCCOC1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 805023793 AXPCHDTUCYDYPB-UHFFFAOYSA-N 417.550 2.193 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCCc4nc(C)ncc43)CC2)cc1 806237247 PVBPTLHDLWUDOS-OAQYLSRUSA-N 423.517 2.026 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc21 807387630 PYABUNCTZTUFPC-UHFFFAOYSA-N 403.236 2.296 10 20 HECD Cc1cc(Br)cc(CN[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)c1O 809693501 WDKHQVSMJMHKHJ-LLVKDONJSA-N 419.263 2.375 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]1[C@@H]1CCCO1 812010196 MXZAKRYJYJRGDO-IHPCNDPISA-N 414.550 2.487 10 20 HECD CN(C)CCn1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 857457087 JTNJAIZYUGHEIF-OAHLLOKOSA-N 407.465 2.445 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCC4)C3)cc2)C1 918122417 KRHMKKZSPLLHNA-PZJWPPBQSA-N 413.566 2.158 10 20 HECD O=C(NCCc1cn2ccccc2n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918201165 GAKQGZUECLUAEJ-UHFFFAOYSA-N 411.481 2.476 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 918444106 LLSRRYIJFUCLCX-UHFFFAOYSA-N 419.503 2.018 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cncnc3)CCC2)cc1)c1cc(O)nc(O)c1 1788426351 HAGBXYSQURBSNY-UHFFFAOYSA-N 405.414 2.344 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)COC2)c1cc(O)nc(O)c1 1797539228 JSNBOEYZQWAOGL-BCDXTJNWSA-N 409.442 2.089 10 20 HECD O=C(CCc1ccc[nH]1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817530689 YAANDGXUFRHSFK-INIZCTEOSA-N 424.461 2.483 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3csc(N4CCCC4=O)n3)CC2)cc1 8138939 HRLJLHYIYRHKCU-UHFFFAOYSA-N 400.504 2.170 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)NC2(CCCC2)C1=O 726526057 BIFOZXUCXJHMEA-HNNXBMFYSA-N 416.547 2.109 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccnc1N1CCC(C(N)=O)CC1 729231497 XEOAPHABTBIEKW-UHFFFAOYSA-N 424.549 2.191 10 20 HECD O=C(NCCCc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 729523560 QJTSSMKPCBKKOR-UHFFFAOYSA-N 413.493 2.152 10 20 HECD CNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 729579702 ONZBSEHQTBRGOM-UHFFFAOYSA-N 416.453 2.109 10 20 HECD O=C(Nc1ccnc2ccnn12)/C(=C/C1=S=CC=C1)n1nnnc1-c1ccccc1 731169058 UEMWJFKCHHXTGB-SSZFMOIBSA-N 414.454 2.140 10 20 HECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NCc2ccc(N(C)C)c(F)c2)c1 731436370 ZPPLPFDBFVMCSY-UHFFFAOYSA-N 422.482 2.152 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 743195721 ZIZPXMWEWDURFI-UHFFFAOYSA-N 423.477 2.470 10 20 HECD C[C@H](NC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 746168806 QUBXIOGLAODHGQ-YADARESESA-N 409.530 2.337 10 20 HECD Cc1ccc2c(c1)c(=O)n(C)c1nnc(CN3CCOc4cc(N(C)C)ccc43)n21 746496368 HMDDJYBYVGSMMU-UHFFFAOYSA-N 404.474 2.355 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 750637449 JHYJGPPHGLYMCZ-IJEWVQPXSA-N 404.486 2.002 10 20 HECD CCC1(CC)NC(=O)N(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 751306096 PZXNESYJQRPZEB-UHFFFAOYSA-N 406.446 2.445 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1F 752064845 HWEKHGPYTQTQRD-UHFFFAOYSA-N 421.494 2.061 10 20 HECD C[C@H]1NC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN(c2ccccc2)C1=O 752149432 MHBOHCPTWBQWNA-VQIMIIECSA-N 422.485 2.238 10 20 HECD COCCCOc1cccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 752627033 JPHKOQSVRZLFNO-UHFFFAOYSA-N 408.476 2.109 10 20 HECD CC(C)c1cnc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 756075368 AYHHIIKXIPWTJR-UHFFFAOYSA-N 406.483 2.497 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)c2ccc(O)cc2)cc1 757769145 VHHUPMFRPWYMGJ-OAQYLSRUSA-N 411.502 2.396 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])cc3F)CC2)cc1 758226723 ZFSRUAXLHLLNDE-KRWDZBQOSA-N 405.426 2.304 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1 760578828 UTLULDPWKCMPEG-UHFFFAOYSA-N 400.497 2.082 10 20 HECD CN(C)CCOc1ccccc1-c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762080668 ZLUBHYLSGKBYOD-UHFFFAOYSA-N 418.475 2.421 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763878639 SQARIDZJZAQNGR-MLNJSSBLSA-N 410.495 2.101 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765904333 RGPFXSRVDDOEBP-UHFFFAOYSA-N 413.249 2.258 10 20 HECD CS(=O)(=O)NC[C@H]1CCCCN1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 768342932 UKKZCNUHYARCOP-QGZVFWFLSA-N 410.540 2.489 10 20 HECD CN1CCC[C@H]1C(=O)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769533104 ODUSIPNAUSZXRO-FQEVSTJZSA-N 415.538 2.324 10 20 HECD C[C@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(N2CCOCC2)c(F)c1 773046083 ZUEXGLDXJHRKBS-HNNXBMFYSA-N 411.543 2.270 10 20 HECD O=C(NCc1ccccn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774470724 MNNUNAGQZKVEQR-UHFFFAOYSA-N 404.417 2.084 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 778418362 DLLJJLSIYKDABB-GJCIYHRCSA-N 415.534 2.220 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1 783590602 VGJDTRXUQVWUML-NSHDSACASA-N 401.444 2.087 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc4n[nH]cc4c3)CC2)cc1 792863195 JYFAZRQHTTVHDY-UHFFFAOYSA-N 407.518 2.443 10 20 HECD C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 793826585 RSAGXPGSTDPTHM-IRXDYDNUSA-N 411.502 2.153 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc4c3OCO4)n2)c[nH]1 800925806 GAEGAXFSIZYCOX-UHFFFAOYSA-N 407.429 2.454 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(c2nccs2)CC1 803175123 YWCPOJUNXSXZHV-UHFFFAOYSA-N 415.563 2.343 10 20 HECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 804083062 IBKRVNLKFOPHHN-SFHVURJKSA-N 424.545 2.329 10 20 HECD CCC1(CC)[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H]1OC 804315065 DOOMDYZQDGYTAF-VQTJNVASSA-N 417.550 2.490 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C)OC3(CCOCC3)C2)cc1F 804852646 CJRMEYSMCLASSW-MRXNPFEDSA-N 421.513 2.085 10 20 HECD NS(=O)(=O)c1ccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)s1 804870983 NGWUWKNVNHQAOW-UHFFFAOYSA-N 410.304 2.407 10 20 HECD Cn1c(=O)n(C)c2cc(S(=O)(=O)NCc3cc(Cl)cc(Cl)c3O)ccc21 805135585 OLFRDBNAMFOKMR-UHFFFAOYSA-N 416.286 2.368 10 20 HECD COc1ccc(N2CCC(NC(=O)NCC3(S(C)(=O)=O)CCCC3)CC2)cc1 805839241 BUWURNJEQRVCKD-UHFFFAOYSA-N 409.552 2.321 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCN(c2ccccc2)C1=O 807099626 BFDLYHKPSBXYKN-NRFANRHFSA-N 422.529 2.331 10 20 HECD C[C@H]1CN(C[C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 807674741 QCNFSGLSDRFSCD-IIMDRIAPSA-N 416.566 2.030 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H](CC(=O)NC)c2ccccc2)cc1 807730137 CUEIMPLWKTXEKJ-OAQYLSRUSA-N 424.545 2.485 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1 813513863 UDRPWEQJZSWEIX-OAHLLOKOSA-N 419.499 2.168 10 20 HECD CN(C)c1ccc(CN(CCC(=O)N2CCN(c3ncccn3)CC2)C2CC2)cc1 917075082 PKVJOUWHQFKIRB-UHFFFAOYSA-N 408.550 2.246 10 20 HECD CNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918211366 KQWKZSRNDTTWIY-UHFFFAOYSA-N 400.454 2.021 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cnn(-c4ccc(O)nn4)c3C)CC2)cc1 918665025 LRKYKKSBHCZZDK-UHFFFAOYSA-N 408.462 2.037 10 20 HECD NS(=O)(=O)c1cc(C(=O)NCc2c(O)ccc3c2CCCC3)cc2c1CCC2 1319465015 RTFOEMBGPIPEDO-UHFFFAOYSA-N 400.500 2.337 10 20 HECD O=C(COC(=O)c1cn(-c2ccc(Br)cc2)nn1)c1ccc(O)c(O)c1 1321035954 NNYBASOWGOLGOS-UHFFFAOYSA-N 418.203 2.481 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1scnc1C1CC1 1796599343 MMPKCUKQDCFHJR-BTTYYORXSA-N 414.487 2.392 10 20 HECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)co1 1804283729 MWRAEWATZOPIHL-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCCC1)c1cc(O)c(O)c(Cl)c1 1804537162 YWNYCXVSXKDYNL-MUJYYYPQSA-N 421.925 2.489 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2=CCCS2)C1 1841645431 GSHCWIJDNUKSPY-UHFFFAOYSA-N 410.499 2.004 10 20 HECD CC(C)(C)c1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)ccn1 1842175519 CUHCHUCYAMOIAC-UHFFFAOYSA-N 410.474 2.316 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1C(=O)COc2ccccc21 10907492 SSLGXIRFIUZPIR-UHFFFAOYSA-N 409.486 2.297 10 20 HECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 60750137 KPIDOMOPOBZZER-UHFFFAOYSA-N 410.518 2.264 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)cc3[N+](=O)[O-])CC2)cc1 105546047 UCLSLVPWIRRBER-UHFFFAOYSA-N 407.448 2.123 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)c1 584014162 CVHAVADFWCHPET-UHFFFAOYSA-N 420.513 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cscn3)cc2F)C[C@H](C)O1 728339324 VCNWNYIGPDQBOD-STQMWFEESA-N 407.467 2.369 10 20 HECD CNC(=O)CCOc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 729581691 PQVQZEHQPBHCJI-UHFFFAOYSA-N 412.490 2.360 10 20 HECD C[C@H]1Oc2c(cccc2C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)NC1=O 729742451 QOFJZIRBWCWAMC-CQSZACIVSA-N 411.458 2.287 10 20 HECD COC(=O)CN(CC(=O)NC1CCN(C(C)C)CC1)Cc1cc(Cl)ccc1O 733995597 IQOYYXWCEYKLQZ-UHFFFAOYSA-N 411.930 2.010 10 20 HECD CCN1C[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751985 YMEYVCRXFFSBQP-WMZOPIPTSA-N 418.538 2.303 10 20 HECD CN(CC[C@@H]1CCCCN1C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 743855246 IEVXFIOETZMZJS-IBGZPJMESA-N 406.546 2.085 10 20 HECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743957787 ADCGVUOURKUBJG-UHFFFAOYSA-N 411.458 2.493 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)c3ccc(OC)c(OC)c3)CC2)cc1 754020024 YBEUFZZDOLOXNA-FQEVSTJZSA-N 415.534 2.332 10 20 HECD NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCCCSc2nccs2)c1 754427281 YPEYFXXUNXYCFZ-UHFFFAOYSA-N 409.917 2.495 10 20 HECD CN1CCCc2cc(CNC(=O)NC3CCN(S(=O)(=O)C(C)(C)C)CC3)ccc21 755651574 PENBBOJFJLDPEY-UHFFFAOYSA-N 422.595 2.461 10 20 HECD COC(=O)c1cc(NC(=O)NCc2ccc(N(C)C)cc2)cc(S(C)(=O)=O)c1 758643277 KHGZKLJSSIPGNP-UHFFFAOYSA-N 405.476 2.264 10 20 HECD CCN(CC)C(=O)CCCC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760086436 LPIJXVGDUVBMIH-UHFFFAOYSA-N 421.538 2.400 10 20 HECD COC(=O)C1CCC2(CC1)NC(=O)N([C@@H](C)c1ccc(N3CCOCC3)cc1)C2=O 761155435 DLZSONIYVOGSEW-JUTLFCHVSA-N 415.490 2.238 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCCC[C@@H]3N3CCOCC3)CC2)cc1F 763660124 QASQZOUWGVSKQC-UXHICEINSA-N 420.529 2.309 10 20 HECD CCCN(CC(=O)OC)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769714432 RAOUVUSMIXSYTJ-UHFFFAOYSA-N 412.489 2.280 10 20 HECD CCC[C@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 770299747 LSURPSVWRWNLNC-PGRDOPGGSA-N 402.539 2.225 10 20 HECD C[C@H](NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 772997261 FEFHCIKZONQKJI-INIZCTEOSA-N 417.531 2.265 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(CC(C)(C)O)C3CC3)CC2)cc1 779518981 JHRKSNYWLGXFBR-UHFFFAOYSA-N 404.555 2.152 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC(C(C)C)C(C)C)CC2)cc1 785526082 BGFBRZVMNPDVPQ-UHFFFAOYSA-N 418.582 2.120 10 20 HECD COc1ccc(N2CCC(NC(=O)Cc3ccccc3S(C)(=O)=O)CC2)cc1 786048863 GISWEJZZXHHQCF-UHFFFAOYSA-N 402.516 2.426 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 788425243 NNPZOSGCLCYDGR-UHFFFAOYSA-N 418.538 2.227 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC12CCC2 789798936 KGUBRTLEQXUDIT-INIZCTEOSA-N 403.498 2.317 10 20 HECD COc1ccc(CNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c(O)c1 792971914 QWZHMJHOWUSUAR-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CCC1(CC)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793733175 LOYYXRAGPDQXNF-SFHVURJKSA-N 414.550 2.043 10 20 HECD O=C(CSCCOCCN1C(=O)c2ccccc2C1=O)c1ccc(O)c(O)c1 795245549 CYGFPRNTLMCZEJ-UHFFFAOYSA-N 401.440 2.327 10 20 HECD C[C@@H](NC(=O)N1CCC[C@@H](CN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1 799892850 PRTSXMZZTDBLBX-UXHICEINSA-N 416.566 2.338 10 20 HECD C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662867 IMENHFBYIGRTPC-MLNJSSBLSA-N 419.522 2.465 10 20 HECD O=C(N1CCCC1)N1CCC[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 804190168 QDUVPCVMMNIYPW-INIZCTEOSA-N 420.897 2.490 10 20 HECD COc1cc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccn1 806664478 SAXUEYOSABXPLQ-UHFFFAOYSA-N 402.451 2.470 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)c(F)c1 807287933 PBOXFNWVFURDAN-HXUWFJFHSA-N 415.440 2.461 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2cccs2)CC1)c1ccc(N(C)C)cc1 807672894 KBROAQQNUMQXBB-MRXNPFEDSA-N 400.548 2.336 10 20 HECD C[C@@H]1C[C@@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808855259 VJCDSENLPDEHKD-RTBURBONSA-N 412.578 2.339 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC(C)(C)[C@@H]1CCCCO1 809423573 OPHHMTOJCJPGMN-FQEVSTJZSA-N 417.550 2.193 10 20 HECD COC[C@]1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 811398779 DWIGUVHTKKHHIK-FQEVSTJZSA-N 409.435 2.097 10 20 HECD CSC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCN(C)CC1 811941108 BXRMYTFKJZWAMF-UHFFFAOYSA-N 424.586 2.413 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@](C)(O)C3CCC3)cc2F)C[C@@H](C)O1 812665444 SGZRTTPXGHYPSY-DOQJBMMISA-N 422.497 2.150 10 20 HECD CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 815398745 UCHGOKUXQHQLQW-UHFFFAOYSA-N 400.431 2.312 10 20 HECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](c1ccccc1)c1ncc[nH]1 817489362 ZQPSIYTVBHOOBK-KRWDZBQOSA-N 400.460 2.348 10 20 HECD COc1ccc(-c2nc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)sc2C)cc1 913072216 IJDHJBCUMMLITM-UHFFFAOYSA-N 406.489 2.365 10 20 HECD CCC(=O)N[C@H](C)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 914671620 AGXKTHCWRMBYDZ-OLZOCXBDSA-N 422.437 2.247 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccco4)n3)cc2F)C[C@H](C)O1 917713251 JXHPAJNGQIAERE-KBPBESRZSA-N 414.441 2.002 10 20 HECD CC(=O)N1CCc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc21 919840088 PPFYKXYMTSRMFW-UHFFFAOYSA-N 413.499 2.083 10 20 HECD COCCN1C(=O)/C(=C/Nc2ccc(OC(F)F)c(Cl)c2)C(=O)NC1=S 920978006 PHCKKPQGHQXEQK-VQHVLOKHSA-N 405.810 2.127 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCc3c(C)nc4ncnn4c3C)CC2)cc1 1335132922 JPUFABXQXWZUGP-UHFFFAOYSA-N 408.506 2.421 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1C[C@H]1C1CC1 1792851527 CSYZLMBKVHMVMP-KCTHJMFYSA-N 420.893 2.001 10 20 HECD O=C(/C=C/c1cccnc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547424 OWNVVIBXZUJJGB-SNAWJCMRSA-N 422.485 2.446 10 20 HECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 147119751 XTUFLEDPDJXQDM-UHFFFAOYSA-N 413.474 2.104 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 725849713 VQGIMMCAGGJDSW-KRWDZBQOSA-N 421.475 2.048 10 20 HECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 734402071 GAKIFKGSJTYWCN-HSZRJFAPSA-N 424.501 2.153 10 20 HECD COC1CCC(N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 734661036 YKDSYOHWJXYCNC-ZJRDLVKKSA-N 402.539 2.487 10 20 HECD COc1ccc(OC)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738884901 MPXZCASXHCGHGR-UHFFFAOYSA-N 419.503 2.260 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccc(C)o3)cc2F)CC1 741413610 OUXAQJCEFRGJON-LJQANCHMSA-N 404.486 2.402 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)[C@H](C)c3ccc(C)cc3)nc12 745755543 ZTFHRDWDUORIRJ-FZKQIMNGSA-N 413.430 2.128 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccnc(O[C@@H]2CCOC2)c1 754141962 QJVQYNJFYRGGQZ-QGZVFWFLSA-N 401.438 2.155 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H](O)c3cccc(F)c3)CC2)cc1 756264675 XLXXVCGMHRQTRU-HXUWFJFHSA-N 416.449 2.150 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O 757005705 KVJCSMPFDCGHFE-YEZVWNJWSA-N 400.523 2.424 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)C[C@@H]3CCOC3)CC2)cc(OC)c1OC 759288985 VNYKFTKXJNBLFH-HOTGVXAUSA-N 407.511 2.359 10 20 HECD COCCC1(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCC1 761441578 JGJPUNJSCNGTAY-UHFFFAOYSA-N 404.507 2.484 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c1 761971127 XUBOUZZSCXMYEW-UHFFFAOYSA-N 419.419 2.377 10 20 HECD C[C@@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)c1ccc(N2CCOCC2)cc1 765136298 LGANQWTVZIXXSU-APWZRJJASA-N 419.522 2.336 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765904794 WNFLQYSZDUIDNI-UHFFFAOYSA-N 407.220 2.196 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)NCc3cc(OC)ccc3O)cccc12 766820823 YNJWCRJCNNDUFX-UHFFFAOYSA-N 402.428 2.214 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 774364343 WIAFDFXWUPHSHB-UHFFFAOYSA-N 407.430 2.058 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1 777765358 MFEBNDBUCLMKRN-AWEZNQCLSA-N 413.540 2.211 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)cc1 778275534 KXCNEERUCBEBDL-RJRNSMGGSA-N 421.497 2.409 10 20 HECD CCOC[C@@H]1CCCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778277587 NAMNIQWKEXKYFF-GNISGLHKSA-N 415.534 2.175 10 20 HECD CN1CCC(N2C(=O)/C(=C/c3cc(Br)nn3C)SC2=S)CC1 779204081 OFZGCMPHMQOJCU-XFFZJAGNSA-N 401.355 2.478 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nn1-c1cccc(F)c1 785297765 SGXXIZHWTAMTPY-GFCCVEGCSA-N 412.421 2.417 10 20 HECD O=C(NCCN1CCOCC1)c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1 802761749 RAOGVMNFUMIPJC-UHFFFAOYSA-N 424.545 2.197 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1 807097099 KBBHEPSUGXCFOH-IEBWSBKVSA-N 400.567 2.446 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807386558 APUFQIMUYHHHMD-UHFFFAOYSA-N 406.236 2.368 10 20 HECD COCCn1nc(C)c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1C 807511889 ZRXNOJGAZOSCMU-UHFFFAOYSA-N 415.277 2.414 10 20 HECD COC(=O)C1(CS(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CCCC1 809825007 KHBNELPMCGOMRQ-UHFFFAOYSA-N 414.499 2.020 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(Br)c2O)cc1 811459853 QORXCKIIZLCLAJ-UHFFFAOYSA-N 413.293 2.058 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CC(=O)NCC(F)(F)F 819519028 MLGXCRZQHDIPIC-UHFFFAOYSA-N 417.428 2.444 10 20 HECD O=C(Nc1ccccc1-n1ccnn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295146 AQFVXRYOMAXPBO-KRWDZBQOSA-N 421.457 2.119 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H]4OCCC[C@H]4C3)cc2)C1 1319343822 FHYOTGOUGBAQEE-NLWGTHIKSA-N 400.523 2.099 10 20 HECD Cc1cc[nH]c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932696 SEZSEUFJPWNSFT-VBUUOAMHSA-N 419.485 2.368 10 20 HECD CC(C)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767972 GWXUXQLAXVLTSD-ZSBFGKGUSA-N 410.898 2.391 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993068 SGOSUFWQDPGKFK-DZKDUJFISA-N 422.485 2.254 10 20 HECD C/C=C(\C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499537 LOWIMTQVSOMPQM-TWXILYBASA-N 421.548 2.228 10 20 HECD CCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)COC1 1831274742 GNSVAUUEDIFWSI-KRWDZBQOSA-N 417.506 2.153 10 20 HECD COCCOc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 27962938 CBGXTWBGFRGQLZ-UHFFFAOYSA-N 420.531 2.369 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2Cl)cc1 326685470 OVKZFUHTPVICNV-UHFFFAOYSA-N 404.853 2.211 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 438825117 HIWRNDURYSFAQJ-UHFFFAOYSA-N 423.450 2.267 10 20 HECD Cc1c(CNC(=O)C(=O)NC[C@H](Cc2ccccc2)N(C)C)n(C)c2ccccc12 550414386 LTDQSFJPTVGESS-IBGZPJMESA-N 406.530 2.392 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccc(C(=O)N(C)C)cc2)n(C)c2ccccc12 555870114 XAHQQDOVHYRTRV-UHFFFAOYSA-N 406.486 2.121 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1 727226827 ASQCXYLBJBJXLL-UHFFFAOYSA-N 415.465 2.359 10 20 HECD CCOC(=O)CN(C)C(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 732201934 BJULCUKFBGXVBT-UHFFFAOYSA-N 419.522 2.485 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1 732704829 ZUIKAGZYJKEOTL-GFCCVEGCSA-N 415.421 2.483 10 20 HECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)N(C)C 733164126 ZVDVBUNYSUNYIW-COVOJHCQSA-N 411.574 2.322 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc(C(C)(C)C)ns1 737118460 VTNKEIBCOAHBSV-UHFFFAOYSA-N 417.535 2.269 10 20 HECD CC(C)NC(=O)CNC(=S)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743015739 MZEVHBCVCCNBHL-CYBMUJFWSA-N 400.495 2.246 10 20 HECD CCc1nncn1CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743699281 FEDUYTMRTYSRFM-CQSZACIVSA-N 408.453 2.410 10 20 HECD COCCN1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745906118 WTSKNMDAYAGZLV-INIZCTEOSA-N 412.481 2.230 10 20 HECD COC(=O)c1c(NC(=O)C(=O)NCc2cc(OC)ccc2O)sc2c1CCCC2 746039890 YPQZIHHZXAJRNO-UHFFFAOYSA-N 418.471 2.383 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 746805295 PICWHNALTKQVMX-RVKKMQEKSA-N 421.538 2.415 10 20 HECD C[C@@]1(c2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)NC(=O)NC1=O 748041337 YJSBQZNMMFSUAP-JPYJTQIMSA-N 423.469 2.268 10 20 HECD CNS(=O)(=O)c1csc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 748849187 KBIXLLGNSWTQRM-AWEZNQCLSA-N 410.517 2.183 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)cc1 749879705 SINRBAINONDWNS-IBGZPJMESA-N 402.520 2.221 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c(O)c1O 750619399 OQPOPRKJOXZQHI-UHFFFAOYSA-N 404.444 2.241 10 20 HECD COc1ccc(N(C)CC(=O)NCc2cc(OC)c(OC)c(OC)c2)c(OC)c1 752118487 YUYJUNXCOWFPGQ-UHFFFAOYSA-N 404.463 2.482 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1F 754040272 LQNRWHLWGXEPIN-UHFFFAOYSA-N 408.480 2.350 10 20 HECD CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 754567779 DKZSAFILVQPXEV-IEBWSBKVSA-N 404.555 2.231 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCNS(=O)(=O)c2cc(C)sc2C)c1 756762067 SLABLZRORJTLBS-GFCCVEGCSA-N 412.533 2.486 10 20 HECD CCOC1CC(CNC(=O)NCc2ccc3c(c2)CCCN3C)(N2CCOCC2)C1 767887448 GYXWHHVKNAZGCJ-UHFFFAOYSA-N 416.566 2.138 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccoc3Br)nc12 773547225 UXGZGAPDALRYGX-UHFFFAOYSA-N 410.180 2.324 10 20 HECD Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774364232 VSHNYJAKFVNQLO-UHFFFAOYSA-N 408.414 2.286 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCNC(=O)Cc1ccccc1 777825979 CXFWBHBHODCBFT-UHFFFAOYSA-N 418.877 2.296 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnn(CC(F)F)c3)CC2)cc1 777933437 MQXCPNRMLFSPNO-UHFFFAOYSA-N 400.451 2.104 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3cnc(C)s3)CC2)cc1 778388991 BHYWUPHBYAZLSC-BQYQJAHWSA-N 414.531 2.024 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CO)c3ccccc3C)CC2)cc1 778422951 OVCYVPREGOVBFP-VDZCTEQFSA-N 423.513 2.058 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)CC34CCCCC4)CC2)cc1 779223033 YZICIWFRFWYWJI-QFIPXVFZSA-N 416.610 2.128 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cn1 784106734 MZRFFPPXMSOLGZ-UHFFFAOYSA-N 416.503 2.229 10 20 HECD C[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H]1CO 785865072 VPKPDGDEVXIINN-DYVFJYSZSA-N 401.429 2.454 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 785871221 ZLAULQNTKJOKID-UHFFFAOYSA-N 400.483 2.153 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(CC)CC 788313049 OPSABPPGCOYFRM-VQTJNVASSA-N 417.550 2.239 10 20 HECD C[C@H]1CN(CCN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 788873394 DGOYKYDJUKAHKD-HDICACEKSA-N 406.596 2.490 10 20 HECD CCc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1 790418577 WDUWXBLRIGNINA-UHFFFAOYSA-N 405.398 2.386 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 790851714 ICMCFUMOGOGKGG-UHFFFAOYSA-N 412.458 2.413 10 20 HECD O=C(NC[C@@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793792724 HREJQZVHQUBBRW-KRWDZBQOSA-N 411.449 2.058 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)[C@H](C)[C@@H](C)C(=O)OC)ccc21 802153107 HXDJTDVGUJVZSY-UKRRQHHQSA-N 424.519 2.162 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1cc(F)cc(F)c1)c1ccc(N2CCOCC2)cc1 803303111 IAALXJZHLZNSQW-OAHLLOKOSA-N 417.456 2.338 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)ccc21 803686036 TYNFQUNIALGOKD-BPQIPLTHSA-N 405.589 2.181 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1)[C@H]1C[C@H]1C 815550073 BXLLTSMGWSSUTJ-ACJLOTCBSA-N 411.458 2.157 10 20 HECD COC[C@H](C)NS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1 863991636 KCYGWDPHGZCNBJ-KRWDZBQOSA-N 419.547 2.449 10 20 HECD CC1=C(C(=O)N(C)C)[C@H](c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)NC(=S)N1 916191881 CHABWTGUDVRKFN-KRWDZBQOSA-N 403.508 2.466 10 20 HECD CC(=O)NCC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 918219833 OVIXZWFKIUSXMT-IYBDPMFKSA-N 420.529 2.497 10 20 HECD CC(C)Oc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918285106 YIRQSGFEDOAWGZ-UHFFFAOYSA-N 416.453 2.099 10 20 HECD O=C(Nc1ccc(-n2cncn2)nc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 918294901 MRTXCQIMNQTTFF-UHFFFAOYSA-N 418.413 2.128 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(-c4ccc(C)o4)[nH]n3)CC2)cc1 919324849 JCLCUQHWJOAVOE-UHFFFAOYSA-N 424.457 2.492 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2cccn2)c(F)c1 1320519070 AOLQPCOCBNQXDT-INIZCTEOSA-N 413.405 2.327 10 20 HECD CO[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccccc1 1796599485 OULYXNKOCNGWDH-CLWJZODNSA-N 411.458 2.132 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccc[nH]1 1796934504 LSSXOLRFXDAKPO-ACHSLPGTSA-N 405.458 2.059 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001927 RLPKBYHRRQHRMV-KKSFZXQISA-N 410.474 2.398 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ncc(Cl)cc2Cl)C1 1840999233 VJSOMHDGJQAVAL-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COCc1oncc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1843567666 NTYRFQUTQDQJGO-UHFFFAOYSA-N 421.837 2.016 10 20 HECD CN1CCC(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1847336065 XGGZCRMTUKCMRC-IRXDYDNUSA-N 421.925 2.299 10 20 HECD O=C(CN1CCC[C@H]1CN1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 727833148 NXNNSMQKQRPGGD-FQEVSTJZSA-N 418.557 2.229 10 20 HECD COC(=O)CN(CC1=Nc2ccccc2S(=O)(=O)N1)Cc1cc(Cl)ccc1O 731845462 ZEQNOUINMBCTEH-UHFFFAOYSA-N 423.878 2.043 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@@H]3c3ccc(CC)o3)nc12 736318061 DTKSVJLCXSGHOT-MRXNPFEDSA-N 400.435 2.341 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CCO)c3ccccc3)cc2)C1 741080533 CHORHKQCNWYYFN-LEWJYISDSA-N 424.545 2.354 10 20 HECD C[C@@]1(c2ccc(CNC(=O)NCc3c(O)ccc4c3CCCC4)cc2)NC(=O)NC1=O 745796058 ODOBYBXBTQSRIP-QHCPKHFHSA-N 422.485 2.325 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](CN4CCCC4)C3)cc2)C1 746413184 CIJGWPLZSVIEKL-UXHICEINSA-N 413.566 2.016 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(-n2cnnn2)cc1 747458600 ZLJKPDPAXVZIND-UHFFFAOYSA-N 400.508 2.328 10 20 HECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccccc3O)cc2)C[C@@H](C)O1 748354829 NXKRYODXPFEEGB-GASCZTMLSA-N 404.488 2.120 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4CCOC4)CC3)cc2)C1 753120209 AUESBNRUJYYOQC-UXHICEINSA-N 414.550 2.346 10 20 HECD COCc1ccc(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753858502 UQNHUJMTBAFADM-UHFFFAOYSA-N 401.482 2.419 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC3(c4ccc(OC)cc4)CC3)CC2)cc1 754144411 QORRPTBNSOCSRR-NRFANRHFSA-N 411.546 2.466 10 20 HECD COC(=O)c1nscc1S(=O)(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1 755972872 HGQDDKISAJNNCI-UHFFFAOYSA-N 421.504 2.041 10 20 HECD C[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(Cl)c(Cl)c1O 756736357 FIXNOTZVSKAQSM-CHWSQXEVSA-N 402.322 2.283 10 20 HECD COCCS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 759258658 JZOXHGGDHZYZQW-CQSZACIVSA-N 422.503 2.381 10 20 HECD CC(C)(C)S(=O)(=O)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 767796280 QZZNOGQGTGWNQQ-OAHLLOKOSA-N 402.944 2.340 10 20 HECD COC(=O)C[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 772584680 YVRLHWPNJKHDCS-CYBMUJFWSA-N 424.500 2.422 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 772600403 HQDWQYBUMLWJAH-MOPGFXCFSA-N 410.536 2.315 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 773128541 FTAHEJJUESPMSH-UHFFFAOYSA-N 423.425 2.262 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCOc3cccc(C)c3)CC2)cc1 779221674 MBYIWGKHKGEEDW-QFIPXVFZSA-N 413.562 2.497 10 20 HECD COc1cccc(CNC(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)c1O 782078309 KAUYRPOZWVAJLZ-UHFFFAOYSA-N 412.490 2.387 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 785298596 WNJNBIMZRAQPRO-LURJTMIESA-N 404.291 2.479 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(Cn2ccnc2)c1 787298283 NYOUTRKTPCZZCS-UHFFFAOYSA-N 417.513 2.464 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1 788327470 LFXOGKKIOUFBDZ-UHFFFAOYSA-N 409.895 2.064 10 20 HECD CCOC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 788886502 RLFJRUBVGXADAO-UHFFFAOYSA-N 418.515 2.487 10 20 HECD C[C@H](NC(=O)C(=O)Nc1nc2c(s1)CCC2)c1ccc(N2CCOCC2)cc1 789392695 LQDFBSGBSMRHEW-ZDUSSCGKSA-N 400.504 2.284 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@@H]1CCCC(F)(F)C1 789798016 AIBIMOFKYGJKAW-OAHLLOKOSA-N 413.440 2.220 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@H](C)[C@@H]3C)cc2F)C[C@@H](C)O1 789821014 RSCZQQNWTSDNHH-BQJWPVKWSA-N 421.513 2.080 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCCC[C@H]1c1ncc[nH]1 789859361 CDHUCASCLFDHGO-SFHVURJKSA-N 413.547 2.333 10 20 HECD C[C@H]1CCCN(C[C@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 793899656 BKFDTZVENUYQEM-ROUUACIJSA-N 400.567 2.480 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1nn(C)cc1C(=O)OCC 802610753 PFRJKJRBRBERRE-UHFFFAOYSA-N 402.451 2.070 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803299334 JJFWANKDMRFCPX-IEBWSBKVSA-N 415.534 2.308 10 20 HECD CO[C@@H](C)c1nc(CNC(=O)C(=O)NCCCSc2nccs2)cs1 806280610 GNKWWSGPNQFKSL-JTQLQIEISA-N 400.551 2.222 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807679706 UUFCCQYZULVRCZ-QGZVFWFLSA-N 410.518 2.287 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)N1CCN(c2ccccc2)CC1 812557938 NYTRLSLKDNWZHP-UHFFFAOYSA-N 418.291 2.120 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(Cl)c(F)cc2O)C1=O 816568382 FKZBLHYXZQMEAI-UHFFFAOYSA-N 420.828 2.290 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3ccc(C(=O)NC4CC4)cc3)nc12 917097250 JIYROROBUFLIJW-UHFFFAOYSA-N 423.473 2.136 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1cc(Br)c([N+](=O)[O-])n1 917613544 KSKGDNLAATUMQH-UHFFFAOYSA-N 410.272 2.480 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccnc1 918193944 SCZURGYTZLGLOJ-UHFFFAOYSA-N 401.410 2.416 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cccc(OC)c1F 1117144060 XQLBRAWCRUMZFC-HNNXBMFYSA-N 405.422 2.469 10 20 HECD C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[C@H]1N1CCN(C)CC1 1319827981 BOLHSFDHXJRPFJ-DENIHFKCSA-N 403.590 2.035 10 20 HECD Cc1nc(N(C)C)sc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1341475654 CXCXLBNFUNCWBH-HNNXBMFYSA-N 401.536 2.149 10 20 HECD Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808496292 HRRIIGBADBKGBM-BEFAXECRSA-N 422.441 2.423 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(=O)n(C)n3)c2C)cc1 107680438 BDKRAZBYVNWJRX-UHFFFAOYSA-N 423.425 2.014 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCSC3(CCOCC3)C2)n(C)c2ccccc12 568050153 OEXBAXGYVFRRTG-UHFFFAOYSA-N 401.532 2.228 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(C(F)(F)F)cc2)SC1=S 727177081 BNOQLLGQKXULAE-DHZHZOJOSA-N 410.464 2.456 10 20 HECD COc1cccc(CNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1O 729858851 FCLXKVFBICYOIF-UHFFFAOYSA-N 418.247 2.190 10 20 HECD C[C@@H](NC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 731979587 HOKPLRJOODWGBE-MRXNPFEDSA-N 419.485 2.299 10 20 HECD O=C(NCCCOC[C@H]1CCOC1)NCc1ccc(N2CCC(CO)CC2)cc1 740920012 FGTNFFWYOPVCHH-HXUWFJFHSA-N 405.539 2.138 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1F 746724561 OMCWPHPDVDEFMO-UHFFFAOYSA-N 414.481 2.364 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(N)=O)o2)NC(=O)OC(C)(C)C)cc1 747420006 OCMUZBOASIHTMK-OAHLLOKOSA-N 416.478 2.440 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sc(C)nc2C)cc1OC 751211147 NEFQAXDOHRAYIV-UHFFFAOYSA-N 405.523 2.331 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)ccc1OC 752001176 QKFDNCXIVOBINJ-ZDUSSCGKSA-N 422.503 2.475 10 20 HECD COc1ccc(N2CCN(CC(=O)NC(=O)N[C@@H]3CCCC[C@H]3C)CC2)cc1F 753856644 DNSPFEOXAKNXKP-CRAIPNDOSA-N 406.502 2.361 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)c3ccc(OC)c(F)c3)CC2)cc1 754058645 CNPZMYVWXHBRAA-LJQANCHMSA-N 403.498 2.462 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(-n4ccnc4)nc3)CC2)cc(OC)c1OC 760088563 WKOKVUYCBXTRPJ-UHFFFAOYSA-N 423.473 2.256 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1C 760542115 VAEQFQPRAWGNMT-OAHLLOKOSA-N 421.519 2.078 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1F 762437750 CQQQAOCAXCTKIK-QGZVFWFLSA-N 417.485 2.302 10 20 HECD CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NCCc1ccc(O)c(O)c1)C2=O 768903920 QTOQRPUZHUPYKT-UHFFFAOYSA-N 417.506 2.283 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CC(=O)N(c2c(F)cccc2F)C1 770704700 KASOOYBJSIMWAD-INIZCTEOSA-N 415.440 2.471 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnn(CC(C)C)c4)n3)CC2)cc1 771055662 IPKYYISPOYCOJD-UHFFFAOYSA-N 424.505 2.489 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)C3CCOCC3)cc2F)C[C@@H](C)O1 775456184 YNAHYSPEEYRHJY-BRWVUGGUSA-N 407.530 2.460 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)Cc3ccncc3)CC2)cc1 778305514 ARHFRZQGBLURSO-DVBCCOPCSA-N 408.502 2.042 10 20 HECD Cc1cnc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 780230517 YKXMRXLMOWARHV-UHFFFAOYSA-N 401.438 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)CC2)cc1 781560048 ZEWWZXHSSDNEHC-FQEVSTJZSA-N 410.430 2.445 10 20 HECD CN1CCCc2cc(CNC(=O)NCc3cccc(S(=O)(=O)N(C)C)c3)ccc21 782537654 OXBFTIFEAAAOPI-UHFFFAOYSA-N 416.547 2.319 10 20 HECD Cc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789825497 MILGPHMWRCMDPS-HZPDHXFCSA-N 414.481 2.075 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1 792702894 HPKQKMXBEOWWBM-UHFFFAOYSA-N 408.501 2.387 10 20 HECD CCCN1CCC(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 793822230 AWFOEEHZXJYKIE-FQEVSTJZSA-N 417.550 2.138 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)cc1 793822775 DHGTWVFJIVYEKR-QGZVFWFLSA-N 411.502 2.187 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3[nH]nnc3-c3ccccc3)cc2)C1 797712425 KWVGYJZRRXVOEJ-KRWDZBQOSA-N 404.474 2.103 10 20 HECD C[C@H](CN1CCCC1=O)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803118709 ZYCBNEOROXMUEM-QGZVFWFLSA-N 414.550 2.199 10 20 HECD CCn1nc(C)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 804465169 FCRWAWJRPUVKMY-SFHVURJKSA-N 414.506 2.049 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](N4CCCC4)C[C@H]3C)CC2)cc1 805014403 ZAFFQXGJFAYPIN-TZIWHRDSSA-N 415.582 2.085 10 20 HECD CN(C)c1nccc(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)n1 808867896 KGFLTKOYUFLNHY-UHFFFAOYSA-N 411.506 2.226 10 20 HECD O=C(NCc1ccc(-n2cncn2)nc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916395488 LDRGVTYTCPMQKU-SFHVURJKSA-N 408.462 2.259 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 918462963 FAZOCTNUNAFGSU-SFHVURJKSA-N 408.502 2.260 10 20 HECD CCOc1ccc(N2CCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1 1319626011 RMHADNLKPIZOJU-UHFFFAOYSA-N 405.564 2.480 10 20 HECD CCOC(=O)[C@]1(COC)CCCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1321187469 KDUJMGIYGBRDOT-JOCHJYFZSA-N 407.530 2.369 10 20 HECD O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1ccc(N2CCC(CO)CC2)cc1 1321969811 UFJGRKIADCQSHP-UHFFFAOYSA-N 423.435 2.392 10 20 HECD O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995011 WUUVABVPXLRVEE-SJKOYZFVSA-N 424.379 2.160 10 20 HECD CC(C)N1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846724948 SQAHGFDBMHDAAR-INIZCTEOSA-N 421.925 2.441 10 20 HECD O=C(C1=CCCS1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034736 OIHDTKMDSAFEEQ-FNORWQNLSA-N 402.472 2.041 10 20 HECD COCCOCc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 60749902 YRXCNCPTKBKSCW-UHFFFAOYSA-N 411.502 2.487 10 20 HECD Cc1nn2cc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)cnc2c1Cl 499287801 UNRPMUKIVDFDFM-UHFFFAOYSA-N 407.883 2.345 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1 729065805 GAPTZOLJFSAJQR-OAHLLOKOSA-N 413.474 2.362 10 20 HECD CN(C)C(=O)COc1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739765478 IZRNSCIFONTAIO-UHFFFAOYSA-N 424.501 2.108 10 20 HECD COc1ncccc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743975013 KWWPRHBASFNLGS-CYBMUJFWSA-N 420.416 2.415 10 20 HECD Cn1c(CCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2ccccc21 746411830 QRRQKHHAQZNZKV-UHFFFAOYSA-N 402.476 2.013 10 20 HECD CCOC(Cn1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1)OCC 748551300 QMFAVOCPXBADLZ-UHFFFAOYSA-N 419.551 2.160 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCN(C(=O)C2CC2)C1 749733664 WYSAVZKVVAZDMF-KRWDZBQOSA-N 403.498 2.052 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)noc3C(F)(F)F)nc12 750491764 AXKDUBXPLSZRRL-UHFFFAOYSA-N 414.296 2.284 10 20 HECD Cn1cnc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1Cl 751371887 LVYVKVOMSVVEKV-CYBMUJFWSA-N 419.334 2.375 10 20 HECD C[C@H](O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 752147596 PPQBAYDDKOSSPQ-BMFAXAFESA-N 407.530 2.291 10 20 HECD CCc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1CC(C)C 757160300 LDJZVHAOJZZZNT-UHFFFAOYSA-N 413.522 2.193 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)C2)nn1 762728104 NZORPQVIUQDGOM-MRXNPFEDSA-N 408.462 2.345 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(NC(C)=O)c(F)c3)CC2)cc1 764966844 WVNJTEPORKBZLS-UHFFFAOYSA-N 414.481 2.345 10 20 HECD O=C(CCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1)OCc1ccccc1 767242192 XUGJNPOUVYGYKW-UHFFFAOYSA-N 418.515 2.076 10 20 HECD NS(=O)(=O)c1cccc2c(C(=O)NCc3ccc(N4CCCC4)cc3)nccc12 768471275 MADNGWXKYDIBGA-UHFFFAOYSA-N 410.499 2.412 10 20 HECD COc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769025132 VLWDPKMDVMLUOQ-UHFFFAOYSA-N 422.529 2.482 10 20 HECD CN(C)C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 769861507 OJKXPJCVDYMJHL-ZDUSSCGKSA-N 409.533 2.278 10 20 HECD Cc1nc(NC2CC2)sc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 770989379 CSKYBPVZKCGXOG-UHFFFAOYSA-N 420.560 2.191 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@@H]4CC[C@@H](C)O4)n3)CC2)cc1 771057932 QYJUYCNIEBFOPW-APWZRJJASA-N 414.506 2.470 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C(C)=O)cn4C)n3)CC2)cc1 771069419 VDDWJKMBIXADDT-UHFFFAOYSA-N 423.473 2.178 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCO[C@@H](C)C4)n3)CC2)cc1 771069518 WLNYTGZNHHISKO-HOTGVXAUSA-N 400.479 2.252 10 20 HECD CCN(Cc1ccc2c(c1)OCCO2)C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 773448083 GJDLHKJLDSCHRF-VMPITWQZSA-N 413.426 2.474 10 20 HECD O=C(NCc1cccnc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774120666 BEPLQMKXFPPUSY-UHFFFAOYSA-N 404.417 2.084 10 20 HECD CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775255441 QMJPFTBPZUPOBF-FDDCHVKYSA-N 409.530 2.490 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc(O)c([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 776341498 TUZASKQCUGRLOJ-TXEJJXNPSA-N 404.398 2.378 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cc1 781604448 OFRMYQZAILNMCM-LJQANCHMSA-N 408.568 2.289 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3cncs3)cc2F)C[C@@H](C)O1 782360645 XDNNCTRRSCGBMJ-ZIAGYGMSSA-N 421.494 2.298 10 20 HECD COc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ncn1 782429136 JYFPXQKCQKEGAN-UHFFFAOYSA-N 409.446 2.312 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C 784024394 NDJWYKQCGIUZOS-UHFFFAOYSA-N 419.503 2.034 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1CCc1ccccc1 785293281 FZURZIGLFXYGLO-HNNXBMFYSA-N 408.458 2.223 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1 785294801 NNHXGIXYGYZTRZ-MRXNPFEDSA-N 411.502 2.422 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)cc1 785423667 FRVYWAJMPOJOAT-UHFFFAOYSA-N 422.529 2.037 10 20 HECD CC1CCN(CCCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 785521335 VBPUFORLRJQUOB-UHFFFAOYSA-N 418.607 2.094 10 20 HECD CC(C)(C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CC1 786412042 ZTOONZQVSNAITF-HNNXBMFYSA-N 414.955 2.482 10 20 HECD C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)(C)n1cncn1 788563328 OZPLACSQRPGWQH-KRWDZBQOSA-N 424.528 2.447 10 20 HECD CCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 788708876 BHJXTDUBOMOWDP-UHFFFAOYSA-N 405.495 2.219 10 20 HECD C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864799 RRLUSZNJJMOYQG-MRXNPFEDSA-N 413.543 2.309 10 20 HECD O=C(NC[C@@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793793873 LELCSEQLAITWSA-PBHICJAKSA-N 411.449 2.058 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@@H]7[C@H]5[C@H]3[C@@H]7C[C@H]64)cc2)CC1 793924076 IVRNIOZLKPWQKW-KHCZZCLHSA-N 405.542 2.365 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795249364 RUGZIBKNXSYBLJ-IAGOWNOFSA-N 413.540 2.027 10 20 HECD C[C@H](NC(=O)C(=O)N(C)C[C@@H](C)c1nccs1)c1ccc(N2CCOCC2)cc1 803300335 RHUZZOYAKYNKRU-CVEARBPZSA-N 416.547 2.419 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 803686260 FLIWJICNXLPAFF-UHFFFAOYSA-N 418.538 2.058 10 20 HECD CC[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1nnc2n1CCCCC2 804101765 QLVHJFUGSNKZNP-CYBMUJFWSA-N 422.580 2.327 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1OC 804290584 RPPOKIZLNVSTPF-UHFFFAOYSA-N 404.488 2.499 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1cc(S(=O)(=O)N2CCCC2)ccn1 804333153 GOVKGOLTJVSXKL-UHFFFAOYSA-N 416.547 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccco3)C2)cc1F 804851637 JOZDSXUUFINTKO-LJQANCHMSA-N 403.454 2.481 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)cc2)CC1 805022764 CUWLDONDQDGJKH-MUUNZHRXSA-N 407.580 2.203 10 20 HECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806234402 KZGLSBQGOOIUSH-XLIONFOSSA-N 424.501 2.192 10 20 HECD O=C(N[C@@H]1CCCC12CCOCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 814181480 AVRGMIVFPIENTH-AZUAARDMSA-N 416.518 2.365 10 20 HECD O=Cc1c[nH]c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 815253522 XRULBFLMWDVNMC-UHFFFAOYSA-N 402.362 2.398 10 20 HECD CC(F)(F)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 818261496 QXPKJGSPURYABR-UHFFFAOYSA-N 415.374 2.486 10 20 HECD CN(C)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncn1C 857472354 LDYJLNPGWGGQML-VQIMIIECSA-N 405.930 2.163 10 20 HECD CCOC(=O)N1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 918220204 ICLLBUANXRLVJD-IYBDPMFKSA-N 422.501 2.423 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 918324826 ZGLSTVKPWMSESJ-CQSZACIVSA-N 424.469 2.280 10 20 HECD CCN1CCN(c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)c(C)c2)CC1 918444611 WDXOFKWRFSGLJL-UHFFFAOYSA-N 410.518 2.440 10 20 HECD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 919863358 HRFJLWWPMKVVEX-OAQYLSRUSA-N 424.480 2.057 10 20 HECD CNS(=O)(=O)c1ccc(Br)c(C(=O)N(C)Cc2ccccc2O)c1 1319112325 BSLVPKUDHMUVJM-UHFFFAOYSA-N 413.293 2.335 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncc(Br)s1 1330735372 NZYKABSOIOQAHX-VIFPVBQESA-N 415.265 2.221 10 20 HECD CC[C@@H](C)[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712663 PILPMSDHUCFCGF-LHNVCGPYSA-N 410.898 2.410 10 20 HECD O=C(c1ccon1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426838 JVHIPKRQSBWTNX-MRXNPFEDSA-N 400.435 2.028 10 20 HECD CCN(C)[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429700 PCIJYPUZZKDUDI-YJBOKZPZSA-N 418.538 2.066 10 20 HECD Cc1nc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cs1 1842530168 JHXSJXPFQBAEBN-UHFFFAOYSA-N 423.498 2.061 10 20 HECD O=C1c2ccccc2C(=O)N1CCC1=CCN(c2cc(N3CCOCC3)ncn2)CC1 480820700 LUHJBTKPAOAKBI-UHFFFAOYSA-N 419.485 2.136 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCC[C@H]1C(=O)N(C)C 726278784 YPKWKUIJJNSFQG-FQEVSTJZSA-N 403.571 2.227 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(-c2ncon2)cc1)c1ccc(N2CCOCC2)cc1 727039235 ULDSTMRMJULAQE-OAHLLOKOSA-N 421.457 2.389 10 20 HECD CSc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1 728014533 CTRDZJDVGNFLNK-UHFFFAOYSA-N 416.502 2.279 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1 728979633 JRVZWHOUHHZRPA-NSHDSACASA-N 414.430 2.225 10 20 HECD CNS(=O)(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 733349043 SYIAPDHZDUGSBW-LJQANCHMSA-N 408.568 2.146 10 20 HECD COc1ccc(CNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 741730873 WMRIWCIVUPXYPB-UHFFFAOYSA-N 413.518 2.289 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCn2cncn2)NC(=O)OC(C)(C)C)cc1 742754261 OCYGUKRUEKKHFR-QGZVFWFLSA-N 402.499 2.116 10 20 HECD O=C1C[C@H](Cc2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)C(=O)N1 743339796 YQPFCDZSJATIKS-VQTJNVASSA-N 422.481 2.419 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCS(=O)(=O)NC(C)C 745787208 VWIXYKKXGBOVSM-UHFFFAOYSA-N 422.345 2.014 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@]1(O)CCSC1 747580618 UQEPZFCTNDIKAL-QGZVFWFLSA-N 419.469 2.209 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)cc1 749864042 TUTFMLAGIQTGLL-OAQYLSRUSA-N 416.428 2.114 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 750874878 OYYZYBHENJOOPJ-SFHVURJKSA-N 401.467 2.374 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1F 753857069 JFRYLEQHYSUOTR-UHFFFAOYSA-N 414.437 2.454 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(=O)N(C)c4ccccc43)CC2)cc1 754070206 XMAGGJGCAYWCCP-FQEVSTJZSA-N 424.545 2.051 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@H]3CC(=O)c3ccccc3)nc12 757637509 DUCKVQKHLCQUJX-QGZVFWFLSA-N 424.457 2.085 10 20 HECD Cc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 762619915 RCDDFTSLYJXXRR-HNNXBMFYSA-N 423.485 2.453 10 20 HECD COCc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 772588164 RGNIBDYNRJTNJQ-UHFFFAOYSA-N 403.504 2.390 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccnc1Br 774269130 GPRVTDRJRHYFAU-UHFFFAOYSA-N 401.264 2.475 10 20 HECD CN1CCN(c2ccc(CNc3cnn(Cc4nnc5n4CCCC5)c3)cc2)CC1 775028571 DMZKFIMSNJYLGG-UHFFFAOYSA-N 406.538 2.223 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCC3CCOCC3)CC2)cc1 778326148 QAIUVIYDNAKFCT-BQYQJAHWSA-N 415.534 2.175 10 20 HECD CC(C)(C)c1cc(O)c(O)c(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)c1 779869564 JUNODASNENCJPX-QGZVFWFLSA-N 412.552 2.022 10 20 HECD C[C@H]1C(=O)CC[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1(C)C 780404604 IQVZWBASVUTXCS-YJBOKZPZSA-N 406.548 2.179 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 781502404 AYWLMNCVGBWVJN-NSHDSACASA-N 402.403 2.012 10 20 HECD CS[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789956018 RPOZDYJNCVHZIE-LBPRGKRZSA-N 419.469 2.026 10 20 HECD COC(=O)[C@H](c1cccc(Cl)c1)N1CCN(C(=O)c2cccc(O)c2O)CC1 790890895 KOXUZMRFJGFKQP-KRWDZBQOSA-N 404.850 2.423 10 20 HECD Cc1cc(F)c(C(=O)O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 793351407 CEBWZXGZXSJJOW-UHFFFAOYSA-N 402.425 2.005 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cn4ccc(C)cc4n3)CC2)cc1 793749237 MEPRAJZCMOPVEO-UHFFFAOYSA-N 421.501 2.006 10 20 HECD CCCN(CCN1CCCCC1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796460159 SERDOXSDDYBVJL-UHFFFAOYSA-N 420.573 2.476 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1OC 796790853 PLCHTEOOLHYVRF-NSHDSACASA-N 402.403 2.012 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c(O)c1 797389979 IECWQJHSNJFSMG-UHFFFAOYSA-N 400.822 2.495 10 20 HECD Cc1cc(C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 800551887 FGPCHOIDGPNQSC-UHFFFAOYSA-N 405.520 2.413 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)cc1F 803661887 CPCVHAJXKFXIJU-SFHVURJKSA-N 422.451 2.205 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCn1cc(Br)cn1 804187853 GVMFFPMCUNLKCO-UHFFFAOYSA-N 413.659 2.469 10 20 HECD CCC(=O)c1ccc(N2CCN(c3ccc(OC)c(F)c3)CC2)c(S(N)(=O)=O)c1 804540220 TWWUHFCKMYTCDY-UHFFFAOYSA-N 421.494 2.401 10 20 HECD COc1cc(F)cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 806454223 QEUZEHPEOLJWNH-SFHVURJKSA-N 416.449 2.364 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3[C@@H]3CCCO3)cc2)C1 806494722 VUSFPPJZIWSRRE-RLLQIKCJSA-N 400.523 2.241 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1nc(-c2cccc(F)c2)no1 807291893 PJXSDVXLIOXXRP-UHFFFAOYSA-N 421.432 2.185 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC[C@H]1C1CC1 807768423 JHYIKEHSMBWAHW-QAPCUYQASA-N 423.460 2.010 10 20 HECD O=C(CN1CC[C@H](n2cc(Cl)cn2)C1)NCc1ccc(N2CCOCC2)c(F)c1 810131088 GNIIMJHYFHJVSM-KRWDZBQOSA-N 421.904 2.075 10 20 HECD COc1cnc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc1 815523020 UQFHYTSXTLJVOJ-UHFFFAOYSA-N 417.377 2.056 10 20 HECD CCn1c(SCC(=O)OCC(=O)c2ccc(O)c(O)c2)nnc1-c1ccco1 916615744 LQYWUWBJPJOXOC-UHFFFAOYSA-N 403.416 2.487 10 20 HECD Cc1ccc(C)c(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 916676601 MFYSQHLSHGMXAJ-UHFFFAOYSA-N 402.516 2.233 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1c[nH]c(C(F)(F)F)c1 1327469042 QLICPIIPYHBNIU-UHFFFAOYSA-N 407.389 2.488 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)cnc1Cl 1796600743 IFBURKFTCPVSDJ-CLLJXQQHSA-N 420.828 2.246 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@@H]1CCc2ccccc2O1 1796602376 ARZZOZYGBPNMMI-ZMMAXQRCSA-N 423.469 2.138 10 20 HECD CC(C)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827018851 GLNQBZHYWYFEEL-SFHVURJKSA-N 418.538 2.114 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1 302810744 VMEYJKXWUSVGJP-UHFFFAOYSA-N 407.518 2.349 10 20 HECD COC(=O)CCOc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729062314 PVSUNBQGNYIVJD-CYBMUJFWSA-N 416.430 2.159 10 20 HECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N2CCCC2)cc1 729286579 DOSKMRCDVFSSPA-FQEVSTJZSA-N 405.506 2.191 10 20 HECD CN(C)C(=O)C1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCC1 733354508 ZCZZGTRDBOWTQN-UHFFFAOYSA-N 420.529 2.235 10 20 HECD C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc(N2CC=CC2)cc1 740917914 VDSOIPHSQYJLSZ-HXUWFJFHSA-N 420.561 2.468 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(N2CCCC2=O)cc1 741099904 MCXFKJFHRQELAO-UHFFFAOYSA-N 404.470 2.445 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C2CC2)[C@H](C)O)c1C 745742589 AJYJVSRCRPPHLB-KKSFZXQISA-N 412.486 2.404 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]([C@H](C)O)C3)CC2)cc1 747393278 AYKYLMUCXZDSJB-RBUKOAKNSA-N 404.555 2.010 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1nc(-c2nc[nH]n2)no1 752659600 NMEVBPCRMXEZHC-AWEZNQCLSA-N 402.434 2.256 10 20 HECD C[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1O 756362559 JWERBVMUVDHCRW-CQSZACIVSA-N 421.475 2.172 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc(-c4nc[nH]n4)c3)CC2)cc(OC)c1OC 760086786 VRCILKXEQRGFED-UHFFFAOYSA-N 423.473 2.460 10 20 HECD Cc1c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1CC(C)C 766528376 OUCOKMOXPRESEM-UHFFFAOYSA-N 419.551 2.404 10 20 HECD CN(CCCOc1ccc(S(C)(=O)=O)cc1)Cc1cc2c(cc1O)OC[C@@H]2O 768443578 SUVOGGDQWSEKMC-IBGZPJMESA-N 407.488 2.122 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)c2)CC1 769849609 XFNQQBYZUPMWBB-UHFFFAOYSA-N 423.560 2.033 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 770255025 FHWQJVCJYHYGMF-ZDUSSCGKSA-N 417.487 2.187 10 20 HECD CNC(=O)COc1cccc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 772456872 HISNAPUCXQXZFB-HXUWFJFHSA-N 412.486 2.267 10 20 HECD C[C@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1ccc(N(C)C)cc1 777705287 PSUKSPWKTJQEPF-INIZCTEOSA-N 403.552 2.402 10 20 HECD CCC1(O)CCC(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778418979 JGTJQACSCILSFY-CMDGGOBGSA-N 415.534 2.100 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n(-c2ccccc2F)n1 785296865 JXPHRTZAHAUBPE-LBPRGKRZSA-N 412.421 2.417 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(C)cs1 789800995 YFECKKNTVXEISG-INIZCTEOSA-N 420.510 2.311 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)S1=O 792389334 SJLTVWIOKJCQBE-KBPBESRZSA-N 410.495 2.242 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3ccc(OC)cc3O)C2)c1 792975804 FQOWSZLIOPDQGG-OAHLLOKOSA-N 401.463 2.496 10 20 HECD C[C@H](NC(=O)C(=O)N1CCOC[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803298848 FMIBLDMIYCDIAZ-PGRDOPGGSA-N 423.513 2.301 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)N(C)C1CC1 804427727 GMAAQDYNVVMCCZ-QGZVFWFLSA-N 412.534 2.473 10 20 HECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NCc1ccc(N3CCCC3)cc1)C2 804967224 LIWNBRZWSWUSRC-SFTDATJTSA-N 413.566 2.170 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)Cc2cncn2C)NC(=O)OC(C)(C)C)cc1 806944359 DYKXWWBXCKNHHW-GOSISDBHSA-N 401.511 2.411 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)[C@H]1CCCN(C(=O)OC)C1 808030552 ZKWJMAASYUTYKS-AEFFLSMTSA-N 418.538 2.084 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC(O)(c2ccc(F)cc2)C1 812007593 ZCBGPMLYLNBSBB-UHFFFAOYSA-N 403.429 2.214 10 20 HECD COCCN(C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)[C@@H]1CCS(=O)(=O)C1 812206609 HHACPMBEOPVQCP-GOSISDBHSA-N 420.531 2.378 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)C1 813837395 KTUSUWKHONGWHD-XTKXOIQPSA-N 417.506 2.265 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3O)cc2F)C[C@@H](C)O1 918138763 RRDKGAOGDWZJTN-TXEJJXNPSA-N 404.398 2.378 10 20 HECD O=C(Cn1nc2n(c1=O)CCCCC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1116242134 RJCVADPKJUBFBX-UHFFFAOYSA-N 416.437 2.185 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ncoc3C(C)C)CC2)cc1 1116453268 XCWJMKGFFBTVFI-MUUNZHRXSA-N 405.520 2.404 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C23CC(C2)C3)[C@H]1c1cccnc1 1813642768 QNNZHFTVLXGWBO-BAQLXYBTSA-N 408.458 2.008 10 20 HECD COc1cccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1O 727761283 SXIRRCFFCULDRP-OAHLLOKOSA-N 410.426 2.106 10 20 HECD C[C@@H](NC(=O)CCNC(=O)c1n[nH]c2ccccc12)c1ccc(N2CCOCC2)cc1 728071779 YDKHIBPLQWBIRT-MRXNPFEDSA-N 421.501 2.397 10 20 HECD C[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2O1 730017339 NWAPTFNAMJRHJB-AWEZNQCLSA-N 406.479 2.464 10 20 HECD Cc1cc(C(=O)Nc2cc(C(=O)NCCC(N)=O)ccc2F)c(C)n1-c1ccccn1 731192256 WOROAJKIVHAKRD-UHFFFAOYSA-N 423.448 2.486 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccs4)nn3)cc2)C1 742566972 UEUZCFOEZTYAKY-MRXNPFEDSA-N 424.530 2.020 10 20 HECD O=C(C[C@@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799614 LUMHVISYKLQIQZ-UONOGXRCSA-N 402.463 2.198 10 20 HECD C[C@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405124 CBSFTOLPQRXHMT-HNNXBMFYSA-N 405.514 2.488 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1nnc2n1CCC2 751033021 KJXUTLMXUTZLJS-UHFFFAOYSA-N 415.453 2.070 10 20 HECD Cc1ccc(C(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)c(O)c1O 751529873 IEYNRWDGBGVCQT-UHFFFAOYSA-N 403.866 2.456 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 752099082 ANSJTHBZZULSMX-NRFANRHFSA-N 415.509 2.126 10 20 HECD C[S@@](=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 752895258 QPQWILPSNZFRNO-MUUNZHRXSA-N 405.495 2.399 10 20 HECD CC(=O)NC1CCC(N(C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 753109774 SQMYJUWHJUCRHZ-UHFFFAOYSA-N 420.529 2.376 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(OC(C)=O)CC3)cc2F)CC1 753613820 VLDOCYLPNIGNQM-UHFFFAOYSA-N 406.502 2.205 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN(C(=O)N4CCCC4)C3)CC2)cc1F 753739323 FCNNGIBTECRORU-QGZVFWFLSA-N 418.513 2.411 10 20 HECD COc1ccc(C(=O)NCc2cccc(OC)c2O)nc1I 761968406 UVEACPAAVGBXMT-UHFFFAOYSA-N 414.199 2.339 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 763282584 GIJFBLIUYOPPFO-YJBOKZPZSA-N 418.515 2.388 10 20 HECD CCN(CC(=O)N(C)C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 764192584 OMOIYMFLOKMXBT-AWEZNQCLSA-N 407.470 2.199 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1Cl 765040158 FXPZYFKFPPMJOA-UHFFFAOYSA-N 402.841 2.049 10 20 HECD O=C(NC[C@@H]1CCCS1(=O)=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765899451 NPZKKPWRTVAAAU-CJNGLKHVSA-N 417.478 2.133 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OC)c(Cl)n3)nc12 766776795 HKXYBJHNGIMKOB-UHFFFAOYSA-N 406.782 2.026 10 20 HECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CCCN(Cc2ccccc2O)CC1 770511083 ZBHYWSKEVUPPSK-UHFFFAOYSA-N 404.488 2.060 10 20 HECD CCOC1CC(O)(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 770697482 CWNCIIQPPVSQEL-JTOQLSFASA-N 413.465 2.486 10 20 HECD CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NCc1ccc(N2CCN(C)CC2)cc1 771842382 NCIMZVJQNBUFOJ-QHCPKHFHSA-N 405.546 2.367 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c1O 775054178 LEVDMPRAILJYJD-OAHLLOKOSA-N 413.496 2.135 10 20 HECD Cc1cc(Br)cc(CNCCS(=O)(=O)NC[C@H]2CCCCO2)c1O 776190351 SHNVCVRCYNLZOM-OAHLLOKOSA-N 421.357 2.041 10 20 HECD COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC 785483277 OPQIBPTVIYSKKY-AWEZNQCLSA-N 415.490 2.272 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(F)c(F)c3)CC2)cc1 786685935 YDAYIYMXYUBPPH-UHFFFAOYSA-N 403.429 2.375 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@H]1CCc2ccccc21 789798153 CNYMHNFNJIWDMY-GOSISDBHSA-N 411.477 2.125 10 20 HECD COc1ccc(N2CCC(NC(=O)c3nnn(Cc4cc(C)no4)c3C)CC2)cc1 794272527 VYMGVNCKCLHSPW-UHFFFAOYSA-N 410.478 2.339 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@](C)(C4CCCC4)C3=O)CC2)cc1F 802734552 RYGQEICKHDWCIY-OAQYLSRUSA-N 404.486 2.415 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2c(F)cc([N+](=O)[O-])cc2F)c1 803303892 AXDKSTJRNKBFRJ-UHFFFAOYSA-N 402.331 2.307 10 20 HECD CCc1nc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 803310526 HPNJNXQEHNDCSA-OAHLLOKOSA-N 416.547 2.378 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3ccn(-c4ccccc4)n3)ccc21 803685391 FRRIQDHONRJSFR-UHFFFAOYSA-N 417.513 2.230 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCC[C@H]3CCCCO3)CC2)cc1 807994874 VNLSFYYOVZCORF-HXUWFJFHSA-N 403.523 2.199 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)[C@@H]1CCCN(C(=O)OC)C1 808030553 ZKWJMAASYUTYKS-FUHWJXTLSA-N 418.538 2.084 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccnc1OCC(F)F 809634266 VXMDMFWZEMEHQT-UHFFFAOYSA-N 407.417 2.486 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3ccc(N(C)C)nc3)n2)o1 811823234 UBZYQDROXMHELU-UHFFFAOYSA-N 421.504 2.301 10 20 HECD CC(C)(C)OC(=O)N1CCN(C(=O)CNCc2cc(Cl)c(F)cc2O)CC1 816537383 CSFOPKVAKAKDLA-UHFFFAOYSA-N 401.866 2.354 10 20 HECD COCCN(CCOC)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 899656896 XBTJAWUFJYGCEL-UHFFFAOYSA-N 412.398 2.105 10 20 HECD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)Cc1cc2c(cc1O)OCO2 915803844 JFUSLRXANYCUHA-UHFFFAOYSA-N 413.474 2.418 10 20 HECD Cc1nc(NC(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)sc1C 920638354 XQWNJPCOZYFNLL-SECBINFHSA-N 413.477 2.021 10 20 HECD CNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 1317916118 XRENIPSLCPGDTE-GOSISDBHSA-N 423.517 2.378 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4nc(O)[nH]c4c3)CC2)cc1 1319699135 VGHONQPYFAJYOT-UHFFFAOYSA-N 402.476 2.178 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCCC3=O)cc2)C1 1321857204 LMWWNABDKJAKGH-SFHVURJKSA-N 420.513 2.445 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)cc(F)c1 1796604782 NBNDVEPLWKPYCU-MUJYYYPQSA-N 403.385 2.337 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)nc1)c1cc(O)c(O)c(Cl)c1 1799361765 JTDMJIXBUVRTQO-BTTYYORXSA-N 417.849 2.417 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccnc1 1816376427 ZTPOLMPIAONXQV-OAHLLOKOSA-N 408.418 2.231 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824134529 QLYGQJZCDJCLTQ-APWZRJJASA-N 419.522 2.133 10 20 HECD O=C(c1cnc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250019 BKJLEFYPHFSTSQ-UHFFFAOYSA-N 423.256 2.325 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(N4CCCC4=O)c3)ccc21 60763614 LNITXAYUXRJJHO-UHFFFAOYSA-N 406.486 2.451 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@H](C)NC(=O)C3CCCC3)CC2)cc1 727104237 PUJZBSLFAVPBEK-SFHVURJKSA-N 416.566 2.018 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 727766482 WHSBSLQYYMSRGH-RTWAWAEBSA-N 411.502 2.483 10 20 HECD O=C(CN1CCC[C@H](C2OCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 728055711 XOADGHZWSFVJGV-HNNXBMFYSA-N 420.465 2.485 10 20 HECD O=C(COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)NCC1CCC1 731235972 NMEPTEHPNWSGFK-UHFFFAOYSA-N 422.393 2.443 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cccnc3-n3cncn3)cc2F)CC1 731278403 PQBIUQLJPLEPIP-UHFFFAOYSA-N 424.484 2.265 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cc2c(nc1O)CCC2 733647351 PMSQECYAEZXCBO-UHFFFAOYSA-N 410.518 2.484 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1nc(C(C)(C)C)ns1)c1ccc(N2CCOCC2)cc1 737156578 ANEFZSJSFGBBFV-CYBMUJFWSA-N 417.535 2.488 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1C[C@@]12CCc1ccccc12 743313041 JEMNBFCRDDIRAW-FYYLOGMGSA-N 410.539 2.442 10 20 HECD CCc1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 743789340 YULCNJFDPORRQD-UHFFFAOYSA-N 403.504 2.289 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nccn3Cc3ccccc3)nc12 744413365 XEFGHIPPHOEACX-UHFFFAOYSA-N 420.473 2.488 10 20 HECD CC(=O)NC(C)(C)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744934059 DIRZRUIDMRDHNF-GFCCVEGCSA-N 422.437 2.247 10 20 HECD CCN1CCC[C@@H]1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748018917 GOHUFUXFGRDEQN-CQSZACIVSA-N 409.533 2.469 10 20 HECD CCn1cc(S(=O)(=O)NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cn1 749220770 LLXJIRHKLBVPFZ-UHFFFAOYSA-N 404.492 2.240 10 20 HECD CN(CCN1CCCC1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060811 OBHQHLMAFIZUOZ-UHFFFAOYSA-N 409.533 2.422 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(CC(=O)NC(C)C)CC3)c2C)cc1 751829669 CRKPFDFKGWQRGG-UHFFFAOYSA-N 412.534 2.385 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 754075754 QYHLEOOHRJAUOH-ZCYQVOJMSA-N 424.589 2.167 10 20 HECD COc1ncc(/C=C/C(=O)N(C)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cn1 754630379 OWWKHCBZJORFQV-IZZDOVSWSA-N 404.492 2.190 10 20 HECD CC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c(S(N)(=O)=O)c1 769359342 MHXOWUSLIKBXDF-UHFFFAOYSA-N 421.494 2.249 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc([S@@](C)=O)c(F)c3)ccc21 774190536 SMNWIKHRVHHCGU-MUUNZHRXSA-N 403.479 2.200 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1cccs1 774852798 FKFOSPXRHVORGX-GOSISDBHSA-N 400.548 2.384 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3([C@@H](C)CCO)CCC3)CC2)cc1 775734650 VEWXGYZFXLADRD-IBGZPJMESA-N 418.582 2.305 10 20 HECD COCCNS(=O)(=O)c1ccc(CNCc2cc(Cl)cc(F)c2O)cc1 776083019 MZKVAMORDQPGGQ-UHFFFAOYSA-N 402.875 2.399 10 20 HECD CCC[C@@H]1C[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780161275 DBWZNUCHFQPJAK-ZWKOTPCHSA-N 422.497 2.417 10 20 HECD CCO[C@@H]1C[C@](CO)(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 780337599 DXTCTDKGCFBASX-ZWDAVXSWSA-N 405.539 2.450 10 20 HECD COCCOC(=O)CSCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783540996 FGKZPYUMDORGGT-UHFFFAOYSA-N 413.451 2.323 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(c3ccccc3F)CC2)cc1 784563005 HGLAYOCOIIRKAZ-UHFFFAOYSA-N 415.465 2.163 10 20 HECD COc1cccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 787156115 IKDHCVNRFSLVCT-FQEVSTJZSA-N 412.486 2.267 10 20 HECD CC(C)(C)OC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789798842 DTCMGZUXDYHNKN-UHFFFAOYSA-N 421.513 2.085 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3)nc12 791619473 CVCAKOZYYTURIW-HDICACEKSA-N 421.501 2.175 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NOCc3ccccc3OC)CC2)cc1 798394786 OIIJREIIMGDAGE-UHFFFAOYSA-N 414.506 2.257 10 20 HECD O=C(COC(=O)c1cc(C2CC2)no1)NCc1ccc(N2CCOCC2)c(F)c1 799579275 MYJPTAUROIPBFX-UHFFFAOYSA-N 403.410 2.001 10 20 HECD COCCO[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 802005669 RQFQAONUYNITFX-SFHVURJKSA-N 409.502 2.124 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2nc3c(s2)CCCC3)cc1F 803665044 VUBUOYXVRVHFEB-UHFFFAOYSA-N 404.511 2.202 10 20 HECD CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 804102444 YNUQZRFTODUXRP-GOSISDBHSA-N 412.538 2.296 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](N4CCCC4)[C@@H]3C)CC2)cc1 806620541 ZAGHXLBGCSBSLS-UGKGYDQZSA-N 415.582 2.085 10 20 HECD COc1cc(C)cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807540105 OVXDCVZVOBTOMB-UHFFFAOYSA-N 411.502 2.115 10 20 HECD O=C(NCc1ccc2c(n1)CCCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807573364 MCGWBFPZTOISFK-FQEVSTJZSA-N 423.513 2.490 10 20 HECD Cc1cc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)nc(C)n1 807670850 KXHDSQKZEKISFY-INIZCTEOSA-N 424.549 2.122 10 20 HECD CS[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 808758616 CRCPKCAJIJPRQR-GOSISDBHSA-N 407.580 2.376 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCc2cnc(C3CC3)nc2)C2CC2)cc1 808870853 RPNYKTZUQRSJJT-UHFFFAOYSA-N 407.518 2.270 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 810045703 UAYJWYAVWACLEQ-UHFFFAOYSA-N 418.515 2.358 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)COC)cc2)cc1 918434905 VXTAHFORSXWMEF-UHFFFAOYSA-N 412.490 2.373 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)cc1 918706306 OIBGULJKCAZHLQ-UHFFFAOYSA-N 423.922 2.349 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)COCC3CC3)cc2F)C[C@@H](C)O1 919150792 HKMWQZCYTZUNEO-HUUCEWRRSA-N 408.470 2.025 10 20 HECD CCC[C@H](C)N1C[C@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 919583618 JAZHBUMJNOEEFA-FUHWJXTLSA-N 403.523 2.291 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCCC[C@H]3N(C)C)CC2)cc1 1318438363 AURWWOFIVJPSKV-FGZHOGPDSA-N 417.598 2.379 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc2c(cc1Cl)NC(=O)CO2 1319139026 JIDQNLQIXVUFCX-UHFFFAOYSA-N 423.878 2.325 10 20 HECD C[C@H](O)C(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1791426548 IUCPLSHPYHSRCF-HNNXBMFYSA-N 420.469 2.294 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1799767067 OWWKTVYAGALHGF-DTFBLWLJSA-N 420.893 2.001 10 20 HECD Cc1cccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)c12 1801152657 ULPICDAHFMCDOE-MUJYYYPQSA-N 421.457 2.015 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(C(=O)CN(C)Cc2ccccc2O)CC1 303380916 NUABTMGKIZUVDD-UHFFFAOYSA-N 424.545 2.169 10 20 HECD O=C(CSc1nnnn1C1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566375 WWNPWBJIUPNSLB-UHFFFAOYSA-N 424.477 2.487 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](C4OCCO4)C3)cc2F)CC1 730134065 LYIVOSHRTIGTAM-SFHVURJKSA-N 420.529 2.262 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3sc(C)nc3C)CC2)cc1 731046461 IXLAVQZKDWRUSZ-UHFFFAOYSA-N 417.579 2.432 10 20 HECD CCn1cc(CN(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 733795700 HSSQIOOEAGFVQN-IRXDYDNUSA-N 417.529 2.404 10 20 HECD CCn1cc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 742334032 DBBOPISTPSHNSG-CYBMUJFWSA-N 400.451 2.452 10 20 HECD CN(C)c1ccc(CNC(=O)Cn2nc(Br)nc2Br)cc1 746136911 AJPBUXMDCDLXEK-UHFFFAOYSA-N 417.105 2.186 10 20 HECD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccccc3O)cc2)C[C@H](C)O1 748354833 NXKRYODXPFEEGB-GJZGRUSLSA-N 404.488 2.120 10 20 HECD C[C@@H](N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1)C(F)(F)F 749552852 CHAMLESVIHHDRP-CQSZACIVSA-N 418.435 2.440 10 20 HECD C[C@]1(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO[C@H]1C1CC1 753123198 XOBGWSXGXSTGLG-JLMWRMLUSA-N 400.523 2.145 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc4c3COC4=O)CC2)cc1F 754040279 MDEJNTXRYMPVTP-UHFFFAOYSA-N 406.435 2.016 10 20 HECD COc1cc(N2CCN(C(=O)CCOCC(F)(F)F)CC2)cc(OC)c1OC 759222164 HQLKBSRRCHNSPY-UHFFFAOYSA-N 406.401 2.330 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765902703 BVZPUFAVRVCQGL-UHFFFAOYSA-N 420.263 2.159 10 20 HECD CC[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 767942571 LKOOMTFKZOQYEA-ZCCHDVMBSA-N 419.497 2.231 10 20 HECD Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2CO)c(C)n1-c1ccc(Br)cc1 770665569 KDVRJCWMWYBIQY-DLBZAZTESA-N 407.308 2.467 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1 774246734 KAYBGFFDAUZPKM-NDEPHWFRSA-N 416.377 2.283 10 20 HECD COCC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(N)=O 775970959 FFXRQEBDGSRUDQ-HNNXBMFYSA-N 408.296 2.477 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@@H](O)COc3ccccc3[N+](=O)[O-])cc2)CC1 783915399 HTXZLJBANDJMSA-GOSISDBHSA-N 415.446 2.082 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)C[C@H](OC)C4)CC2)cc1 784676574 WCNDQERNYKGRTC-JOCHJYFZSA-N 423.513 2.486 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(OCC(F)F)nc3)cc2)CC1 786261373 CGNLUVJTPYMEJW-UHFFFAOYSA-N 418.444 2.324 10 20 HECD CN(C)c1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 786901851 WULHLVAIIFNQOI-HXUWFJFHSA-N 411.502 2.282 10 20 HECD COC(C)(C)CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 787128380 GKHPPVKZCYULBU-HUUCEWRRSA-N 410.486 2.414 10 20 HECD COc1cccc(Cl)c1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788313818 WBGMYLAQWIMQLO-UHFFFAOYSA-N 417.893 2.118 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccs1 788318785 HIWFWHWGSHSYKB-UHFFFAOYSA-N 401.532 2.295 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)c3ccc4c(c3)OCO4)CC2)cc1 794254836 MYUDPPRVUBVDQY-KRWDZBQOSA-N 411.502 2.466 10 20 HECD CCOCC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 799319127 AUPDJIZGVLGJCY-UHFFFAOYSA-N 413.497 2.375 10 20 HECD C[C@@H](CO[C@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676434 IGZPPICEKOYLEQ-UWJYYQICSA-N 417.550 2.382 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CC3CCN(C)CC3)cc2)CC1 805023188 COBSZNQZKLBKBF-UHFFFAOYSA-N 400.567 2.339 10 20 HECD Cc1noc(C)c1CCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806477850 NLYNOZHDRHZTRF-GOSISDBHSA-N 415.490 2.254 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807545111 BZTYCAAIFPTRJE-GCJKJVERSA-N 408.546 2.348 10 20 HECD CN1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)N[C@H]3CCOC3)cc2)CC1 809710481 XFAMYHYALTXQIB-RBBKRZOGSA-N 416.566 2.308 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](CO)(Cc4ccccc4)C3)nc12 812872947 WVAATBWPOOEHMV-QHCPKHFHSA-N 424.501 2.429 10 20 HECD CCCNC(=O)C1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 874097323 HYOWJEXWDFSTLK-UHFFFAOYSA-N 417.550 2.165 10 20 HECD COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918001019 XEBXPNWEDQBSCD-QGZVFWFLSA-N 410.474 2.497 10 20 HECD NC(=O)[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccccc1 920058673 AZSMAKGMKNCTOA-NRFANRHFSA-N 420.492 2.259 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cl)c2c(c1)OCO2 1320143097 RVDSJXPLOOBEHS-ZDUSSCGKSA-N 407.806 2.384 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@](C)(CO)C3)cc2F)C[C@@H](C)O1 1322912741 WPJXTXBNQJYCHT-DRSNIGMVSA-N 407.530 2.150 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ccncn3)CCC2)cc1)c1cc(O)nc(O)c1 1788428076 YXIDGWKURZAETR-UHFFFAOYSA-N 405.414 2.344 10 20 HECD O=C(Cc1cc(F)ccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603561 SGGULSFAGAANBE-MUJYYYPQSA-N 417.412 2.266 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1)C2)c1cc(O)c(O)c(Cl)c1 1799769008 IYLNUCJBLILNKJ-JLVBRIDZSA-N 416.861 2.268 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799945554 HYCVTDNQDUCWGO-MCADOKRXSA-N 408.502 2.464 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCCS1 1823013799 MOEXAPMAQHPHFL-ZIAGYGMSSA-N 417.491 2.417 10 20 HECD Cn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827426752 FCFGPWAUBFKQQK-SFHVURJKSA-N 412.490 2.378 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCNC(=O)c3ccco3)cc2F)C[C@H](C)O1 55529434 LSLSNGIXSXCZEW-GJZGRUSLSA-N 403.454 2.469 10 20 HECD C[C@@H](NC(=O)c1ccccc1NS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 148595282 ZHOSQVFDOHVFSC-OAHLLOKOSA-N 403.504 2.386 10 20 HECD C[C@@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 302963361 QPYHDNNIESDVSA-OAHLLOKOSA-N 401.532 2.392 10 20 HECD Cn1cc(-c2ncc(/C=C3\CCn4c3nc3cc(C(=O)O)ccc3c4=O)cn2)cn1 530528925 RTBYZVXOYLRMAN-AWNIVKPZSA-N 400.398 2.230 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3c(C)oc4ncnc(O)c34)cc2F)CC1 730235982 QSXJHBDSFFMTBS-UHFFFAOYSA-N 413.453 2.448 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 734215149 DDRUZIURWQQYER-SJORKVTESA-N 420.529 2.233 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c1O 737286210 SKSSAAOTHCZXIH-GASCZTMLSA-N 413.474 2.269 10 20 HECD Cn1cc([C@@H](O)CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 745906364 ZOBLFBWFQGLWGH-PBHICJAKSA-N 409.437 2.023 10 20 HECD COc1cc(OC)c(CNC(=O)CN2CCOc3cc(N(C)C)ccc32)c(OC)c1 746493107 QLSGRXGWDURCBW-UHFFFAOYSA-N 415.490 2.294 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3[C@H]4CC[C@H]3CC(=O)NC4)c2C)cc1 748826337 CGYCTQHWCTWUCD-OALUTQOASA-N 409.486 2.416 10 20 HECD Cc1nnc2n1C[C@@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 750731844 WILBVXDBHSZWLV-VBQJREDUSA-N 401.486 2.218 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccnc3Br)cc2)C1 758176736 TVUBLNOWJVGPGI-CQSZACIVSA-N 417.307 2.476 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(OC)cc3C(C)=O)CC2)cc1 758220955 ARCXMHWEIZNXNH-IBGZPJMESA-N 414.502 2.468 10 20 HECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C(=O)[C@@H]2C1 761088216 BSFDCGYBEKMCNZ-BFIPOCKSSA-N 405.470 2.381 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCNC(=O)C3)c2C)cc1 761207704 OXFZDLMHLLZKLY-INIZCTEOSA-N 412.442 2.133 10 20 HECD CN1CCCc2cc(CNC(=O)CCC(=O)N3CCN(c4ccccn4)CC3)ccc21 765337227 STBMTQAHVWXSKM-UHFFFAOYSA-N 421.545 2.209 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 768922777 JCTLHDQXOFMFJG-CQSZACIVSA-N 410.490 2.375 10 20 HECD O=C(NCCc1ccccc1F)C(=O)NCc1ccc(N2CCSCC2)cc1 775198955 YWOYUGRQUHTNIY-UHFFFAOYSA-N 401.507 2.354 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CC3(Cl)Cl)CC2)cc1 778238862 QNEOJSXYMGREEX-PSKZRQQASA-N 412.317 2.210 10 20 HECD Cc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1F 781689585 DDDKMWHRGLQEJZ-MRXNPFEDSA-N 405.495 2.314 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1 785428595 NVOIHBYANNDJNO-GOSISDBHSA-N 418.538 2.275 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788938264 QMXCMZLWSOFSBM-LJQANCHMSA-N 422.529 2.307 10 20 HECD C[C@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800890 RLXRRUPVNOLQAX-INIZCTEOSA-N 411.477 2.424 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c(O)c1 797389775 XRDCXKRGUGLECV-INIZCTEOSA-N 418.421 2.353 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](c1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803308330 WKBSGPVEFXEHOG-HRAATJIYSA-N 408.502 2.363 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(F)c(F)c3)CC2)cc1 803554599 QLNAGLGJEUWGJX-UHFFFAOYSA-N 417.456 2.371 10 20 HECD COC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803677528 QCEBXFSCSXJUIR-UHFFFAOYSA-N 415.534 2.483 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)cc1F 804853287 WDSFZBLCEGBTPF-PKOBYXMFSA-N 404.530 2.231 10 20 HECD Cc1nn(C)cc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 804987155 YWFPKJRCEKSXAS-UHFFFAOYSA-N 400.451 2.277 10 20 HECD C[C@H](NC(=O)C(=O)N1CCn2c(nnc2-c2ccccc2)C1)c1ccc(N(C)C)cc1 807673732 YBCZXJSREATNSY-INIZCTEOSA-N 418.501 2.231 10 20 HECD O=C(NC[C@@H]1CCCCN1C1CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809821886 ACMNRUQXGXVPJH-VQTJNVASSA-N 415.534 2.033 10 20 HECD O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1ccc2nc(O)nc(O)c2c1 915220729 PBWRVJCWTKLHBK-UHFFFAOYSA-N 400.460 2.120 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3ncc4ccccc4c3=O)cc2F)C[C@@H](C)O1 917711304 FVHGEOGAIYWMLE-HZPDHXFCSA-N 424.476 2.466 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCS(=O)(=O)C1 919568982 UTYXARHPWJNCPO-KBPBESRZSA-N 410.517 2.004 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 920635008 AXZCSHPTQVOFMD-WFGGJUAMSA-N 412.508 2.250 10 20 HECD CC(C)(C)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796014471 OXLOOEUVQFPMEX-BTTYYORXSA-N 409.914 2.391 10 20 HECD CCc1nc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)co1 1845501609 HMRNYENIGPORNF-UHFFFAOYSA-N 405.838 2.432 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O 426867342 UKACWBDRVQUBDF-JOCHJYFZSA-N 414.506 2.369 10 20 HECD CN(CCN1CCOCC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729610703 BFUKCMBHQDTDHT-UHFFFAOYSA-N 412.481 2.230 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1 729627740 QZGRNOYGSUWQDH-TZIWHRDSSA-N 400.567 2.482 10 20 HECD COC(=O)CCc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 729787153 CTBMZVOJXZUDRQ-UHFFFAOYSA-N 409.486 2.430 10 20 HECD C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NCc3ccc(N(C)C)cc3)n(C)c2)C1 730162417 SWZKHRCMQOSOPL-MRXNPFEDSA-N 418.563 2.442 10 20 HECD COC(=O)N(C)Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 735326422 KCIBAWKQFXDEFM-UHFFFAOYSA-N 407.448 2.214 10 20 HECD COC(=O)N(C)Cc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 735393762 GHXUNNOCXIDQKE-CYBMUJFWSA-N 415.446 2.415 10 20 HECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NCc1c(O)ccc2c1CCCC2 743715698 BXAWQBWFVQBBGI-DEOSSOPVSA-N 419.481 2.281 10 20 HECD COCCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746779612 LFSLTTDTPHXUCA-UHFFFAOYSA-N 401.486 2.375 10 20 HECD CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2O)cc1F 751151950 YSCOXHUOWOCBHP-UHFFFAOYSA-N 402.469 2.160 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC([C@@]3(C)NC(=O)NC3=O)CC2)cc1F 754377025 WEMVCHDYEWAWKX-OAQYLSRUSA-N 419.501 2.192 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3c(OC)ncnc3N(C)C)CC2)cc1F 754452412 RTKBOLKCFFMCIP-UHFFFAOYSA-N 404.446 2.053 10 20 HECD C[C@H](NC(=O)N[C@H](CO)C[C@@H](O)c1ccccc1)c1ccc(N2CCOCC2)cc1 754584930 YQLAOOCPMWCZOS-RBDMOPTHSA-N 413.518 2.368 10 20 HECD Cc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ncn1 757921622 YOSUNYHZRDDCNJ-UHFFFAOYSA-N 404.473 2.283 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](C)N3CCCCC3)CC2)cc(OC)c1OC 759277360 HZDKZIYFUKIPQK-KRWDZBQOSA-N 420.554 2.418 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@](C)(C(=O)OC)C3)cc2F)CC1 760168163 MRNHJHYKCNSPSW-NRFANRHFSA-N 406.502 2.062 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4ccccc4F)C3=O)cc2)C1 761116617 BKZBHOYEVSREBC-DNVCBOLYSA-N 410.449 2.321 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n(-c2ccccc2)n1 761898256 QZOVDOPZDUGSPA-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CCN(CCCN[C@@H](C)c1ccc(N2CCOCC2)cc1Cl)S(C)(=O)=O 765253728 LRGFTRKEGBGNJI-HNNXBMFYSA-N 403.976 2.499 10 20 HECD C[C@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)c(F)c1 765326168 UXSOVIPBOPDVTE-DOTOQJQBSA-N 418.465 2.482 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C 768167963 REZVKHJYYGFLTJ-UHFFFAOYSA-N 400.454 2.157 10 20 HECD C[C@@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N(C)C)cc1 776243560 DUQGIXVNBCTOOT-PBHICJAKSA-N 401.463 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCOC(C)(C)C)CC2)cc1 778388492 GBYFSJHFTIHRST-KHPPLWFESA-N 403.523 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(C)(C)[C@@H](O)C(C)C)CC2)cc1 778393679 HXYSJTDKDUNTDU-NEQMZLFVSA-N 417.550 2.059 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(N2CCCCC2)nc1 787204189 XKRKWDZGSAVUOT-UHFFFAOYSA-N 419.576 2.443 10 20 HECD CN(C)CCOCCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788015497 BNJJMCIBOAHLFN-OAHLLOKOSA-N 400.470 2.134 10 20 HECD Cc1cnc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)s1 788312065 BWDMDGWFFBSPCE-SFHVURJKSA-N 414.531 2.172 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(OCC2CC2)nc1 788931863 JVBXXLOQXREZCB-UHFFFAOYSA-N 408.502 2.403 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)ccc1C(N)=O 789743853 KNYXZASIPUCQFQ-AWEZNQCLSA-N 412.490 2.455 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOC3CCCC3)cc2F)C[C@@H](C)O1 789817194 GUOHTPVUFYCULT-IYBDPMFKSA-N 421.513 2.131 10 20 HECD COC[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789856210 QHLVOTPQULVCBZ-SFHVURJKSA-N 405.564 2.131 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C(C)C)C(C)(C)O)CC2)cc1 790122579 ADPOQLJHMVFXPD-FQEVSTJZSA-N 406.571 2.302 10 20 HECD CC1CCC(OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 795950715 IGSYKCKDXOMRSM-UHFFFAOYSA-N 422.497 2.417 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1OC(C)C 799262923 GTJVRNYDCGFTKE-UHFFFAOYSA-N 416.430 2.230 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3cccc(F)c3)C2)cc1F 803665061 WEUOTHLJNGWIRK-LJQANCHMSA-N 403.429 2.247 10 20 HECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 806878197 IOIXMHOXTSKVPI-UHFFFAOYSA-N 400.454 2.239 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CCCCS1(=O)=O 807929888 FJVNHFZPCPQFCT-IBGZPJMESA-N 410.536 2.342 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)cc2)C1 917835089 ZDOOARSQXBCMLS-OALUTQOASA-N 420.513 2.058 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1 918215388 FIOMAZMHMYSLNH-UHFFFAOYSA-N 418.563 2.452 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1 918309742 HSVXZUCTJUPWEA-UHFFFAOYSA-N 410.474 2.461 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c(Br)c3)cc2)C1 1116068747 QOXQULFYPDVWEC-ZDUSSCGKSA-N 405.296 2.409 10 20 HECD CCOC(=O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1320484264 VQBJKJLADFZKTB-MJGOQNOKSA-N 416.522 2.016 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NC[C@@H]3COc4ccccc4O3)CC2)cc1 1324604529 JQWLDNLSMOQJLL-HXUWFJFHSA-N 411.502 2.164 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1 1784947712 COYOXLFBRODOHH-HSZRJFAPSA-N 423.469 2.128 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1CCC=CO1 1796934867 WCDUMVREWHIBDC-MJKGWSOKSA-N 422.485 2.110 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnsn1 1800715804 QCNCSOZWWNKVAP-JGPRNRPPSA-N 408.867 2.168 10 20 HECD O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806837923 QMVOUDILPMRDDD-PXAZEXFGSA-N 424.379 2.160 10 20 HECD O=C(Cn1ccc2c(F)cccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847534440 WKUQZLUIUONGPF-ROUUACIJSA-N 424.432 2.102 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc2c(=O)n(C)c(S)nc2c1 10907806 DVXCUJRPJKMWCM-UHFFFAOYSA-N 424.526 2.331 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN(CC(F)F)CC1 64255114 MVLHVTWIVOMRHT-UHFFFAOYSA-N 400.445 2.191 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 110353314 JDDBTWZEEWQQDS-WOJBJXKFSA-N 413.518 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)CNC3(c4noc(C)n4)CCCCC3)CC2)cc1 138825985 ZPWXBEMSPUHINK-UHFFFAOYSA-N 413.522 2.484 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSC[C@H]3CCCCO3)CC2)cc1 727376291 XCBONYSEOJDQGH-HXUWFJFHSA-N 407.580 2.236 10 20 HECD COc1cccc(CNC(=O)CCCC(=O)NCc2cccc(OC)c2O)c1O 729859158 KHBQNVUUPDMFRT-UHFFFAOYSA-N 402.447 2.218 10 20 HECD Cc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1S(N)(=O)=O 735752039 TVCRCHWMOMLDDM-UHFFFAOYSA-N 418.519 2.143 10 20 HECD COCCCOC1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 742153763 XSBYMZKWHDHXGF-UHFFFAOYSA-N 420.550 2.445 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1 743910055 LUZDVCQTVZFPMB-UHFFFAOYSA-N 401.488 2.209 10 20 HECD CN(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 749636173 XOPGAZKHLLMQBY-UHFFFAOYSA-N 416.909 2.498 10 20 HECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 750253970 VNTPGNVMWFHHOK-UHFFFAOYSA-N 412.490 2.108 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)NCc1ccc(N2CCSCC2)cc1 754449574 FBUHCMLFXPEJAI-UHFFFAOYSA-N 402.524 2.426 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(Cc3nc(-c4ccccc4)n[nH]3)no2)c1 761933028 RAQUTLPZONVAAG-UHFFFAOYSA-N 412.431 2.190 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccco3)cc2F)C[C@H](C)O1 767515695 OYIRGLMXOFKEFB-GJZGRUSLSA-N 404.438 2.434 10 20 HECD CCN(CC)C(=O)CN1CCN(Cc2cc(Br)cc(OC)c2O)CC1 768214979 LCPUUPINWLABDV-UHFFFAOYSA-N 414.344 2.149 10 20 HECD C[C@H](O)CNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 769083030 LSUQPVVYYGVUTC-TXEUWIOXSA-N 415.334 2.147 10 20 HECD CCC[C@@]1(C(=O)OCC)CCCN1Cc1cc(O)n2ncc(C(=O)OCC)c2n1 770003226 QYOVZUOXTSNAJM-FQEVSTJZSA-N 404.467 2.309 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)CCC(=O)O)cc1 775287233 WKOAGMVXSKZJCP-UHFFFAOYSA-N 407.400 2.027 10 20 HECD CCN1CCN(c2ccc(CNC3CCN(CCCC(=O)OC)CC3)cc2F)CC1 775625690 CPSFZNQFQJPDQI-UHFFFAOYSA-N 420.573 2.475 10 20 HECD NS(=O)(=O)c1ccc(CN2C(=O)/C(=C\c3ccc(F)nc3)SC2=S)cc1 777403794 NZXZOXHXWWMHIS-NTUHNPAUSA-N 409.489 2.270 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCCCN(C)C)cc1 785293265 FUTSYLAMWDXOEU-OAHLLOKOSA-N 415.490 2.114 10 20 HECD COc1ccc(Cn2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)n2)cc1 785296557 GHYYGHROVWUFQL-AWEZNQCLSA-N 424.457 2.037 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(N3CCc4ccccc43)CC2)cc1 785427979 IHWIDQIVSMIDKI-UHFFFAOYSA-N 406.530 2.423 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1cccc(F)c1)c1nccn1C 785599364 BKXUWHIUDOFYKO-HXUWFJFHSA-N 423.492 2.456 10 20 HECD O=C(NCc1ccc(Cl)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786614618 QFPNHFPJDDGXGL-INIZCTEOSA-N 403.866 2.265 10 20 HECD CCCN1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1=O 788320692 CNVICCQTVXHHIW-UHFFFAOYSA-N 419.545 2.122 10 20 HECD COc1cccc(O)c1CNC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 788528956 KSWBIFJCYMIDAG-KRWDZBQOSA-N 402.466 2.347 10 20 HECD CCOC1(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCC1 792831991 CTBPKNKNOZHOIM-UHFFFAOYSA-N 408.470 2.171 10 20 HECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1OC 799184248 AFMHZHIKWCQZBX-UHFFFAOYSA-N 408.461 2.140 10 20 HECD CS[C@H]1CCCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803300448 SAQHGKQEBKIUJU-LPHOPBHVSA-N 405.564 2.445 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1F 803660770 CMXCKANLWIQEAP-LJQANCHMSA-N 412.509 2.146 10 20 HECD COCCN1CCC[C@@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 804352019 NAFOAWJHGZYKJC-HXUWFJFHSA-N 417.550 2.281 10 20 HECD C[C@@H](NC(=O)NCC1(S(C)(=O)=O)CCCC1)c1ccc(N2CCOCC2)cc1 804989004 KSGCSXYQHFUNTB-MRXNPFEDSA-N 409.552 2.241 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCC[C@H]1CCO 809558731 ARCADCLVFGCUEG-SWLSCSKDSA-N 413.312 2.171 10 20 HECD CCN(Cc1ccccc1)c1ccc(CN2CCN(C(=O)Cn3cnnn3)CC2)cc1 809733614 APCVGFKPYZLOLU-UHFFFAOYSA-N 419.533 2.044 10 20 HECD CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCOC(C)(C)C1 810042681 FACHUJUKSLOEHJ-SFTDATJTSA-N 405.583 2.458 10 20 HECD CNS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)s1 914847584 ZGFYGELNKJKRLE-UHFFFAOYSA-N 404.517 2.389 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4nc(O)oc4c3)CC2)cc1 919807820 GPTCKRFAJJEMQB-UHFFFAOYSA-N 410.474 2.484 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1CCN(c2cnccn2)CC1 919968873 MLYVDTGCTJIEDW-UHFFFAOYSA-N 409.534 2.218 10 20 HECD O=C(CSCC(=O)N1CCCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 920455243 YNHZLRFSMPUORJ-UHFFFAOYSA-N 419.591 2.257 10 20 HECD O=C(CSCC(=O)N1CCCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 920455622 MZAZWIHHRHCYHL-UHFFFAOYSA-N 423.554 2.149 10 20 HECD CCC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CCC1 1777847979 FXEMXFLJDDSXRO-OPAMFIHVSA-N 417.506 2.201 10 20 HECD CC(C)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819505325 VVKOVZMPCARZNY-IUODEOHRSA-N 417.466 2.335 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CN2CCCCC2)C1 1842819968 WWCAXEWXGWMPBL-UHFFFAOYSA-N 407.898 2.054 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2 1843249514 RZLKQUVPYZBYNX-SFHVURJKSA-N 413.396 2.227 10 20 HECD C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 140260146 UWFIVQCADHJRDE-AWEZNQCLSA-N 404.492 2.053 10 20 HECD C[C@]1(c2ccc(CNC(=O)NCc3ccc(N4CCCC4)cc3)cc2)NC(=O)NC1=O 726233960 JRLREPGOZGSAOX-HSZRJFAPSA-N 421.501 2.341 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 727617369 LZPOUDSMNICZQE-UHFFFAOYSA-N 407.417 2.311 10 20 HECD CC(C)COc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 730292081 ZSAYUNDYMKZFAJ-XNTDXEJSSA-N 414.574 2.472 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(N4CCCCC4)n3)cc2)C1 739528471 YYGBCQKLIWOWLA-GOSISDBHSA-N 422.533 2.099 10 20 HECD COc1cc(N(C)CC(=O)N2CCN(Cc3ccccc3)CC2)cc(OC)c1OC 741795953 WMSDJWQSSLIWKL-UHFFFAOYSA-N 413.518 2.493 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1 743906605 OMCWCFIIUNRBDB-ZDUSSCGKSA-N 413.430 2.482 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCc2c1cnn2C 749542769 HXNFWEYFRNEWDS-LJQANCHMSA-N 415.513 2.021 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc4c(=O)n5c(nc4c3)CCC5)CC2)cc1F 753740622 VFJAFAAPXJHWOP-UHFFFAOYSA-N 422.460 2.453 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C(=O)N(C4CCCCC4)C3=O)CC2)cc1F 754014107 QHHPPUYLDNMYHK-UHFFFAOYSA-N 418.469 2.037 10 20 HECD CC(C)NS(=O)(=O)c1cccnc1NCc1ccc(N2CCOCC2)c(F)c1 763010911 BHFPZGFDZGYKEO-UHFFFAOYSA-N 408.499 2.356 10 20 HECD CC(C)OC[C@H](CO)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 764227033 CPVAGGVJYOMJHG-NUJGCVRESA-N 411.518 2.367 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@H](CO)OC[C@H]3C)c2C)cc1 766945052 PCKXEMGLEKYBMH-DNVCBOLYSA-N 400.475 2.145 10 20 HECD COc1ccc(-n2cnnc2SCC(=O)NCCc2ccc(O)c(O)c2)cc1 768900309 FFGKWBIOZXVVSC-UHFFFAOYSA-N 400.460 2.138 10 20 HECD CC[C@@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)OC 769741452 BPYDZLNLPIBWBC-QGZVFWFLSA-N 412.489 2.326 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3ccc(C)cc3)CC2)cc1 772675430 IHWVQYGXSOLHGO-LEQVUBRHSA-N 423.513 2.058 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccnn1-c1ccc(C)nn1 773219090 RWTNSKOTPPHXDU-UHFFFAOYSA-N 407.478 2.024 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccnn2-c2ccc(C)nn2)cc1 773231172 AXDPTDRAMVSJJW-UHFFFAOYSA-N 407.478 2.072 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](c1ccccc1F)c1nccn1C 785608303 ZZRAXASKHRWAOZ-FQEVSTJZSA-N 423.492 2.489 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(=O)c4ccccc4o3)cc2)CC1 786659060 GWDWXSYGBIESIB-UHFFFAOYSA-N 405.454 2.392 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccccc1-n1ccnc1 793721593 YCFGDULRGFMTCK-UHFFFAOYSA-N 401.470 2.181 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 795544519 RTJDODKTLFUSOO-KRWDZBQOSA-N 417.462 2.174 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NCCCSc1nccs1 801690509 BDNIBHQVGPFXSE-UHFFFAOYSA-N 422.575 2.016 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](C)CC3)cc2F)CC1 805009559 LZMMXPULOFNHTE-QGZVFWFLSA-N 404.530 2.232 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807674416 KNOOGVKBBKCHTA-WBVHZDCISA-N 403.523 2.368 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(N2CCCC2)n1 813507870 XEYISEUWJAASSX-UHFFFAOYSA-N 404.854 2.251 10 20 HECD Oc1cc(F)c(Cl)cc1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 816514423 XNFAQPFMZCVGKO-UHFFFAOYSA-N 407.877 2.134 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1cc(O)cc(Br)c1O 917501812 QAEDTQBLYTXOTF-QGZVFWFLSA-N 420.263 2.197 10 20 HECD CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917834785 QBDCKKMZLTUFGY-ALFKQNEGSA-N 420.513 2.182 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(-c2cccs2)[nH]n1 918337545 MMTMBNRMFAOSLX-UHFFFAOYSA-N 416.528 2.303 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1cnn(-c2ccccc2)c1 921067156 ZBRIRPCHJAIIIW-UHFFFAOYSA-N 416.478 2.327 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c1 921078545 OVFRCIFLUFBYBN-HNNXBMFYSA-N 418.393 2.246 10 20 HECD CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1842310315 SIRWPDYZSGOOTI-UHFFFAOYSA-N 422.844 2.307 10 20 HECD CS(=O)(=O)Nc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 109507826 RVNOGEMRWOJCHN-UHFFFAOYSA-N 423.922 2.478 10 20 HECD CCOC(=O)N[C@@H](C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)C(C)C 303258664 CNRNUPZZKAKHEJ-LJQANCHMSA-N 408.518 2.355 10 20 HECD Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1 303340640 WCDGTUUWDRENKV-UHFFFAOYSA-N 414.524 2.391 10 20 HECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCc1ccc(N2CCCC2)cc1 726277915 RINKYNBRLIFRNG-HXUWFJFHSA-N 401.555 2.029 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1cccnc1-n1cncn1 731278418 QGVIVEISFVNCLX-UHFFFAOYSA-N 407.478 2.193 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(O)c3)cc2F)C[C@H](C)O1 732392631 ZCOLAAGOFVNVKC-KBPBESRZSA-N 417.437 2.013 10 20 HECD Cc1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1N1CCNC1=O 739767434 CCPGPEABHSUFLR-UHFFFAOYSA-N 421.501 2.479 10 20 HECD CNC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 740919433 TUISOBOTEUMOEW-UHFFFAOYSA-N 424.545 2.297 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)cc1 741704828 YOHYOAAPFHQDFX-UHFFFAOYSA-N 407.474 2.402 10 20 HECD C[C@H](Oc1ccc(F)c(F)c1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743869279 QHHZUUSFUUFQEP-AWEZNQCLSA-N 424.469 2.283 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)Oc3ccc(F)c(F)c3)nc12 744587645 ZPWBHJRAGCDJBW-SNVBAGLBSA-N 421.356 2.401 10 20 HECD CN(C)c1ccc(CN(C(=O)Nc2cnn(CCN3CCOCC3)c2)C2CC2)cc1 747562749 OBTBPQHVGKDXMA-UHFFFAOYSA-N 412.538 2.478 10 20 HECD Cc1ccc(-c2nnn(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)n2)cc1 749405137 CJLMUKFHQNKRSR-UHFFFAOYSA-N 424.480 2.065 10 20 HECD CN(CCn1cccn1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068954 ZWALYAIQLDUTCV-UHFFFAOYSA-N 406.489 2.223 10 20 HECD Cn1c(=O)oc2c(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 753341115 AONPVNZWKNFEFI-UHFFFAOYSA-N 400.410 2.429 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)C(C)(C)CN(C)C)CC2)cc1 754355769 RPSYIHAEWZODFW-SFHVURJKSA-N 405.587 2.093 10 20 HECD CN(CC(=O)Nc1cc(-n2nnnc2C2CC2)ccc1F)c1ccc2c(c1)OCO2 756645024 MPCGEZGDFFWJQY-UHFFFAOYSA-N 410.409 2.482 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759599390 HHLPOEHLTBNUHS-UXHICEINSA-N 407.530 2.462 10 20 HECD COc1cc(Cl)cc(CN2CCN(S(=O)(=O)c3csc(C)n3)CC2)c1O 761194266 UIFSBNQDUWPODR-UHFFFAOYSA-N 417.940 2.326 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C1CCN(C(=O)CCOc2ccccc2)CC1 762263245 CJDMXDYEFMFMES-UHFFFAOYSA-N 412.486 2.464 10 20 HECD CCN(CCOC)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 763691115 HZTWFEKCZQSHEJ-UHFFFAOYSA-N 423.447 2.210 10 20 HECD COc1ccc(S(=O)(=O)N2CCCN(Cc3cc4c(cc3O)OCO4)CC2)cc1 765146539 YVOQSLZNCGNUGD-UHFFFAOYSA-N 420.487 2.026 10 20 HECD C[C@@H](NCCCN1CCC[C@H]1C(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 765626634 QDULTBMLUIRWKN-UTKZUKDTSA-N 406.546 2.256 10 20 HECD Cc1cc(S(=O)(=O)NCCNC(=O)NCc2ccc(N(C)C)cc2)c(C)s1 771906175 LVAIWGKKVFTQKB-UHFFFAOYSA-N 410.565 2.209 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1O 774911582 HROMHJXASQMPET-DOMZBBRYSA-N 411.455 2.423 10 20 HECD COC(=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 777577840 VCKMVJYTLMZROD-LJQANCHMSA-N 409.486 2.034 10 20 HECD CCCC[C@H](COC)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778285019 DBHALFILOLXALI-YUIUBULTSA-N 403.523 2.221 10 20 HECD COc1ccccc1CC(=O)N1CCC(NC(=O)/C=C\c2ccc(O)c(O)c2)CC1 779481371 NFFLVKGIZTYWGY-CLFYSBASSA-N 410.470 2.470 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@]34CCOC4=O)cc2F)C[C@@H](C)O1 779531044 WHISKZLMWAVFEQ-PZPWOCDFSA-N 405.470 2.430 10 20 HECD COc1ccc(OC)c(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407053 DSEYSYIQUBKZJJ-UHFFFAOYSA-N 419.503 2.173 10 20 HECD O=C(COC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)c1ccc(O)c(O)c1 784119411 RCZJPHSVEOESMH-UHFFFAOYSA-N 400.355 2.275 10 20 HECD CCCNC(=O)c1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786258210 ALTSRJPSKDZYPH-UHFFFAOYSA-N 422.529 2.425 10 20 HECD CCOc1cccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 787214805 PFWQSCSGKOPTPZ-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)O2 788931138 FZWIGNOBMJFHPN-WEQDKIBNSA-N 415.534 2.341 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1C(N)=O 789611591 QKRDPIIBAIANSJ-UHFFFAOYSA-N 422.532 2.266 10 20 HECD CNS(=O)(=O)N1CCC(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 795762061 YQEUVRBWYZEZED-UHFFFAOYSA-N 422.595 2.248 10 20 HECD C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 796559902 FZVSVMAZPQWMDP-OYLFLEFRSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3nc(C)c(C)s3)CC2)cc1 804318035 WTRWJOBUEAGTHW-UHFFFAOYSA-N 402.520 2.170 10 20 HECD CCOCCCN1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@H](C)C1 806225563 RHLLSHSFFKXGDR-OPYAIIAOSA-N 418.582 2.183 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)cc1 807096772 KCBRNIGCBCZCIF-UHFFFAOYSA-N 424.545 2.425 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N(C)C 807097592 ZOYVSPJVLQMXCA-FQEVSTJZSA-N 400.498 2.235 10 20 HECD CCO[C@@H]1COCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 807131572 PXFVBFJGBDDOBJ-UYAOXDASSA-N 404.507 2.364 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 807172858 OCLXFWDEVUEJSK-UHFFFAOYSA-N 411.418 2.232 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC4(C3)OCCO4)cc2Cl)C1 807954134 JWHLQVOTUSGCMD-OAHLLOKOSA-N 421.925 2.168 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1 809494911 DGGCLWODDUOLNE-UTKZUKDTSA-N 405.564 2.272 10 20 HECD O=C(CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1)NCc1ccc(N2CCOCC2)c(F)c1 810092900 JPMJQYJBOKMSHB-IRLDBZIGSA-N 417.525 2.312 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 816861744 ICBKSKUEYGQVQZ-NKHIQRNRSA-N 408.570 2.426 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1 917752763 CKGNZYQVADOXQA-UHFFFAOYSA-N 402.425 2.086 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4cccc(F)c4)=NO3)cc2)C1 917835100 ZMINOVKQPREGSX-UTKZUKDTSA-N 424.476 2.337 10 20 HECD COCCc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917918062 KIJKJIHLUZGKBF-UHFFFAOYSA-N 408.495 2.330 10 20 HECD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782004477 WJZKTBMSQGQIMW-HXUWFJFHSA-N 420.849 2.410 10 20 HECD C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CC1(F)F 1816729191 XYIBANWFWRTLGH-HUTHGQBESA-N 424.429 2.220 10 20 HECD O=C([C@@H]1C[C@@H]1C1CC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441193 RBAGMIMXOLMXJD-QZTJIDSGSA-N 406.486 2.029 10 20 HECD C[C@@H]1Cc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc2N1S(C)(=O)=O 108559649 NCZVUSMWTDLSMW-OAHLLOKOSA-N 415.515 2.486 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 437004914 FLHGMDSAGXVOGY-FNHZYXHNSA-N 404.536 2.204 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC3CCN(CC(=O)N(C)C)CC3)cc2)CC1 731757316 BAEJOOGJFGRCQM-UHFFFAOYSA-N 415.582 2.275 10 20 HECD COC[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 733198046 XBXAUVASVIEMFR-KRWDZBQOSA-N 419.547 2.283 10 20 HECD CCOC(=O)N1CCC(NC(=O)CCCNCc2ccc(N(C)C)c(F)c2)CC1 733330804 OGHHQFOAZVBGCK-UHFFFAOYSA-N 408.518 2.499 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCCN(c3cccc(F)c3)C2=O)c1 734579481 URXAVIVGOPBWTE-QGZVFWFLSA-N 422.434 2.255 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ncn(Cc2ccccc2)n1 737117753 QSMOVAIDSLXVDY-UHFFFAOYSA-N 406.490 2.380 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCOC[C@@H]3CCOC3)cc2F)CC1 740920204 FPUKCWLUHVRUBM-IBGZPJMESA-N 422.545 2.210 10 20 HECD O=C1CC[C@@]2(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)SCCN12 742800435 KAPJTYFSJNFJGW-YJYMSZOUSA-N 411.474 2.439 10 20 HECD CC(C)(C)n1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 746363432 YEIIFIGPWDHFBX-KRWDZBQOSA-N 400.479 2.490 10 20 HECD CC(C)OCCN1CCC(NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 747581982 UBQMDUDAQKBYMA-UHFFFAOYSA-N 404.555 2.212 10 20 HECD CCOC[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 747967955 ZODYEULBUVLFLN-SCTDSRPQSA-N 407.530 2.414 10 20 HECD CN1C(=O)N[C@@]2(CCC[C@@H]2CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1=O 748098830 OQPKOICXFHEFOD-IIBYNOLFSA-N 415.494 2.395 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)cc1 749879706 SINRBAINONDWNS-LJQANCHMSA-N 402.520 2.221 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1F 750363456 YBPWYLQRVHFCES-UHFFFAOYSA-N 416.844 2.381 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)oc1C 751113614 XJRQAUPKZMBJFN-UHFFFAOYSA-N 408.476 2.032 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1 751144361 ACIZDZXDJAOHHP-UHFFFAOYSA-N 407.473 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1F 753739506 XKORHCKJLFLRCS-UHFFFAOYSA-N 419.409 2.479 10 20 HECD CCCN(CCC)S(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 754153983 LEYYIGSRTWJYRH-UHFFFAOYSA-N 424.611 2.008 10 20 HECD CC[C@@H](CN1CCCC1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758713515 UTZJROQHFHIRDZ-MOPGFXCFSA-N 401.555 2.062 10 20 HECD COC(=O)[C@H]1CCCC[C@]1(C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 759841610 AUNGYENPAIHJBO-KNQAVFIVSA-N 403.523 2.055 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccnc12 763432634 HPGXFPCNBSQVOO-UHFFFAOYSA-N 423.473 2.015 10 20 HECD COCCCNC(=O)[C@H](C)N1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 769328817 SPCHAVLZXYAWQC-ZDUSSCGKSA-N 404.338 2.358 10 20 HECD COC(=O)C1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 770078066 ZQEDDYHPEHQNBY-UHFFFAOYSA-N 410.473 2.080 10 20 HECD C[C@H](NC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc(N(C)C)cc1 773012696 YOFPPCPGYFCUHI-AWEZNQCLSA-N 422.576 2.309 10 20 HECD O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775157905 BNXHYBWIOSAQEN-KBPBESRZSA-N 401.290 2.210 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1 779473172 JZGXTYGUGXZVRG-CLFYSBASSA-N 401.444 2.220 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cnn(-c2ncccn2)c1 783315965 JTPFNHYULHHZBS-UHFFFAOYSA-N 407.478 2.104 10 20 HECD COC(=O)COc1ccc(N(C)Cc2nnnn2-c2ccc(OC(F)F)cc2)cc1 784564802 IUDGLAVJZVYGEW-UHFFFAOYSA-N 419.388 2.452 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1 785304842 RXTZGQNKAURPOA-LLVKDONJSA-N 415.837 2.018 10 20 HECD CC[C@H]1CCCCN1C(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785529141 LOQMEUAEATUANW-IBGZPJMESA-N 416.566 2.115 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCOc1ccccc1 785588252 PDZDZQZSIRZIJU-UHFFFAOYSA-N 411.502 2.067 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3NC(=O)O[C@@H]3C)c2C)cc1 786072573 QFXGXJCMHQOTMH-ACJLOTCBSA-N 414.414 2.104 10 20 HECD CC1CCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789865054 WAVZGOHUSJOZLD-GOSISDBHSA-N 418.607 2.093 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c(O)c1 794383906 SJILHWAOXFPFBX-OAHLLOKOSA-N 424.544 2.488 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)cn1 795114282 COIGVTGPXAIEFQ-UHFFFAOYSA-N 410.517 2.324 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NCc1cc(C)ccc1O 796408054 RTMCLBAZTFJUTQ-UHFFFAOYSA-N 405.520 2.257 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CN(C)Cc2ccccc21)c1ccc(N2CCOCC2)cc1 803303160 YHXQFZMDTMKOAI-HTAPYJJXSA-N 422.529 2.003 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@H](Cc2ccncc2)C1)c1ccc(N2CCOCC2)cc1 803304244 FNTWVJDGFKZVJP-AZUAARDMSA-N 422.529 2.187 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3nc(C)c(C)s3)CC2)cc1 804318619 PPEDQCBCPXZXDG-UHFFFAOYSA-N 416.547 2.212 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc1F 804851843 QQDGJGKOUNTMTO-HOTGVXAUSA-N 420.529 2.194 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cn(C)nc1-c1ccccc1 806774617 ZPZZYMTUFBJACK-UHFFFAOYSA-N 405.502 2.394 10 20 HECD NS(=O)(=O)Cc1cccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807209403 JXEFILUIWQUWIH-UHFFFAOYSA-N 418.302 2.487 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)N(CC)CC 809883941 YBFYTUOVAQJOBG-CYBMUJFWSA-N 414.344 2.350 10 20 HECD CCCNS(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 813700707 SAVOUHJRACQVAR-INIZCTEOSA-N 400.545 2.152 10 20 HECD COCc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc(C(=O)OC)c1 815519289 RBMUPJOMJXOIEF-UHFFFAOYSA-N 423.469 2.251 10 20 HECD COCCn1cc(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1=O 1322351442 UCMONJWLZYUFOB-UHFFFAOYSA-N 400.479 2.294 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cc(O)ncn3)cc2)CCC1)c1cc(O)nc(O)c1 1786470112 VCZYPBACRRPYNI-UHFFFAOYSA-N 421.413 2.050 10 20 HECD O=C(c1ccccc1F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442375 GJLGQRWXUBEJDD-UHFFFAOYSA-N 420.444 2.436 10 20 HECD Cc1cc(C)nc(SCC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1 7229235 AZEWKYFHEHJLID-UHFFFAOYSA-N 402.520 2.453 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cccnc2OCC(F)F)n(C)c2ccccc12 563562098 KGYASAZIOXTDGW-UHFFFAOYSA-N 416.428 2.458 10 20 HECD CN1CCN([C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 729259216 KUYMXTSMBQNUSR-DEOSSOPVSA-N 422.573 2.470 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NC1CCN(CCS(C)(=O)=O)CC1 731648404 CXDLBYHZOYQJRI-UHFFFAOYSA-N 409.577 2.394 10 20 HECD C[S@@](=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 735574965 SFSVJLYHCPXCTG-HYDGNGQDSA-N 414.531 2.447 10 20 HECD COc1ccc(N2CCC(NC(=O)NCc3cccc(OCC(N)=O)c3)CC2)cc1 745799602 JRUWAYYSMWFTNO-UHFFFAOYSA-N 412.490 2.028 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3[C@H]4CC[C@H]3CC(=O)NC4)cc2F)C[C@H](C)O1 748616340 ASJOAKFHTPPQJJ-OTRWWLKZSA-N 404.486 2.002 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)NCCCSc2nccs2)s1 749106523 HGBFDARGIFVKNI-UHFFFAOYSA-N 408.548 2.461 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1 749239230 HSUBCIHGUAWSOY-AWEZNQCLSA-N 420.491 2.156 10 20 HECD C[C@H](CC[S@@](C)=O)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069282 HLALANIYAOTSEV-SSINHNECSA-N 416.546 2.141 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCCCS1(=O)=O 753487791 OOYOOQNHQAJAOU-INIZCTEOSA-N 420.453 2.126 10 20 HECD Cc1ccc(O)c([C@@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1 756590730 PLXJVCYRVYGFFX-QGZVFWFLSA-N 403.548 2.488 10 20 HECD COc1ccc(C[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 758537482 RLZVBCJCPYPHSL-QGZVFWFLSA-N 416.543 2.425 10 20 HECD CCc1onc(C)c1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 759012188 XXHCABDAVVSEJP-UHFFFAOYSA-N 417.485 2.081 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 769711533 CBHNZSQDIXPGSB-LJQANCHMSA-N 418.471 2.416 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](O)C[C@H]2CO)c(C)n1-c1ccc(Br)cc1 770665361 KDVRJCWMWYBIQY-IRXDYDNUSA-N 407.308 2.467 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1c(F)cc(Br)cc1F 774363273 SKXGGTFWNLOZGJ-UHFFFAOYSA-N 415.190 2.436 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1 775287837 QPNDKSSOXKCOMQ-UHFFFAOYSA-N 403.771 2.470 10 20 HECD CC(=O)NC[C@@H]1CN(Cc2cc(Br)cc(Br)c2O)CCO1 775701609 UMLAJRUZMNSXLN-GFCCVEGCSA-N 422.117 2.254 10 20 HECD Oc1c(Cl)cccc1CN[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1 776169675 OYLMDODBMZPTKG-INIZCTEOSA-N 403.914 2.431 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)c1 777961709 LJACPSAJMUIEOG-SECBINFHSA-N 400.384 2.496 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@H]2CCN(C3CC3)C2)cc1 788801492 AKEAOABKZCAKFZ-LJQANCHMSA-N 424.545 2.475 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)COc3ccccc3)CC2)cc1 793704588 WHYJJXSGMLCDTC-GOSISDBHSA-N 411.502 2.318 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cncc(OCCOC)c3)cc2F)CC1 800883599 CZNVXLISBQDFDT-UHFFFAOYSA-N 416.497 2.318 10 20 HECD CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccc(O)c(O)c2)(n2cccn2)CC1 802784377 NEKBPFOEGCUWAZ-UHFFFAOYSA-N 416.478 2.337 10 20 HECD CCc1cnc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803310045 FYKZKBAGLRZFHR-CQSZACIVSA-N 402.520 2.036 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1 804278197 QCPMGBRTQFHBHG-OAQYLSRUSA-N 408.546 2.349 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1nncn1C 805824435 RCRUIHDIVFCUPZ-CYBMUJFWSA-N 403.442 2.050 10 20 HECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1cccc(OC)c1O 806735351 CJJYPDVJQNDHJY-UHFFFAOYSA-N 424.475 2.151 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCN(C)C3)cc2Cl)C1 807955179 PYXUYKJOWYSQMC-DOTOQJQBSA-N 406.958 2.403 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1C 810355906 FJXJMAUWGSLGKB-UHFFFAOYSA-N 405.401 2.381 10 20 HECD O=S(=O)(c1ccc(NC(=S)NNc2ccccc2F)cc1)N1CCOCC1 812474960 LFVYXXHVFWOGSV-UHFFFAOYSA-N 410.496 2.160 10 20 HECD CC(C)OC(=O)CCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 818976985 PBUSVIGPJZESPM-UHFFFAOYSA-N 410.382 2.442 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CN(C)S(C)(=O)=O)c2C)c1 914922125 IYWLDQMBMRQKKR-UHFFFAOYSA-N 424.544 2.433 10 20 HECD O=C(NCCNC(=O)c1cccs1)NCc1ccc(N2CCC(CO)CC2)cc1 918210887 YCHNUYKGOONDDI-UHFFFAOYSA-N 416.547 2.186 10 20 HECD Cc1ccncc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1794372969 BLTMPVUWOUYERD-BCDXTJNWSA-N 410.474 2.081 10 20 HECD Cc1ncoc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795233502 FRGUSBRPYFKTDV-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(c1cc(F)ccc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250633 UVYUPMMVECZHGR-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COc1ccnc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1 1845501642 LJJPSOOUNGDNGK-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@H]2CCO)c(C)n1-c1ccc(S(N)(=O)=O)cc1 71808359 IYGFRIPOLFNBEL-KRWDZBQOSA-N 419.547 2.161 10 20 HECD C[C@H](NC(=O)c1ccc(NS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 148467336 FFRGVVIRAZHVKF-HNNXBMFYSA-N 403.504 2.386 10 20 HECD Cc1c(CNC(=O)NC[C@]2(N3CCOCC3)CCSC2)n(C)c2ccccc12 471739494 ULYPWFWLVMVXOT-OAQYLSRUSA-N 402.564 2.494 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3cccc(S(N)(=O)=O)c3)CC2)cc1 726609028 JYZKJYNFHYQOBY-UHFFFAOYSA-N 404.492 2.133 10 20 HECD CN(C)CCCOc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 728610831 OCSRWSZSHIYLAJ-UHFFFAOYSA-N 421.519 2.024 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nnnn1Cc1ccccc1 732202892 HSWCCXYHOIZDDK-UHFFFAOYSA-N 401.854 2.256 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)c3cccs3)cc2)C1 741081418 QDSMWZRSUMWXPA-FUHWJXTLSA-N 416.547 2.373 10 20 HECD O=C(NCCCN1CCN(c2ncccn2)CC1)NCc1c(O)ccc2c1CCCC2 743523074 CYNQMHZMGJNNOU-UHFFFAOYSA-N 424.549 2.073 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC(C)(C)C[C@H](C)O)CC2)cc1 745352098 VLSWDZGQYJFULI-SFHVURJKSA-N 406.571 2.304 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H]1CCCc2c1cnn2C 749175453 IEZGBDHQSNNEMI-PXNSSMCTSA-N 424.549 2.341 10 20 HECD Cn1ccc(N2CCC[C@@H](OC(=O)c3csc(Cc4ccc(N)cc4)n3)C2=O)n1 751936577 KGHIVIKZXAUAFO-MRXNPFEDSA-N 411.487 2.402 10 20 HECD COC(=O)[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 752332026 KXWKMVOOABBGPZ-TWOQFEAHSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4c(C)cccc4c3=O)CC2)cc1F 753737598 GUNRQFKDLQORMR-UHFFFAOYSA-N 410.449 2.201 10 20 HECD CCO[C@@H]1C[C@H](N(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C12CCC2 754099690 XPLKNIXAYLENBP-ACIOBRDBSA-N 417.594 2.458 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)CC2)cc(OC)c1OC 759268416 WJHIZKFYAFCCHL-YSGRDPCXSA-N 419.522 2.358 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](C)CN3CCCC3)CC2)cc(OC)c1OC 759277318 HLYNIFXBWDMKFM-QGZVFWFLSA-N 420.554 2.276 10 20 HECD C[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@]1=O 759867105 INWAYJYUZADQTE-ONSXPEOJSA-N 410.495 2.243 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)cc2)C1 761116334 AENWGFJBXPKDCV-HOYKHHGWSA-N 418.497 2.282 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)NC(=O)CC2 767993768 LSPFGQMIMFVOBT-UHFFFAOYSA-N 422.485 2.435 10 20 HECD CCOc1cccc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1O 768157744 SQQAGGRAOVXMNP-UHFFFAOYSA-N 421.475 2.206 10 20 HECD CO[C@@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 770283793 YCFJRAFBEZOCIO-SFHVURJKSA-N 415.538 2.322 10 20 HECD CCN(CC)c1ccc(CNC(=O)N(CCOC)[C@@H]2CCS(=O)(=O)C2)cc1F 774212921 VYUOVLBWMRUHOE-MRXNPFEDSA-N 415.531 2.017 10 20 HECD COC(=O)C1(NC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)CCCCC1 775254971 MEAOLVNOWDUXCU-KRWDZBQOSA-N 403.523 2.166 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NOCCC(F)(F)F)CC2)cc1 777724524 XWMLSKMJFJSPBT-UHFFFAOYSA-N 404.433 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCOCC(C)C)CC2)cc1 778221475 NXUVSAUQOLFWIG-KTKRTIGZSA-N 403.523 2.079 10 20 HECD CC(C)NC(=O)c1cnn2c1C[C@@H](CNCc1ccc(N3CCN(C)CC3)cc1)CC2 785563152 LGQXZZYQKWSKNY-FQEVSTJZSA-N 424.593 2.125 10 20 HECD COCn1nc(C)c(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c1C 788598365 TWSRJYZMVTYVIN-UHFFFAOYSA-N 410.565 2.136 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)nc12 795122048 NHECYVSJAYTBDT-ZIAGYGMSSA-N 417.510 2.079 10 20 HECD COc1cccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1F 795366831 KVAWZPDYQNXOFF-UHFFFAOYSA-N 420.506 2.318 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2F)c1 800839439 HAUVHXPWUBFBIJ-UHFFFAOYSA-N 402.469 2.363 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1F 802550220 RBDDDAANDPZMQZ-UHFFFAOYSA-N 405.401 2.415 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(Cl)cn3)CC2)cc1 804315697 QHNRYVZBHBDNGR-UHFFFAOYSA-N 402.882 2.145 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CCc3cccn3C)CC2)cc1 804317711 NFNLDDJUCAXVGZ-QGZVFWFLSA-N 412.534 2.256 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1 804319310 NTTFCMUFCZNBGR-XLIONFOSSA-N 417.550 2.490 10 20 HECD CC[C@@H]1C(=O)N(CC)CCN1C(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 805022824 FNOLMHBRUFYMCM-HXUWFJFHSA-N 414.550 2.008 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NCc2ccc([N+](=O)[O-])c(OC)c2O)s1 809721034 LODDHLNLJNUJAR-UWVGGRQHSA-N 409.468 2.476 10 20 HECD COc1ccc(/C=C/C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 916676777 RRTPXHGOKWLGPX-IZZDOVSWSA-N 400.500 2.260 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C(F)(F)F 917835860 GGHJKJBAANFLJP-CYBMUJFWSA-N 409.412 2.071 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(OC(F)F)c1 918335030 KFUMBEGCKNLLDB-UHFFFAOYSA-N 410.442 2.453 10 20 HECD COCCn1c(-c2ccc(S(C)(=O)=O)cc2)nnc1N(C)Cc1ccccc1O 1342051283 HZEUQIFOQSQNRN-UHFFFAOYSA-N 416.503 2.337 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)C2CC2)[C@H]1c1cccnc1 1814165965 MQNFTRNPCGYBCA-YSKVMHACSA-N 423.469 2.328 10 20 HECD Cc1ccc(CC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)o1 1843442240 INQYFQPUVLEDDW-UHFFFAOYSA-N 420.469 2.127 10 20 HECD COc1ccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1 18150779 AIANITXMDGPHCR-UHFFFAOYSA-N 417.531 2.474 10 20 HECD CN(CC(=O)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 303497677 UIPHXPJCPHGVEV-INIZCTEOSA-N 408.545 2.101 10 20 HECD Cc1c(CNC(=O)C(=O)NCCN(C)Cc2ccc(F)cc2)n(C)c2ccccc12 578157728 GWOHOFKZONNCBM-UHFFFAOYSA-N 410.493 2.490 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc1 726562089 FFAJVVTUDPKNMU-UHFFFAOYSA-N 403.504 2.466 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)C(=O)NC4=O)cc2F)C[C@@H](C)O1 729286174 ZOGAAEVPTKYFLG-CHWSQXEVSA-N 411.433 2.253 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730591062 GZEATXBJMHVBPE-BBRMVZONSA-N 412.442 2.402 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)c2cc(O)cs2)CC1 732284261 NEFLWCYBGMGDQL-UHFFFAOYSA-N 409.552 2.461 10 20 HECD CN(CC(=O)N(Cc1ccco1)Cc1ccccc1O)S(=O)(=O)c1cccnc1 735927135 NDVJWMHAFBISJE-UHFFFAOYSA-N 415.471 2.230 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 740472862 FLZVMDVRAMYXKN-IERDGZPVSA-N 416.547 2.157 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cnn(Cc2ccncc2)c1 746423901 YHDRRZCYHXFXOV-UHFFFAOYSA-N 405.458 2.166 10 20 HECD COc1cc(CN2CCN(Cc3cc4c(cc3O)OCO4)CC2)cc(OC)c1OC 749968084 GCJPGGJFYVCNPK-UHFFFAOYSA-N 416.474 2.465 10 20 HECD NC(=O)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCC1 751066314 GFGQIXOPVQYPJX-UHFFFAOYSA-N 423.516 2.030 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)c1O 754489746 UYLNCLHGTBAPPV-UHFFFAOYSA-N 421.453 2.174 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3csc(NCC(C)C)n3)nc12 754822767 FNACKAQAHBHQRF-UHFFFAOYSA-N 419.463 2.493 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(C)n1-c1ccccn1 755491545 XUVWTBKPEVDWMX-CPLUKWAASA-N 404.470 2.026 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc4c3oc(=O)n4C)CC2)cc1 756876078 GMCRFSVWTIXSJJ-UHFFFAOYSA-N 424.501 2.082 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)C[C@@H](O)C(F)(F)F)cc2F)CC1 758468238 OEURNUMBYBISKM-MRXNPFEDSA-N 406.424 2.032 10 20 HECD COCC(=O)N(C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)CCC3)c1C 758797656 BXZRVOFXBUHAJU-UHFFFAOYSA-N 412.486 2.414 10 20 HECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765904346 RLVMGRTWDDWWSV-UHFFFAOYSA-N 420.263 2.392 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCc3ccc(O)c(O)c3)C2)s1 768921056 ZYORNXSNBAXQCS-AWEZNQCLSA-N 410.517 2.185 10 20 HECD CNC(=O)c1cc(Br)ccc1NS(=O)(=O)c1cccc2nonc12 771159451 MKWKLOSLLZCXKB-UHFFFAOYSA-N 411.237 2.146 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN(C)C(=O)OC(C)(C)C 777826676 QISAPAFXEUTWBU-UHFFFAOYSA-N 400.859 2.414 10 20 HECD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)/C=C\c3ccc(O)c(O)c3)c2)C1 779516037 WIOCMJSRGBAXLU-FUKPKEADSA-N 409.486 2.125 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3CCO[C@@H](C(C)C)C3)nc12 781791127 RWEBHGJYCJKSPS-CZUORRHYSA-N 405.451 2.496 10 20 HECD CC1(C)OC[C@@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)O1 783180728 YJOUEIGJUZINOI-OAHLLOKOSA-N 417.428 2.493 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCc2ccccc21 788334612 XXSQSHFNPRENSV-HXUWFJFHSA-N 407.514 2.376 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2cccc(F)c2C1 789801893 VVFXNQIQUYWFEP-UHFFFAOYSA-N 415.440 2.003 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]2CCC[C@@H]21 789848123 ZYGUZYKVBIHZME-LPHOPBHVSA-N 403.498 2.194 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1 795344895 JSDIHWGTXSPIJN-UHFFFAOYSA-N 415.519 2.004 10 20 HECD Cc1cc2c(cc1S(=O)(=O)Nc1cccc(N3CCC(C(N)=O)CC3)c1)OCO2 795614543 DWNOYVFCQMMICJ-UHFFFAOYSA-N 417.487 2.226 10 20 HECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 797639555 FWONCWFEBNGLRN-ZDUSSCGKSA-N 409.446 2.444 10 20 HECD Cc1nc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)sc1S(N)(=O)=O 801667616 QSSTYAIHARXCHO-GHMZBOCLSA-N 414.528 2.464 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662897 IWHWCKIXKNJPQJ-ODZKNYGOSA-N 405.514 2.296 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H](C)CCC(C)(C)C)CC2)cc1 803750542 NHZQDWBADABWMG-SFHVURJKSA-N 418.582 2.264 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C)C[C@H]3C(C)C)cc2)CC1 805025532 UAMPVZLNYKQOSY-NRFANRHFSA-N 400.567 2.338 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCOC[C@H]3C)CC2)cc(OC)c1OC 805820909 AGNLRZHOCGHGLB-HZPDHXFCSA-N 407.511 2.217 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@@H](C)N3CCCCC3)CC2)cc1 807700270 HJKPKCUZAHBSRX-LJQANCHMSA-N 416.566 2.115 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 810183485 YFTWPSNUTXKHQQ-LJQANCHMSA-N 409.486 2.495 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc4c3OCC(=O)N4)cc2)C1 810257070 GYVKGLJVZCYPRR-HNNXBMFYSA-N 423.473 2.041 10 20 HECD COCCn1c([C@H]2CCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 812115450 CODZBBVRNOIESI-KRWDZBQOSA-N 401.511 2.154 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3sc(C)cc3C)CC2)cc1 814270403 IWYLAOOYFGUVNM-UHFFFAOYSA-N 409.577 2.474 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 915922652 XXRAHRYAQYIQTM-OAQYLSRUSA-N 404.555 2.021 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)cc2)C1 918373325 VZFKTZCBSOMERG-CQSZACIVSA-N 422.445 2.103 10 20 HECD Cc1cc(C(=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 1115881481 UMCVRMVWSAARMJ-HNNXBMFYSA-N 424.906 2.208 10 20 HECD CCc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)no1 1845501578 CZTGCIALSORXRL-UHFFFAOYSA-N 405.838 2.432 10 20 HECD CCNC(=O)COc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 472812359 ZGZXEZVIMTWABS-UHFFFAOYSA-N 422.485 2.257 10 20 HECD CC(C)[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(N)=O 730508763 JYUOKXOTPZNBKI-FWLQQBITSA-N 411.574 2.356 10 20 HECD Cn1cc(N2CC[C@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2=O)cn1 735584336 SNZIKDOZCSHCOP-SFHVURJKSA-N 409.446 2.236 10 20 HECD O=C(C[C@H]1C=CS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800339 IXBASKLVOHIRCE-ZIAGYGMSSA-N 400.447 2.321 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC)c(F)c3)CC2)cc1 742948163 NAZWWOGRCCTZRS-UHFFFAOYSA-N 416.497 2.464 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2F)C[C@@H](C)O1 748482728 YBDVTMSWKYFICU-OKILXGFUSA-N 401.438 2.400 10 20 HECD CC(C)Cn1cnc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 749864801 SDJXTQUUSQHHEJ-UHFFFAOYSA-N 406.917 2.365 10 20 HECD CC(=O)N1CC[C@H](CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 754843632 ZZPLEYMROOMFBF-JTDSTZFVSA-N 420.529 2.449 10 20 HECD CCOC(=O)N1CCC(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 756337308 RYESRDSMZFTCSM-IBGZPJMESA-N 419.522 2.110 10 20 HECD CC1(Cn2cc(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)nn2)COC1 758952614 XQFMWJGWGVNMGP-UHFFFAOYSA-N 402.410 2.342 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1 759091435 SXPBSAZDDSNOLH-UHFFFAOYSA-N 416.452 2.175 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761401219 PRTCNPJPWBMOCT-UONOGXRCSA-N 400.884 2.166 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cnc2n(c1=O)CCS2 761751297 CGOPXXPKJJFGIJ-UHFFFAOYSA-N 410.293 2.479 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1ccccc1Cl 763279084 IIWLXHUWGDFQCH-GFCCVEGCSA-N 412.895 2.167 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C 773760260 FTHBGCQVYXYWCU-QKFKETGDSA-N 423.469 2.144 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773845954 LIUBCGJOIBNZSI-CQSZACIVSA-N 412.490 2.279 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCn4cccc4[C@H]3C)CC2)cc1 778232248 GQNDWLUBXDPKKI-HJCTWCACSA-N 408.502 2.305 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)NC(=O)CC(C)(C)C)CC2)cc(OC)c1OC 779092410 ZLDRZVILXIKIGL-HNNXBMFYSA-N 421.538 2.302 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@H]3CCCC[C@@H]3O)CC2)cc1 779338449 UUWMDAXXYGQXES-NQIIRXRSSA-N 404.555 2.010 10 20 HECD O=C(Nc1ccc(NC(=O)C2=S=CC=C2)cc1)C(=O)Nc1ccnn1CC1CC1 783969239 XTZCWAQIYMPDPD-UHFFFAOYSA-N 409.471 2.086 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2NC(=O)O[C@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 786069281 MTGUPXOFGFDDJW-DJJJIMSYSA-N 414.414 2.088 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCC(=O)N3C)c2C)cc1 786179840 DMPYOLJGZAFZAP-GOSISDBHSA-N 412.442 2.227 10 20 HECD O=C(COC(=O)CSCC(F)(F)F)NCc1ccc(N2CCOCC2)c(F)c1 786461965 JPMDISZCVFGCQV-UHFFFAOYSA-N 424.416 2.117 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 786686230 ZFAFMRWFJALBII-AWEZNQCLSA-N 403.429 2.295 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc2ncccc2c1 788321183 UBNSXMSAGJZROQ-UHFFFAOYSA-N 404.470 2.004 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O 792035636 NVZQCYHXPVAXCE-LJQANCHMSA-N 411.424 2.343 10 20 HECD COc1ccc(CNC(=O)[C@@H](C)[C@@H](C)C(=O)NCc2ccc(OC)cc2O)c(O)c1 794389735 CTPIQFOOSWLTLS-OKILXGFUSA-N 416.474 2.320 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCN(C)C(=O)OC(C)(C)C)CC2)cc1 795776781 YAGXDHOJFMFACE-UHFFFAOYSA-N 420.554 2.190 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 798254700 OLGFZZCJGDETAN-UHFFFAOYSA-N 404.536 2.061 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3cnc(C(C)C)nc3)CC2)cc1 799334517 PCHWJXVBPANALA-NRFANRHFSA-N 413.566 2.224 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CCC[C@H]1OC 804109668 NQLDAWZTKFZKLM-MLGOLLRUSA-N 413.312 2.435 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H](Cn1cccn1)c1ccccc1 806166297 QBBUOHMLHYFRGD-JOCHJYFZSA-N 415.497 2.433 10 20 HECD CCC[C@@]1(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCOC1 806334445 OSZLEZXXTDYEPY-JOCHJYFZSA-N 404.555 2.466 10 20 HECD O=S(=O)(Nc1cc(Cl)c(O)cc1F)c1cccc(S(=O)(=O)NC2CC2)c1 808113498 BCRMHEMMJOOXJM-UHFFFAOYSA-N 420.871 2.426 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 808237797 GMERIJNXLXPFDW-GJZGRUSLSA-N 415.531 2.062 10 20 HECD CC(C)CSCCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 808865716 BLGBAOHAWUPARO-UHFFFAOYSA-N 407.580 2.377 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C=O)c[nH]3)cc2F)C[C@H](C)O1 815255786 YWPWMLLLZLBQSJ-KBPBESRZSA-N 417.437 2.053 10 20 HECD Cc1noc(N)c1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 913242919 CYRWXTUGKLGQOT-UHFFFAOYSA-N 405.366 2.136 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(OCC(N)=O)c(OC)c1 916640768 KQSOWWIHABMQGY-UHFFFAOYSA-N 414.506 2.357 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1N1CCN(C)CC1 918307095 MVLUMPROLFQPCP-UHFFFAOYSA-N 423.561 2.492 10 20 HECD Cc1noc(-c2ccc(C(=O)NC3=S=C(c4ccccc4)C=C3C(N)=O)cc2)n1 1115828421 UBQSHSDXBNDVPZ-UHFFFAOYSA-N 404.451 2.284 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](CC(N)=O)C1 1322787337 XIXKHQLMHODBOX-CABCVRRESA-N 419.481 2.376 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc3c(c2)CCCN3C)cc1 1323930627 RPMWNUVZWRIVGF-UHFFFAOYSA-N 417.531 2.062 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3sc(N(C)C)nc3C)CC2)cc1 1336791440 UNXGACYSYIIKRR-UHFFFAOYSA-N 403.552 2.078 10 20 HECD O=C(Cc1noc2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600572 OYVZZSSUFULKLR-QDMKHBRRSA-N 422.441 2.129 10 20 HECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)C(=O)N(CCc2cccs2)C1=O 23852643 XXDAEZFVQCPHBW-UHFFFAOYSA-N 400.504 2.237 10 20 HECD Cc1cc(C(=O)NCc2ccc(C(=O)NCC(N)=O)cc2)c(C)n1-c1ccc(F)cc1 71938691 YYTHVHAVIMRWOV-UHFFFAOYSA-N 422.460 2.378 10 20 HECD CC(=O)N(C)C1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 143753237 MWGLDPLLGAYPGS-UHFFFAOYSA-N 419.481 2.343 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 437022133 GSESVILCOSWBJT-QGZVFWFLSA-N 423.469 2.302 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1c(C)c2ccccc2n1C 471238014 YJZRQELUADCSPR-UHFFFAOYSA-N 418.501 2.494 10 20 HECD CC(C)COc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 730292078 ZSAYUNDYMKZFAJ-GDNBJRDFSA-N 414.574 2.472 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3scnc3C)CC2)cc1 731223132 WNRYGVRIIZCCKG-UHFFFAOYSA-N 403.552 2.424 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 734066051 NEUPGNXZLAFFFX-WZONZLPQSA-N 410.518 2.095 10 20 HECD COc1ccc(C=O)c(OCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 736197111 ZKXMLXNHGYOCPJ-UHFFFAOYSA-N 412.486 2.412 10 20 HECD CCC[C@H](O)CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 740982568 NFHBCOIPAPMCCM-INMHGKMJSA-N 410.486 2.150 10 20 HECD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2c(O)ccc3c2CCCC3)c1 743718098 YDTVSSWLBFUVPT-UHFFFAOYSA-N 404.488 2.383 10 20 HECD C[C@H]1[C@@H](C)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@]1=O 744408330 WMRQLCYQEJTRAH-MZICGWGFSA-N 410.495 2.242 10 20 HECD Cn1cc(C[C@H]2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)cn1 746757144 FTAGDONIJKIQPE-QGZVFWFLSA-N 401.486 2.170 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)NCCc2ccc(O)c(O)c2)cc1 750791625 LTUFLVPNIPAEQJ-UHFFFAOYSA-N 400.460 2.013 10 20 HECD COC(=O)CN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 752428852 MPFVVPBBCNXHJO-UHFFFAOYSA-N 408.366 2.148 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@H]1CCCN1S(C)(=O)=O 753691732 MRIGTPLUWRDEAP-LJQANCHMSA-N 408.568 2.242 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058684 APXKIKWOXCLBRV-FUHWJXTLSA-N 417.554 2.209 10 20 HECD COc1ccc(C(F)(F)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 755585836 FYHFAXUORLRGOV-UHFFFAOYSA-N 424.469 2.338 10 20 HECD CNC(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 756685348 QEOSEVNRAFJVQQ-RKVPGOIHSA-N 408.518 2.399 10 20 HECD Cc1ccc2c(c1)c(=O)n(C)c1nnc(COC(=O)/C=C/c3ccc(O)c(O)c3)n21 759595782 LZZIZMYQKAILEP-VMPITWQZSA-N 406.398 2.057 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 770630151 FYYAOOBCUXQWHF-MDOVXXIYSA-N 410.486 2.270 10 20 HECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1=O 771243900 QVAROYDSUZMRCK-HSZRJFAPSA-N 424.501 2.187 10 20 HECD CS(=O)(=O)C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 774188140 PKVHUAWVWFUKFH-FQEVSTJZSA-N 417.531 2.108 10 20 HECD COc1c([N+](=O)[O-])ccc(CNC[C@@H](c2cccs2)N2CCN(C)CC2)c1O 774942858 QFDCKESODMLHMY-INIZCTEOSA-N 406.508 2.449 10 20 HECD C[C@@H](NC(=O)N1CCN(CC(=O)N2CCCCC2)CC1)c1ccc(N(C)C)cc1 776249397 OEUUVGUZEIWLSH-GOSISDBHSA-N 401.555 2.153 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@@H]4c5ccccc5CCN4C3=O)CC2)cc1 777628607 SGEYWBOEHUJCHG-QFIPXVFZSA-N 420.513 2.379 10 20 HECD O=C(Cn1ccc2sccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 779812002 VTPLNADFYGZXOL-UHFFFAOYSA-N 401.463 2.355 10 20 HECD CC[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 785427676 GFLOJYHTDKPAPW-OAQYLSRUSA-N 408.546 2.322 10 20 HECD CSc1ccc(F)cc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324059 QZNQXHFEXZNOAJ-UHFFFAOYSA-N 417.506 2.317 10 20 HECD CC[S@](=O)[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788910500 LPDLTZQHWHESLB-KILVOPBSSA-N 405.564 2.099 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C(F)(F)F)O[C@H](C)C2)cc1 788969075 YQISEUPVHDHSSD-CJNGLKHVSA-N 401.429 2.327 10 20 HECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C12CCC2 789854907 HGGDMZJAPGUOQR-MOPGFXCFSA-N 417.575 2.320 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 797710011 PUILLACDUXRJMQ-MVWRLGRASA-N 423.485 2.118 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC([C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 803308493 GFNAXBCIZOGLCP-DYESRHJHSA-N 415.534 2.118 10 20 HECD O=C(NCCOC[C@@H]1CCOC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804935745 WYOBDIHGAIAMMB-QGZVFWFLSA-N 404.507 2.223 10 20 HECD Cn1nnnc1-c1cccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)c1 805135712 QXBNOUNRJLEVJJ-UHFFFAOYSA-N 414.274 2.368 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C1 806282462 LNSQULRGDFVWHX-CQSZACIVSA-N 420.560 2.145 10 20 HECD CC(=O)NCC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457571 OPDJDRXVPPXQLI-KRWDZBQOSA-N 420.529 2.235 10 20 HECD COc1ccc(CN2CC[C@H](NCc3cc([N+](=O)[O-])ccc3O)C2=O)c(OC)c1 808423644 HCTGQPALSPLOKD-KRWDZBQOSA-N 401.419 2.208 10 20 HECD CC(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918006364 VUYRJJZSWVMLKI-IBGZPJMESA-N 423.517 2.346 10 20 HECD CN(C)c1ccc(CN(C(=O)NCc2cccc(S(N)(=O)=O)c2)C2CC2)cc1 918069762 IVWPUSHEVUXAAG-UHFFFAOYSA-N 402.520 2.274 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCCN4CCC[C@H]4C3)cc2F)CC1 1252069567 SUAWIAMUDHWDQE-IBGZPJMESA-N 403.546 2.347 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777848384 SHBSCNIMYBRNSM-MSLCTRMTSA-N 417.506 2.057 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)C1CC2(CCC2)C1 1804340604 WSXUBHAICICSFQ-QDMKHBRRSA-N 421.588 2.065 10 20 HECD Cn1cccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816330851 WJHRUTPIWPNAOQ-AWEZNQCLSA-N 410.434 2.174 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727109 DTPQWTBXZLLABD-OKAXRFMISA-N 402.476 2.221 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1C(N)=O 727359389 QAPAUPVHOJJAER-UHFFFAOYSA-N 413.503 2.206 10 20 HECD Cn1cc(Br)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 728165987 YIZDKOGEEWBUOJ-AWEZNQCLSA-N 419.323 2.419 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1 728979991 SOGQIJXGVNKXML-LLVKDONJSA-N 421.413 2.293 10 20 HECD COc1cccc(CNC(=O)[C@@H](CCSC)N2C(=O)c3ccccc3C2=O)c1O 729861133 DTWPEGPCMVTJNU-MRXNPFEDSA-N 414.483 2.435 10 20 HECD Cc1cccc2nc(CNC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cn12 731756777 OHQOWHAMAJLWMF-GOSISDBHSA-N 420.517 2.344 10 20 HECD COCCN(CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(=O)OC(C)(C)C 733949618 CGJBCVBNYDNUPY-UHFFFAOYSA-N 421.538 2.365 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 734557540 HSDVYIUUEFYGDU-RTWAWAEBSA-N 411.502 2.449 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2c(O)nn(C)c2n1 736196279 QGEWEQQWXDTRLN-UHFFFAOYSA-N 409.490 2.121 10 20 HECD Cc1ncc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 743975201 OCKHBNDBBPFIPY-ZDUSSCGKSA-N 405.405 2.110 10 20 HECD COCCN(Cc1nnc2n(C)c(=O)c3ccccc3n12)c1ccc(OC)c(OC)c1 746478095 MYLGIFVSCAOMBL-UHFFFAOYSA-N 423.473 2.251 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2cnc3c(N)ncnc32)c(C)n1-c1ccccc1 750508738 ICFQYNRDVXPVOW-UHFFFAOYSA-N 404.430 2.242 10 20 HECD COC1CCN(CCNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 751086373 YRVYWYNUAQOREH-CALCHBBNSA-N 422.545 2.349 10 20 HECD C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 753852850 GPNORTHJKMABCJ-CYBMUJFWSA-N 406.460 2.016 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(CC(C)C)nn3C)CC2)cc1F 754213365 RLWYIPMMMAOWPT-UHFFFAOYSA-N 417.485 2.054 10 20 HECD CCn1c(SC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)nnc1C1CC1 758188501 FWWYAYAPRIOKKW-GOSISDBHSA-N 417.579 2.459 10 20 HECD CCOc1ncccc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759221685 DWZIEXFPZSIDDJ-UHFFFAOYSA-N 401.463 2.469 10 20 HECD COCc1nc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cs1 759223646 SLXAEDFDEGJFAH-UHFFFAOYSA-N 407.492 2.278 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc(OC)c1O 763963953 MGWKDPHFUHXIOK-HNNXBMFYSA-N 413.474 2.041 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccn(Cc2ccncc2)n1 768023755 DQXOBCHXJNCIGH-UHFFFAOYSA-N 406.490 2.380 10 20 HECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NCc2ccccc2O)cc1 769363856 WTWDHYFYQQETPE-LJQANCHMSA-N 416.499 2.454 10 20 HECD C[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CN(C)CCO1 770107067 GRMLXPKJZVTTAZ-KBXCAEBGSA-N 412.481 2.275 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOCC4(CCCC4)C3)CC2)cc1 776123568 UQTZHFRAZIOSDQ-UHFFFAOYSA-N 416.566 2.419 10 20 HECD CCOCCC1(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778394660 WUHNSDRJAYXEHF-CMDGGOBGSA-N 415.534 2.223 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)O)ccc3C)c2)CC1 780407761 OVZQOJLANJCJGN-UHFFFAOYSA-N 417.487 2.163 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)c1ccc(N(C)C)cc1 787635591 FFZFIDCZHCGZCW-MGPUTAFESA-N 400.498 2.488 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccccc1N1CCOCC1)c1ccc(N(C)C)cc1 788331322 JUOPFLUIOGSANS-KRWDZBQOSA-N 410.518 2.083 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC(C)(C)[C@H]3C)cc2F)C[C@@H](C)O1 789815885 BFZHPSLORVVYTP-BZUAXINKSA-N 421.513 2.081 10 20 HECD C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)S1=O 792387967 JYPNZEHNHIWQKM-ZIAGYGMSSA-N 410.495 2.242 10 20 HECD C[S@](=O)C1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 799364679 LTWQBDVHCPAPIO-NDEPHWFRSA-N 419.469 2.252 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1Cc1ccccc1 807290413 ISJTWOZVNVEPDM-KNQAVFIVSA-N 418.541 2.458 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)cc1 807675736 IUTPOOLGNSKWHW-JOCHJYFZSA-N 422.529 2.037 10 20 HECD COC(=O)CC[C@]1(C)NC(=O)N(CN2CCCc3cc(OC(F)F)ccc32)C1=O 811761926 LKPISQJDCFDRAP-IBGZPJMESA-N 411.405 2.262 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]c(C(F)(F)F)c1 814330227 MYPWAASAPSXPPE-UHFFFAOYSA-N 401.410 2.198 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCCc4nc(O)ccc43)cc2)C1 918119013 XNWALHUCUDRVDB-UZLBHIALSA-N 423.517 2.366 10 20 HECD CNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918211201 IIXQUSLFNRFGLT-UHFFFAOYSA-N 414.481 2.146 10 20 HECD CCOc1cc2c(cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)O[C@@H](C)C2 919807837 HJMVDMMJWAOBIJ-LBPRGKRZSA-N 420.487 2.416 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(N2CCOCC2)cc1 920890253 RLEYSAOLFDKFCL-CQSZACIVSA-N 419.503 2.091 10 20 HECD COc1cccc(CC(=O)N2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 921070842 ZLQXJUSASRDVSD-UHFFFAOYSA-N 410.518 2.358 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CC[S@@](=O)C1 1116279711 ZELJYANLVJFANP-FERWIPGYSA-N 414.599 2.367 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(CNC(C)=O)cc3)CC2)cc1 1319597275 AMBABTDPFLSNOO-UHFFFAOYSA-N 417.531 2.232 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)cc1 1340495411 RFWZNGQMHZEJFB-LJQANCHMSA-N 422.529 2.359 10 20 HECD O=C([C@H]1CCCSC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037096 DWVSRYXGRLWFRD-ZKKXHLJNSA-N 418.515 2.163 10 20 HECD CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 7229078 ZYGIKNVFVDIBNB-JOCHJYFZSA-N 412.465 2.365 10 20 HECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1 15134769 JADUJUBGEMUQOI-UHFFFAOYSA-N 415.437 2.366 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1 443014371 ZTDCUEJOZIVYJE-UHFFFAOYSA-N 420.882 2.174 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CO4)cc2F)CC1 730194586 MIKURHRZHJGNFE-UHFFFAOYSA-N 412.465 2.229 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 734270889 ZIDZSDDBNLUORF-HLLBOEOZSA-N 406.502 2.107 10 20 HECD O=C(CCNS(=O)(=O)c1cccs1)N(Cc1ccccc1O)C[C@H]1CCCO1 735519748 UBJDQXOZEDUTKM-MRXNPFEDSA-N 424.544 2.330 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3Cn3cccn3)nc12 741346236 HCLDCNVPQILBLV-UHFFFAOYSA-N 421.413 2.213 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)n1nnc(-c2ccccc2)n1 742689720 JIPCTBQCBQGPOH-KRWDZBQOSA-N 420.517 2.426 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O 743889002 JCAFOGRFEAQICP-UHFFFAOYSA-N 423.922 2.407 10 20 HECD COC1(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCOCC1 747318487 TUGDVTKTPQLZLW-UHFFFAOYSA-N 424.409 2.296 10 20 HECD Cc1ccccc1CC(=O)N1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 749908321 XXCMQIQJDJQYNJ-UHFFFAOYSA-N 422.573 2.406 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OCCO3)cc1 751272928 SNDLLVRNSRPMEV-UHFFFAOYSA-N 412.489 2.410 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1 761995804 NKXYMRUNRPDDFB-UHFFFAOYSA-N 420.487 2.453 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc(S(N)(=O)=O)ccc1OC 766270932 XAIYJNVSUVELHQ-UHFFFAOYSA-N 419.503 2.133 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nc([C@H](C)SCC)no3)nc12 767105883 BYQBMWJLTIKPSA-NSHDSACASA-N 420.495 2.441 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1 769663926 LBWKHZUZLXXUQB-GOSISDBHSA-N 403.504 2.331 10 20 HECD O=C(CN1CCC[C@@]12CCOC2=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778244764 JWFQWWJIZNTKIX-QHCPKHFHSA-N 404.422 2.182 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)c1 779287786 RNVWMNHSWVPHDA-QGZVFWFLSA-N 412.414 2.256 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC[C@@H]3CCCCO3)CC2)cc1 780057885 ZOEVOQLYMLCIBF-NRFANRHFSA-N 404.555 2.466 10 20 HECD O=C(NCCNC(=O)c1cc[nH]n1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 780229087 HTTLPQRMDDHSMB-UHFFFAOYSA-N 405.418 2.310 10 20 HECD CC(=O)Nc1ccc(C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 780405076 MVKSONSWKCTAOO-UHFFFAOYSA-N 415.515 2.118 10 20 HECD COc1cc(N2CCN(C(=O)NCC3(N(C)C)CCC3)CC2)cc(OC)c1OC 782634303 OPXDFEXDTGAERR-UHFFFAOYSA-N 406.527 2.028 10 20 HECD O=C(NCCn1cnc2ccccc21)C(=O)NCc1ccc(N2CCSCC2)cc1 786985729 PMVHKCBXKUCRDU-UHFFFAOYSA-N 423.542 2.022 10 20 HECD O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 789965330 FLFXIPHQEJKTTC-INIZCTEOSA-N 414.481 2.306 10 20 HECD Cn1cc([C@@H]2CSCCN2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 790220509 XHMCNKKKRRFRII-IBGZPJMESA-N 419.526 2.396 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCn3cccn3)cc2Cl)C1 793758269 WGRQNDYJQXDEOL-HNNXBMFYSA-N 403.914 2.205 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c(O)c1 794389559 QQXGSOUBCAKTON-MRXNPFEDSA-N 404.488 2.118 10 20 HECD CN(CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 795396446 JFPDIUYLJFNCJR-QGZVFWFLSA-N 418.538 2.262 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@H]1O 806444017 XSBMSGVWNLPNEJ-SUMWQHHRSA-N 401.429 2.454 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN3c4ccccc4C[C@@H]3C2)c1 811613816 CICBDXLDRKGAPP-MRXNPFEDSA-N 401.488 2.041 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1789783895 HOQQGICHKPAJMT-FECCGZLWSA-N 422.909 2.391 10 20 HECD Cc1ocnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428493 RDVFIWMTOZWWMN-INIZCTEOSA-N 414.462 2.336 10 20 HECD CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)Cc3ccc(N)cc3)CC2)cc1 236747147 RCFAGUAIRCKLKB-UHFFFAOYSA-N 401.532 2.468 10 20 HECD Cc1c(CNC(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)n(C)c2ccccc12 472228085 YLDXZBSEQVFSFC-SFHVURJKSA-N 411.550 2.325 10 20 HECD CCN1CCN(c2ccc(NC(=O)COC(=O)c3ccc(C)c(O)c3O)cc2)CC1 727005071 FERWYLZNQTUBSJ-UHFFFAOYSA-N 413.474 2.344 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4cccn4)nc3)cc2F)CC1 730194537 KOCKNCDVEFCAMD-UHFFFAOYSA-N 408.481 2.478 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 731857812 FNNUZUBSGGNFCA-KRWDZBQOSA-N 423.469 2.237 10 20 HECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097485 SMLLMYNYKQYDNP-UHFFFAOYSA-N 412.877 2.331 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CCCCO)C3CC3)cc2F)C[C@@H](C)O1 741250136 INFRYKLSGMEMTE-IAGOWNOFSA-N 407.530 2.292 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCCC(N)=O)cc1 743150151 NMRRNOIZHYLWEA-UHFFFAOYSA-N 412.490 2.441 10 20 HECD COc1cccc(CNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1O 743212560 LECDIBYQEGVHEN-UHFFFAOYSA-N 405.476 2.411 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 745784565 XXCPYXOBISZWEV-DENIHFKCSA-N 404.555 2.320 10 20 HECD CC(=O)N1CC[C@@](C)(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 746834704 VFLVKKPVTOZVKO-LJQANCHMSA-N 413.440 2.417 10 20 HECD CN(Cc1ccccc1O)C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 749242006 VBRRJTOJAXZIDJ-HNNXBMFYSA-N 404.492 2.490 10 20 HECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCCCSc3nccs3)ccc21 749731124 JTOCXJQLZKQUAQ-UHFFFAOYSA-N 404.517 2.289 10 20 HECD CNC(=O)c1cccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753931681 VBKSHHRJJVPCDG-UHFFFAOYSA-N 400.454 2.226 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCCc3c[nH]c4ccccc34)CC2)cc1 758184027 DKEGPLWPMIXOQY-NRFANRHFSA-N 408.546 2.492 10 20 HECD COc1cc2c(cc1/C=C1/SC(=S)N(CCCN3CCOCC3)C1=O)OCO2 758818261 CZJDGSGMXOBCGL-LICLKQGHSA-N 422.528 2.347 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1S(C)(=O)=O 759594064 FHBARIGAOGJDSY-CUZBXDDWSA-N 405.428 2.085 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCCN3C3CC3)cc2)C1 764848909 FOIIZGADHSFQNK-GHTZIAJQSA-N 413.566 2.204 10 20 HECD COc1cc(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)ccc1OCC(N)=O 765402571 CHLNYUSFLQTTJP-OAHLLOKOSA-N 417.481 2.386 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 769395364 GOSVTNPTJZCOLP-QGZVFWFLSA-N 409.552 2.020 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)cc1 770286038 JZDYFCBPPGWFPA-UHFFFAOYSA-N 416.547 2.379 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN(C)C(=O)c1ccc(Br)o1 773740905 QVTJVJFLMKUWOP-JTQLQIEISA-N 411.252 2.273 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccnc(N(C)C)n3)cc2F)C[C@@H](C)O1 775727480 SUJVMBLSOFXVRY-HUUCEWRRSA-N 416.501 2.295 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 779474976 HAMMQGFYNZSPOT-ONNFQVAWSA-N 411.502 2.448 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@@H]3CCO)CC2)cc1 779518894 HMRPACLHVNAXHJ-NQIIRXRSSA-N 404.555 2.058 10 20 HECD C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424608 RAJGCKLGOSTNPO-WBVHZDCISA-N 418.538 2.273 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1 785427624 FDLOHGAJYHLCQO-QGZVFWFLSA-N 400.910 2.417 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)c1 787485194 LJGYWULODOLFMZ-CYBMUJFWSA-N 412.446 2.055 10 20 HECD CN(Cc1ccc(F)cc1F)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798124 CBMSLZUKOZSKIW-UHFFFAOYSA-N 421.419 2.215 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC2(CCOCC2)O1 790500407 DSDUCEVDAXCYON-MRXNPFEDSA-N 407.486 2.142 10 20 HECD CC[S@@](=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 803472053 RSQUOFHVGAMKFA-MUUNZHRXSA-N 405.472 2.360 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)cc1F 803662202 UXQVYFVGTGRZEG-IBGZPJMESA-N 412.509 2.241 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 804118496 RZTNEPOQDGZDOX-GOSISDBHSA-N 410.518 2.081 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1ccc([S@@](C)=O)cc1 807098977 HOKVPGGYVQHELN-MUUNZHRXSA-N 401.532 2.073 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H](O)C3CC3)cc2Cl)C1 807957020 VRKFJBNIZCMKFC-AUUYWEPGSA-N 407.942 2.422 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3nn(C)c4ccccc34)cc2)CC1 857493804 CPYZPQMZXWOWBO-UHFFFAOYSA-N 405.502 2.101 10 20 HECD CC(C)C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 917355973 PPKUQKOMRAFJCK-IXDOHACOSA-N 400.475 2.122 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 920250221 CBFCEMBYHCLBGH-HJWRWDBZSA-N 409.442 2.267 10 20 HECD CC(C)CNC(=O)c1ccccc1N/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 920979959 NTMKCRGFFIDXFG-XNTDXEJSSA-N 402.520 2.268 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2)CC1 1825827242 AXEBKNVCHJFWSD-SFHVURJKSA-N 410.474 2.435 10 20 HECD Cc1nc[nH]c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427064 CORRAFYDPBMELD-MRXNPFEDSA-N 413.478 2.071 10 20 HECD C/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831338198 FVMKHMOCELUIAC-FIMWJMCYSA-N 409.577 2.043 10 20 HECD O=C(CCC1CCCC1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055870 PFURZSSFTDNXSF-UHFFFAOYSA-N 409.577 2.021 10 20 HECD CCSc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847193910 FMZTVLMHLTXGBN-GJZGRUSLSA-N 414.487 2.129 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 15141607 RPKCGCBXLCLOEL-UHFFFAOYSA-N 405.476 2.471 10 20 HECD CCCNC(=O)[C@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 15692373 IHCNNPONJDDCDJ-NSHDSACASA-N 410.382 2.442 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCCC[C@H]1C 726615840 HETNIIZACXPNJC-CVEARBPZSA-N 420.529 2.376 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC3CCC(C(=O)OC)CC3)cc2F)CC1 730131875 WBUHXHHTOGWRFO-UHFFFAOYSA-N 420.529 2.499 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCOc3ccc(C=O)cc3)cc2)C1 731612238 HZMJZNLGOWAGOC-LJQANCHMSA-N 409.486 2.286 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c1 734073262 ITCPGNQQLBZZIP-GJZGRUSLSA-N 413.474 2.269 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(CCN(C)C)CCN(C)C)cc2F)C[C@@H](C)O1 741080339 ZWTDABGSYKCMME-QZTJIDSGSA-N 423.577 2.074 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3ccnc3S(C)(=O)=O)c2C)cc1 746138158 HOKYQUXJDSRCTB-UHFFFAOYSA-N 415.471 2.364 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)o1 748053153 KGNSVCCTZBGNOR-UHFFFAOYSA-N 408.476 2.366 10 20 HECD CCCN(CC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 750875205 POWLUYZRQZTLQX-KRWDZBQOSA-N 420.535 2.107 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2C1=O 761157223 JZOUJBRKFQNRBT-UHFFFAOYSA-N 404.517 2.008 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@H](Cc4ccncc4)C3=O)cc2F)CC1 761275109 DEECZDBNOOBRSL-LJQANCHMSA-N 411.481 2.026 10 20 HECD O=C(CCN1C(=O)c2ccccc2C1=O)NCc1cccc(Br)c1O 765732901 UNEQFRMHWJLYBA-UHFFFAOYSA-N 403.232 2.457 10 20 HECD CC1CCN(c2ccc(CNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)cc2)CC1 766875316 OAIIMYAYGBBYDD-UHFFFAOYSA-N 418.538 2.180 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(=O)OC)n(C)c2)cc1F 774228295 RTGSBXXFHILFDI-UHFFFAOYSA-N 404.442 2.052 10 20 HECD CCOC[C@H]1CCCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778277591 NAMNIQWKEXKYFF-VYENPZKTSA-N 415.534 2.175 10 20 HECD CCN(CC)c1ccc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)cc1F 779607314 JLSGQASENBBELE-GOSISDBHSA-N 413.559 2.298 10 20 HECD C[C@@H](OC(=O)Cc1ccn(C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 782380203 KPWZUAMIAKOTIT-CYBMUJFWSA-N 417.421 2.308 10 20 HECD CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422619 PFTCTGBWDFSRIL-JOCHJYFZSA-N 423.561 2.277 10 20 HECD CCS[C@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789810556 BDGZFFZZRTYVSV-MJGOQNOKSA-N 423.554 2.459 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(CNC(=O)C(F)(F)F)CC1 799171994 WDHHYDONUKJVSC-UHFFFAOYSA-N 414.472 2.102 10 20 HECD O=C(NCc1cscn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449779 MWKRADKLONAUQZ-UHFFFAOYSA-N 410.446 2.146 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCc1cccc(F)c1 805233658 KTJXBEAZHZQPAX-UHFFFAOYSA-N 413.493 2.370 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3csc(C(C)=O)c3)CC2)cc1 815278519 GMDMSRNPXOJJBQ-UHFFFAOYSA-N 402.472 2.465 10 20 HECD CCOc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918337997 ITVXNYFQNHGRHB-UHFFFAOYSA-N 418.515 2.015 10 20 HECD CC[S@@](=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918372613 NGHANRRBGYMAEY-SFNQZPIRSA-N 413.543 2.446 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccccc4O)CC3)cc2F)CC1 1116441891 XWHVFVXXAIMZPD-UHFFFAOYSA-N 412.509 2.241 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3sc(N(C)C)nc3C)cc2)CC1 1324998196 IRZDNPXQCKVQNG-UHFFFAOYSA-N 401.536 2.116 10 20 HECD CC1(C)NC(=O)N(CCCNC(=O)NCc2cc(Cl)cc(Cl)c2O)C1=O 1357714630 IVRIPYZGSSFSCU-UHFFFAOYSA-N 403.266 2.219 10 20 HECD CC(C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843443 OPZINZQQYRTBSO-AWEZNQCLSA-N 417.466 2.337 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1cc(O)nc(O)c1 1817843993 MGSUPAAVMDXRHA-GFCCVEGCSA-N 414.447 2.292 10 20 HECD CC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426537 YZENZLKYLZZVIS-KRWDZBQOSA-N 403.479 2.095 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@H](NC(N)=O)c1cccs1 9975467 RKQFAOHCZBBQBZ-KRWDZBQOSA-N 402.520 2.343 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCN(CC(=O)N(C)C)CC3)c2C)cc1F 28729703 JVHTYBTXERHWTM-UHFFFAOYSA-N 414.525 2.430 10 20 HECD O=C(c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1)N1CCC(O)CC1 55628782 GZJIJGFXHKRQIB-UHFFFAOYSA-N 418.500 2.089 10 20 HECD COC(=O)CSCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 111165178 DDEGUNQENYHMNI-UHFFFAOYSA-N 420.453 2.455 10 20 HECD CCCN(Cc1ccccc1O)C(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 727170718 WEOMCAUJMZSHJJ-UHFFFAOYSA-N 407.470 2.203 10 20 HECD Cc1ccccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732886522 GLKZIWWVPTZIEZ-RXVVDRJESA-N 410.518 2.230 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1 733041967 ISVHGAQIDRCYHL-LLVKDONJSA-N 421.466 2.025 10 20 HECD NC(=O)CN1C(=O)/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)SC1=S 733370069 SYGPKJUXKXQNMG-VZUCSPMQSA-N 406.470 2.405 10 20 HECD CNC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745903261 FCOBWXLWPZDMMK-LSDHHAIUSA-N 410.465 2.424 10 20 HECD Cc1[nH]nc(C(F)(F)F)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746590750 MZAGPTVWQBFZSI-ZDUSSCGKSA-N 409.412 2.369 10 20 HECD COC(=O)c1c(C)cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 751031882 HTQBAKSJTFXPAA-UHFFFAOYSA-N 404.488 2.097 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1[N+](=O)[O-] 751229147 VIIQKAPHRWXUQA-UHFFFAOYSA-N 423.466 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)CC2)cc1F 753741214 DIOVNTKVAYWCPT-JOCHJYFZSA-N 413.493 2.384 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(c4cc(C)[nH]n4)CC3)CC2)cc1 754096146 ASZYOAZOOMPDTM-NRFANRHFSA-N 413.566 2.089 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)CN(C)C4)CC2)cc1F 754218374 YMGGHXKSDKUQRL-UHFFFAOYSA-N 412.465 2.067 10 20 HECD NC(=O)C1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCCC1 755976360 XCIGAQXBXQDVQO-UHFFFAOYSA-N 405.454 2.178 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc4c3OCCO4)CC2)cc1 761009217 AVBQEKLSGIIACE-GOSISDBHSA-N 400.475 2.028 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)NC4(CCSCC4)C3=O)cc2F)CC1 761281572 PMDFGXQYJXETJZ-UHFFFAOYSA-N 406.527 2.285 10 20 HECD C[C@@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763878064 LOSNMFIOTAPBST-IQYXRRSRSA-N 424.522 2.489 10 20 HECD COc1cc(C(=O)O)c(NS(=O)(=O)c2cccc3nonc23)cc1OC(F)F 765051564 CJLHATFJMBXQLG-UHFFFAOYSA-N 415.330 2.332 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1 769707109 WXMYZMOZVUIBIK-UHFFFAOYSA-N 407.423 2.282 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccccc1Cl 774552284 YCBRFACKPINMKW-UHFFFAOYSA-N 401.894 2.451 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 776078616 ZXQNHFYYEISNCL-NQIIRXRSSA-N 423.579 2.409 10 20 HECD C[C@H](NC(=O)N1CCN(CC(=O)N2CCCCC2)CC1)c1ccc(N(C)C)cc1 776249398 OEUUVGUZEIWLSH-SFHVURJKSA-N 401.555 2.153 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 776269506 LDCCNYQLNPAIEX-AWEZNQCLSA-N 403.504 2.111 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(N3CCSCC3)CCCCC2)cc1 785422914 POJXNFBAAFSOJW-UHFFFAOYSA-N 418.607 2.237 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1csc(O)n1 792079468 MZBAAKQLACEKOV-UHFFFAOYSA-N 414.466 2.034 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 792330080 JYVBKSRCMFZZCU-UHFFFAOYSA-N 413.547 2.483 10 20 HECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccco1 793850510 YUGHXJLVKZFKLO-FQEVSTJZSA-N 412.534 2.478 10 20 HECD Cc1c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nnn1Cc1ccccc1F 802144111 IYQLGECSPIOJHK-UHFFFAOYSA-N 419.438 2.103 10 20 HECD CC[C@@H](CO)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687281 ZHJIUZMUWLTKFF-NRFANRHFSA-N 409.530 2.485 10 20 HECD C[C@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2ccccc21 803909811 CYRRZOWYEBBPSJ-CQSZACIVSA-N 404.561 2.309 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 807290738 NAGHTTGDPQFBMV-OAQYLSRUSA-N 409.461 2.418 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CC45CCOCC5)n3)CC2)cc1 809464464 GFZBEWCISDGOLH-GOSISDBHSA-N 412.490 2.254 10 20 HECD O=S(=O)(NC[C@H]1CCCN(Cc2cc(Br)ccc2O)C1)C1CC1 809784861 PCQXUWHAMVRUCL-GFCCVEGCSA-N 403.342 2.449 10 20 HECD COc1ccc(N2CCC(NC[C@@H](O)COc3ccc4c(c3)OCO4)CC2)cc1 812826240 HMQSKJYWASLGJZ-GOSISDBHSA-N 400.475 2.422 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3nnc4n3CCCC4)cc2F)C[C@@H](C)O1 918216069 LRZOSJXZPHYZGD-GASCZTMLSA-N 416.501 2.367 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 919568760 KVEBIEGEFHEDKU-LSDHHAIUSA-N 424.544 2.346 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920870183 MPXRGMLYBVGMCJ-AWEZNQCLSA-N 420.487 2.270 10 20 HECD CCN(CC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1 921061568 GYJNFBBGJNLWBF-SFHVURJKSA-N 424.563 2.488 10 20 HECD Cc1c[nH]c(C)c1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1793263701 AFMJHSGJDPNOTA-BJWYYQGGSA-N 412.490 2.322 10 20 HECD Cc1ncccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1794182902 CIELCFMIHDBPHJ-BCDXTJNWSA-N 410.474 2.081 10 20 HECD Cc1ccoc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1796514578 SBAMIKMTGRMJDX-YWVIFJGQSA-N 420.849 2.170 10 20 HECD O=C(Cc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722674 UGSJUXSIGDEDRS-CQSZACIVSA-N 424.482 2.418 10 20 HECD CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CN2CCCc3cc(OC)ccc32)C1=O 28623657 NHAJPFCKDMBPLC-HSZRJFAPSA-N 422.485 2.336 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3Oc4ccccc4O[C@H]3C)CC2)cc1 106213110 JWNCZEZKMCZATK-JTSKRJEESA-N 411.502 2.162 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NCCCN3CCC[C@H](C(N)=O)C3)ccc21 489953192 ATOMQUHECDAHPE-IBGZPJMESA-N 414.550 2.222 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3onc(C)c3c2)cc1 726767116 XLVFSLAINQHBOJ-UHFFFAOYSA-N 410.477 2.484 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 737165277 DNXMRWLCJXTSFA-UHFFFAOYSA-N 401.442 2.288 10 20 HECD CCN(CC)c1ccc(CNCC(=O)Nc2cccc(S(=O)(=O)NC)c2)cc1F 740004713 UCKCETHHKHVPND-UHFFFAOYSA-N 422.526 2.308 10 20 HECD CCN(CC)c1ccc(CNCCS(=O)(=O)NC[C@H]2CCCCO2)cc1F 740005444 CJQLIQFKGHFAMQ-QGZVFWFLSA-N 401.548 2.250 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3ccsc3)CC2)cc1 740466963 LTDGXFZKWXOQFL-FQEVSTJZSA-N 418.563 2.302 10 20 HECD COc1ccc(N2CCN(C(=O)C3(S(=O)(=O)c4ccccc4)CC3)CC2)cc1F 753737217 CPTHQNIQBKXUJO-UHFFFAOYSA-N 418.490 2.489 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1 756178917 MKSUZGDMKVAUTD-HNNXBMFYSA-N 421.453 2.427 10 20 HECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1N1CCOC1=O 769938240 NGLLZHHBCQQIBS-UHFFFAOYSA-N 405.432 2.281 10 20 HECD Cc1nnnn1-c1ccc(F)c(NC(=O)CN2CCOc3cc(N(C)C)ccc32)c1 774754906 ZZODYPCDLKBUDR-UHFFFAOYSA-N 411.441 2.013 10 20 HECD COCCCN(Cc1cc(Br)cc(C)c1O)[C@@H]1CCS(=O)(=O)C1 775644307 GUXUFXURTBWXQP-OAHLLOKOSA-N 406.342 2.489 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 776074390 XUHIZMMQKMLEBS-RXVVDRJESA-N 423.579 2.411 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](CC(F)F)C(=O)O)cc2F)C[C@@H](C)O1 780445839 TZGLXBAYNHKGJL-GYSYKLTISA-N 403.401 2.347 10 20 HECD COc1cccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 787156943 NTWNYSRJAHDQKO-QGZVFWFLSA-N 411.502 2.068 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](C)N(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 787635731 GAAUJILHRJTQFD-MOPGFXCFSA-N 424.545 2.342 10 20 HECD Cn1cc([C@H]2CSCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 790241491 VMWFMTSXAVTGOU-LJQANCHMSA-N 401.536 2.256 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)Nc3ccc(O)cc3OCC)ccc2O1 790409364 OKECDONHARRSEW-SFHVURJKSA-N 407.444 2.458 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 790514261 KPXWPIQAOCNMGI-UHFFFAOYSA-N 419.409 2.274 10 20 HECD CCC(CC)CN(CC)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793733297 LYNAXQPHKWZRFB-LJQANCHMSA-N 416.566 2.289 10 20 HECD COCC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)CC1 796351571 UOKXNVSJLAZICL-UHFFFAOYSA-N 423.462 2.487 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c(OC)c1 800601557 UIQAEHIQKHQVGA-UHFFFAOYSA-N 413.474 2.104 10 20 HECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 807100961 PACZNCMATSTGSM-NRFANRHFSA-N 422.529 2.297 10 20 HECD Cc1cc(-c2nc(-c3cn(CCO)c(=O)nc3O)no2)c(C)n1-c1ccc(F)cc1 904864433 NNHNJJYYZCPBMI-UHFFFAOYSA-N 411.393 2.205 10 20 HECD O=C(CCNS(=O)(=O)c1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 917364122 DXGKFQVTYOFJOZ-GOSISDBHSA-N 418.515 2.268 10 20 HECD O=C(NC1CCOCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 918343043 LNAPKELAPIMSPU-UHFFFAOYSA-N 421.431 2.010 10 20 HECD CC(C)(C)CC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785508749 KSVPPSXWUIRMAL-HVPBSWBLSA-N 418.490 2.083 10 20 HECD O=C(Cc1cc(F)cc(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600540 KSJFQUVGVNCGGI-BJWYYQGGSA-N 417.412 2.266 10 20 HECD COc1ccc([C@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847779548 XWGCTLKRBFMTDB-YRXWBPOGSA-N 423.469 2.121 10 20 HECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc3c(c2)CCCN3C)C1 726250195 TWBBSKSEVQCLHM-VQIMIIECSA-N 402.539 2.142 10 20 HECD C[C@@H](NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2)C(=O)N(C)C 727142722 JYKWOJSXRUZKFZ-CQSZACIVSA-N 403.504 2.119 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2)c1 734016422 PXRJBGUQBWRQBB-KRWDZBQOSA-N 424.544 2.117 10 20 HECD Cc1cc(S(N)(=O)=O)cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1C 735754064 YAZOEGYENALKMH-UHFFFAOYSA-N 418.519 2.109 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 735858389 XVZXEYSKUSDEAN-DEOSSOPVSA-N 409.530 2.417 10 20 HECD COCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 737756588 NQEMEOTXPNHMPJ-UHFFFAOYSA-N 406.432 2.154 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2cccc(-n3cnnn3)c2)cc1 742632749 NSXJBWLMHXSFER-UHFFFAOYSA-N 400.508 2.329 10 20 HECD CCCCOC(=O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751061011 QMMLEGHSGKDUOF-UHFFFAOYSA-N 412.489 2.328 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2csc(S(N)(=O)=O)c2)cc1 751405821 MONAGJXRROPZFT-KRWDZBQOSA-N 423.560 2.283 10 20 HECD CC(=O)c1cccc(OC[C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755302455 BWWFXOBTYCUWDH-NRFANRHFSA-N 412.486 2.376 10 20 HECD C[C@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(F)cc1O 756712400 PRPBVWDBQUUMFD-RDJZCZTQSA-N 401.486 2.478 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@H]([C@@H]4CCCO4)C3)cc2F)CC1 757200011 KWWJFZAGOSJXSJ-SFTDATJTSA-N 420.529 2.057 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)c3cn(C)nc3C)CC2)cc(OC)c1OC 759252352 DLOXNPZRNKDWEF-AWEZNQCLSA-N 417.510 2.347 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 762267345 FPAJYLWCISNIJF-LBPRGKRZSA-N 405.432 2.031 10 20 HECD CC[C@@H](C)NS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765102854 STWNHYIRGIPRNO-LLVKDONJSA-N 410.477 2.100 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc(-c2nnco2)c1 765927414 RDJRMVIECZGUJL-UHFFFAOYSA-N 417.219 2.460 10 20 HECD COc1ccc(CN(Cc2cc3c(cc2O)OCO3)[C@@H]2CCS(=O)(=O)C2)cc1 768193815 RAIVFFIPUYQHKD-MRXNPFEDSA-N 405.472 2.319 10 20 HECD CCOc1ccc(CN2CCCN(S(=O)(=O)c3c(C)noc3C)CC2)c(O)c1 768215892 OETYLLWWBZUQLQ-UHFFFAOYSA-N 409.508 2.292 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H]1c1cccc(Br)c1 768466262 XBKOEIBVNXWUJJ-WMZOPIPTSA-N 419.275 2.254 10 20 HECD C[C@H]1CCc2c(sc(=O)n2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772897531 IMPOZCJSWDWTAJ-AWEZNQCLSA-N 419.522 2.327 10 20 HECD CCC1(CC)CC(=O)N(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C(=O)C1 774668156 NIWRGCBOCXHKCR-IBGZPJMESA-N 417.550 2.134 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(F)cc3)cc2)CC1 786121190 DBCSIAFUWNUPFO-UHFFFAOYSA-N 405.495 2.114 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1C 787494075 MCSQBLAOWXQOOO-UHFFFAOYSA-N 409.490 2.154 10 20 HECD CCO[C@@H]1C[C@](O)(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 788756321 KECRQGJVMQFGRI-PERKRYKHSA-N 405.539 2.450 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H](C)C1 789861731 RMBLBRWSBFWZBO-YLJYHZDGSA-N 418.607 2.045 10 20 HECD C[C@@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)(N(C)C)C1 793816276 ZHWNNJITTMRNDZ-UZUQRXQVSA-N 400.567 2.312 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1ccccn1 804498716 RROCXTZZYSXSPI-WMZOPIPTSA-N 404.536 2.327 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1F 804852233 CYYMKGVHVDMFPR-IPELMVKDSA-N 403.498 2.362 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1nc(-c2cccc(F)c2)no1)c1ccc(N(C)C)cc1 807675267 VUSPEZYJIOLFCC-CYBMUJFWSA-N 411.437 2.435 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 810379113 PTNDRTFSIFHWSD-UHFFFAOYSA-N 424.207 2.066 10 20 HECD COC(=O)c1cc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)oc1C 814285336 GYBPWWBWJAVKPD-RVDMUPIBSA-N 410.517 2.298 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C[C@@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 815063043 UVNLOAVHHIPHBU-UXLLHSPISA-N 412.527 2.270 10 20 HECD CN(C)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncn1C 857472352 LDYJLNPGWGGQML-LPHOPBHVSA-N 405.930 2.163 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918031486 FLOGXXRKJVCFJS-SFHVURJKSA-N 423.517 2.378 10 20 HECD CC(C)NCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715292 FUNLCCNZMJPTQC-QDMKHBRRSA-N 409.914 2.391 10 20 HECD C[C@H](Cc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802733699 ZFQPANZQMFSXAZ-NKGKWGDASA-N 410.474 2.018 10 20 HECD COCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877223 AWUSQZUABYUFEK-JKNJVXJCSA-N 418.490 2.083 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 13313647 MOPTYEOYTIGKNN-UHFFFAOYSA-N 420.487 2.051 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(CCN2CCOCC2)CC1 726600866 OLMACYQGXZYTOX-UHFFFAOYSA-N 402.583 2.145 10 20 HECD CN(CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1)Cc1ccccc1O 731843486 KIBVCVRJOITCOI-UHFFFAOYSA-N 403.504 2.247 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n(C(C)(C)C)n1 737108506 XJBPNQBPKHYVBY-UHFFFAOYSA-N 417.485 2.177 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1 741096994 HYEUDJVFNXCHHH-UHFFFAOYSA-N 424.476 2.293 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1C(N)=O 742654462 DPLDWPDDGLLFAQ-UHFFFAOYSA-N 403.504 2.263 10 20 HECD CC(=O)OC1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 753192092 ZZSGGAVVQSHDGZ-UHFFFAOYSA-N 406.438 2.428 10 20 HECD CS(=O)(=O)Cc1noc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)n1 765248168 VIVVHGMTOXQTEZ-UHFFFAOYSA-N 406.420 2.147 10 20 HECD C[C@]1(c2ccc(C(=O)NCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 765747684 QJUMHHLYCZFLFS-GOSISDBHSA-N 418.247 2.139 10 20 HECD Cc1cc(C(=O)CN2C[C@H](CO)OC[C@@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 766944074 GLARCXDETIYCME-MAUKXSAKSA-N 400.475 2.130 10 20 HECD COc1cc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c(O)cc1C 768444415 AZZDNFRIDUBDQP-UHFFFAOYSA-N 418.515 2.071 10 20 HECD C[C@H](NC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1)c1ccc(N2CCOCC2)cc1 768977959 USQIVBIJOSJKDA-WNSKOXEYSA-N 422.485 2.069 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)[C@@H]1CN(C)CCO1 770436491 VWQSOPYBRLIXCY-WBMJQRKESA-N 400.317 2.405 10 20 HECD CC(C)[C@@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 770562241 SDPHGYKPPKWNGZ-VTJXTGGHSA-N 410.486 2.006 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1 772529255 IPDJODAYCQKKQN-FZMZJTMJSA-N 422.507 2.456 10 20 HECD COc1cc(O)c(CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1OC 776208218 RSIZFBVLFZJERW-UHFFFAOYSA-N 420.531 2.493 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1 779475842 MEOXGYILDDFCQR-VURMDHGXSA-N 422.890 2.298 10 20 HECD O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc(O)c(O)c1 783659453 MJFNHPVHVDFKEF-NSHDSACASA-N 420.399 2.098 10 20 HECD CCOC(=O)c1cc(C)sc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296490 FVQOKEVOEMBCOP-JTQLQIEISA-N 406.460 2.330 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@]3(O)CCc4ccccc4C3)CC2)cc1 785723813 KPUFNTVRELBUPK-RUZDIDTESA-N 423.557 2.244 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cccc(OC)c3)CC2)cc1 787155940 HOXGCRIYVWMJDL-UHFFFAOYSA-N 411.502 2.148 10 20 HECD Cc1cccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 788154694 XJMIVSNVETYROU-INIZCTEOSA-N 418.444 2.393 10 20 HECD O=C(c1cccc(NCc2ccc(N3CCOCC3)c(F)c2)n1)N1CCC[C@H]1CO 788743165 FIZHGXQKPWTWIB-KRWDZBQOSA-N 414.481 2.266 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccccc3-n3ccnc3)ccc21 793716521 DUEMCOWDMDGPIE-UHFFFAOYSA-N 403.486 2.187 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1)c1ccc(N2CCOCC2)cc1 793826587 RSAGXPGSTDPTHM-SJORKVTESA-N 411.502 2.153 10 20 HECD Cc1ccc(C2=NO[C@H](CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1C 801396944 JAYUQARCUYZTBT-INIZCTEOSA-N 417.487 2.304 10 20 HECD COCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 803301805 ZEOMPPRNRWAJTI-APWZRJJASA-N 415.490 2.187 10 20 HECD O=C(NC[C@@H]1CCCS1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806917934 RHJBOERVRQIHEE-CJNGLKHVSA-N 413.490 2.385 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 810318989 TVCJFFQVVGPNOF-ZDUSSCGKSA-N 405.449 2.307 10 20 HECD CC(C)COC[C@H](O)CNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918209349 VTRXQAXIBCLQKW-SOLBZPMBSA-N 411.518 2.272 10 20 HECD Cc1nc(C)c(CCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(O)n1 919971554 QEVQQJVZUQCANQ-UHFFFAOYSA-N 402.470 2.148 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCc3nc4cccnc4[nH]3)cc2F)CC1 1318454489 SFGBMGMHXBARHF-UHFFFAOYSA-N 410.497 2.488 10 20 HECD CCOc1cccc(CNCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O 60358316 RDIOYFKETOLKJB-UHFFFAOYSA-N 406.504 2.102 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c1 115735004 YSPKLYJBIOOOAG-UHFFFAOYSA-N 421.494 2.297 10 20 HECD Cc1c(CNC(=O)NC2CCN(S(=O)(=O)C(C)C)CC2)n(C)c2ccccc12 472235981 CXSNEVLNGNZFQU-UHFFFAOYSA-N 406.552 2.489 10 20 HECD CO[C@H](C)CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 726624071 CKFVESLOISMYTG-GFCCVEGCSA-N 423.447 2.256 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@H]2[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730261357 IGXLDLGGISUFHS-JXFKEZNVSA-N 419.547 2.160 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)C1 731217568 FEFCEXDQINYXSQ-QUCCMNQESA-N 415.582 2.275 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1F 731356797 SUZKYDUCKBVCGK-UHFFFAOYSA-N 407.467 2.481 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](CNS(C)(=O)=O)C2)cc1F 731365031 ZPIBJQKIAMRPCS-INIZCTEOSA-N 414.547 2.143 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(CCC(=O)N(C)C)CC1 731543632 NYWJXULWIKAPQI-UHFFFAOYSA-N 403.571 2.227 10 20 HECD Cn1nnnc1SCCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742797462 CKXDBOLCWCQYLD-GFCCVEGCSA-N 412.466 2.079 10 20 HECD CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)CC(=O)N(C)C 744389231 AZUYMSUBCLREOZ-UHFFFAOYSA-N 407.470 2.201 10 20 HECD COc1ccc(NC(=O)NC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753858979 YTTZYLPRGRFNHW-UHFFFAOYSA-N 416.453 2.313 10 20 HECD Cc1cc(C(=O)CN2CCN(CC[S@@](C)=O)CC2)c(C)n1-c1cccc(F)c1 755956956 TZFLCQWKZOTPHO-MUUNZHRXSA-N 405.539 2.412 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H]3COc4ccccc4C3)CC2)cc1 758196711 DPRHJECGXVEKHI-UGKGYDQZSA-N 411.546 2.019 10 20 HECD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 758547653 MWKXVVSLUJBMRQ-OWFXSXJRSA-N 402.447 2.438 10 20 HECD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759225627 RRCRYOHZSDYBDT-JKSUJKDBSA-N 420.506 2.340 10 20 HECD Cn1ccnc1[C@](O)(CCNC(=O)NCCCSc1nccs1)C(F)(F)F 759549520 GSCOXMUSTFXLRF-CQSZACIVSA-N 423.486 2.498 10 20 HECD O=C(NCCCSc1nccs1)NCCNS(=O)(=O)Cc1ccccc1 759557552 YFAAVHKIMRQRSU-UHFFFAOYSA-N 414.578 2.044 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc([C@H]2CCOC2)c1 761371287 FJGKWONNLMUSSG-FQEVSTJZSA-N 414.527 2.355 10 20 HECD O=C1NC(=S)S/C1=C\c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1 763109834 VOBILYJCYQZJCH-SDQBBNPISA-N 410.864 2.198 10 20 HECD Cc1noc(C2CC2)c1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 768034482 RGYCAFBZVVKCKV-UHFFFAOYSA-N 412.490 2.324 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H]1c1ccccc1Br 768465685 PQUUCHVVDYDOIG-WMZOPIPTSA-N 419.275 2.254 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C(=O)Nc4ccccc4)n3)CC2)cc1 771056364 MGSVAYOISKVFEF-UHFFFAOYSA-N 421.457 2.222 10 20 HECD Cn1cnn(-c2ccc(NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)c1=O 771462494 SAWJCIJJGRJAIE-IBGZPJMESA-N 423.473 2.490 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)c1 775035225 XVNAGHMSQCGEKG-INIZCTEOSA-N 417.418 2.221 10 20 HECD C[C@H](NC[C@H](O)Cn1c(-c2ccccc2)noc1=O)c1ccc(N2CCOCC2)cc1 775262187 ZHCWVGDHNRJJMB-UWJYYQICSA-N 424.501 2.052 10 20 HECD CC[C@H]1C[C@@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 781776165 FOUBAOFGFBMCFW-WMZOPIPTSA-N 422.497 2.417 10 20 HECD COC[C@@H]1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H](C)O1 784069724 GHLUJFVFKGPDJE-CUSZFKRNSA-N 409.502 2.385 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cc1 785444284 RIMKMQXSIKIGOR-WOJBJXKFSA-N 416.472 2.209 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(N(C)C)cc1 786121016 SMBIPVOHNIQZQH-KRWDZBQOSA-N 405.502 2.474 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cn1 787192373 WBOHDIFFOQSRRL-UHFFFAOYSA-N 409.534 2.243 10 20 HECD CCC[C@@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860177 IVGVGIWQKICJPH-NRFANRHFSA-N 405.564 2.010 10 20 HECD COCCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CC[C@H](C)C1 792466437 WTJDYLWBQNEIQK-KSEOMHKRSA-N 405.583 2.315 10 20 HECD COc1cccc(-c2nsc(NC(=O)C(=O)NCc3ccc(OC)cc3O)n2)c1 797390239 AUDAVPSTSFDFSX-UHFFFAOYSA-N 414.443 2.183 10 20 HECD CCOC(=O)[C@]1(COC)CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 798386471 RZQQKBFNCGXJCX-JOCHJYFZSA-N 419.522 2.025 10 20 HECD CN1CCN(CCNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1(C)C 799683838 PXUBDKXTTPEZOW-IBGZPJMESA-N 404.555 2.109 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@@](C)(C2CCCC2)C1=O 802723885 ISFAGTVZBMEULG-QFIPXVFZSA-N 400.523 2.413 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1c1cccn1C)c1ccc(N2CCOCC2)cc1 803303425 NAXLZTOOQVYEKZ-UWJYYQICSA-N 410.518 2.403 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc[nH]1 806524928 ORIFTDIEYCYQLM-QGZVFWFLSA-N 409.534 2.040 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 807292120 VJZNPJHKIDNSLR-OAQYLSRUSA-N 409.461 2.498 10 20 HECD Cc1cnn([C@@H]2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 812009965 LEIZFRFKRLVNTL-UYAOXDASSA-N 410.522 2.050 10 20 HECD CCCc1nnc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 864236414 JPAZYGKKZLZLGW-UHFFFAOYSA-N 421.482 2.451 10 20 HECD CC[C@H]1CO[C@@H](C)CN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 916199409 WWODZTJYNPVLSL-OALUTQOASA-N 404.555 2.416 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCNc3cnccn3)cc2F)C[C@@H](C)O1 918211380 LTFLIYMKSTYWGT-HUUCEWRRSA-N 402.474 2.141 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cccc(OCC(N)=O)c1 918311726 XZJZREFNQTUKJL-UHFFFAOYSA-N 424.501 2.138 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3(O)CCCCC3)cc2F)C[C@@H](C)O1 919047328 XPWSDJDPDBAYDD-HZPDHXFCSA-N 422.497 2.294 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(N2CCOCC2)cc1 920890252 RLEYSAOLFDKFCL-AWEZNQCLSA-N 419.503 2.091 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c[nH]1 1797141534 VROCPCQSQOZRTR-GGPHIMKMSA-N 419.485 2.368 10 20 HECD COC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1823829678 VNDARVCEFHCBEJ-INIZCTEOSA-N 405.495 2.151 10 20 HECD C/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1825037950 IXNVQTAXJVGRKM-NHEDYWLLSA-N 423.498 2.424 10 20 HECD CC(=O)O[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C(C)C 1845501346 FLKFPHNWVGQQDH-KRWDZBQOSA-N 424.881 2.156 10 20 HECD CCOC(=O)N1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 38344412 XROOLJXLIHSFHN-UHFFFAOYSA-N 421.453 2.175 10 20 HECD COc1ccc(N2CCN(CC(=O)NCCc3ccc(OC)c(OC)c3)CC2)cc1 57548544 XXAQXPNJADDMPT-UHFFFAOYSA-N 413.518 2.193 10 20 HECD C[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(N(C)C)cc1 302457463 UTRGFDUIYIKDHU-INIZCTEOSA-N 403.552 2.257 10 20 HECD CN(C)c1ccc(CN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1 726472352 RPACDBDDTZDSEX-UHFFFAOYSA-N 418.588 2.439 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(=O)C1CCCC1 727165124 WQPCAOXDUOKVTL-OAHLLOKOSA-N 405.514 2.488 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1 728978851 QQQHXKSWIWGYFC-SECBINFHSA-N 404.897 2.271 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1 729062400 RMGOHRWJTNJBPU-NSHDSACASA-N 415.837 2.451 10 20 HECD COC(=O)CCc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729788768 BGGJQQVYZQYGEA-CYBMUJFWSA-N 400.431 2.322 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3C[C@H]4CC[C@H]3O4)cc2F)C[C@@H](C)O1 733840431 DRWKQAHICOAJPK-TWRCCJGTSA-N 420.481 2.166 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)N2C(=O)c3ccccc3C2=O)c1 734015272 FCNBFYYMDGPBBI-KRWDZBQOSA-N 414.483 2.435 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN1CCOCC1 745249320 BIARBMNSAQBZLR-UHFFFAOYSA-N 400.317 2.409 10 20 HECD CCCNC(=O)C1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 750602189 VTLMZAIWAVRFAQ-UHFFFAOYSA-N 416.566 2.163 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2c(c1)COC2 751238337 ZLYLNVRBHWMUBP-UHFFFAOYSA-N 406.479 2.296 10 20 HECD CCO[C@@H]1C[C@H](N(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 754041587 CNUYCGHZYOLIPO-ILWGZMRPSA-N 405.583 2.314 10 20 HECD Cn1nnc2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 754321204 UVZCVAOUZVFVOD-CYBMUJFWSA-N 402.405 2.364 10 20 HECD C[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN1Cc1ccccc1 758328937 WWKQAAAAQULADE-PBHICJAKSA-N 403.504 2.157 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(OCC(F)F)c3)cc2)C1 758575585 HXKMHXUDWLSSNL-INIZCTEOSA-N 418.444 2.357 10 20 HECD O=C(N[C@H](CO)CC(F)F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760676230 GXSZMRCCQHYNMF-JTQLQIEISA-N 406.432 2.000 10 20 HECD COc1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1 761121327 NJUWBUWMZXSHCJ-FXAWDEMLSA-N 422.485 2.190 10 20 HECD Cc1cc(C(=O)COC(=O)CCc2nc[nH]n2)c(C)n1-c1ccc2c(c1)OCCO2 764009974 CEQFVTAKUJVWDL-UHFFFAOYSA-N 410.430 2.342 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 764629926 QARPQXGJBYPRSI-LJQANCHMSA-N 419.522 2.118 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)NC(=O)CC2 768114036 WDJWGMOWCHCPPY-UHFFFAOYSA-N 414.437 2.040 10 20 HECD COCC1(C)CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 774180224 QAOYYMRCXHEVJE-SFHVURJKSA-N 402.539 2.346 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H]1CC1(Cl)Cl)c1ccc(N2CCOCC2)cc1 775156760 AFFHTDOMBVHFOP-TZMCWYRMSA-N 400.306 2.010 10 20 HECD COc1cc(N2CCN(C(=O)Cc3n[nH]c4c3CCCC4)CC2)cc(OC)c1OC 777321314 IWJKPTKIYHQKHR-UHFFFAOYSA-N 414.506 2.206 10 20 HECD CCOC[C@@H]1CCCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778277589 NAMNIQWKEXKYFF-OEIFXAAASA-N 415.534 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3c(C)noc3C)CC2)cc1 778278635 YYJCWGPRURCWEW-FJVVXJACSA-N 412.490 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](OC)C(C)(C)C)CC2)cc1 778295893 XQTDBFFRGYCRKP-GNISGLHKSA-N 403.523 2.077 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)cc1 780679988 HVCXNUKUGWAADY-UHFFFAOYSA-N 423.560 2.014 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)cn2)CC1 785426122 USSDPHXEFWWXNZ-UHFFFAOYSA-N 409.534 2.317 10 20 HECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785435472 ZWRDJEOEWHISOZ-SFHVURJKSA-N 410.518 2.020 10 20 HECD O=C(COC(=O)/C=C\c1cncc(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 785854293 OYSGYOOAMBXPJE-RQOWECAXSA-N 417.412 2.069 10 20 HECD CC(=O)c1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)nc1C 786661016 MKBMKKBHDVBUFG-UHFFFAOYSA-N 408.502 2.500 10 20 HECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845244 UJRYUHBYUBEAFM-APWZRJJASA-N 405.514 2.488 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnn(C)c3C)n2)s1 794018525 WXCYBDLFABQWIA-UHFFFAOYSA-N 411.534 2.350 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC([C@](C)(O)C(F)(F)F)CC1 807097836 PKXGJOASSJTXTG-IBGZPJMESA-N 415.456 2.229 10 20 HECD O=C1NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2Br)nn1 811689885 ONRYJADTYYQMJF-GXDHUFHOSA-N 410.231 2.491 10 20 HECD Cc1ccc(Cn2nccc2N/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)s1 814316666 QNKPFHPMKIPJIZ-RIYZIHGNSA-N 403.533 2.496 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C=O)c[nH]3)cc2F)C[C@@H](C)O1 815255795 YWPWMLLLZLBQSJ-ZIAGYGMSSA-N 417.437 2.053 10 20 HECD Cc1ccccc1NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1796150254 HMBOIOIFBHLBRM-BJWYYQGGSA-N 410.474 2.165 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccsc1)c1cc(O)nc(O)c1 1796225947 DACOBTOFPKMZFX-MUJYYYPQSA-N 401.488 2.439 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2ncoc2c1 1796601362 XWTVDRZLHNEJSC-QDMKHBRRSA-N 408.414 2.200 10 20 HECD CC[C@H](C)CC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834985995 UERVBUSLTQKHTM-HNNXBMFYSA-N 418.538 2.114 10 20 HECD CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)CC(=O)N(C)C 140042567 IJKBQCULLCLGDI-UHFFFAOYSA-N 407.470 2.201 10 20 HECD CN(C)C(=O)C1(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCC1 303673501 XKASAFPPCGMEQP-UHFFFAOYSA-N 406.502 2.110 10 20 HECD Cc1ccc(S(=O)(=O)NCCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1C 437013607 ANTKSMGETUPPMT-UHFFFAOYSA-N 417.531 2.463 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)OCCO4)n2)c[nH]1 727248005 ZFZAXOPZGRPFLQ-UHFFFAOYSA-N 421.456 2.497 10 20 HECD CC(=O)NCc1ccc(-c2nc(NS(=O)(=O)c3ccnn3C)sc2C)s1 727249005 JUUDGVFJHYTZHL-UHFFFAOYSA-N 411.534 2.350 10 20 HECD Cc1nn(CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)c1[N+](=O)[O-] 727851156 HJLPPKKTVXRCNP-UHFFFAOYSA-N 415.494 2.323 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1 729064066 OFGUFHFSXDBVHV-CQSZACIVSA-N 411.458 2.339 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCS(=O)(=O)CC(C)C)cc2F)CC1 730193890 VVQUVLHBBQMUIY-UHFFFAOYSA-N 413.559 2.045 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C)c3nnc4n3CCC4)cc2F)CC1 730937637 SGXYBWHQLNAGSO-HNNXBMFYSA-N 415.517 2.066 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NC(=O)Cc2ccccc2)c1 734014972 PRKBLOJRFXLQCE-SFHVURJKSA-N 402.516 2.498 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](c4cc[nH]n4)C3)CC2)cc1 734274282 UKLQRSVROPMLOC-GOSISDBHSA-N 412.538 2.130 10 20 HECD CCc1noc2ncc(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)cc12 742917515 YZERQTOFCOTLMM-UHFFFAOYSA-N 409.490 2.346 10 20 HECD Cc1nc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)sc1C 743711776 VBDWKGDAEFYNPD-INIZCTEOSA-N 401.536 2.461 10 20 HECD C[C@@H](NC(=O)CCN1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 746167164 AVULUXGGQJCBSY-HXUWFJFHSA-N 423.561 2.308 10 20 HECD C[C@H](NC(=O)COC1CN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 748533482 PSFCACVBJRSVMG-INIZCTEOSA-N 419.522 2.336 10 20 HECD COCc1cccc(CNC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753857555 NBBOKAZBCIJQHL-UHFFFAOYSA-N 401.482 2.419 10 20 HECD O=S(=O)(Nc1ccc(N2CCOCC2)c2ccncc12)c1cccc2nonc12 753924372 VZPFAFUMRASPBQ-UHFFFAOYSA-N 411.443 2.408 10 20 HECD C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)ccc1O 756707317 UZKYGXBJPDVLCF-JSGCOSHPSA-N 421.357 2.294 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCCCSc2nccs2)cc1 759550686 BTNHSBKVNVSTEF-UHFFFAOYSA-N 414.578 2.174 10 20 HECD CCc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc12 762518158 NOOFUFAPIAQJFW-UHFFFAOYSA-N 402.476 2.100 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](O)c3ccccc3Cl)cc2)C1 764858017 BJLXGWYJONPBTR-HNAYVOBHSA-N 401.894 2.392 10 20 HECD O=C(CN1CCN(C2CCCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 766142198 NRABNDOMKLHHDP-UHFFFAOYSA-N 418.557 2.229 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(c3ccc(F)cc3)CCOCC2)c1 769782716 MRYVVDNFMNIGMA-UHFFFAOYSA-N 408.451 2.339 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1)c1ccc(N(C)C)cc1 773857213 KNJGUCZQEFCCTO-OAHLLOKOSA-N 409.490 2.488 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(-n2cncn2)cc1 785398854 PEMLJZRWWAKJAB-CYBMUJFWSA-N 416.532 2.200 10 20 HECD Cc1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ncn1 786114463 VGHABDPYEHRXMS-UHFFFAOYSA-N 401.378 2.356 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(OC(F)F)cn3)cc2)CC1 786256567 UDXQXKVCICNJIF-UHFFFAOYSA-N 404.417 2.282 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)OC(C)(C)C 788888359 JDOYKCMAEMNPLW-UHFFFAOYSA-N 416.522 2.052 10 20 HECD CN(CCCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910866 FEYARCNOHGMBAE-UHFFFAOYSA-N 418.538 2.276 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1ccccc1 789800723 NYDKFHYMJCNACH-IIBYNOLFSA-N 411.477 2.498 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H](C)c1cccnc1 789813814 VXPRAZRBQLOUDR-MRXNPFEDSA-N 414.481 2.283 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H](C)C1 796315469 MKDILVGSYQXZNZ-BZSNNMDCSA-N 406.546 2.082 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCCC4(CCN(C)CC4)C3)CC2)cc1 799178079 FZAZUVICBHIZBY-UHFFFAOYSA-N 400.567 2.152 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 804003813 AXNBZHPMQLGACL-OAQYLSRUSA-N 422.529 2.018 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)NCCCC(C)(C)C)CC2)cc(OC)c1OC 804526124 JYUDOPYAENZZJH-UHFFFAOYSA-N 421.538 2.304 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCC[C@@H](C(=O)N(C)C)C1 806177637 FAMSDPQUTFSYRI-MOPGFXCFSA-N 416.566 2.253 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCN(c2ccccc2)C1=O 807099627 BFDLYHKPSBXYKN-OAQYLSRUSA-N 422.529 2.331 10 20 HECD C[C@H]1CN(c2ccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])cc2F)C[C@H](C)O1 811738519 ARLCQPDXQNPDDJ-RYUDHWBXSA-N 403.414 2.454 10 20 HECD COc1cc(Cl)cc(CN(C)CCOc2ccc(S(N)(=O)=O)cc2)c1O 816624972 NEKKSMFCXIZQJY-UHFFFAOYSA-N 400.884 2.212 10 20 HECD CNC(=O)c1cc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)cn1C 914789562 INIHNZZSBJQSMF-UHFFFAOYSA-N 402.501 2.408 10 20 HECD CN(CCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1)S(C)(=O)=O 915777823 RCAPKHVQXUYIEU-UHFFFAOYSA-N 417.491 2.438 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1nncn1-c1ccccc1 916580786 WKRUVFMGHAYKIS-UHFFFAOYSA-N 406.490 2.446 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)OCO4)cc2)C1 918006591 HZVBHXLOGOEGLD-GOSISDBHSA-N 424.501 2.159 10 20 HECD CCNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918037434 PPKOUIAGTMJCRB-SFHVURJKSA-N 423.517 2.460 10 20 HECD COC(=O)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CC(C)C 1340273779 PMQWLYMCUHOUGS-IAGOWNOFSA-N 423.529 2.187 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242129 NYQCNAKMDHOOBR-JDFRZJQESA-N 408.882 2.145 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnsn1)c1cc(O)c(O)c(Cl)c1 1794697226 LTSALCRSIXHRKH-JGPRNRPPSA-N 408.867 2.168 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)on1 1795142547 HMEFUAPRNQKGGI-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCC=CO3)CC2)C1 1810546630 KHBNQFAYUVSEIO-MRXNPFEDSA-N 401.463 2.030 10 20 HECD Cc1ccc(NCCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(C)c1 1844306614 TVFWRSLYSBEFDO-UHFFFAOYSA-N 424.501 2.429 10 20 HECD Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cc(O)nc(O)c3)c2c1 1848144125 MRZMWPMGKGBFAM-OALUTQOASA-N 420.469 2.341 10 20 HECD O=C(COc1cccc(NS(=O)(=O)c2cccc3nsnc23)c1)N1CCCC1 32628814 PTYIBBGQOZXZFB-UHFFFAOYSA-N 418.500 2.493 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=S)NCCCN2CCOCC2)cc1 59075973 CNGNWXDHZFEOGK-OAQYLSRUSA-N 420.623 2.330 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCN(c2cnccn2)CC1 302999041 MMMCLLWREDYIPO-UHFFFAOYSA-N 413.497 2.110 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC4(CC3)OCCO4)cc2F)CC1 303271360 GBTPINSVKNOBKL-UHFFFAOYSA-N 406.502 2.016 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1S(C)(=O)=O 472788612 NUSPCYUUWQIFFU-UHFFFAOYSA-N 413.499 2.454 10 20 HECD Cc1ccc([C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)N2CCCC2)o1 725902115 HJJRQEVOMUGCAR-MRXNPFEDSA-N 407.492 2.232 10 20 HECD CN(C)CCNC(=O)c1cccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)c1 727480429 ZFDDMAUOCKPRPR-UHFFFAOYSA-N 415.513 2.183 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1O 737283961 IPOKIZVIBUZWKL-UHFFFAOYSA-N 405.838 2.011 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1OC 741097874 ZONVECMASCJPQR-UHFFFAOYSA-N 411.458 2.344 10 20 HECD CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NCc1ccc(N(C)C)cc1 742489064 UQOZVGCJBNWCGV-QGZVFWFLSA-N 404.536 2.362 10 20 HECD C[C@@H](COCC(F)(F)F)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 742760100 JHEADKLZYIHJED-ZFWWWQNUSA-N 416.444 2.155 10 20 HECD C[C@@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 747615869 ANZNHTGBUWNBMR-CHWSQXEVSA-N 410.517 2.488 10 20 HECD COC(=O)[C@@H](C)CN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748028178 XKMAZIMMOULBAC-NSHDSACASA-N 412.489 2.136 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751042164 CAOBJHIPWSIQCF-MRXNPFEDSA-N 418.515 2.490 10 20 HECD C[C@@H](Sc1nnnn1C1CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752150980 DBXQETFREAWXJT-CZUORRHYSA-N 403.508 2.402 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 752351811 BMNCXEVAFHMUBW-UHFFFAOYSA-N 419.507 2.397 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 752801520 ZQKSMFCQJZIKNE-MRXNPFEDSA-N 422.478 2.261 10 20 HECD CC1([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)OCCO1 753109872 UJBJSMJACNNATA-QGZVFWFLSA-N 421.513 2.471 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl 766047062 DSKSCTNNUSRYDT-UHFFFAOYSA-N 403.865 2.453 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNC(=O)CNC(=O)OC(C)(C)C 766335343 CIACMAQTMANEIP-UHFFFAOYSA-N 418.538 2.276 10 20 HECD Cc1ccn2c(CN3CCN(Cc4cc5c(cc4O)OC[C@H]5O)CC3)c(C)nc2c1 768442009 NFAJDWGJOWMREN-OAQYLSRUSA-N 408.502 2.400 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1F 768562308 OYHRCGPTCPGURB-OAQYLSRUSA-N 404.486 2.399 10 20 HECD COC(=O)C(C)(C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769764005 JWTKHZDJXMBVES-UHFFFAOYSA-N 412.489 2.278 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3ccnc(O)c3Br)CC2)cc1 770813755 QBWGMYHZTLBMPB-UHFFFAOYSA-N 406.280 2.450 10 20 HECD CCOC(=O)c1c(C)csc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785297457 OOYDQMGLADFFEW-NSHDSACASA-N 406.460 2.330 10 20 HECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cn2)n1 787491504 SFZGJVWGSCIGKP-UHFFFAOYSA-N 420.517 2.191 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)[C@H](C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 788289437 VIDJQHJDFCLHDV-BARDWOONSA-N 400.516 2.125 10 20 HECD CN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801000 YHBSNECGHJYJRP-UHFFFAOYSA-N 403.429 2.076 10 20 HECD O=C(CN1CCCC[C@H]1c1cc[nH]n1)NCc1ccc(N2CCOCC2)c(F)c1 796193141 ILVNMGXCCNUOAU-FQEVSTJZSA-N 401.486 2.229 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N3CCC(C)CC3)CC2)cc1 803541175 AHTQFPKIYYJOAR-GOSISDBHSA-N 416.566 2.017 10 20 HECD Cn1cccc1C(=O)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 805653319 QFQVZPRUYHTALO-UHFFFAOYSA-N 416.389 2.165 10 20 HECD O=C(N[C@@H]1CCCOCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807562631 RAWMDOXLGTWWQB-HUUCEWRRSA-N 411.449 2.058 10 20 HECD C[C@@H]1CSCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768175 DNSITPLNXUFHHL-ZIAGYGMSSA-N 413.490 2.337 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2cnn(CC(F)(F)F)c2)C2CC2)cc1 808396421 YYDXJJDVJYYHGP-UHFFFAOYSA-N 423.439 2.319 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@H](C1CC1)C(F)(F)F 808869625 MIWRVLANXLHOPD-HNNXBMFYSA-N 405.442 2.062 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCOCC3)cc2F)C[C@@H](C)O1 918179794 GOAQNDJCFFLWIO-CALCHBBNSA-N 422.545 2.349 10 20 HECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1807993714 MNXNBHFXXGEBOM-QRWLVFNGSA-N 422.441 2.423 10 20 HECD C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387015 YUOZZOWLWBCGMT-YLJYHZDGSA-N 402.539 2.360 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(NS(C)(=O)=O)c1 21963379 OZSIQWMSJULYFF-UHFFFAOYSA-N 403.504 2.167 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCOC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 731682817 XRFUKJMCWNUQBQ-SOLBZPMBSA-N 409.502 2.292 10 20 HECD CNS(=O)(=O)C1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 732248379 VUJCYMLNIORCDY-UHFFFAOYSA-N 408.568 2.146 10 20 HECD COC(=O)CCCOc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 732833562 ATRSRHXHEXUORL-UHFFFAOYSA-N 422.459 2.348 10 20 HECD CCN(CC)C(=O)CN1CCCN(C(=O)NCc2ccc(N(C)C)cc2C)CC1 734687504 DWUFBVYXIKLASM-UHFFFAOYSA-N 403.571 2.147 10 20 HECD CN1CCN(CCCCNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 737065304 QQFZOPYJXPGYNY-HXUWFJFHSA-N 404.555 2.110 10 20 HECD COC(=O)COc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739767335 ZIYBVJGCNQGDGX-UHFFFAOYSA-N 411.458 2.192 10 20 HECD CS(=O)(=O)NCc1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741071939 LBTWWVCNKXFGIT-UHFFFAOYSA-N 400.504 2.434 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccc(CC)cc4)CC3)nc12 744423125 YEPISNNUMDFQEB-UHFFFAOYSA-N 409.490 2.496 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1F 746719243 ZMJVYWNLIRLNGK-UHFFFAOYSA-N 414.481 2.364 10 20 HECD O=C(NCc1ccccc1O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1 748347206 ZLTWBMLOUWRBCH-UHFFFAOYSA-N 409.895 2.158 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3O)CC2)cc1 748353572 BBXWBIYODXFWCE-UHFFFAOYSA-N 404.488 2.118 10 20 HECD NS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)cc1 751356175 ONYOXJGSQHKUFL-UHFFFAOYSA-N 410.517 2.173 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCN(c2ccccn2)C1 753124336 PDIMRZGSZXPBGC-QGZVFWFLSA-N 413.497 2.260 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)s1 753643289 HMQWDCRHOUXIGP-DOMZBBRYSA-N 424.544 2.368 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 755227172 JCTLHDQXOFMFJG-AWEZNQCLSA-N 410.490 2.375 10 20 HECD CCn1nc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C1CC1 759023843 ZTFOUSQQNVRIKP-UHFFFAOYSA-N 411.506 2.214 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 760204487 LPNTVQRTDRSJCE-UHFFFAOYSA-N 419.489 2.134 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](O)CCc3ccccc3)CC2)cc1 764640072 MMUSDKLQOJCBCQ-HSZRJFAPSA-N 411.546 2.317 10 20 HECD O=S(=O)(Nc1cc(Br)ccc1-n1cncn1)c1cccc2nonc12 765067431 JBUVRNLRZOZTHQ-UHFFFAOYSA-N 421.236 2.367 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@H]3CS(N)(=O)=O)c2C)cc1 769575461 JMDCFGCRAGCAEK-KRWDZBQOSA-N 405.520 2.386 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C5CC5)n(C)n4)n3)CC2)cc1 771058844 WJACZJAERNOWMF-UHFFFAOYSA-N 422.489 2.247 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773860212 WSIPRILROWFGGH-OAHLLOKOSA-N 411.506 2.109 10 20 HECD CCO[C@H]1COCC[C@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 776482484 OODOEBNGPBGYBN-MJGOQNOKSA-N 408.454 2.184 10 20 HECD Cc1nn(-c2ccccc2)cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 781413801 WEOIXWYGKSBNFP-UHFFFAOYSA-N 400.460 2.188 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C 782713087 WPENVDYSQIRICF-UHFFFAOYSA-N 424.505 2.141 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@@H]3CN(C)C[C@@H]3C2)c([N+](=O)[O-])c1Br 784631656 WEOMZZPXYGTQHL-DTORHVGOSA-N 401.217 2.272 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 784691678 GRMUHGOMVYWZJC-UHFFFAOYSA-N 417.437 2.089 10 20 HECD CCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 785746038 VJRBMLLMMDALKT-QGZVFWFLSA-N 411.502 2.416 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cn(Cc2noc(C)n2)nn1 787425060 MGNDVBPCCLIKLX-UHFFFAOYSA-N 421.255 2.148 10 20 HECD CCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789825611 NAJRHDDBQWRJJF-JZXOWHBKSA-N 421.513 2.083 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2SC)cc1C 794593554 FHVSQSKBHPWLMG-UHFFFAOYSA-N 402.519 2.131 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4ccc(C)cc4C3)CC2)cc1 796429630 JTKRONORLLHTIB-QFIPXVFZSA-N 411.546 2.381 10 20 HECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)nc1 797654214 VZUJBYXGTAHPQE-UHFFFAOYSA-N 401.492 2.030 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(CC(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797710000 PPSZZAORGKCICS-HUUCEWRRSA-N 423.485 2.215 10 20 HECD Cc1cc(C(=O)CS(=O)(=O)Cc2nnc3n2CCOC3)c(C)n1-c1ccccc1 797934253 NBWHLLIHNNTWFJ-UHFFFAOYSA-N 414.487 2.014 10 20 HECD CCN(CCOCCO)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 799974514 AIHIHSSANRCNTM-UHFFFAOYSA-N 408.205 2.109 10 20 HECD CN(C)CC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C 806388235 BZXCNVCHEISJIJ-QUCCMNQESA-N 419.566 2.382 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807310067 YHYLEGWYIMTZIY-KSSFIOAISA-N 415.490 2.252 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 807512644 BJSBEJZGIQBOKC-ZDUSSCGKSA-N 413.261 2.329 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(NC(C)=O)nc2)cc1 807888107 KVBWMUVOMBSULU-UHFFFAOYSA-N 411.506 2.161 10 20 HECD COC(=O)CNS(=O)(=O)c1cccc(NCc2cc(Cl)cc(F)c2O)c1 809683001 LJPKKEXKBJEBBU-UHFFFAOYSA-N 402.831 2.248 10 20 HECD COC(=O)C1(CS(=O)(=O)NCc2cccc(Br)c2O)CCCC1 809838810 HIHOXCZWDCVMNM-UHFFFAOYSA-N 406.298 2.308 10 20 HECD CN(C/C=C\C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CC(F)(F)F 814588851 XQACVOXNSYTGKM-IMMZDGJCSA-N 412.456 2.055 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCCC4=O)c3)cc2)C1 917832847 HZXIADRJPAHHBY-IBGZPJMESA-N 420.513 2.445 10 20 HECD Cc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918463044 HHPHTJRUSOVEPE-INIZCTEOSA-N 412.465 2.091 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 918618109 XRMOWQMSQFXFSI-ATZDWAIDSA-N 415.559 2.420 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 918618112 XRMOWQMSQFXFSI-ZYSHUDEJSA-N 415.559 2.420 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@H](NC(N)=O)c1ccccc1 928973501 ADETXZLLQBHFHO-IBGZPJMESA-N 412.490 2.054 10 20 HECD CCOC(=O)C1=C(C)C(C(C)=O)=S=C1NC(=O)c1ccc(-c2nc(C)no2)cc1 1318672610 RLLACJKTSYHNOC-UHFFFAOYSA-N 413.455 2.293 10 20 HECD COc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1803601694 XWUXERBYXYUGNL-BTTYYORXSA-N 415.421 2.206 10 20 HECD CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1806337491 KCSUDYLPTUUOTH-QOWAEHBASA-N 411.458 2.328 10 20 HECD Cc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826030994 UMNHYFKVUPXJQW-KRWDZBQOSA-N 414.462 2.336 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826841851 NVKFYANBGQYFRL-JNAXZKDPSA-N 418.538 2.100 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccccc3)CC2)cc1 12069047 ZJLZUBHXJZCSHM-UHFFFAOYSA-N 403.548 2.327 10 20 HECD C[C@@H](NC(=O)NC[C@@H](O)COc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 139967496 YYLMKGYLQSWPDS-OXQOHEQNSA-N 417.481 2.462 10 20 HECD C[S@](=O)c1ccc(NC(=O)C2=S=C(S(=O)(=O)c3ccccc3)C=C2)cc1 467532363 ONWNVKCVCGXDFA-VWLOTQADSA-N 405.522 2.442 10 20 HECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 738169233 GFOLJJZLYKHZPJ-QGZVFWFLSA-N 415.534 2.213 10 20 HECD O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751239634 LIVJIFOLBUVIOF-UHFFFAOYSA-N 419.503 2.423 10 20 HECD O=C(COC(=O)/C=C/c1cccc(O)c1)NCc1ccc(N2CCOCC2)c(F)c1 753461401 MJYJPBJICXDRAU-FNORWQNLSA-N 414.433 2.241 10 20 HECD Cc1cc(C(=O)CN(CCO)CCN2CCOCC2)c(C)n1-c1cccc(F)c1 754865776 SWBPWFCNUCFEOO-UHFFFAOYSA-N 403.498 2.042 10 20 HECD COc1cc(N2CCN(CN3C(=O)SC(C)(C)C3=O)CC2)cc(OC)c1OC 758964500 MFBALZVBGUVGBA-UHFFFAOYSA-N 409.508 2.266 10 20 HECD CCn1nc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C1CC1 759027219 OMHPONFUACHDHF-HNNXBMFYSA-N 411.506 2.433 10 20 HECD COc1cc(N2CCN([C@H](C(N)=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 759872074 HMJPAEVOZQPWIC-IBGZPJMESA-N 403.454 2.200 10 20 HECD C[C@H](CC(=O)NCc1ccc(N(C)C)cc1)NS(=O)(=O)c1cccnc1Cl 760300965 SKTZYHHUARUDKA-CYBMUJFWSA-N 410.927 2.174 10 20 HECD COc1ccc(N2CCC(NCCC(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 765514047 GUXKFQZFOKEJCO-UHFFFAOYSA-N 423.561 2.388 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC[C@@H]21 766880252 KYPIOZASHYSTEN-SBHAEUEKSA-N 413.566 2.014 10 20 HECD COc1cc(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)cc(OC)c1OC 772770834 UZQHRJBYKRDDOW-ALCCZGGFSA-N 403.387 2.319 10 20 HECD CCNC(=O)c1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772906403 NIVXQPPGRVFQFD-UHFFFAOYSA-N 414.481 2.140 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccncc3)cc2F)C[C@H](C)O1 774177575 IQUPICVTPHFCRP-HOTGVXAUSA-N 414.481 2.109 10 20 HECD CN(C)C(=O)CC1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 781365383 IIWCUFAQVWLKSU-UHFFFAOYSA-N 406.502 2.062 10 20 HECD COc1cccc2c1CCN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 782526982 NVLUMYTZZUULLJ-UHFFFAOYSA-N 413.493 2.345 10 20 HECD CC(C)(C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)S(=O)(=O)C1CC1 786412045 ZTOONZQVSNAITF-OAHLLOKOSA-N 414.955 2.482 10 20 HECD COc1cc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cc(OC)c1OC 787269909 RWLSLVZUCARONQ-UHFFFAOYSA-N 416.434 2.165 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 788187117 JVQFILFEPUEZQV-IYBDPMFKSA-N 414.481 2.075 10 20 HECD Cc1ccccc1[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788318867 IXPLQHJGKPJCSF-HXUWFJFHSA-N 407.514 2.464 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H]1CCN(c2ccccc2)C1=O 788912818 ZCNCKPVHHXZFLP-OAQYLSRUSA-N 420.513 2.167 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC[C@H]3C)cc2F)C[C@@H](C)O1 789823195 ZNZVJLQSHSZDHR-RBSFLKMASA-N 409.527 2.019 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1 790410871 DXZDAVWLXXLNGA-UHFFFAOYSA-N 406.460 2.064 10 20 HECD O=C(COc1ccc2c(c1)NC(=O)CC2)NCc1ccc(N2CCOCC2)c(F)c1 795224297 WRLCONAMPXORCV-UHFFFAOYSA-N 413.449 2.242 10 20 HECD COCc1ccc(OC)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 795288729 BBKRNLWZDCAHON-UHFFFAOYSA-N 400.478 2.014 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCOC[C@H]3C)CC2)cc1 805820946 AOMZPZSUGTVIIT-RTBURBONSA-N 404.555 2.179 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCCN(C2CCC2)C1 807289810 JSRUFSXNSLAFCX-ICSRJNTNSA-N 410.562 2.448 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 809363130 PKXGYSOHTPVRDS-DOMZBBRYSA-N 424.339 2.245 10 20 HECD COc1ccc(CCNC(=N)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 848998558 SXDPLVKKGUVDMQ-LJQANCHMSA-N 409.534 2.254 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)C(=O)c1ccco1 1800715733 MYKNSOBFWZLBKQ-CLLJXQQHSA-N 418.833 2.479 10 20 HECD O=C(CC1CCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1802030012 YLCLMWFZQXQXIO-ZSBFGKGUSA-N 408.882 2.145 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c(C)o1 1804332349 XDMMQIPWVQNLID-BTTYYORXSA-N 421.544 2.009 10 20 HECD CC(C)C1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CCC1 1804340519 TXTWUNKISZXVDM-QDMKHBRRSA-N 423.604 2.311 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)C(F)F)[nH]n1 1823475545 WJDRDAJDTRLVIF-PZBABLGHSA-N 422.388 2.497 10 20 HECD C[C@H](NC(=O)CCNS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 145513376 MTYOAVZFUGBOFY-KRWDZBQOSA-N 417.531 2.069 10 20 HECD CS(=O)(=O)N1CCC(NC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 726091342 KGPFXJWXJLQGCH-UHFFFAOYSA-N 407.492 2.121 10 20 HECD CCOc1ccc(OCC)c(NC(=S)NNc2ccc(S(N)(=O)=O)cc2)c1 726894497 XHNIDWQIYVXUFS-UHFFFAOYSA-N 410.521 2.445 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)c(O)c1O 727006000 ZCTASIPZIYHEKF-AWEZNQCLSA-N 402.422 2.439 10 20 HECD COc1ccc(N2CCC(NC(=O)NCc3nnnn3-c3ccccc3)CC2)cc1 730582063 BUGJDSJMYUQUPA-UHFFFAOYSA-N 407.478 2.139 10 20 HECD CCCNC(=O)CN1CCC(NC(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731364282 WIPYOZONDYMQJY-UHFFFAOYSA-N 421.561 2.462 10 20 HECD O=S1(=O)NC(CN(Cc2ccccc2O)C[C@@H]2CCCO2)=Nc2ccccc21 731845390 ZMIHQCIACVOUPW-INIZCTEOSA-N 401.488 2.395 10 20 HECD CN(C)c1ccc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)cc1F 733326589 NKJHTKLOBNRGAO-GOSISDBHSA-N 414.529 2.277 10 20 HECD COc1ccc(O)c(CNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1 734066854 ZXXBWBSPRCDTIB-UHFFFAOYSA-N 422.279 2.393 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(F)cc1F 741097512 TWNXYZFJJSFHSH-UHFFFAOYSA-N 415.396 2.383 10 20 HECD COCCN(CC(=O)NC[C@H]1COc2ccccc2O1)c1ccc(OC)c(OC)c1 746475403 SAGSCCCQBNOQFC-KRWDZBQOSA-N 416.474 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](CN(C)CC4CC4)C3)CC2)cc1 746494565 JOZDMIQYLHOKCK-HXUWFJFHSA-N 400.567 2.008 10 20 HECD CS(=O)(=O)CCc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 747376158 SPYBOIVGDJKQQO-UHFFFAOYSA-N 417.531 2.432 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)c1O 750045332 IZBAHEUGAMWZFH-UHFFFAOYSA-N 421.925 2.184 10 20 HECD COCCN(C[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(OC)c(OC)c1 751484612 ZLODPEOTMFMXMJ-GOSISDBHSA-N 409.504 2.294 10 20 HECD Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 752295059 FTCIPLXPQGNETN-INIZCTEOSA-N 422.489 2.015 10 20 HECD O=C(NCCOCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 752640770 HRKIIKJSLQOBPY-HXUWFJFHSA-N 412.486 2.346 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@](C)(CO)C3CCCCC3)CC2)cc1 755967694 QMNWPXYDWHTPEI-HSZRJFAPSA-N 418.582 2.448 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(OC)c(OC)c3)CC2)cc1 758226718 ZFNANBMPKHYQDJ-SFHVURJKSA-N 402.491 2.274 10 20 HECD CCN(CC)C(=O)CCC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759238080 BFLIKKMNXYGQSY-UHFFFAOYSA-N 407.511 2.010 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc(C(=O)O)oc2Br)cc1F 761286217 DWVKSPROPQPLMR-UHFFFAOYSA-N 421.244 2.424 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnc4c(Cl)c(C)nn4c3)CC2)cc1 766753967 KXDMUOYHIHODDX-UHFFFAOYSA-N 421.910 2.211 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)N3CCC4(CC3)OCCO4)cc2)CC1 766800279 AVGHTSVESATYFZ-UHFFFAOYSA-N 409.552 2.096 10 20 HECD Cc1cc2c(cc1C)[C@@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)CO2 771234315 MVZIGUUYZYUXDS-FQEVSTJZSA-N 414.527 2.331 10 20 HECD C[C@H](NC[C@H]1CCCN1S(C)(=O)=O)c1ccc(N2CCOCC2)cc1Cl 773107428 ZETHBUDDLVGRQF-GOEBONIOSA-N 401.960 2.251 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)/C=C\c1ccccc1 773750858 XIWNEMXUUYBNAU-WQTVUKCASA-N 404.488 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4nc(C)cn4c3)CC2)cc1F 774310490 GUDYBKLGQBMULC-UHFFFAOYSA-N 411.437 2.078 10 20 HECD O=C(NCc1cn2ccccc2n1)C(=O)N(Cc1ccco1)Cc1ccccc1O 775130195 QHRNTWRCFWOBLB-UHFFFAOYSA-N 404.426 2.478 10 20 HECD CCN(Cc1ccccn1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778314317 PTQQKZUYQFGWOA-QXMHVHEDSA-N 408.502 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](CCO)CC(C)C)CC2)cc1 778324003 AQQDASWKYBXKJB-CSHXORCISA-N 417.550 2.061 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)n(C)c1 778667774 UBRCGAPRPGXURT-UHFFFAOYSA-N 404.536 2.196 10 20 HECD CCN1CCN(C(=O)[C@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 784670964 HEUJPJPAOZCHPI-AWEZNQCLSA-N 402.520 2.026 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(OC)c(OC)c1OC 787298623 NNPXCOKUQIYEIY-UHFFFAOYSA-N 416.474 2.473 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccsc3)cc2F)C[C@H](C)O1 787329354 SCFWCHGXILZNKK-KBPBESRZSA-N 405.495 2.433 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3c(F)cccc3F)CC2)cc1 787907945 BMNXINDYNNVJGJ-UHFFFAOYSA-N 417.456 2.371 10 20 HECD CCSCC[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800827 PUVCVPBHOGGTFJ-OAHLLOKOSA-N 411.543 2.269 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1OC 796909960 KLXHTBVVMNLVAU-UHFFFAOYSA-N 409.489 2.175 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)c3cn(CC(=O)N(C)C)nn3)cc2Cl)C1 800048783 CBTTXBXIZLMFAM-CQSZACIVSA-N 418.929 2.186 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1noc(-c2ccccc2)n1 803662438 BTCYRXDXIYRYFT-ZDUSSCGKSA-N 411.437 2.435 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 804317330 ZVGARVJRYXGUCM-XMSQKQJNSA-N 403.523 2.100 10 20 HECD COCC1(CCNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 818017191 YTRUHHALVSPGIZ-HJWRWDBZSA-N 415.534 2.223 10 20 HECD NC(=O)C1(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCCCC1 917678743 GKJPCOMOMIVXMV-UHFFFAOYSA-N 421.409 2.288 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3COc4ccc(F)cc4C3)cc2)CC1 1326849836 UQRUPIUBULAOGL-LJQANCHMSA-N 411.477 2.362 10 20 HECD CN1CCN(c2ccc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)cc2F)CC1 1327192226 PGKIAKWMQFIYJY-UHFFFAOYSA-N 420.554 2.118 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)C3CC(F)(F)C3)C2)CC1 1804999768 CLANJQPXMZKSRP-UHFFFAOYSA-N 409.433 2.383 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CC2(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845785 WBICBXKLNCIRBQ-ZYHUDNBSSA-N 407.377 2.177 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2CCC(F)(F)C2)C1 1841017138 IYNDPJLEENSUEA-LYKUJDHUSA-N 422.428 2.455 10 20 HECD Cc1cncc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1842479760 KUGAEUXLDXEMEE-GQCTYLIASA-N 409.442 2.037 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2CNC(=O)O2)C3)cc1 1845397883 BJGJVRYVIAPTDR-IBGZPJMESA-N 422.485 2.020 10 20 HECD COCCN1C(=O)CCc2cc(NS(=O)(=O)c3cccc4nsnc34)ccc21 96399791 PQMYIXPOZNOUJA-UHFFFAOYSA-N 418.500 2.418 10 20 HECD O=C1CC(=O)Nc2cc(S(=O)(=O)Nc3nc(-c4ccco4)cs3)ccc2N1 727251527 VXGPEOGPGPAWRF-UHFFFAOYSA-N 404.429 2.485 10 20 HECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N2CCCC2)cc1 729286849 DOSKMRCDVFSSPA-HXUWFJFHSA-N 405.506 2.191 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccnc3OCCOC)cc2F)CC1 730193328 GEGHXWGOYSEOCN-UHFFFAOYSA-N 416.497 2.318 10 20 HECD CSC[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 731385015 DXERMXYFWVYRHZ-GFCCVEGCSA-N 424.544 2.467 10 20 HECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NCCCSc1nccs1 733972378 QLJUAEQUZPKOCS-MBNYWOFBSA-N 400.595 2.467 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccc2c(c1)C(=O)NCC2 735376394 UGBVFBOHMVNIQC-UHFFFAOYSA-N 412.465 2.394 10 20 HECD COC[C@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 741796211 XLAFENOFTKZYGJ-GOEBONIOSA-N 408.454 2.136 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3nc(C)cs3)CC2)cc1 742940092 QUNHWPHVDSLBJE-UHFFFAOYSA-N 403.552 2.124 10 20 HECD O=C(CSc1nnnn1CC(F)(F)F)NCc1ccc(N2CCCC2)cc1 750957222 AZWYAKBAUGOYGH-UHFFFAOYSA-N 400.430 2.244 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3C3CCOCC3)CC2)cc1 754234885 RDTCJQZBZARAJB-JTHBVZDNSA-N 403.567 2.069 10 20 HECD COc1cccc(-c2nsc(NC(=O)C(=O)NCc3cccc(OC)c3O)n2)c1 755244186 DHYOHHWJZLNRKG-UHFFFAOYSA-N 414.443 2.183 10 20 HECD C[C@H]1C[C@@H](NCc2ccccc2S(=O)(=O)N(C)CCO)c2c(O)ccc(F)c21 756704697 KXXLRXQDJZEFTL-XJKSGUPXSA-N 408.495 2.482 10 20 HECD CCOC(=O)C[C@H](C)CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759290897 SKQNWXRMRZXWAJ-HNNXBMFYSA-N 423.510 2.133 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1cccnn1 764209683 KUAUFMXREWWKMX-UHFFFAOYSA-N 408.441 2.054 10 20 HECD CCN(Cc1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)=O 769685847 QEPGNZQIYHUCFO-UHFFFAOYSA-N 405.476 2.384 10 20 HECD CN(C)C1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCCCC1 774814477 JHOSLAOCGPMINI-LJQANCHMSA-N 417.550 2.281 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2ccc3oc(=O)n(CCN(C)C)c3c2)c1O 775047703 AAZLTICKAQWMNR-UHFFFAOYSA-N 402.407 2.391 10 20 HECD COC(=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 777577839 VCKMVJYTLMZROD-IBGZPJMESA-N 409.486 2.034 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-n4cncn4)c(C)c3)c2)CC1 781277652 DUBVQOQBJFPNEN-UHFFFAOYSA-N 404.474 2.497 10 20 HECD COC[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)O1 784370235 JRTGVMDTGDSULH-ZBFHGGJFSA-N 408.454 2.136 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(n3c(O)nc4ccccc43)CC2)cc1 785423831 HMOPLGKRQFFZPU-UHFFFAOYSA-N 421.501 2.288 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccccc1Cn1cccn1)c1ccc(N(C)C)cc1 785638679 CLHAQKXPCVMIKP-QGZVFWFLSA-N 405.502 2.491 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 787504045 UXLYHJCNXLPJNF-UHFFFAOYSA-N 422.485 2.364 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)cc1 787855354 JPUDOSBTVMJBPM-UHFFFAOYSA-N 410.518 2.167 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c(O)c1 794389558 QQXGSOUBCAKTON-INIZCTEOSA-N 404.488 2.118 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCSC[C@@H]3C(=O)O)cc2F)C[C@@H](C)O1 797710458 YYOZVXGBWLWMDC-IIYDPXPESA-N 411.499 2.151 10 20 HECD Cc1cc(C(=O)CN2CC[C@H](S(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 800467974 CFKCPAZECXMZKJ-KRWDZBQOSA-N 418.515 2.167 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1c[nH]c2ncccc12 803389901 MBGQMIOOTHTZFQ-UHFFFAOYSA-N 416.503 2.376 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 804729084 DBGQLIZEOUDBDO-HXUWFJFHSA-N 424.545 2.475 10 20 HECD CN(C)CC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C 806388234 BZXCNVCHEISJIJ-ICSRJNTNSA-N 419.566 2.382 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1 806830318 CTGOYTVJGFOLBP-UHFFFAOYSA-N 413.453 2.066 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCN4CCCC[C@@H]34)CC2)cc1 916197131 UTXCTVUKYRVBPD-YADHBBJMSA-N 415.582 2.133 10 20 HECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 918305974 QHWBTGBPZVLNRS-UHFFFAOYSA-N 402.882 2.363 10 20 HECD COc1ccc(N2CCCN(C(=O)CCNS(=O)(=O)c3cccs3)CC2)cc1 918369107 ICYGGSQBABYYDZ-UHFFFAOYSA-N 423.560 2.164 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(NC(=O)OC)cc3)nc12 919065887 ZJLVISGYLZSGHZ-UHFFFAOYSA-N 414.374 2.147 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)[C@H]3CCCC[C@H]3C(=O)OC)CC2)cc1 1338267173 GODODJMNNRVGJM-MOPGFXCFSA-N 410.536 2.269 10 20 HECD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)n1cncn1 1791858633 XEVBVSNPPVBJMW-ZDUSSCGKSA-N 422.445 2.093 10 20 HECD Cc1noc(C)c1CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1841927433 SMBROSKXLDHKLJ-UHFFFAOYSA-N 419.865 2.416 10 20 HECD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)ccc(F)c1F 1846818267 OPIRENFVIAPOCY-UHFFFAOYSA-N 403.385 2.210 10 20 HECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C2=O)cc1 7228459 POQVIHQJOKLFRS-QHCPKHFHSA-N 424.501 2.187 10 20 HECD Cn1c(=O)n(C)c2cc(S(=O)(=O)NCc3ccc(N4CCCCC4)cc3)ccc21 51155748 DTBRIVCRJVOLPZ-UHFFFAOYSA-N 414.531 2.346 10 20 HECD Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NS(=O)(=O)c1cccc2nsnc12 522756728 FAKBDIUEEGNOBF-OAHLLOKOSA-N 418.500 2.410 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C 726278785 YPKWKUIJJNSFQG-HXUWFJFHSA-N 403.571 2.227 10 20 HECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCC1 729598493 CJYAUJRVSKSOKK-CTNGQTDRSA-N 415.582 2.308 10 20 HECD CCN(CC)Cc1ccc(CNC=C2C(=O)N(CC)C(=S)N(CC)C2=O)cc1 730989519 BOHJWELFWVABMF-UHFFFAOYSA-N 402.564 2.497 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3ccc(N4CCCC4=O)cc3)n2)cn1 743050053 PIBOXABERMLYNO-UHFFFAOYSA-N 403.489 2.471 10 20 HECD COC[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746756823 LCHOPOHXJFUBPA-NHCUHLMSSA-N 424.545 2.445 10 20 HECD Cc1cc(C(=O)CN2CC[C@@]3(CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756903088 JEIJUUFVTJFAMW-OAQYLSRUSA-N 417.531 2.037 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@]12CCCO2 759221403 PXNVUUAGRFVVDL-QKNQBKEWSA-N 407.486 2.188 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-n4ccnn4)cc3)CC2)cc1 760247620 YVCDIKLSYMYVHR-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)CC[C@@H](CC(C)C)C3=O)CC2)cc1 760368243 GHLPCQNPRWAANI-KRWDZBQOSA-N 401.507 2.155 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 766269756 PKHFXWBKCHMWRK-IAGOWNOFSA-N 405.514 2.310 10 20 HECD Cc1cc(NC(=O)CN2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)no1 768229801 NBAOUDMGVDFNKO-UHFFFAOYSA-N 409.830 2.007 10 20 HECD C[C@H](C[S@@](C)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768448971 QIKTVMXYGHZMEC-SSINHNECSA-N 416.546 2.094 10 20 HECD CCO[C@H](C)c1noc(CN2CCN(Cc3cc(OC)c(OC)cc3O)CC2)n1 768464852 BQGBJLMVVTWWSN-CQSZACIVSA-N 406.483 2.208 10 20 HECD Cc1ccc(C(=N)NOCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 772886217 XKILZKOQDYFWAA-UHFFFAOYSA-N 418.444 2.273 10 20 HECD C[C@H](NC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 776107418 HDWLEXTXUACGFX-LAUBAEHRSA-N 409.534 2.367 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CCc3cccn3C)CC2)cc1 778295086 NHCBLXZQPIKMOP-SYGIOELKSA-N 424.545 2.376 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(CS(C)(=O)=O)c3)c2)CC1 781045990 VKYBDYIMQWRBBR-UHFFFAOYSA-N 415.515 2.152 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1Cl 782367769 ZZDVYIHCVMJABO-UHFFFAOYSA-N 413.835 2.041 10 20 HECD O=C(OCc1cc(=O)c(O)co1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407189 FGMGBCDEUUCXRV-UHFFFAOYSA-N 423.424 2.270 10 20 HECD CCCc1nc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)co1 786516603 BYXWPXKZRGAKPO-UHFFFAOYSA-N 405.426 2.076 10 20 HECD O=C(NCc1ccc(Cl)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786614620 QFPNHFPJDDGXGL-MRXNPFEDSA-N 403.866 2.265 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)O[C@H](C)C2 786626748 MUNLIFIWEKNLGS-OAHLLOKOSA-N 411.502 2.359 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCc2c(O)cccc21 789862537 VIMQYBJZLTZHRF-LJQANCHMSA-N 411.527 2.365 10 20 HECD CC(=O)NC[C@H]1CCn2ncc(C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c2C1 792780665 IVFRORAJCLDHCM-SFHVURJKSA-N 409.534 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)COc3c(Cl)cncc3[N+](=O)[O-])CC2)cc1 795245897 RQRWFRVIBSQUMH-UHFFFAOYSA-N 406.826 2.379 10 20 HECD COCCOc1cccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 800872512 ZKVCALGHTKMJTG-UHFFFAOYSA-N 400.475 2.448 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@](C)(O)CCc3ccccc3)cc2)CC1 801220675 MDFMPGOOYWJGLP-DEOSSOPVSA-N 409.530 2.355 10 20 HECD O=C(NC[C@@H]1CCC=CO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805512605 ZWXIWZXTLDULTK-YOEHRIQHSA-N 409.433 2.182 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)C1 806282461 LNSQULRGDFVWHX-AWEZNQCLSA-N 420.560 2.145 10 20 HECD CCCN(CCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806496568 ZMLUIUIMGJQMRQ-HXUWFJFHSA-N 415.582 2.406 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O 807289889 MBFDGPGXDZGBEH-NRFANRHFSA-N 424.545 2.119 10 20 HECD CNC(=O)c1ccc(CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C2CC2)cc1 807671924 VDEIEENBGDZOJP-MRXNPFEDSA-N 422.529 2.481 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807674745 QDRCTRMOUSRUQR-JENIJYKNSA-N 416.566 2.473 10 20 HECD Cc1cc(=O)cc(C)n1CCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 810182858 JUTLUKLMKOLWDW-FQEVSTJZSA-N 424.545 2.263 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(CN(C)C)CC3)CC2)cc1 916196366 CLTYJVBMGSJERI-UHFFFAOYSA-N 417.598 2.191 10 20 HECD COc1ccc(C(C)=O)cc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832536 ABXFQSGEZFSCPQ-IBGZPJMESA-N 423.513 2.458 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c4ccccc4c3=O)cc2)C1 918670907 CNSXZIVIHSHTGE-MRXNPFEDSA-N 404.470 2.160 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4c(c3)nc(O)n4C)CC2)cc1 920287138 FDIDIGBTAXOYGY-UHFFFAOYSA-N 423.517 2.230 10 20 HECD C[C@H](NC(=O)c1ccc(N2NC(=O)CCC2=O)cc1)c1ccc(N2CCOCC2)cc1 920886416 KNOUMSMGXIEVOA-INIZCTEOSA-N 422.485 2.172 10 20 HECD C[C@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C(=O)OC(C)(C)C 1321755976 KEOQTRGETLYBBA-GFCCVEGCSA-N 415.512 2.139 10 20 HECD Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)n1 1808200764 RVIINESXBHJGET-UHFFFAOYSA-N 410.474 2.355 10 20 HECD CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813693150 JKHQOAMETHXYDD-KYNLDRKZSA-N 410.474 2.420 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)N[C@H](C)Cc3ccsc3)nnc2n1 108659677 VISSIPCFFGKYJN-LLVKDONJSA-N 420.568 2.284 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 140127637 JXLIPIGUWZYSSQ-HNNXBMFYSA-N 404.488 2.349 10 20 HECD Cn1cc(/C=C2/CCn3c2nc2scc(-c4ccccc4)c2c3=O)c(=O)n(C)c1=O 649239972 ULCGQYUHWGFMJN-UVTDQMKNSA-N 418.478 2.467 10 20 HECD COc1ccc(N(CC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)C(C)C)cc1F 725816538 WMHPCDAISVDJPP-UHFFFAOYSA-N 422.545 2.108 10 20 HECD CCn1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 727450251 IAQYPTUXWROBLN-UHFFFAOYSA-N 418.441 2.237 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 727903011 CYGSGHRJUBFEEY-UXLLHSPISA-N 408.470 2.025 10 20 HECD O=C(COC(=O)c1cnc(C2CC2)s1)NCc1ccc(N2CCOCC2)c(F)c1 729770012 QIKFYBCXIUWAEA-UHFFFAOYSA-N 419.478 2.469 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c1 734015491 OBYSZUNOTCPUQQ-CYBMUJFWSA-N 423.447 2.070 10 20 HECD C[C@H](NC(=O)N1CCC(OCCN(C)C)CC1)c1ccc(N2CCOCC2)cc1 734271266 FVNVVCDDSZCLJJ-SFHVURJKSA-N 404.555 2.336 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 741084480 FUOCMYGEGIOSKG-LPHOPBHVSA-N 409.552 2.319 10 20 HECD C[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)n1nnc(-c2ccccc2)n1 742496677 BJTVVAZPNHESSH-QGZVFWFLSA-N 406.490 2.396 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)c3cnn(C)c3)CC2)cc1 743634569 YRWISGACSWNZIH-KRWDZBQOSA-N 400.527 2.001 10 20 HECD CCO[C@H](C)c1noc(CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n1 743814484 MEOPMGAXHPINOL-MRXNPFEDSA-N 416.526 2.261 10 20 HECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905601 OYGRJRUAGJHHOX-KBPBESRZSA-N 419.494 2.331 10 20 HECD CCCn1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 746354984 PWEDJPQOLOXKFG-HUUCEWRRSA-N 417.485 2.301 10 20 HECD CC(C)(C)n1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 746363491 DKYJLMUPHSNCJL-UHFFFAOYSA-N 413.522 2.102 10 20 HECD O=C(NCc1ccccc1O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1 748349456 GIPSMJHBQUNLIR-OAHLLOKOSA-N 424.906 2.433 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC[C@@H]1COc2ccccc2O1 756336812 QTJLKBPUOOSTEA-RBUKOAKNSA-N 412.486 2.329 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)cc1F 760913454 XLCQQHSLCZPMSM-UHFFFAOYSA-N 401.847 2.210 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 770255060 REEQGSGRZWUMFJ-GASCZTMLSA-N 400.454 2.398 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)c2)CC1 770287338 YACOUCZPYBYVQA-UHFFFAOYSA-N 416.547 2.345 10 20 HECD COC(=O)c1ccc(F)c(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772906441 PISHBHABIZXWEG-UHFFFAOYSA-N 419.428 2.316 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(Br)cn3)ccc21 773140536 SGCRXHQJEYLOMR-UHFFFAOYSA-N 403.280 2.481 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1)c1ccc(N(C)C)cc1 773844765 GPGVCCBOKZLABG-SFHVURJKSA-N 423.561 2.316 10 20 HECD COc1cc(O)c(CNCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC 776151110 FUQJERYDKSEDQK-UHFFFAOYSA-N 406.504 2.484 10 20 HECD C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cn(CC(=O)N(C)C)nn1 777823572 UTRCQDMDMQROGQ-MRXNPFEDSA-N 407.474 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCOCC(C)C)CC2)cc1 778221476 NXUVSAUQOLFWIG-MDZDMXLPSA-N 403.523 2.079 10 20 HECD CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 779335487 DLTQYNASALQTBE-SVFBPWRDSA-N 413.566 2.014 10 20 HECD CNC(=O)CCCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 779603553 AGWCLECVVFKHED-UHFFFAOYSA-N 401.429 2.465 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCCCSc1nccs1 781534385 NOMKCEBNDKZYPJ-UHFFFAOYSA-N 415.443 2.445 10 20 HECD CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1F 783307228 DYBPGIFUIWYLKC-UHFFFAOYSA-N 412.425 2.363 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cc1 785424702 SQISPNVLIDPPAQ-UHFFFAOYSA-N 423.561 2.220 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cn2cc(Cl)ccc2n1 786506902 QBFNNKRRNZOTSA-UHFFFAOYSA-N 409.924 2.359 10 20 HECD COc1cc(Cl)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1C(=O)O 790392894 CIVBZVGTASOLGJ-UHFFFAOYSA-N 401.780 2.251 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)c1 795549923 SUGAWVJEDHNWNS-UHFFFAOYSA-N 418.500 2.382 10 20 HECD COc1ccc(NCc2cccc(OC)c2O)cc1S(=O)(=O)N1CCOCC1 796402727 LERVXNDQQSJIRW-UHFFFAOYSA-N 408.476 2.042 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(OC)c(C)c1OC 796646926 LJLPZHMNNNGKAU-UHFFFAOYSA-N 401.463 2.342 10 20 HECD CO[C@H](C)CS(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 799820510 NTRMGMOQNLHBEL-RHSMWYFYSA-N 415.556 2.273 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1c(C(=O)OCC)cnn1C 802609543 CTBZVGVZYQMVNX-UHFFFAOYSA-N 402.451 2.070 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCN(C)C(=O)OC(C)(C)C)cc2)CC1 803161526 DBSASDLRHIMPBT-UHFFFAOYSA-N 418.538 2.228 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCCSCC1 803448626 UZJLYUIPZOUNRP-UHFFFAOYSA-N 413.490 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)cc1F 804853446 YDGHWYPMORHXMD-DMPWYTOCSA-N 421.513 2.083 10 20 HECD COCCOCCN(C)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 808146568 YSEVJWYSUBQLJT-UHFFFAOYSA-N 408.205 2.373 10 20 HECD CCC[C@@H](C(=O)OCC)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccn2)c1C 821585713 UVNGNAQMKHCFQJ-INIZCTEOSA-N 407.492 2.281 10 20 HECD O=C(NCCCOC[C@@H]1CCCO1)NCc1ccc(N2CCC(CO)CC2)cc1 918196896 HXIKOUWZUVKJPE-NRFANRHFSA-N 405.539 2.280 10 20 HECD CCc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n[nH]1 919699515 PJPPCZBGNWRTQM-UHFFFAOYSA-N 409.469 2.158 10 20 HECD COc1cc(CNCc2ccc(N3CCOCC3)cc2)cc(Cl)c1OCC(N)=O 920181049 TXJCAXQPSJJQPE-UHFFFAOYSA-N 419.909 2.339 10 20 HECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319947121 FVWMXEWMEPUBKD-INIZCTEOSA-N 420.554 2.418 10 20 HECD COC(=O)[C@H]1CCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1323170462 XOMGIYIBRQNGJF-BBRMVZONSA-N 422.393 2.442 10 20 HECD CCc1ncccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842224021 STXRKEKUTCGSQL-VQHVLOKHSA-N 423.469 2.291 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(C)cc3)CC2)cc1 12069492 FSIBZOWKUKHDQL-UHFFFAOYSA-N 410.518 2.271 10 20 HECD CCCN(CC(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1)Cc1ccccc1O 110733254 OYUITKASHKWXNA-UHFFFAOYSA-N 405.520 2.459 10 20 HECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)N1CCOc3cc(N(C)C)ccc31)C2=O 536043882 OQISIJOVKBWOJJ-YEZVWNJWSA-N 414.506 2.225 10 20 HECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729063950 MBDBQJJXDWSCJM-JTQLQIEISA-N 405.838 2.230 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1 737079301 MSVLBBWHEDQLLO-UHFFFAOYSA-N 414.418 2.077 10 20 HECD C[C@@H]1CC(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 742096294 VUJZEHMYHVGPHG-POKNLVKOSA-N 423.585 2.467 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n(C)n1 743975072 MOQIZDIQTBUBGL-CYBMUJFWSA-N 407.421 2.054 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](c3ccccc3)N(C)CC)nc12 745097997 PKXUAIHMRKJVAM-GOSISDBHSA-N 412.446 2.348 10 20 HECD NC(=O)[C@H]1CCCN(CCCNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 745829493 FQSRJBCRFQJWFD-SFHVURJKSA-N 414.506 2.284 10 20 HECD Cc1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 747249924 DWRMNBXXFWNOBA-INIZCTEOSA-N 405.495 2.314 10 20 HECD COc1cc(N2CCN(C(=S)NCCc3cccnc3)CC2)cc(OC)c1OC 758920482 IEJRDBDWHGNWHC-UHFFFAOYSA-N 416.547 2.347 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)[C@@]2(O)CCSC2)NC(=O)OC(C)(C)C)cc1 765836496 NJUOIDSEEPKNGG-OXJNMPFZSA-N 409.552 2.303 10 20 HECD O=C(c1ccccc1OC(F)F)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440885 HJQULUBLRPWHGI-KRWDZBQOSA-N 420.412 2.377 10 20 HECD OC[C@H](c1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768445030 DZGMCDDPYFWJJB-UYAOXDASSA-N 404.894 2.323 10 20 HECD O=C(CNC(=O)c1ccc(O)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771059442 RIFVYLMJZMZXJR-QGZVFWFLSA-N 417.893 2.262 10 20 HECD C[C@@H]1[C@@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 771403882 JBFRSNQCTIBNEF-CHWSQXEVSA-N 409.533 2.419 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)c(Br)cc1F 774362681 CXGITTPNMBCMRD-UHFFFAOYSA-N 415.190 2.436 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)c(Br)c(F)c1 775164507 ANDJQSBOVVFRMM-UHFFFAOYSA-N 415.190 2.436 10 20 HECD CCc1oc(C(=O)OC)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 778603412 CMIORCPHSVVMDG-UHFFFAOYSA-N 422.503 2.286 10 20 HECD C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331262 ILGLJAIKWJFFDN-GOEBONIOSA-N 413.440 2.329 10 20 HECD COc1ccc(CNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)(C)C)c2)c(O)c1 794381864 PTHPVZDBBNGVHR-UHFFFAOYSA-N 422.503 2.416 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H]3C[C@@H](O)c3ccco3)ccc21 803688829 CEKRBZVGQBGUIX-UYAOXDASSA-N 411.502 2.393 10 20 HECD CCC[C@]1(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCOC1 806334446 OSZLEZXXTDYEPY-QFIPXVFZSA-N 404.555 2.466 10 20 HECD CCOc1cc(CCO)ccc1OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 808272524 GAHCWVIQJJLKGY-UHFFFAOYSA-N 414.502 2.356 10 20 HECD COc1ccc(N2CCCN([C@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1 918995294 YXCXVRXOPHNOJT-FQEVSTJZSA-N 424.457 2.448 10 20 HECD Cc1cc(C(=O)COC(=O)C2(CO)COC2)c(C)n1-c1ccc(OC(F)F)cc1 1116904833 YUTOCKNYJCDYGY-UHFFFAOYSA-N 409.385 2.430 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)CC2)cc1 1319496605 PADTVQFRCPLVLU-UHFFFAOYSA-N 419.485 2.332 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cc3ccccc3S(C)(=O)=O)CC2)cc1 1322987409 GBYBHYUPQACNLO-UHFFFAOYSA-N 402.516 2.380 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](C)NC(=O)C1CCCCC1 1325762005 GOTCBABJQAWQHT-YOEHRIQHSA-N 420.506 2.163 10 20 HECD CC1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1782002553 KCNARIMNABTSDW-FQEVSTJZSA-N 408.882 2.385 10 20 HECD COc1cscc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601285 PHUULUWYBPHMNK-CLLJXQQHSA-N 403.460 2.129 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCCC1)CC2)c1cc(O)nc(O)c1 1816722012 AFDWJXDKNBPWLT-GFCCVEGCSA-N 402.476 2.365 10 20 HECD C[C@@H]1CN(c2ccc(CNc3ncc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 725787310 DZXVLJNACOLAFQ-GHMZBOCLSA-N 400.501 2.155 10 20 HECD CCN1CCC[C@@H](CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 729586573 JMACAELQYYIHCD-FQEVSTJZSA-N 417.598 2.238 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCC1(N2CCCC2)CCOCC1 729595750 ARWDMDPJOIOLDV-UHFFFAOYSA-N 420.529 2.107 10 20 HECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)C1 731217566 FEFCEXDQINYXSQ-AZUAARDMSA-N 415.582 2.275 10 20 HECD CC(=O)NCc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 733633054 IEPUUVLPDUMOPO-LJQANCHMSA-N 423.517 2.346 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c1 734015469 MQIZHTPSWOSWRL-SFHVURJKSA-N 404.488 2.179 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C(C)C)nn(C)c3Cl)nc12 745190947 MOLAHZVHADRJKU-UHFFFAOYSA-N 421.841 2.479 10 20 HECD CC(C)CCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 746354993 QFSNLKNKDGSFOV-UHFFFAOYSA-N 417.485 2.160 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](c3ccccc3)n3cccn3)cc2)C1 747644472 BWMDYGCXTSJJER-UNMCSNQZSA-N 417.513 2.491 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1Cc2ccccc2C1 751228350 PRCBOCJHWPKKIG-UHFFFAOYSA-N 404.507 2.374 10 20 HECD COc1cc(OC)cc(N2C[C@H](C(=O)NCc3cc(OC)ccc3O)CC2=O)c1 752803822 GHVQKFKLONIBFM-CQSZACIVSA-N 400.431 2.087 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)c4ccc(C)cc4C3=O)CC2)cc1F 753740570 RUBONSSKNZDRLT-UHFFFAOYSA-N 411.433 2.088 10 20 HECD COc1ccc(N(C)CC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1Cl 757856629 DVFHDTJFJABZBA-GFCCVEGCSA-N 423.922 2.410 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H]3CC(=O)N(C(C)(C)C)C3)CC2)cc(OC)c1OC 759220952 NGJADGUWJPPLAZ-OAHLLOKOSA-N 419.522 2.008 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(Cn4cncn4)cc3)no2)c1 761555710 XHHBNKYNLZHDPD-UHFFFAOYSA-N 412.431 2.121 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=O)C3CCCC3)cc2F)C[C@H](C)O1 768517364 PQCFJOMTUNADFY-GJZGRUSLSA-N 407.486 2.294 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cnc4c(c3)c(C)nn4C)c2)CC1 769848933 SCJBQJRWSDEMIU-UHFFFAOYSA-N 414.535 2.219 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cn(C)c(Cl)n3)cc2F)C[C@@H](C)O1 769894436 YZEWTGKWCFICPC-VXGBXAGGSA-N 416.906 2.305 10 20 HECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1c1nccn2cnnc12 770279231 GXEXHRWQSCBIMA-NSHDSACASA-N 403.830 2.102 10 20 HECD O=C1[C@H]2CCCCN2C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777616632 SSWGOVURJOEAAX-LJQANCHMSA-N 424.480 2.259 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccn2c(O)nnc12 780985904 VHLUZBUKCPWBLM-AWEZNQCLSA-N 401.854 2.188 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n(C)n1 784765705 BJCYGKNADLKGNF-MRXNPFEDSA-N 419.913 2.061 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2ccc3c(c2)OCO3)cc1F 785507421 YJKWNDARVVCICJ-UHFFFAOYSA-N 415.465 2.376 10 20 HECD CC(C)(C)OC(=O)NCCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 786704027 BMHSVRSJNTXAJW-UHFFFAOYSA-N 417.462 2.155 10 20 HECD CCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 787285606 WRUDFYWCSSLDKN-UHFFFAOYSA-N 402.470 2.398 10 20 HECD CCN(CCCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788314325 UVBRYGRYHGEEDZ-HXUWFJFHSA-N 415.582 2.406 10 20 HECD CC(C)c1csc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789370408 MCBDUVXIVSQHBP-UHFFFAOYSA-N 406.483 2.497 10 20 HECD CCS[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789810551 BDGZFFZZRTYVSV-HKUYNNGSSA-N 423.554 2.459 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1 793915985 SWZFKKAVDXZINN-UHFFFAOYSA-N 419.460 2.320 10 20 HECD Cc1nnc(COCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 795361175 VFWSHKBZMNCWIS-CHWSQXEVSA-N 408.499 2.432 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c(O)c1 797389213 VHQZNYVYTYIPCJ-UHFFFAOYSA-N 412.421 2.348 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 803303872 VOHOFAJLJCUWAN-HNNXBMFYSA-N 416.909 2.108 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC(=O)N1CCCCCC1 804080074 GFNBHDLYJADITI-UHFFFAOYSA-N 402.539 2.010 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@](C)(CC)C3)cc2F)CC1 805007000 CHKJGAHOGJVBFP-JOCHJYFZSA-N 404.530 2.232 10 20 HECD Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)NCCCSc1nccs1 806278810 XDVZNJKOEYMXHY-GOOCMWNKSA-N 419.576 2.412 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(OC)cc3C)CC2)cc1 806738299 ZDGRAMZMSNQLSN-UHFFFAOYSA-N 411.502 2.367 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@H](C1CC1)C(F)(F)F 808869626 MIWRVLANXLHOPD-OAHLLOKOSA-N 405.442 2.062 10 20 HECD CCCCN(C)C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 811931421 HCXJSMJAEPQZST-PKOBYXMFSA-N 403.571 2.308 10 20 HECD CCOCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 812008841 GIBODJMKBPXVIH-ZDUSSCGKSA-N 421.473 2.267 10 20 HECD O=C(N[C@H]1CCCC12CCOCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 814181481 AVRGMIVFPIENTH-ICSRJNTNSA-N 416.518 2.365 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)C1=COCCC1 1796935137 ZKBJCZQLSQVXEZ-GGPHIMKMSA-N 422.485 2.112 10 20 HECD C[C@H](OC(=O)C1=COCCO1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 5895299 FOYAPUUSCBKVRT-LBPRGKRZSA-N 407.378 2.220 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCCOC3CCCC3)CC2)cc1 726247880 KBSORMGHKUSZQX-UHFFFAOYSA-N 404.555 2.466 10 20 HECD COc1cccc(CNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c1O 729858736 BLMWCKCQYFBTKH-UHFFFAOYSA-N 406.504 2.311 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 732202765 BNUIMWOFFHXVGT-UHFFFAOYSA-N 407.810 2.228 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NCCCSc1nccs1 733972657 UJXGTPUYZJVWAX-UHFFFAOYSA-N 401.517 2.438 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)N(C(C)=O)CC4)CC2)cc1 734490618 QTDNDJVRPONXJQ-UHFFFAOYSA-N 415.515 2.115 10 20 HECD C[S@](=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 737110496 BPTPWMHWIUKORM-ADKRDUOOSA-N 416.499 2.276 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(C3OCCO3)CC2)c1 738137938 IAFPLJWDDJEFLN-UHFFFAOYSA-N 404.507 2.012 10 20 HECD CC(C)Oc1ncccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738899850 JMWNNVKRSPKZBG-UHFFFAOYSA-N 418.519 2.425 10 20 HECD CC[C@@]1(C)NC(=O)N(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 744373407 XZUWUQKYFLRTNS-RNODOKPDSA-N 424.448 2.094 10 20 HECD CCN1CCO[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 746315750 DAPDVNQUZDDOJR-RBUKOAKNSA-N 420.554 2.155 10 20 HECD O=C(NCCC(=O)N1CCCCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 748343565 KGGVFHBBAAICLP-UHFFFAOYSA-N 420.529 2.379 10 20 HECD CCOC(=O)N1CCCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 748460006 GGLFNHUTMLVINK-QGZVFWFLSA-N 404.511 2.458 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC(c4nc5ccccc5[nH]4)C3)CC2)cc1 754072274 RRGPXVLAYPAWQW-FQEVSTJZSA-N 421.545 2.154 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC(C)(C)c3ncc(C)s3)CC2)cc1 754699581 LXNOURBIEISNOT-SFHVURJKSA-N 404.580 2.468 10 20 HECD COC(=O)c1cc(C)ccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758225065 SDPRLUYKWMZQEB-IBGZPJMESA-N 414.502 2.352 10 20 HECD CC(C)OC[C@@H](CO)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 764227034 CPVAGGVJYOMJHG-SOLBZPMBSA-N 411.518 2.367 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)Nc3ccc(O)cc3C(C)=O)ccc2O1 766047807 LCNSKYNAWXSLKX-GOSISDBHSA-N 405.428 2.262 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CCN([C@H]2CCC[C@@H]2O)CC1 767938344 WYRCRBNMLMOHGW-SFTDATJTSA-N 418.607 2.417 10 20 HECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 768708917 NEWNHEUJVUQCSJ-UHFFFAOYSA-N 410.503 2.399 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)cn1C 769529483 BJJNPPCKMSEFGC-UHFFFAOYSA-N 419.334 2.247 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)c2)CC1 770287002 UVHMFBBDWKRQEI-UHFFFAOYSA-N 422.938 2.382 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)CCNC(=O)OCc1ccccc1 771755702 JJOLVPDXHXLEJR-UHFFFAOYSA-N 405.520 2.407 10 20 HECD CCO[C@@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 780310906 DAXUZUUKQWHHCP-NQIIRXRSSA-N 409.502 2.028 10 20 HECD CNC(=O)[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)CCO1 782097434 BRZMSMBFUPVJAA-LJQANCHMSA-N 421.444 2.325 10 20 HECD CNS(=O)(=O)CCNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 784706164 UWKFLTLAFLCWIN-UHFFFAOYSA-N 414.325 2.136 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 785438327 CJJOCEJIVCFZFB-KRWDZBQOSA-N 418.538 2.132 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccnc(-n2cccn2)c1 787241528 MHWBPRUYLPKZMK-UHFFFAOYSA-N 407.474 2.418 10 20 HECD COC(=O)[C@H]1C[C@H](O)CN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 788604798 VVDSODHDXNIOME-MAUKXSAKSA-N 422.428 2.486 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)OC(C)(C)C3)cc2F)C[C@@H](C)O1 789811750 HANVGHAYADWBLA-OWCLPIDISA-N 421.513 2.081 10 20 HECD CCOC1CC(CCNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 789854525 COTOAEOJJLHJTG-CMDGGOBGSA-N 415.534 2.221 10 20 HECD Cc1ncc(CN(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789854580 IYXRGYMQSYNGAK-UHFFFAOYSA-N 404.561 2.280 10 20 HECD COc1ccc(CNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)c(O)c1 792851878 GREQQPALVYGKJQ-UHFFFAOYSA-N 421.519 2.477 10 20 HECD CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 803996600 XREZMZJQQMIINQ-HXUWFJFHSA-N 417.550 2.281 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1nncn1C 805824436 RCRUIHDIVFCUPZ-ZDUSSCGKSA-N 403.442 2.050 10 20 HECD Cc1cccc(CN2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)c1 807290017 BGKXGRYIVJLKHD-UHFFFAOYSA-N 418.541 2.332 10 20 HECD COCCOCCN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808791708 KZFCKISOOVPKJD-HNNXBMFYSA-N 410.470 2.384 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOCC(F)(F)C1)c2[N+](=O)[O-] 809341586 WTNDWULSXRBXIN-UHFFFAOYSA-N 416.336 2.478 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CN2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)c1O 809784532 LDVSFXIFWXBIRL-NSHDSACASA-N 403.888 2.248 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O 814272075 UQPZYUUTMHVLJR-UHFFFAOYSA-N 402.472 2.230 10 20 HECD COc1cc(Br)cc(CNc2ccc(C(=O)NCCC(N)=O)cc2)c1O 816620197 MBXDFDYTVNAEGU-UHFFFAOYSA-N 422.279 2.381 10 20 HECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C[C@H]1CCOC1 917064737 CPMJRVODQBTABB-JENIJYKNSA-N 407.530 2.414 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(C(=O)O)ccc3F)CC2)cc1 917927068 FGRCOCKHOMGZJP-UHFFFAOYSA-N 408.451 2.434 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1 918308987 DSKQMPVGHMOGMB-UHFFFAOYSA-N 407.478 2.106 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2c(F)cccc2NS(C)(=O)=O)c1 1319206121 JYDVXPGCFJQZNH-LLVKDONJSA-N 411.455 2.472 10 20 HECD CC(C)(C)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1 1330619492 WTSMUCKAJIRBHM-UHFFFAOYSA-N 417.535 2.331 10 20 HECD O=C(/C=C/C1CC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931152 PPASOSJOXKAXGM-DAAAGXSWSA-N 406.486 2.384 10 20 HECD O=C(Cc1ccc(Cl)s1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248976 MHUJSTQFKYKLFG-UHFFFAOYSA-N 407.879 2.267 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1 109981425 WLOYUASOINEKRF-LJQANCHMSA-N 415.559 2.347 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1 514409282 LFUYHVFRMYCVPA-KRWDZBQOSA-N 412.534 2.258 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCSC[C@H]2c2cnn(C)c2)n(C)c2ccccc12 578341756 ASCCQKQFYBVAHO-IBGZPJMESA-N 411.531 2.153 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](NS(C)(=O)=O)C3)ccc21 590701321 CUSWMILEQMQKFF-KRWDZBQOSA-N 407.536 2.058 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)N(C)C[C@H]2COc3ccccc3O2)c(O)c1O 727003701 CVCAYGPEDHOJMO-KGLIPLIRSA-N 401.415 2.250 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 729259068 HBQIRASVOOFGIK-SFHVURJKSA-N 405.564 2.429 10 20 HECD COc1ccc(C(=O)NCCCSc2nccs2)cc1S(=O)(=O)N(C)C 733973958 AIGQOGJWSZNCDZ-UHFFFAOYSA-N 415.562 2.314 10 20 HECD C[C@H](NC(=O)N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 740910445 QFEZZHMCTCEZDZ-IEZWGBDMSA-N 409.552 2.239 10 20 HECD O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1ccc(N2CCC(CO)CC2)cc1 742691071 WNIVXJIZNJOYGZ-UHFFFAOYSA-N 420.513 2.423 10 20 HECD COCCn1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1=O 742799088 UXXDKHIHQJFRMA-INIZCTEOSA-N 421.444 2.495 10 20 HECD CN(C)c1ccc(CN(C(=O)Nc2ccn(CCN3CCOCC3)n2)C2CC2)cc1 743169509 UKNRFSLRAUXLHJ-UHFFFAOYSA-N 412.538 2.478 10 20 HECD CC1(C)[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]2CCCO[C@H]21 743649412 UKSPSHJZRHTGJT-MTFMMBMASA-N 414.550 2.391 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c1 743722640 QNQYOSYNTTUSLP-UHFFFAOYSA-N 418.450 2.061 10 20 HECD COc1ccccc1S(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 744208399 JGSIVCBWJKIVDK-UHFFFAOYSA-N 416.480 2.030 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCCN3C)cc2F)C[C@@H](C)O1 745080942 YSTCWYPNPJHMTQ-GQIGUUNPSA-N 421.513 2.083 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc2c1OCCO2 751235724 CBVKGKIOXCXWLG-UHFFFAOYSA-N 418.515 2.145 10 20 HECD COc1cccc(CNS(=O)(=O)c2cccc(I)c2)c1O 751310230 YHHWACMPNBYHIQ-UHFFFAOYSA-N 419.240 2.484 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)c4ccccc4C3)CC2)cc1 754029362 GBGCOEDFTXFFPG-QFIPXVFZSA-N 410.562 2.130 10 20 HECD COC(=O)c1ccc(C)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754039946 GQFZFZBSBGDIFR-UHFFFAOYSA-N 422.478 2.440 10 20 HECD C[C@@H](CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccncc1 754946924 KDEYQLACSRMYDG-INIZCTEOSA-N 415.465 2.411 10 20 HECD COc1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Cl)cc1C(=O)O 757658858 VURFINURMDTNDX-UHFFFAOYSA-N 401.780 2.251 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 758494041 LVOVHQDODMMDFW-UHFFFAOYSA-N 420.491 2.242 10 20 HECD CN(Cc1ccccc1)C(=O)CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761030251 MIPCJNLCPUJZEM-UHFFFAOYSA-N 401.850 2.468 10 20 HECD O=C(CCNC(=O)c1n[nH]c2ccccc12)NCc1cccc(Br)c1O 765770338 OLRAVZLHVXTXLH-UHFFFAOYSA-N 417.263 2.467 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)c1 767795286 WHJQIGVGEDPOOL-CYBMUJFWSA-N 411.451 2.434 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCOC2(CCOCC2)CC1 769491220 KWUVDVDRVYHQJN-UHFFFAOYSA-N 421.513 2.268 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 772317686 GCWBERIKRFCPDC-CLCXKQKWSA-N 408.470 2.168 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC 773745675 QFIGDVCRIMSXEJ-ZDUSSCGKSA-N 423.487 2.026 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCCCC1 774889569 KZERZJFDTDPTSP-IBGZPJMESA-N 417.550 2.281 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCS(=O)(=O)c2ccccc2C1 775888406 XPZKENNNRWDHIH-UHFFFAOYSA-N 401.532 2.001 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1F 776038377 HBFKUBOQGAQLKU-UHFFFAOYSA-N 403.429 2.489 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC1(O)CCCCCC1 778286261 LPYLGEABAYAWGA-UHFFFAOYSA-N 407.530 2.296 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2cncn2)nc1 783325848 DCPFFAYEEVDJQQ-UHFFFAOYSA-N 407.478 2.104 10 20 HECD COCN1C(=O)CCc2cc(NS(=O)(=O)c3cccc4nsnc34)ccc21 784727408 YQEXRWXBCRXMNE-UHFFFAOYSA-N 404.473 2.375 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccc(Cn4ccnc4)c3)ccc21 787298316 OHJLITISBMLHBC-UHFFFAOYSA-N 417.513 2.246 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccccc1CN1CCCC1=O)c1ccc(N(C)C)cc1 787433855 RJMBPCOEMPNZEE-KRWDZBQOSA-N 422.529 2.369 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCN3CCC[C@@H](C)C3)cc2)CC1 787673187 YYGUBQOLPVRLNS-LJQANCHMSA-N 400.567 2.387 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H]([S@](=O)CC)C2)cc1 788928242 CIAJLLHYBVUDAX-JHUILQHCSA-N 407.580 2.345 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3[C@H](C(=O)OC)CC[C@H]3c3ccccc3)nc12 789378076 MVCRUHDDADONQK-ROUUACIJSA-N 424.457 2.490 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C1CCOCC1 789855027 NQNVWPWTTLTUSH-LJQANCHMSA-N 405.564 2.177 10 20 HECD C[C@@H]1CCCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864177 MYXKFSFDGWHGLP-QZTJIDSGSA-N 418.607 2.093 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(=O)OC(C)(C)C 792037407 ASWJHGQJTJPJQA-AWEZNQCLSA-N 424.517 2.499 10 20 HECD O=C(NCc1nnc2n1CCOC2)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 792423864 LXARLDNXYORXIR-UHFFFAOYSA-N 405.418 2.479 10 20 HECD CN(C)C(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 799818604 TXTKJIDZFJHGHW-UHFFFAOYSA-N 413.293 2.335 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(S(N)(=O)=O)c1 802610604 HWXNKPMBILYIEP-UHFFFAOYSA-N 419.503 2.115 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N3CCC[C@@H](C)C3)CC2)cc1 804318271 GCFHGMYNSBBOGI-MSOLQXFVSA-N 416.566 2.017 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CN3CCCC3)C2)cc1F 804853609 SOLMNGUUGMXKEI-SFHVURJKSA-N 404.530 2.232 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)NCCCSc2nccs2)ccc1F 806546925 SQJDAWDKUMIBEW-UHFFFAOYSA-N 404.514 2.494 10 20 HECD O=C(COC(=O)Cn1cc(Cl)cn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808554574 DPTWZUFFSWXWKK-UHFFFAOYSA-N 423.812 2.494 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)c3ccc(Cl)cc3F)nc12 811368762 FIRFOWCNCOJLTC-HNNXBMFYSA-N 423.784 2.181 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCS(=O)(=O)C1 919568985 UTYXARHPWJNCPO-UONOGXRCSA-N 410.517 2.004 10 20 HECD NC(=O)[C@H]1CCCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 920428314 LWZYGALSEGFEIM-LQELWAHVSA-N 423.585 2.453 10 20 HECD CCN(CC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C)c1ccc(OC)c(OC)c1 921061363 DAMZBXVUMFCSPN-UHFFFAOYSA-N 421.519 2.433 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1 1003571512 CCLPKVGBJFMJNP-WJQMWINMSA-N 411.462 2.278 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(C(=O)OC)s3)CC2)cc1 1324584166 FXIBXODIIRPSJG-UHFFFAOYSA-N 410.517 2.444 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1ccco1 1785901650 SHHPVUAIUSYIGB-BNLOLNQZSA-N 420.849 2.251 10 20 HECD CCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)COC1 1827429996 XMPVKOOUOYQABH-KRWDZBQOSA-N 417.506 2.153 10 20 HECD O=C(CCc1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249647 HLFUEIVIDCSIPQ-UHFFFAOYSA-N 420.469 2.424 10 20 HECD O=C(C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1ccco1 1845500877 ZHDLYJCKJZPZHQ-UHFFFAOYSA-N 404.806 2.044 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H](C)c3ccccc3)CC2)cc1 12069533 VVUSOYGULDJCHW-IBGZPJMESA-N 424.545 2.201 10 20 HECD COc1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 147104963 BUHUFAVMKUDWRI-UHFFFAOYSA-N 405.401 2.065 10 20 HECD Cc1c(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)n(C)c2ccccc12 550202716 SXZQZQBCRHSYQI-IYBDPMFKSA-N 414.550 2.107 10 20 HECD COc1cccc(S(=O)(=O)CCN(C)Cc2ccc(N3CCOCC3)cc2)c1 726692209 SSTIPMDTWJAZDV-UHFFFAOYSA-N 404.532 2.438 10 20 HECD O=S(=O)(Nc1nc(-c2cccc(-n3cnnn3)c2)cs1)c1cncc(F)c1 727249713 DDQHFPOPDVPDBT-UHFFFAOYSA-N 403.424 2.121 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(NC(=O)OC)c3)nc12 728656329 GIANMFXMDOQZRU-UHFFFAOYSA-N 414.374 2.147 10 20 HECD CCC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730194948 ZIVRWGUGBQRTJS-SFHVURJKSA-N 404.530 2.232 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097697 VWAAWRWBEIRJNI-UHFFFAOYSA-N 407.474 2.459 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)c1 743335862 COOXOISXPYCYQJ-LLVKDONJSA-N 424.475 2.281 10 20 HECD CN(C)[C@@]1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCSC1 748620463 XUTSUOQZQFCMDO-OAQYLSRUSA-N 406.596 2.132 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4ccccc43)cc2)C1 748626360 LMBOSTYLSBJZMW-VQIMIIECSA-N 406.486 2.131 10 20 HECD Cc1ccc(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 748865437 WPFPDZUALBNKNW-UHFFFAOYSA-N 404.488 2.351 10 20 HECD O=C(CN1CCc2ccc(F)cc2C1)NCc1ccc(N2CCOCC2)c(F)c1 749448721 KIKLYJLPVQWEBG-UHFFFAOYSA-N 401.457 2.476 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1 750334835 FBBBCQGCPUSKJJ-MRXNPFEDSA-N 424.862 2.379 10 20 HECD CO[C@]1(C)C[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 752074233 DWBZHAGWVOGKKM-SIKLNZKXSA-N 407.530 2.414 10 20 HECD COC(=O)c1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 759222665 SMVUODSCLFNIIE-UHFFFAOYSA-N 400.450 2.432 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@@H]4C[C@@H](C)CCN4C3=O)CC2)cc1 760952874 WDQJLLOGCSVYQJ-PXNSSMCTSA-N 400.523 2.270 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNc3cc(N4CCCC[C@@H]4CO)ncn3)cc2)C1 764782713 HZJHAROFGGEXFU-AZUAARDMSA-N 424.549 2.142 10 20 HECD CCOC(=O)[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 767025953 AZQDJMLUWQXHGV-GQIGUUNPSA-N 421.513 2.083 10 20 HECD CCOC1CC(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)(N2CCOCC2)C1 767861864 SYMQZLZBQIUODI-FEPNQTLGSA-N 404.555 2.383 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CCO)c3ccco3)cc2F)C[C@@H](C)O1 769220961 JKVIGRMMIWUAQB-JTDSTZFVSA-N 419.497 2.362 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCSCC(F)(F)F)cc2)C1 769732849 PJQGBUULHAMMLP-AWEZNQCLSA-N 418.485 2.483 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cc(Br)cn(C)c1=O)c1ccc(N(C)C)cc1 773855290 FRWPMMSTSPTSMM-LLVKDONJSA-N 421.295 2.030 10 20 HECD CCC[C@@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780161270 DBWZNUCHFQPJAK-QZTJIDSGSA-N 422.497 2.417 10 20 HECD CCCCNC(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407361 IPBOJYARUTWUMK-UHFFFAOYSA-N 412.489 2.328 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](CO)O[C@H](C)C2)c(C)n1-c1ccc2c(c1)OCCO2 787315079 UHBIMCFIDCCPJO-QAPCUYQASA-N 400.475 2.130 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C 789779703 ZHJWOFBWJUBIQP-GUYCJALGSA-N 413.474 2.169 10 20 HECD Cc1ncsc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822515 WXLKVXXKIXCRGO-CHWSQXEVSA-N 420.510 2.137 10 20 HECD C[C@@H](Cc1ccsc1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844338 RCODRCCUQWPSDY-AWEZNQCLSA-N 419.522 2.212 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 793406334 RNJSKWGPXUGEPD-UHFFFAOYSA-N 409.416 2.214 10 20 HECD CC(C)N(C)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248514 DQRNZDVQBIIZBI-QGZVFWFLSA-N 414.572 2.493 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c(O)c1 797389259 XLJISOUXBLLLNE-UHFFFAOYSA-N 407.430 2.318 10 20 HECD CCN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCNC1=O 799445582 PPKPGXHDFXOAAI-MBFWDRTGSA-N 423.585 2.467 10 20 HECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 799763251 DRCGBVYSLIXTAT-UHFFFAOYSA-N 404.488 2.178 10 20 HECD CO[C@@H](C)CS(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 799820511 NTRMGMOQNLHBEL-WMLDXEAASA-N 415.556 2.273 10 20 HECD Cc1ccccc1N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806276175 KATGJJMOWWVBLF-UHFFFAOYSA-N 404.561 2.399 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(C4CCCC4)nc3N)cc2)C1 806538984 CJHMZEINAPGXNP-KRWDZBQOSA-N 422.533 2.348 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1COC2(CCC(C)CC2)O1 806703752 MPVFZFYMDYIBGN-WDALLZDZSA-N 403.523 2.115 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CCN(C2CCOCC2)C1=O 806904958 SYTPFNMJXDCHLZ-CQSZACIVSA-N 402.278 2.278 10 20 HECD CN1C(=O)c2ccc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)cc2C1=O 807512958 DJYYDQVSNYHPJV-UHFFFAOYSA-N 422.224 2.180 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC2(CC2)C1 807771110 RRFZMERYULNVFO-OAHLLOKOSA-N 423.460 2.012 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc(COC(C)(C)C)on1 807887548 UDASIZCLQNNWFW-UHFFFAOYSA-N 402.495 2.331 10 20 HECD CS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)c(F)c1 808114379 WIZOESOEIWQRJC-UHFFFAOYSA-N 412.823 2.496 10 20 HECD Cc1cnc([C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 808822763 DTJNNJJAJOMEBX-HNNXBMFYSA-N 416.547 2.166 10 20 HECD CCOc1ccc(O)c(CN(CCN)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 809728390 VOPCKBRVXZMFSE-UHFFFAOYSA-N 409.464 2.068 10 20 HECD COCCn1c([C@@H]2CCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 812115452 CODZBBVRNOIESI-QGZVFWFLSA-N 401.511 2.154 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c[nH]nc3C(C)(C)C)CC2)cc1 815320087 FSFOATGMHZIPRI-UHFFFAOYSA-N 400.479 2.221 10 20 HECD CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 920635066 CFSNAWRXVWMUHU-LBPRGKRZSA-N 420.443 2.150 10 20 HECD CCOc1ccc(N2CCN(C[C@@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 1319613682 CDLYDYRJETUOQA-OAQYLSRUSA-N 404.532 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccnn3C[C@@H]3CCOC3)CC2)cc1F 1342972178 RHMIOBGFAFRJGT-HNNXBMFYSA-N 403.458 2.421 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1ccco1)c1cc(O)c(O)c(Cl)c1 1792596704 UPYDNZUZGBRBNK-YFQWEKLQSA-N 420.849 2.330 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCCC1)C2)c1cc(O)c(O)c(Cl)c1 1799770830 MIDMZWWROJTJJB-XOIINTDNSA-N 408.882 2.145 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1cccnc1)c1cc(O)nc(O)c1 1803167647 PGOBGDKSPSKTJL-BCDXTJNWSA-N 410.474 2.163 10 20 HECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cs1 1843441437 XFXRMEFBDRAZKV-UHFFFAOYSA-N 423.498 2.061 10 20 HECD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845899200 AODAFLPPOVLYEK-CQSZACIVSA-N 413.449 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(OC)cc3[N+](=O)[O-])CC2)cc1 4894266 LLVWWWLGVKHJFF-UHFFFAOYSA-N 401.419 2.340 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](N4CCCC4)C3)cc2F)CC1 303250145 AQUACAPTYHXFRM-LJQANCHMSA-N 403.546 2.347 10 20 HECD CCCCS(=O)(=O)N1CCC(C(=O)N2CCOc3cc(N(C)C)ccc32)CC1 437011802 XNYMJZDRWMUNKL-UHFFFAOYSA-N 409.552 2.320 10 20 HECD Cc1c(N)cccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 728359597 HLWZSJNNZDPIAZ-UHFFFAOYSA-N 401.438 2.026 10 20 HECD C[C@@H](c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1)N1CCOCC1 729784815 ULMVLKKKBMCUHK-KRWDZBQOSA-N 410.518 2.401 10 20 HECD COC(=O)Cn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4ccccc4)c3C)cnc21 731565761 APYKKIKAXDFYEG-UHFFFAOYSA-N 419.441 2.056 10 20 HECD C[C@H](C(=O)NC(=O)NCc1ccccc1)N(C)Cc1ccc(N2CCOCC2)cc1 741737020 XVXGTOAPQNFWCF-GOSISDBHSA-N 410.518 2.370 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)COc2ccc(S(N)(=O)=O)cc2)cc1 749716513 IOICUQWYEUTDOJ-UHFFFAOYSA-N 405.520 2.218 10 20 HECD CCN1CCN(CCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 750872480 MUZXUSWIUPKTOC-HDICACEKSA-N 406.546 2.083 10 20 HECD CNC(=O)CCCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753210377 YBNZGHUGEKSKLU-CQSZACIVSA-N 407.470 2.247 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@]3(CCc4ccccc43)C2)c1 753855094 XROWFLBZHXYSRN-HXUWFJFHSA-N 402.472 2.078 10 20 HECD CC(C)(CC(N)=O)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 754783903 RPUVGXGUKWLOAM-FMIVXFBMSA-N 411.574 2.500 10 20 HECD C[C@](O)(CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 756330723 XRAYRODAMIRWAW-QHCPKHFHSA-N 407.422 2.495 10 20 HECD CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCCCSc1nccs1 759589583 JXVAKDDQWFKAAD-ZDUSSCGKSA-N 406.599 2.129 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCOC2(CCOCC2)C1 769036122 WXWSKMDMAZUUNU-KRWDZBQOSA-N 421.513 2.314 10 20 HECD CC(=O)C[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770087926 TXAPFCYIRMKZRO-LLVKDONJSA-N 421.431 2.199 10 20 HECD Cc1cc(Br)cc(CN2CCN(c3ncccc3C(N)=O)CC2)c1O 775652775 SPFNKPSCKOSEEP-UHFFFAOYSA-N 405.296 2.279 10 20 HECD COc1ccc(O)c(CN2CCC[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)c1 775665619 GJAGNVKQTUZWMD-HNNXBMFYSA-N 407.511 2.254 10 20 HECD Cc1cc(Br)cc(CNCCS(=O)(=O)NC[C@@H]2CCCCO2)c1O 776190350 SHNVCVRCYNLZOM-HNNXBMFYSA-N 421.357 2.041 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@H](n2cncn2)C1 776857190 XCQXGHFOBLQOSU-INIZCTEOSA-N 424.427 2.290 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc4ccccc4[nH]3)CC2)cc1 778269580 NQDLDHFHMWEDTB-ZHACJKMWSA-N 419.485 2.093 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(-c2cc[nH]n2)cc1 780042722 FMTDZKIYGMNPKQ-UHFFFAOYSA-N 423.448 2.307 10 20 HECD CS(=O)(=O)c1ccc(OCCCC(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 783264717 NIVVWFVTRUFNBJ-UHFFFAOYSA-N 408.428 2.086 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCOC4=O)cc3)cc2)CC1 786261998 IDGPMVGWEJBUAS-UHFFFAOYSA-N 422.485 2.242 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/c3ccc4c(c3)OCO4)cc2)CC1 786263460 XDVMRKVTNBWTFD-WEVVVXLNSA-N 407.470 2.413 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1N1CCNC1=O 787497620 FPNKPOCONPJCGZ-UHFFFAOYSA-N 419.485 2.156 10 20 HECD Cc1ccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788313402 SRKBUVXHUYQDTE-NRFANRHFSA-N 407.514 2.464 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1 788974128 CSOJOIXUKDDGIF-LJQANCHMSA-N 414.550 2.056 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1COCCN1C1CCCC1 789986782 OFGGSAAUTNQUGJ-NRFANRHFSA-N 405.514 2.046 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)[C@@H]3OCCc4sccc43)nc12 795481874 RJXYUBMUSOWSLF-GTNSWQLSSA-N 402.476 2.465 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OCCO 798329495 HZHJXFQJZCEYSF-UHFFFAOYSA-N 418.465 2.097 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)cc1 803306964 VPKMZINNLGMETL-MJGOQNOKSA-N 423.513 2.383 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803679798 VYYHDBKJTHQHBC-SFHVURJKSA-N 414.550 2.199 10 20 HECD C[C@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccccc1 803688616 WULJYJRDXUMFCK-UWJYYQICSA-N 409.530 2.356 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)Cc3c(C)noc3C)CC2)cc1 804318928 VUXAXJFHCSNLLE-AWEZNQCLSA-N 414.506 2.132 10 20 HECD COc1ccc(N2CCCN(c3nnc(C(=O)Nc4ccccn4)n3C)CC2)cc1 809866202 ODQCFUFZGJWJDS-UHFFFAOYSA-N 407.478 2.188 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc1C 810444892 ALZJRIOIECJYHC-UHFFFAOYSA-N 402.516 2.483 10 20 HECD CO[C@](C)(C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 812656125 GNVURERTNLQZBH-DFFLPILJSA-N 422.497 2.414 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CC(=O)N(c2ccccc2F)C1 812877589 AUVWDFRCJQIZFZ-KRWDZBQOSA-N 412.465 2.267 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1-c1ccccc1 917709592 RHFMZECLJFNOTJ-UHFFFAOYSA-N 422.460 2.447 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2 918204068 OPRADKLDCFHYSY-HXUWFJFHSA-N 409.534 2.350 10 20 HECD Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 919808926 NUHPZLHIKUWTAR-UHFFFAOYSA-N 414.487 2.496 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OC)c(OC)c1OC 1254761892 UTDQFRBKFRIJRA-AWEZNQCLSA-N 419.430 2.028 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccccc3)cc2F)C[C@@H](C)O1 57373896 UTJMZNJGJRTUSK-IAGOWNOFSA-N 413.493 2.414 10 20 HECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cn1 138469617 HFKOBSXRBWOSMB-UHFFFAOYSA-N 404.474 2.213 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 730808971 UVUYSFGWHGZXMH-LMMKCTJWSA-N 407.530 2.414 10 20 HECD C[C@@H](NC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 734271871 MWCJNGGOBOTNKX-QUCCMNQESA-N 415.582 2.052 10 20 HECD COCC[S@](=O)Cc1cccc(NS(=O)(=O)c2cccc3nsnc23)c1 735027862 MBAIMEZGYFHACC-VWLOTQADSA-N 411.530 2.387 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC3CCOCC3)cc2F)C[C@@H](C)O1 735358683 BSHZUAOYGUXEHQ-IYBDPMFKSA-N 422.497 2.415 10 20 HECD C[C@]1(c2ccc(CNC(=O)NCc3ccc(N4CC=CC4)cc3)cc2)NC(=O)NC1=O 741086259 YHUHGMATPRHVEN-HSZRJFAPSA-N 419.485 2.117 10 20 HECD COc1ccc(N(CCNS(=O)(=O)c2cnn(C)c2)Cc2ccccc2)cc1 744385792 OWZMLOOJYJNCJD-UHFFFAOYSA-N 400.504 2.414 10 20 HECD C[C@@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc(F)ccc1O 756713010 UGHMZKYPEQQMPA-WBVHZDCISA-N 401.486 2.478 10 20 HECD COc1cc2c(cc1/C=C1\SC(=S)N(CCCN3CCOCC3)C1=O)OCO2 758818262 CZJDGSGMXOBCGL-YVLHZVERSA-N 422.528 2.347 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN4CCCC[C@@H]34)CC2)cc(OC)c1OC 759254501 PUSQKCKZKLYVFF-ROUUACIJSA-N 418.538 2.171 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CN(C4CC4)C[C@H]3C)CC2)cc(OC)c1OC 759286113 BQFRJKYWPDZRFP-QAPCUYQASA-N 418.538 2.027 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)ccc1O 763433809 ZJXZMUXNRQYVPD-UHFFFAOYSA-N 408.407 2.266 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@H](CO)OC[C@@H]3C)c2C)cc1 766945055 PCKXEMGLEKYBMH-HNAYVOBHSA-N 400.475 2.145 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1NC(=O)CCN(C)C 767045249 FTXKQXWQYYHHNW-UHFFFAOYSA-N 403.464 2.222 10 20 HECD COc1ccc(S(=O)(=O)N2CCCN(Cc3cccc(OC)c3O)CC2)cc1 770356772 YPQUEGMZDSSXDY-UHFFFAOYSA-N 406.504 2.306 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(C(C)C)c3C)CC2)cc1 771181394 MBMMQFVFDXLOHV-UHFFFAOYSA-N 400.479 2.287 10 20 HECD COCCc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)n(C)n1 783317252 OZSKJZGCLOVLGJ-UHFFFAOYSA-N 401.511 2.051 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 784509654 HKGHSSWQAVBAMX-LMMKCTJWSA-N 402.539 2.393 10 20 HECD CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785293714 IBHJUSPTOURMSN-SMJHDNPOSA-N 412.442 2.360 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](O)Cc1cccc(OC)c1 785625502 QHRGWFXSUMKTGI-GOSISDBHSA-N 407.850 2.159 10 20 HECD Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 786225515 VSDYKDDMQFSYCF-LJQANCHMSA-N 415.509 2.498 10 20 HECD COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786762549 TUDWVYAUECCAQN-HNNXBMFYSA-N 415.465 2.165 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(Cn2cccn2)c1 788908755 AHFYJPKBSNPDHQ-UHFFFAOYSA-N 417.513 2.464 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccccc2C(F)(F)F)ccc1O 790407553 NGPMATQOTLCTBJ-UHFFFAOYSA-N 410.395 2.120 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 790836150 PYOXVHOLYAWECH-OAHLLOKOSA-N 421.494 2.015 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCC(=O)N2 796765912 ZQHUQWREKORTPR-OAHLLOKOSA-N 415.515 2.103 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1 797430797 AREIXHRFXDFGHN-UHFFFAOYSA-N 420.310 2.126 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(Cl)c(-c3nn[nH]n3)c2)cc1F 799766369 XVHLQPAOMUNLCP-UHFFFAOYSA-N 410.862 2.204 10 20 HECD C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803300337 RHUZZOYAKYNKRU-HOTGVXAUSA-N 416.547 2.419 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803307525 HIXZVAPIYMOIFH-LSDHHAIUSA-N 414.506 2.053 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3nccn3C(F)F)CC2)cc1 804318550 NONOAULSYDIURF-UHFFFAOYSA-N 421.448 2.030 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC3(CCOCC3)C2)cc1F 804853279 VRPGGNNJSBEURF-UHFFFAOYSA-N 423.554 2.413 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(-n2ccnn2)c1 806140763 ZYFOAFMPDUSVAV-KRWDZBQOSA-N 411.531 2.353 10 20 HECD COCc1nc2n(n1)C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)CC2 806953444 AIBBCUCFJMRZRW-NSHDSACASA-N 400.266 2.251 10 20 HECD COc1c(C)cnc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1C 807290410 IPEZQCDCCUJNLN-UHFFFAOYSA-N 408.502 2.358 10 20 HECD CC(=O)Nc1ccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 807888844 XJCNXLLRVMWNOO-UHFFFAOYSA-N 422.441 2.184 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(Cl)c(S(C)(=O)=O)c1 821199390 WJHWYHOXZCPCQT-UHFFFAOYSA-N 419.864 2.037 10 20 HECD CN1CCCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)CC1 918246410 NKAGXNOITCVCKX-UHFFFAOYSA-N 409.534 2.149 10 20 HECD C[C@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 1341765096 CZNJMJBTXVPEAI-INIZCTEOSA-N 420.529 2.235 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)F)c1)c1cc(O)nc(O)c1 1794568153 ZGOLVEXDNKDSOE-BTTYYORXSA-N 418.400 2.391 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715574 UHYGTSNEZOCKFL-RLDUGPAZSA-N 409.914 2.376 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423818 JMKXFEZGTOYCKQ-APWZRJJASA-N 419.522 2.133 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2ccccn2)C1 1842117807 LMXACQMYFUOPIW-RMKNXTFCSA-N 423.469 2.048 10 20 HECD O=S(=O)(Cc1ccccc1CNCc1ccc2c(c1)CCO2)N1CCOCC1 238026893 ZFTOFJOSJHOQFZ-UHFFFAOYSA-N 402.516 2.073 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnc2n(c1=O)CCS2 726566054 XNYYBKJVRNNQHC-UHFFFAOYSA-N 422.457 2.349 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)COC3)cc1OC 727719643 JFVYAKFLSOIOLB-UHFFFAOYSA-N 412.489 2.288 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnn(C)c3-n3cccc3)cc2F)CC1 730235405 WMPABZAIPFYNHV-UHFFFAOYSA-N 410.497 2.422 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1 735272469 APBGQEWGLHFQQW-UHFFFAOYSA-N 413.503 2.463 10 20 HECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@](CC)(c3ccccc3)C2=O)cc1 739922923 RKSNHIHCJSBPQA-JOCHJYFZSA-N 410.474 2.410 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(N2CC=CC2)cc1 740681212 ZQYIOJNYDRUAMT-UHFFFAOYSA-N 402.498 2.372 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)cc1F 746654958 PNSOHZAWVGKUJA-UHFFFAOYSA-N 419.482 2.078 10 20 HECD Cc1nccn1C[C@@H](C)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 749196929 VKTTYXPWBBHNII-QFBILLFUSA-N 412.538 2.029 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] 749915125 ARCOWUYQJYUSIN-UHFFFAOYSA-N 423.878 2.413 10 20 HECD COc1ccc(N2CCN(CC(=O)NCCOc3cccc(C)c3)CC2)cc1F 753860601 KEYUFJLPPSXQOQ-UHFFFAOYSA-N 401.482 2.460 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccn(CCc2ccncc2)n1 759034733 GGFOQJIZBDTGGK-UHFFFAOYSA-N 416.532 2.214 10 20 HECD CC[C@H](C)N(C)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759268734 WSRZGXFQPGBZQF-INIZCTEOSA-N 408.543 2.274 10 20 HECD C[C@H](OC(=O)CC1(CO)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759962183 QYZOIBFZKUCDAB-ZDUSSCGKSA-N 407.422 2.495 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(O)(C(F)(F)F)CC2)c1 760283558 DGXUZCISEVTLRP-UHFFFAOYSA-N 416.440 2.316 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc2c1OCCO2 765904313 QRIIYQQUXVLBGN-UHFFFAOYSA-N 407.220 2.181 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccnn1-c1ccccc1 768026971 XIBAJGHGVWLLJL-UHFFFAOYSA-N 419.485 2.306 10 20 HECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1NC(=O)CCN(C)C 768032328 AYEPNOBJAVFPAY-UHFFFAOYSA-N 412.490 2.188 10 20 HECD CCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769783077 COIPINMGGONRDF-CQSZACIVSA-N 406.460 2.066 10 20 HECD C[C@@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 773105292 VIMPTPWLNUJJDJ-HUUCEWRRSA-N 401.960 2.109 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C 773760256 FTHBGCQVYXYWCU-LFVRLGFBSA-N 423.469 2.144 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3)cc2F)C[C@H](C)O1 774458156 KGYUESDEGXTSRZ-IRXDYDNUSA-N 413.493 2.414 10 20 HECD Cc1cc(Br)cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)c1O 775650217 RLNVYUHMJHBEJG-UHFFFAOYSA-N 405.296 2.279 10 20 HECD C[C@H](N[C@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)c(F)c1 777116561 SNUVDASAIWAQNA-VCBZYWHSSA-N 401.486 2.240 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CC(C)(C)O)C[C@@H]3C)CC2)cc1 780386518 AKOAGHUUZSTSHO-KRWDZBQOSA-N 404.555 2.151 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1C(F)(F)F 788583601 ULOBBMUPMJSANB-UHFFFAOYSA-N 413.421 2.265 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCc3cn4c(n3)CCCC4)cc2)CC1 788847161 SJMSRPXIFQGFQT-UHFFFAOYSA-N 423.561 2.431 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnn3-c3ccccc3)cc2)CC1 791725258 WCWZUYXACZEDPB-UHFFFAOYSA-N 403.486 2.471 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cc3c(cc2OC)NC(=O)CO3)cc1 797442502 AMVKAYLGKSICKO-UHFFFAOYSA-N 419.503 2.351 10 20 HECD CCOC(=O)[C@@]1(COC)CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 799199012 NITWJKODPCSELT-QFIPXVFZSA-N 405.539 2.003 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)c2ccc(Cl)cc2S1(=O)=O 800841531 IJWIFWIZHPZQTI-UHFFFAOYSA-N 421.906 2.209 10 20 HECD CCS(=O)(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 840951828 CGVGESNJMVPTCC-UHFFFAOYSA-N 417.531 2.250 10 20 HECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 918199579 IJTONFNBIRCPQK-CALCHBBNSA-N 422.545 2.349 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CNC(N)=O)C3)cc2F)C[C@@H](C)O1 918219309 IKCOFOVKGFZLRB-HLLBOEOZSA-N 421.517 2.029 10 20 HECD C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 919821622 MWRMKWDZQMKRRV-RHSMWYFYSA-N 403.504 2.329 10 20 HECD COCCN1C(=O)/C(=C\Nc2nc(-c3ccccc3)c(C)s2)C(=O)NC1=S 920978627 NEHBXPRFGJJJFN-RAXLEYEMSA-N 402.501 2.304 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCN4CCC[C@H]4C3)CC2)cc1 1252063588 PCMKXZUZOSLTJZ-NRFANRHFSA-N 415.582 2.087 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848385 GXIRMCBKCBXBDM-ABAIWWIYSA-N 415.450 2.137 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)C1CC1)CC2 1828200022 IWGOXQXZJBZJJI-WNPFHQFXSA-N 415.471 2.295 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCC(NS(C)(=O)=O)CC3)c2C)cc1 115410057 YNZBVAJONFHMOW-UHFFFAOYSA-N 405.520 2.257 10 20 HECD CS(=O)(=O)c1cccnc1N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1 480829461 NLYHAHQOQLCJHL-UHFFFAOYSA-N 411.483 2.308 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(N(C)C(C)=O)cc3)CC2)cc1 726728587 VTZQKLVTUVBYMG-UHFFFAOYSA-N 424.501 2.402 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CSC[C@@H]3CCCCO3)cc2)C1 727308621 QBUWRDASRSPELI-MJGOQNOKSA-N 405.564 2.307 10 20 HECD CN(C)c1ccc(/C=C2\N=C(c3cccc(S(=O)(=O)N(C)C)c3)OC2=O)cc1F 727657808 APRCRDCOCFJBOY-BOPFTXTBSA-N 417.462 2.487 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CCN(C)C)cc1)c1ccc(N2CCOCC2)cc1 728141351 NPURDEWZQGWQBM-SFHVURJKSA-N 424.545 2.443 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1 729066640 OCFOJJZESYSKQN-LLVKDONJSA-N 404.419 2.243 10 20 HECD Cn1cc(C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c(=O)n(C)c1=O 735154003 UUKGIBGLGZBMFC-UHFFFAOYSA-N 421.413 2.295 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)cc1 737484726 TVGAQOSATBWEPS-UHFFFAOYSA-N 423.517 2.059 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1 743639606 WULBXHSOOKZXFL-JKSUJKDBSA-N 413.474 2.441 10 20 HECD CCc1cnc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 743693044 IMVCUMSBOMEGSM-HNNXBMFYSA-N 401.536 2.407 10 20 HECD Cc1cc(C(=O)CN(C)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 746288279 VYSHXLAZMDLJRN-KRWDZBQOSA-N 418.515 2.167 10 20 HECD CCN1CCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751059847 LNPXYISEEHWVBD-UHFFFAOYSA-N 409.533 2.469 10 20 HECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 752809948 ZZZCLJJCTPIDSR-PWIZWCRZSA-N 413.518 2.045 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 754133384 HXYUXCNEIOUPHV-UWJYYQICSA-N 414.506 2.437 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cccnc2N2CCC(C(N)=O)CC2)c1 756534486 KXIOHTSKLVVMDJ-CQSZACIVSA-N 412.490 2.126 10 20 HECD COC(=O)c1ccccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758226208 WIULXOFVGQQMIT-GOSISDBHSA-N 400.475 2.044 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)CC1(C)OCCO1 758704478 ZIFAXGWVAORYAJ-KRWDZBQOSA-N 405.539 2.484 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21 760491006 DYYZMAIRZMFIDB-QKFKETGDSA-N 412.486 2.220 10 20 HECD CCN1C[C@H](C)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H]1C 766252515 GWWJJWYFSVPKTD-XWSJACJDSA-N 420.573 2.470 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1 769027679 NJGJMLIRCTVESL-ZSEKCTLFSA-N 403.479 2.469 10 20 HECD CCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774358071 FQVBTENQUHCSGH-HXUWFJFHSA-N 422.529 2.053 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](CC(C)C)c2nc(-c3nc[nH]n3)no2)c1O 775048277 QFEHMMTXUCHNII-LLVKDONJSA-N 403.399 2.354 10 20 HECD Cc1cc(C(=O)CN2CCO[C@H](C(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778243053 QWUUHDDZDNSPEW-NRFANRHFSA-N 419.547 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(CC(C)C)c3)CC2)cc1 781688379 BDWDJJHOUUUYJJ-UHFFFAOYSA-N 400.479 2.053 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1ccc(=O)n(CC)c1 785193345 XKGDHRHKXHTHKD-UHFFFAOYSA-N 422.279 2.324 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCN3CCc4ccccc4C3)ccc21 787719616 USVYTCORPIBAHY-UHFFFAOYSA-N 420.557 2.250 10 20 HECD CNC(=O)c1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 787860710 BYHBUPQLCCUDIP-UHFFFAOYSA-N 422.529 2.311 10 20 HECD O=C(c1cccc(O)c1O)N1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1 790920806 DSZIFOXBNGKVCW-LJQANCHMSA-N 409.486 2.047 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncsc1C(F)(F)F 792067163 SDTVJQFGALLORK-UHFFFAOYSA-N 419.450 2.327 10 20 HECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1 799231415 LIDAOENVKHSJPR-STQMWFEESA-N 417.441 2.338 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](S(N)(=O)=O)C3)cc2Cl)C1 799993993 MTORUXNVYIFTQR-ZFWWWQNUSA-N 414.959 2.149 10 20 HECD CCn1c([C@@H](C)OCCOC)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801830187 PWKGPGLDQABZLX-QGZVFWFLSA-N 403.527 2.495 10 20 HECD Cc1csc([C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 803304062 COKCJRDWPMJXEK-GOEBONIOSA-N 416.547 2.385 10 20 HECD C[C@@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccccc1 803665063 WFBDVUVXTICBDM-CRAIPNDOSA-N 401.482 2.179 10 20 HECD CN(CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)CC(F)(F)F 804139196 NMKQIOPTYQQTJE-UHFFFAOYSA-N 413.396 2.124 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2C2OCCO2)cc1F 804852113 ZTAAEJIWDKKMDI-GOSISDBHSA-N 407.486 2.042 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1(N(C)C)CCC1 807029143 PYGIUWBSPKEXEZ-UHFFFAOYSA-N 412.328 2.104 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(CCc2cccs2)CC1)c1ccc(N(C)C)cc1 807672229 ADZOKZJKFNKEPE-KRWDZBQOSA-N 414.575 2.378 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)C2CCCCC2)CC1)c1ccc(N(C)C)cc1 807675676 ZPMQFJLWEXFEGT-QGZVFWFLSA-N 414.550 2.181 10 20 HECD C[C@H]1[C@H](C)CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851779 KLBSRWSQLAYUOX-MOPGFXCFSA-N 412.578 2.482 10 20 HECD CC[C@H](O)c1nccn1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 810004546 VSLFNKJMIAWCRU-CLCXKQKWSA-N 404.486 2.396 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1[N+](=O)[O-] 916676200 BUVUPTBHYDORAE-UHFFFAOYSA-N 403.460 2.068 10 20 HECD CN(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918438448 PFZVCCVDBAVBOA-UHFFFAOYSA-N 414.481 2.108 10 20 HECD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 919863627 OHUSUEHJUJWCPP-OAQYLSRUSA-N 424.480 2.057 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)c4ccc(C)cc4C3=O)CC2)cc1 920089331 ZYXBPZPZBHIMTD-INIZCTEOSA-N 407.470 2.337 10 20 HECD COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 921208464 CPJUKODWQWUYEN-GOSISDBHSA-N 409.446 2.404 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccnc2)no1 138516435 SKNAJNQMDUXGNA-JTQLQIEISA-N 404.404 2.127 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCn1c(=O)oc2ccccc21 303354617 ZDVFHHFJKGEIJO-UHFFFAOYSA-N 410.474 2.273 10 20 HECD O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)NCC(=O)N1CCCC1 727143434 USYBQDCWHUMGEI-UHFFFAOYSA-N 415.515 2.265 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cn3cc(Br)cn3)cc2F)CC1 730194000 HXQNVDCTXIMLHK-UHFFFAOYSA-N 424.318 2.243 10 20 HECD O=C1c2ccccc2C(=O)N1C[C@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 732203393 RYOKBLPDELUVTM-MSOLQXFVSA-N 410.470 2.030 10 20 HECD COc1ccc([C@H](CO)N(C)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 733195260 ILKMBUSGWCBDEH-QFIPXVFZSA-N 413.518 2.018 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735517409 ARAGMOMUNDXAGB-QGZVFWFLSA-N 424.501 2.334 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H](c1cccc(F)c1)N1CCOCC1 742054666 CXCUIQJYGJTQCZ-JOCHJYFZSA-N 413.493 2.352 10 20 HECD CC(=O)NC(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742751574 VGLKUULHXGBMSI-QGZVFWFLSA-N 406.527 2.349 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(C)nn2C2CCOCC2)c1 746396938 XNSBUSMNCXVQBH-ZDUSSCGKSA-N 402.451 2.073 10 20 HECD COCCN(Cc1csc(CS(C)(=O)=O)n1)c1ccc(OC)c(OC)c1 746474655 KNWUSAIYYXZXQB-UHFFFAOYSA-N 400.522 2.358 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1 749140311 BLMRGQCMLHYDCJ-UHFFFAOYSA-N 402.425 2.086 10 20 HECD Cc1ccccc1Cc1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 750883393 FYEVKLJYKFUFTM-UHFFFAOYSA-N 417.443 2.403 10 20 HECD COc1ccsc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227416 IGTBFBOZSKFLFI-UHFFFAOYSA-N 400.497 2.335 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CSCc1cc(=O)n2ccsc2n1 753640279 NKCSDJCDGQGWFU-NSHDSACASA-N 405.501 2.148 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1cccc(F)c1I 758993792 UJFFEFYRPVPVBV-UHFFFAOYSA-N 414.174 2.391 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 759500762 WUZWXUAWALIFQO-AWEZNQCLSA-N 419.494 2.333 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cn(C)c(Cl)n3)cc2F)C[C@@H](C)O1 769894433 YZEWTGKWCFICPC-TXEJJXNPSA-N 416.906 2.305 10 20 HECD COc1ccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 771056576 IWAFFJWIEXIMCR-UHFFFAOYSA-N 418.431 2.004 10 20 HECD O=C(c1cccc(O)c1O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 776317601 HXZVMIRMBMILLJ-UHFFFAOYSA-N 412.467 2.398 10 20 HECD CC(=O)N[C@@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 779377523 IZFDHVXZBWTMJE-HXUWFJFHSA-N 422.437 2.104 10 20 HECD CNC(=O)[C@@H]1CN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CCO1 781547338 MXYBRUNKJBAWES-MOPGFXCFSA-N 421.457 2.181 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc(OC4COC4)cc3)cc2)C1 782092604 HXVXQNJQJAZDEI-KRWDZBQOSA-N 424.501 2.488 10 20 HECD CCN1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1=O 786711206 YNUAUGNTMNBUBF-HOTGVXAUSA-N 406.502 2.203 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CN(C)C(=O)c2ccccc21 787493953 MWTBCSNRRFSKIU-QGZVFWFLSA-N 416.861 2.417 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(c3ncc4n3CCCC4)CC2)c1 790156659 GTLCXWYIRCBVGA-UHFFFAOYSA-N 418.519 2.316 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@@]4(CCOC4)C3)cc2F)CC1 792991605 ADEAREVSSPVELT-JTSKRJEESA-N 420.529 2.057 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 803563355 YSOMCLROJPYJNY-QUCCMNQESA-N 417.550 2.136 10 20 HECD COc1cc(C)c(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC 803659010 IMEQFMVXGHIIBZ-UHFFFAOYSA-N 417.481 2.492 10 20 HECD CCc1nc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cs1 804035607 KPELOOMZIIYZPD-UHFFFAOYSA-N 416.547 2.158 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)c1cnn(C)c1 805733470 MXVTVADJGDJDTF-NSHDSACASA-N 409.284 2.114 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2nn(C)c3ccccc23)C2CC2)cc1 805744696 JRRCUTBKLPXSID-UHFFFAOYSA-N 405.502 2.447 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1 806179663 UIOQPMGNSPAKFV-RTBURBONSA-N 416.566 2.254 10 20 HECD C[C@H](NC(=O)C(=O)N1CCNC(=O)C[C@@H]1c1ccccc1)c1ccc(N(C)C)cc1 807678780 JPLXBIULLYAZRV-OXJNMPFZSA-N 408.502 2.020 10 20 HECD CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCSC1 807771868 YHQKRYCSNBHUIM-ZFWWWQNUSA-N 413.490 2.337 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC3(COC)CCOCC3)cc2F)CC1 813633471 YVWWAOYMYKSFBN-UHFFFAOYSA-N 422.545 2.210 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1Nc2ccccc2S(=O)(=O)N1 813685372 WWNAKNSOZNNBCB-AWEZNQCLSA-N 402.259 2.045 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c1 820255689 PFJLBPNOPOSIKV-UHFFFAOYSA-N 423.560 2.286 10 20 HECD C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917833561 BAEHIONGVKDOIL-LUQKVYGDSA-N 409.486 2.233 10 20 HECD CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917834787 QBDCKKMZLTUFGY-ISXGRJCASA-N 420.513 2.182 10 20 HECD COCCN(C)CCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918209479 MPNVTGQEXOLDGK-IRXDYDNUSA-N 410.534 2.207 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2cccc(S(=O)(=O)NC)c2)cc1 918212538 JEHHQUOKKCXKMX-UHFFFAOYSA-N 404.536 2.440 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCS(=O)(=O)C1 919568986 UTYXARHPWJNCPO-ZIAGYGMSSA-N 410.517 2.004 10 20 HECD CN(C)c1ccc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1 920256976 AGDGPXFPRCAUIB-UHFFFAOYSA-N 416.547 2.251 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc([C@H]2CCCO2)s1 1116669582 VFHFBWCQEUMXRC-SWLSCSKDSA-N 406.460 2.310 10 20 HECD CCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)COC1 1827429997 XMPVKOOUOYQABH-QGZVFWFLSA-N 417.506 2.153 10 20 HECD Cc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1844458033 UFWASLULGPNDFX-GQCTYLIASA-N 409.442 2.037 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COc3ccc(F)cc3)CC2)cc1 5361620 CANGQHUHBRWIHV-UHFFFAOYSA-N 402.422 2.105 10 20 HECD Cc1cc(C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c(C)n1-c1ccc(F)cc1 8362071 NUIALRITOBPQQL-SFHVURJKSA-N 401.438 2.256 10 20 HECD OC[C@@H]1CCCN(c2cc(NCc3ccc(N4CCC(O)CC4)c(F)c3)ncn2)C1 301222310 BFJNYUNABCOIAZ-QGZVFWFLSA-N 415.513 2.398 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)n(C)c2ccccc12 519215233 VUPQDJIUOWDQTD-MSOLQXFVSA-N 424.545 2.400 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726560837 RQFKLEHRZFMMFW-UHFFFAOYSA-N 403.504 2.002 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CSC[C@H]3CCCCO3)cc2)C1 727308620 QBUWRDASRSPELI-IEBWSBKVSA-N 405.564 2.307 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN4CCC[C@@H]4C3)cc2F)CC1 730117453 YJZBKZQNGQKWMG-RTBURBONSA-N 403.546 2.394 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1 734074825 VQYOEXHLMADODC-UHFFFAOYSA-N 417.425 2.390 10 20 HECD CC(C)N1CC[C@@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 734167663 YWQVLAXTAJRNLH-RVKKMQEKSA-N 406.502 2.248 10 20 HECD COCc1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740609879 OATSUHWZHSOYPG-UHFFFAOYSA-N 403.504 2.336 10 20 HECD Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NCc1ccc(N2CCOCC2)cc1 742247070 NUCFCEUCZCFLHI-UHFFFAOYSA-N 423.517 2.376 10 20 HECD CN(CC[C@@H]1CCCCN1C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745691356 JJBUYLCBLLMLEP-PMACEKPBSA-N 415.582 2.404 10 20 HECD Cc1nc(-c2ccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc2)n[nH]1 746164288 UPYZCRLTNYNUSS-UHFFFAOYSA-N 411.487 2.267 10 20 HECD CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccc(N2CCOCC2)cc1 747560537 CWULNUKWHPRSCV-UHFFFAOYSA-N 411.506 2.005 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)c(C)o2)cc1 751147205 ZQIONXGYVGQQFO-UHFFFAOYSA-N 416.477 2.327 10 20 HECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751293441 BFULKHBHQATOPP-KRWDZBQOSA-N 415.490 2.155 10 20 HECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751293477 BFULKHBHQATOPP-QGZVFWFLSA-N 415.490 2.155 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)cc1F 753370086 CCYQQFYBKJITHV-HNNXBMFYSA-N 423.485 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSC[C@@H](C)C3)CC2)cc1 754746049 SUGUJDJXMWZPNG-OZSKJFCKSA-N 403.548 2.112 10 20 HECD COc1cc(N2CCN(C(=O)NCC3(C)CCOCC3)CC2)cc(OC)c1OC 759283262 YQGVEBTZFYLDCB-UHFFFAOYSA-N 407.511 2.361 10 20 HECD CCOC(=O)CC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCCC1 760803540 BZIFNEZUFAVLPE-UHFFFAOYSA-N 412.508 2.397 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 762273919 JELKGYXTQHBABO-LJQANCHMSA-N 400.523 2.114 10 20 HECD COc1cccc(CNS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)c1O 767792834 KHINWERKLFULDY-ZDUSSCGKSA-N 411.451 2.434 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(Br)cc(C)c3=O)CC2)cc1 767832203 SBYYVLCXKUOWIO-UHFFFAOYSA-N 420.307 2.277 10 20 HECD C[C@H]1CCCCN1C(=O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 768298672 DVQJYDPXOIBSNS-AWEZNQCLSA-N 410.902 2.472 10 20 HECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1C 769400228 YTSMTIQSURZUMR-UHFFFAOYSA-N 421.519 2.123 10 20 HECD O=C1COc2ncc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2N1 770735102 ZCQMEQMDOATKMB-UHFFFAOYSA-N 418.400 2.413 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(COC4(C)CCC4)n3)CC2)cc1 771067653 NWBWLJYTWGLCPN-UHFFFAOYSA-N 400.479 2.429 10 20 HECD COc1cc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC 773987720 GRDILCKNSJTBJX-AWEZNQCLSA-N 415.490 2.386 10 20 HECD C[C@@H]1[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCC[C@H]1C 774753170 IITNFCZLUIBAOF-VCBZYWHSSA-N 405.514 2.344 10 20 HECD CC[C@@H](CSC)N(C)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778420197 RXQGQHUIQHYLBM-MQNTZWLQSA-N 405.564 2.500 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1CC(C)(C)O 780300819 KNCHANHQWGVSEW-QGZVFWFLSA-N 406.596 2.226 10 20 HECD CN(C)C(=O)CC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 781365477 QAJOLXPBNJPVKL-UHFFFAOYSA-N 420.529 2.187 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2 785293825 BRSHTOVRIRQATH-SNVBAGLBSA-N 406.822 2.208 10 20 HECD Cc1ccc(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 789800225 MLVJYDIIJHWEIP-AWEZNQCLSA-N 419.522 2.396 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCSC3)cc2F)C[C@@H](C)O1 789825425 LRYQFNPRZVPXMV-FMKPAKJESA-N 409.527 2.019 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C2 790833585 FMFWBFMNIYSFEU-OAHLLOKOSA-N 416.547 2.490 10 20 HECD CO[C@@H]1CCOc2c(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cccc21 790966019 NWAZNENEIGRBNR-KZULUSFZSA-N 400.431 2.254 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@H]7[C@@H](C[C@H]64)[C@@H]3[C@@H]75)cc2)CC1 793924069 IVRNIOZLKPWQKW-HXWNTUAVSA-N 405.542 2.365 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1C 807512702 FMLZGYVFYKOULG-UHFFFAOYSA-N 400.218 2.079 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)C1CCN(C(=O)OC)CC1 807832266 KBFHNCVDNAEUSZ-INIZCTEOSA-N 418.538 2.084 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c(O)c1 811485065 VQNCVKHMQZODBQ-UHFFFAOYSA-N 419.286 2.302 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)NCc2ccc(OC)cc2O)c1 813700271 HZUQXUXSHDTCBF-UHFFFAOYSA-N 409.460 2.202 10 20 HECD CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NCCc2ccc(O)c(O)c2)cc1 917371597 JMNONVGLLBHSBJ-UHFFFAOYSA-N 420.531 2.423 10 20 HECD COc1ccc([C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918211337 JYIIFVWIZOVXMS-FQEVSTJZSA-N 403.454 2.204 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CNC(N)=O)C3)cc2F)C[C@@H](C)O1 918219311 IKCOFOVKGFZLRB-INMHGKMJSA-N 421.517 2.029 10 20 HECD CC[C@H](C)NC(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 918228305 ICIOODUYQYYJHR-SFHVURJKSA-N 403.571 2.275 10 20 HECD CCOc1ccc(N2CCN(CC(=O)N3CCN(Cc4ccco4)CC3)CC2)cc1 1253831330 CHGLTGDBJHFEMS-UHFFFAOYSA-N 412.534 2.145 10 20 HECD O=C(NCc1cccc(Br)c1O)c1n[nH]cc1I 1339116374 PBNCMQVHJYJYRZ-UHFFFAOYSA-N 422.020 2.412 10 20 HECD CC(C)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1800499814 DFUXFOBSPFLVHE-ZSBFGKGUSA-N 410.898 2.391 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1CCC=CO1 1804286147 MSUHMOZFYYDRKA-ALDGSTNNSA-N 414.458 2.148 10 20 HECD CCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199506 WNCQSDANYRJUDC-VUQUXZKVSA-N 403.460 2.295 10 20 HECD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843249104 WPJQNFZBSKOHMW-ROUUACIJSA-N 423.469 2.122 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2ccncc2)C1 1845051034 VECDCQYDYWSNRC-UHFFFAOYSA-N 401.850 2.206 10 20 HECD CN(C)c1ccc(CNc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)cc1F 58545355 SWHMIEYLQPUFAC-UHFFFAOYSA-N 400.497 2.311 10 20 HECD COC(=O)c1c(F)cccc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 729675885 VAYMJHVCIQPLCB-UHFFFAOYSA-N 401.438 2.382 10 20 HECD CC[C@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 730191386 VRQQHKQKOLICAW-UQRISPGASA-N 423.585 2.467 10 20 HECD O=C(NCC[S@@](=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1 735095518 VEJCIDIOXHZJEF-MUUNZHRXSA-N 401.532 2.271 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1O 737285120 ZOFJCHSZADCQPI-MHZLTWQESA-N 410.879 2.188 10 20 HECD CCCCn1c(N)c(N(CC)C(=O)CN(C)c2ccc(OCC)cc2)c(O)nc1=O 739922423 KMRVIEHWQDHGJL-UHFFFAOYSA-N 417.510 2.219 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1 740494276 BGPQRUIMMKUBNI-CXAGYDPISA-N 400.431 2.384 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 740677827 RWERVXCQUQWGQC-UHFFFAOYSA-N 411.462 2.328 10 20 HECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905605 OYGRJRUAGJHHOX-UONOGXRCSA-N 419.494 2.331 10 20 HECD CC(C)OCCN1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 746415328 OEWMADIDAVSQDP-UHFFFAOYSA-N 406.596 2.492 10 20 HECD O=c1[nH]c2ccc(S(=O)(=O)N(Cc3ccccc3O)C3CCCC3)cc2[nH]c1=O 751355291 BLMKKOVSCDRYFC-UHFFFAOYSA-N 415.471 2.056 10 20 HECD CCN1C(=O)[C@H]2CN(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)CCN2C1=O 752336558 UKSRNNPQBMWXGC-LJQANCHMSA-N 412.465 2.384 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ncccc3F)CC2)cc1 752640475 GXUICBABNAXFOY-UHFFFAOYSA-N 401.486 2.241 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1F 753932098 RKBWTCIXTUWZGA-GOEBONIOSA-N 413.515 2.022 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 756576136 JZFBSKRDHOUHTE-LLVKDONJSA-N 424.441 2.391 10 20 HECD CCS(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1 760561426 QAPDQRYSTCWKDM-UHFFFAOYSA-N 400.497 2.164 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)c1 763389839 OABQVCZPRWGIIG-UHFFFAOYSA-N 408.451 2.254 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(C(F)F)c3)CC2)cc1 767890576 MIVFLDKYLNPCJI-SREVYHEPSA-N 405.405 2.130 10 20 HECD Cc1cnoc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 768613182 NPFMGYBHYXEPIR-KBPBESRZSA-N 405.426 2.209 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C2)s1 768900313 SSVCZSLRNBLRQS-OAHLLOKOSA-N 424.544 2.227 10 20 HECD CN1CCC[C@@H]1C(=O)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769533107 ODUSIPNAUSZXRO-HXUWFJFHSA-N 415.538 2.324 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 772484550 HFSXVYGWFSSPNK-ATZDWAIDSA-N 410.536 2.235 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773847784 SWVFDXWNAQBOOJ-AWEZNQCLSA-N 403.504 2.280 10 20 HECD CCCCC[C@H](C)NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 774641362 ZGBWUZICCHXOIC-INIZCTEOSA-N 421.538 2.446 10 20 HECD C[C@@H](NCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 775835219 SMWLQHWAXALPSW-OXQOHEQNSA-N 407.580 2.362 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 779498581 ITTMVHRUTZTCEO-XFFZJAGNSA-N 404.488 2.456 10 20 HECD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779498884 GJXCGVDGQBGVOU-LYASGUKUSA-N 413.449 2.422 10 20 HECD CCC[C@H]1C[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780161272 DBWZNUCHFQPJAK-ROUUACIJSA-N 422.497 2.417 10 20 HECD COCCO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 780311069 DITBVWQYVDJTDN-SOLBZPMBSA-N 409.502 2.386 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4ncn(C)n4)cc3)c2)CC1 781045625 MNSVNADJVOYTEF-UHFFFAOYSA-N 404.474 2.403 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1 784558642 BUQVBZWJTIXHKH-HXUWFJFHSA-N 416.449 2.414 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nc(C)n(-c4ccccc4)n3)cc2)CC1 786258417 DYLYAQFUPGGYQM-UHFFFAOYSA-N 418.501 2.174 10 20 HECD CCN1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 787324521 HQFBTHNYOBLMRU-HNNXBMFYSA-N 419.481 2.343 10 20 HECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 788403547 VRXWSYWXVFCUMM-KRWDZBQOSA-N 409.486 2.271 10 20 HECD COc1cc(Br)cc(CNc2cccc(C(=O)N(C)CC(N)=O)c2)c1O 790636955 CBRSKCNWSLAFSI-UHFFFAOYSA-N 422.279 2.333 10 20 HECD Cc1ccc2c(c1)CC[C@@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)O2 793124355 NHEMKPIVOZEPKK-NRFANRHFSA-N 414.527 2.240 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1 799121530 ASXBWPRHUWCCGK-UHFFFAOYSA-N 417.896 2.001 10 20 HECD CCN(CCOCCO)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 800427954 HZDOEZPRZVKCBS-OAHLLOKOSA-N 410.470 2.120 10 20 HECD O=C(NC[C@H]1CCSC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450049 CAHHQRVLJYKSJU-CYBMUJFWSA-N 413.490 2.242 10 20 HECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807103544 RRWIYAJQYBYNQZ-HKUYNNGSSA-N 416.566 2.221 10 20 HECD C[C@@H]1CN(C[C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 807674742 QCNFSGLSDRFSCD-IKVWTGGYSA-N 416.566 2.030 10 20 HECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)NCCCO 864049547 JMHIJRHUDGVKTN-XYOKQWHBSA-N 415.334 2.149 10 20 HECD CCc1nnc(S[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 864238142 VLGCPRKTDOQITO-LLVKDONJSA-N 421.482 2.449 10 20 HECD COC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 919970432 BJEUFVJTFQWUSU-UHFFFAOYSA-N 403.454 2.448 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(F)(F)F 1795842075 JGEUSJMFDFQTLB-JHURRJJJSA-N 414.380 2.407 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824546142 KNDKUDCUIDPLAV-JNAXZKDPSA-N 419.522 2.133 10 20 HECD O=C(CCc1cccnc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039136 SZAJGNPKJGYMLS-RMKNXTFCSA-N 423.469 2.048 10 20 HECD CS(=O)(=O)Cc1cc(F)ccc1NS(=O)(=O)c1cccc2nsnc12 531588749 PGGDPYWMKXQALJ-UHFFFAOYSA-N 401.466 2.176 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2OC(F)F)SC1=S 727177328 GPDHEIJJMUNTFP-FLIBITNWSA-N 408.473 2.038 10 20 HECD CC(C)(C)n1cnnc1SCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 727654334 BSUYJBPNFNNAKT-UHFFFAOYSA-N 407.515 2.417 10 20 HECD CCCCCS(=O)(=O)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 728068192 FNEWKXPCKTUBPO-UHFFFAOYSA-N 400.516 2.008 10 20 HECD COC(=O)NC(C)(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729177291 OIDFXEBNFXPFTR-UHFFFAOYSA-N 403.401 2.293 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(N(C)C)cc2C)n(C)c1 734404066 FESLBCBTZAUTDG-UHFFFAOYSA-N 406.552 2.360 10 20 HECD CN(CCCO)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 741078166 DNUDDNOSNGDEGM-UHFFFAOYSA-N 406.596 2.228 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc2n(c1=O)CCS2 742799887 DWMYFVVLBKTUNJ-LBPRGKRZSA-N 422.457 2.349 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 748481419 KTLDRYTWIZHYNY-UHFFFAOYSA-N 408.502 2.179 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)s1 749107589 YNRLEOCCXKLOHR-UHFFFAOYSA-N 410.517 2.404 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)CCO2 751235702 BQRQPFOZHQLSPS-UHFFFAOYSA-N 402.516 2.309 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1 752132586 VEERCBZAMOXLHV-UHFFFAOYSA-N 407.224 2.326 10 20 HECD O=C(Cc1cccc(F)c1)NCCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761205715 OLHGQACHXYADQH-UHFFFAOYSA-N 419.840 2.308 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1noc(Cc2ccccc2)n1 764537621 YMJHEUDYALERJR-GFCCVEGCSA-N 416.459 2.229 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](CCO)C1 765230798 NKXKDGSFJALCEH-CYBMUJFWSA-N 410.517 2.489 10 20 HECD CCOC1CC(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)(N2CCOCC2)C1 767888442 TZDQIMTYSBHUFR-NNDYNSRJSA-N 407.511 2.031 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(N2CCOCC2)cc1 774778800 FIPPOVMGAZTBBI-PGRDOPGGSA-N 424.545 2.120 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)c1 775372732 HLKOGFTUFJMVNC-DOTOQJQBSA-N 424.563 2.400 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3nc(C4CC4)no3)C(C)C)nc12 776018342 GNMNFNFVJYPKCG-HNNXBMFYSA-N 400.439 2.359 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@@H]3CCO)CC2)cc1 779518898 HMRPACLHVNAXHJ-WIYYLYMNSA-N 404.555 2.058 10 20 HECD O=S(=O)(Nc1ccccc1S(=O)(=O)N1CCCCC1)c1cccc2nonc12 780747224 BATRVXLFPBZYMS-UHFFFAOYSA-N 422.488 2.198 10 20 HECD Cc1cnc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 782104376 FHOHLJBUYZSQQX-RYUDHWBXSA-N 406.483 2.459 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)cc1 785434570 VBQKVJOPMGTWLQ-LJQANCHMSA-N 402.926 2.441 10 20 HECD COc1cccc(F)c1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321543 XCIJHYALXTZXON-HNNXBMFYSA-N 415.465 2.165 10 20 HECD CCCN(CC)C[C@H](C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 794269946 ALRJUYKQYYHTEO-CVTTXWKISA-N 416.566 2.137 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)N2CCCC2)NC(=O)OC(C)(C)C)cc1 795249122 OTUCJJDRWZKACU-KRWDZBQOSA-N 412.556 2.249 10 20 HECD C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(S(N)(=O)=O)cn1 798337479 PGJODZRNMWGEDT-HNNXBMFYSA-N 414.487 2.026 10 20 HECD COCC1(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 799996244 RLRKYUFHUUGTDW-UHFFFAOYSA-N 404.555 2.323 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@]2(CCCOC2)C1)c1ccc(N2CCOCC2)cc1 803308792 KDTZJIHLGSNXEP-MBSDFSHPSA-N 415.534 2.120 10 20 HECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 804881160 OMMGNKGMCBFPCM-LOWQCSRCSA-N 420.462 2.122 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCc1cccc(C(=O)NC)c1 807358862 LFGCTRJOUGVTKL-UHFFFAOYSA-N 411.502 2.239 10 20 HECD COC[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807448609 UPQKYNALTGJHNU-PBHICJAKSA-N 413.465 2.160 10 20 HECD CCC1(O)CCC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 809321602 YXLOZNJNXKEJSC-UHFFFAOYSA-N 405.564 2.056 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nc(C4CC4)ccc3=O)cc2F)C[C@@H](C)O1 810010726 LCDVCMPGAFCVFI-HUUCEWRRSA-N 414.481 2.190 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)c(C)c2)ccc1O 811699972 BXVXFNNRBOVVAT-UHFFFAOYSA-N 424.422 2.428 10 20 HECD COCCn1nc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ccc1=O 914455192 OBYBVMYJRCRELH-UHFFFAOYSA-N 410.474 2.391 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCOC3CCCC3)CC2)cc1 918058579 TXRCWEDCLDTSNW-UHFFFAOYSA-N 404.555 2.466 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)C2CC2)cc1 918457174 YQONSWUXLAMLGP-UHFFFAOYSA-N 408.458 2.213 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCCCC3)cc2)cc1 1329070082 MIDNYNRIQHSFBJ-UHFFFAOYSA-N 401.532 2.444 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cccc(O)c1)c1cc(O)nc(O)c1 1801742415 IFEXIQPCUVMBKN-SRXHPEDYSA-N 409.442 2.164 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=COCCC2)[nH]n1)c1cc(O)nc(O)c1 1817848403 HKCHILVFPIOVNN-HNNXBMFYSA-N 413.434 2.216 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 727159944 UBCWYJATMWOHAS-GGPKGHCWSA-N 418.557 2.226 10 20 HECD COc1cccc2cc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)oc12 727178369 VZVPDAWCEHRDBR-UKTHLTGXSA-N 412.514 2.192 10 20 HECD Nc1cccc(Cl)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 732404937 UIOHKGWSWDCYMI-UHFFFAOYSA-N 421.856 2.371 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1 733856168 TULMBAMTFBEVMW-UHFFFAOYSA-N 416.437 2.245 10 20 HECD COc1cccc(CNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c1O 745414812 AMLAXRLYIMDFDN-UHFFFAOYSA-N 412.490 2.303 10 20 HECD C[C@@H]1COCCN1CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745802374 LKOQZBHFBIFLGG-HZPDHXFCSA-N 412.481 2.277 10 20 HECD CS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746010850 MGZXZOIPWLMTKA-UHFFFAOYSA-N 406.479 2.120 10 20 HECD CN1CCCc2cc(CNC(=O)NCc3cccc(NS(C)(=O)=O)c3)ccc21 746718523 HBRNTTPAJPWOSJ-UHFFFAOYSA-N 402.520 2.440 10 20 HECD Cc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 746782873 GQBPZDORJABQMU-CHWSQXEVSA-N 406.483 2.459 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 748039292 XOXFQYDWLABTOW-QHCPKHFHSA-N 422.485 2.149 10 20 HECD CN1C(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C(=O)[C@@H]1Cc1ccccc1 761128919 ZTNFDLQTPQMSGO-CTNGQTDRSA-N 420.513 2.394 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2cccc(Br)c2O)C[C@@H](C)O1 764764114 YBKOHIIBZHQDLN-CHWSQXEVSA-N 400.317 2.453 10 20 HECD COc1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)on1 765950050 KZMQDIWTRQWGGR-UHFFFAOYSA-N 406.350 2.254 10 20 HECD Cc1ccc(O)c(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1 768185142 MLPJJNDNKOJQPZ-UHFFFAOYSA-N 404.517 2.212 10 20 HECD COCCCNC(=O)[C@H](C)N1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 769331011 YUFBEEPBDJJCRX-FQEVSTJZSA-N 402.583 2.336 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnc(C2OCCO2)s1 774012181 ASYIENRTYLMYLP-UHFFFAOYSA-N 407.467 2.219 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)Nc3nc(C)cs3)CC2)cc1 775906932 NWOMIEYOLJWZND-OAHLLOKOSA-N 418.519 2.153 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc21 776038862 LTRAOFXBGCRQHN-UHFFFAOYSA-N 410.543 2.487 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1Oc1ccccc1 776273238 YVPFLNCCFKVSJB-QRQLOZEOSA-N 420.487 2.119 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C[C@@]4(CCc5ccccc54)C3=O)CC2)cc1 781137962 LOAIIWYUVFLKJX-XMMPIXPASA-N 405.498 2.418 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1 784029822 JTYNWKBHUFWYLO-UHFFFAOYSA-N 420.469 2.375 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784767565 PVJPMBKIXMFZHV-KRWDZBQOSA-N 402.882 2.468 10 20 HECD CCCn1nccc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768457 YJGKFBLHRAKDBE-INIZCTEOSA-N 419.913 2.371 10 20 HECD Cc1c(NS(=O)(=O)c2cccc3nsnc23)cccc1N1C(=O)CCNC1=O 799930836 WGJKGJLLUOKTBR-UHFFFAOYSA-N 417.472 2.247 10 20 HECD CC(C)(C)C(=O)NCCNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 804098334 HUABSLRMXUKICL-UHFFFAOYSA-N 403.523 2.332 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 806279692 WWKSTKMTEWFGGO-OAHLLOKOSA-N 418.544 2.053 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@@]2(CCOC2)C1 807769530 GXXNKJGYALQUND-YCRPNKLZSA-N 423.460 2.012 10 20 HECD O=C(NCCCOC(F)F)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770534 LZTCMEDASVBLKY-GFCCVEGCSA-N 421.391 2.119 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 810049061 IZNKPHZWYOOXMR-SFHVURJKSA-N 419.499 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3COc4ccccc43)CC2)cc1 813891938 POQDLHQRSCUKQC-DOJUMQAQSA-N 421.497 2.192 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c[nH]c4ccc(OC)cc34)nc12 919145595 NNFPDGOMIQCQOX-UHFFFAOYSA-N 424.413 2.387 10 20 HECD O=C(O)c1cc2c(c(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)c1)CCC2 919730404 YULSCVLPMILVLF-UHFFFAOYSA-N 416.499 2.189 10 20 HECD CCOc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 1324102240 PZYXCPWCYZQZEY-FQEVSTJZSA-N 423.561 2.340 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncs1)C1=NN(c2ccccc2)C(=O)C1 1795290220 KBZVYCBSZADZQL-RBVVOMGSSA-N 423.498 2.188 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)cc(F)c1)c1cc(O)nc(O)c1 1796282499 BPFNPGRJANXLQC-BJWYYQGGSA-N 417.412 2.266 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1 1823819147 UWNBGWXGDPHSQV-ZWKOTPCHSA-N 417.506 2.295 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cnnn4)cc3)cc2F)C[C@H](C)O1 57372398 PCBHMJAPTMHOJG-GJZGRUSLSA-N 410.453 2.345 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 195662008 VTPQGYRQHFVDLV-UHFFFAOYSA-N 404.492 2.167 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](N4CCCC4)C3)CC2)cc1 727224864 SCKSQEIVWWNFDR-OAQYLSRUSA-N 415.582 2.087 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c1 727852442 ZOAAOPKVBGBNKS-CYBMUJFWSA-N 407.467 2.159 10 20 HECD CCOc1ccc(S(=O)(=O)NCCC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 728980425 FPUWVGZPLMXFGW-CQSZACIVSA-N 422.503 2.345 10 20 HECD Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)CN(C)Cc2ccccc2O)CC1 731843117 XAPVIPPFXHGHLU-UHFFFAOYSA-N 424.545 2.224 10 20 HECD CCOc1cccc(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1O 735086614 QHKFDEQAOHMWCJ-UHFFFAOYSA-N 419.547 2.017 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(C(=O)c2ccc(O)cc2)CC1 741090781 OGQPYVXOQGDCCR-UHFFFAOYSA-N 406.486 2.436 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCc1nc(-c2nc[nH]n2)no1 743809354 QWDQNDVFTBZNSY-UHFFFAOYSA-N 421.255 2.304 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 743897973 BHIIGWVLHZEKPO-CYBMUJFWSA-N 417.487 2.187 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743956750 VBMAMLMUMPZRJD-UHFFFAOYSA-N 411.458 2.382 10 20 HECD C[C@H](NC(=O)N1CCNC(=O)[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 749011082 XWUVDOQAPLZMHX-LAUBAEHRSA-N 408.502 2.467 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751044042 PCBKVSROPQRESQ-OAHLLOKOSA-N 404.488 2.349 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 752402976 BYDRXQJGXRQJOW-AWEZNQCLSA-N 421.494 2.061 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)CC2)cc1 753926800 WCRDZMZTVMXQCR-MOPGFXCFSA-N 415.582 2.132 10 20 HECD COc1ccc(CCNC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 759580338 QTGYTEZTWBQFIU-DEBLGDTFSA-N 415.442 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(OCCF)c3)CC2)cc1F 760121082 QZGUEJUJXBBEFO-UHFFFAOYSA-N 419.428 2.470 10 20 HECD COc1ccccc1OC[C@@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 765403528 OQFVRRHDENHPOI-ZDUSSCGKSA-N 408.476 2.217 10 20 HECD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 766330094 RVFLNTMFOOJOOC-OALUTQOASA-N 423.579 2.457 10 20 HECD CCc1nc(CC)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 768518065 MCGUMQOTTYSKOD-GJZGRUSLSA-N 403.502 2.472 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1 772495009 PLRSXDBXBYKKPK-UHFFFAOYSA-N 411.506 2.308 10 20 HECD CCNC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773847943 QCSSEDNXNIWNQZ-OAHLLOKOSA-N 412.490 2.083 10 20 HECD CN(C)C1(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCCCC1 774813465 CNLLRXCTMMEJES-UHFFFAOYSA-N 418.607 2.237 10 20 HECD CC[C@@H](CO)NC(=O)Cc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2O)cc1 774930405 RKUHREAXRGFYRJ-HNNXBMFYSA-N 403.435 2.351 10 20 HECD COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 776434439 FXHUISSWVUCSKR-UHFFFAOYSA-N 406.416 2.248 10 20 HECD COc1ccc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778220686 KXKPHJCJYXSVQK-VAWYXSNFSA-N 409.486 2.225 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(C)(C)c3ccncc3)CC2)cc1 778423449 SVSQIWWJIGYQFM-HJWRWDBZSA-N 422.529 2.389 10 20 HECD CC[C@@H]1C[C@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 781776164 FOUBAOFGFBMCFW-SJLPKXTDSA-N 422.497 2.417 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1 786377954 VSOIOKOOLFYORT-UHFFFAOYSA-N 422.529 2.263 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)[C@@H](C)c3ccc(C)cc3)cc2)CC1 787318407 DOJJVYVMQWVEHM-FDDCHVKYSA-N 409.530 2.444 10 20 HECD CS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789833191 FGWMEVBARDJPEB-QGZVFWFLSA-N 423.554 2.147 10 20 HECD O=C(Cc1ncccc1F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 792079352 KSTXWGOVPRJVBI-UHFFFAOYSA-N 424.455 2.335 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)COCc1ccccc1 793953040 DRURROYCQSQYSL-INIZCTEOSA-N 401.482 2.477 10 20 HECD O=S(=O)(Nc1ccc(CCN2CCOCC2)cc1)c1cccc2nsnc12 799184387 ILSHQGFXJDBQDB-UHFFFAOYSA-N 404.517 2.367 10 20 HECD CN(Cc1cnn(-c2ccccc2)c1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664140 FPIILJPXRWQECC-UHFFFAOYSA-N 409.465 2.352 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(CCN(C)C)Cc1ccc(F)cc1 807100298 IFKIJWOEUWSJHH-UHFFFAOYSA-N 414.525 2.407 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ncc(-c2ccccc2)cn1 807289042 HDPQHJLBKQCODA-UHFFFAOYSA-N 413.481 2.452 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 809728765 HGUAQDJSYIGFOW-JOCHJYFZSA-N 412.509 2.007 10 20 HECD CC(C)NC(=O)CN1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 915227277 PFLKIWJSUACMLC-UHFFFAOYSA-N 403.527 2.227 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(C)cc4)n3)CC2)cc1 1335573668 SSPGWKYJMVJPPV-UHFFFAOYSA-N 406.490 2.396 10 20 HECD C/C=C(\C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1790805626 IOBACAPNSDDERJ-KOCKHJGFSA-N 408.882 2.311 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC1(F)F 1797741331 CSTOTKXNMAYWGM-LSIKNRGBSA-N 408.401 2.110 10 20 HECD CN1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1800713520 NDLKGBDKWHKIMX-MUJYYYPQSA-N 421.925 2.345 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(F)(C1)C3)C2 1804282799 CWRDHBAAEVMVCZ-GOEWXDGDSA-N 416.449 2.347 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CCC1)C2 1804291703 VGCSIBFLOGFNNO-PLCSWTFUSA-N 404.438 2.347 10 20 HECD CC(C)(C)C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1809135771 JXKSNWFUGFQPFE-UHFFFAOYSA-N 411.593 2.124 10 20 HECD O=C(c1cc(Cl)cc(Cl)n1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250127 OERHQYLOTXVOGA-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2nc[nH]n2)C3)cc1 1845398528 YMPGNRSGYQGKOM-UHFFFAOYSA-N 404.474 2.343 10 20 HECD CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 7099151 PPQPRQOAZSCGBG-QHCPKHFHSA-N 424.501 2.235 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccccc2CN2CCCC2)c1 55137117 PKRGAXNYZHOZHM-UHFFFAOYSA-N 403.504 2.290 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(NC(C)=O)c(OC)c2)c1 729063296 INCZUVNCKITNDA-LLVKDONJSA-N 401.419 2.184 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1F 731409042 JGPUIUVCAKTNFI-UHFFFAOYSA-N 404.417 2.165 10 20 HECD NC(=O)[C@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN1c1ccccc1 731858213 INAGFSJYEPLTBT-UYAOXDASSA-N 422.485 2.020 10 20 HECD C[C@@H](NC(=O)COCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 732553611 PHNTZSYEBZHSJH-MRXNPFEDSA-N 407.511 2.242 10 20 HECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 732675206 XLCIPNURJCKOCM-RRFJBIMHSA-N 415.531 2.014 10 20 HECD COc1ccc(O)c(CNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1 734066018 HOGRBCFNTSBATC-UHFFFAOYSA-N 412.534 2.408 10 20 HECD Cc1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 740701144 VFXYPKBSMPRRPV-UHFFFAOYSA-N 424.422 2.342 10 20 HECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCc1c(O)ccc2c1CCCC2 743717939 WTPBEMPKUOUNQD-UHFFFAOYSA-N 406.479 2.395 10 20 HECD COc1cccc(CNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1O 745296132 BKHRSTCUONHSRU-INIZCTEOSA-N 404.536 2.250 10 20 HECD CCCN(C)C[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 745690317 ASPGZCWXAFGXIQ-UXHICEINSA-N 415.582 2.262 10 20 HECD CCNC(=O)N1CCc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc21 748321623 JVUNIXAAWVJLOB-UHFFFAOYSA-N 418.475 2.108 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@@H]2c2ccccc2)c1 748798403 YAGKLRQUUFMOKZ-QFIPXVFZSA-N 423.513 2.100 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1F 752010024 LLBYVCMVSXAZCC-QVKFZJNVSA-N 419.501 2.192 10 20 HECD CCOc1ccccc1C(=O)NCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754028184 NKWIOPNGAKXSDE-UHFFFAOYSA-N 415.465 2.312 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(C(=O)NC2CC2)cc1 757847320 KXKOZAXUZJSDLI-UHFFFAOYSA-N 409.486 2.460 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cccc(O)c2O)NC(=O)N[C@@H]1c1ccccc1 758559880 GTESSOODMFUQBF-QGZVFWFLSA-N 412.398 2.126 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)nn1 762568697 NCIRNGSYWQEBRX-SFHVURJKSA-N 412.494 2.212 10 20 HECD O=C(CN1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1)Nc1ccccc1Cl 768440813 FAJCGPWOUJSTMT-IBGZPJMESA-N 417.893 2.228 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)c1ccc(F)cc1 770261842 KVTMPRWHMUQRJM-FQEVSTJZSA-N 405.445 2.459 10 20 HECD CCN1CCN(c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CC1 770721758 SITOTLZJXTUFJO-UHFFFAOYSA-N 423.561 2.492 10 20 HECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2C)C1=O 771265250 CVFIDLJQONXTCO-HSZRJFAPSA-N 424.501 2.153 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)CCc3cnccn3)cc2F)CC1 771430116 CSIHCGKLQFRHFP-UHFFFAOYSA-N 400.502 2.142 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc(C4CC4)nc3)CC2)cc1 778258330 QALFMPBOQSITFB-HJWRWDBZSA-N 407.474 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccnn3CC3CC3)CC2)cc1 778377455 TYEVZYZWKSHSNH-HJWRWDBZSA-N 409.490 2.145 10 20 HECD CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)/C=C\c1ccc(O)c(O)c1 779514832 NVPQGTCYCNBUIS-POHAHGRESA-N 405.476 2.066 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(-c2ccccc2F)n1 785296864 JXPHRTZAHAUBPE-GFCCVEGCSA-N 412.421 2.417 10 20 HECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785421491 CWKKMVMGLVJTJF-YJBOKZPZSA-N 418.538 2.131 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cccc1N1CCNC1=O 787455326 SGBOPEAJRMWVMS-UHFFFAOYSA-N 421.501 2.380 10 20 HECD CN1C(=O)Cc2cc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 788707720 XOHOYONTXRABOP-MRXNPFEDSA-N 421.501 2.229 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)cc2F)C[C@@H](C)O1 789823030 XUIMEBFTVMUXCR-OVSBLAMYSA-N 415.509 2.216 10 20 HECD COc1cccc(CNC(=O)[C@@H](C)[C@@H](C)C(=O)NCc2cccc(OC)c2O)c1O 790787391 DBVDKLYBQKOQGW-OKILXGFUSA-N 416.474 2.320 10 20 HECD CN1Cc2cc(-c3csc(NS(=O)(=O)c4ccnn4C)n3)ccc2NC1=O 799187426 RPNMTUWMNCEUFJ-UHFFFAOYSA-N 404.477 2.322 10 20 HECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 799263713 ZNCDQBOZVSPGSJ-NSHDSACASA-N 403.391 2.091 10 20 HECD CON(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)CC1CCOCC1 801604198 NHKFAGQIVCMJLZ-IRXDYDNUSA-N 423.529 2.346 10 20 HECD COCCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802424255 GRWBKTOIBOOOII-UHFFFAOYSA-N 408.506 2.460 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662894 IWHWCKIXKNJPQJ-BIJSTVTOSA-N 405.514 2.296 10 20 HECD CCCN(CCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806496567 ZMLUIUIMGJQMRQ-FQEVSTJZSA-N 415.582 2.406 10 20 HECD COCCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807099814 BEINMBDSTLOTGZ-UHFFFAOYSA-N 413.518 2.327 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)c2nonc12 814379435 FXKMOKFFYQXLNK-UHFFFAOYSA-N 408.867 2.191 10 20 HECD CNc1snc(C)c1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 849192387 AUDZXDGDUYBTNJ-UHFFFAOYSA-N 403.552 2.444 10 20 HECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)CC1 863995095 LGDPUQGXJBQVAR-UHFFFAOYSA-N 400.548 2.491 10 20 HECD CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(CCOC)C2)sc2c1CC[C@@H](C)C2 914460992 ZJKCLLZSXLPBIZ-CHWSQXEVSA-N 408.520 2.483 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2 918311899 WQBULOALAQJGQN-UHFFFAOYSA-N 422.485 2.005 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971840 ZFHKJWIODVKGGO-UHFFFAOYSA-N 424.476 2.122 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCSc3ccccc32)c1 920636843 NUPRZTKVYPTFQZ-UHFFFAOYSA-N 422.484 2.059 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320886243 UVHSJMGMVHZKHU-DEOSSOPVSA-N 419.529 2.457 10 20 HECD CC(C)(F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786763032 BUHRZQHQLHMZBQ-WBIUFABUSA-N 414.861 2.093 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H]1CCc2ccccc2O1 1796602375 ARZZOZYGBPNMMI-SFNKJDCFSA-N 423.469 2.138 10 20 HECD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816719936 AQQOILLZIRTAJV-NSHDSACASA-N 414.443 2.390 10 20 HECD Cc1nscc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842314147 YSTYCXOBTFPVNT-GQCTYLIASA-N 415.471 2.099 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H](C)c3ccccc3)CC2)cc1 12069534 VVUSOYGULDJCHW-LJQANCHMSA-N 424.545 2.201 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc(N2CCOCC2)s1 109067497 PQYVWJHVPYIZQA-UHFFFAOYSA-N 407.565 2.191 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c(O)c1O 110523626 VAAAQXNSPVTSFC-UHFFFAOYSA-N 415.370 2.198 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C(N)=O 727594961 SIJPTTXGSNUDSE-INIZCTEOSA-N 409.490 2.117 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)s2)cc1 729352766 VHZZTQPPLPLNIY-INIZCTEOSA-N 423.560 2.283 10 20 HECD CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 730075839 NKQCURNCRLBMAL-QGZVFWFLSA-N 409.527 2.226 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCCC[C@@H]2CNS(C)(=O)=O)cc1F 731404505 NUYVAEVWZRHDHS-MRXNPFEDSA-N 414.547 2.285 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCc3ccccc3C2)cc1C 732747707 ZLEULIKBUUBJDG-UHFFFAOYSA-N 409.533 2.472 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CCO)c3ccccc3)cc2)C1 741080534 CHORHKQCNWYYFN-NHCUHLMSSA-N 424.545 2.354 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1 743169519 VIZYPRUWOKRIMJ-UHFFFAOYSA-N 400.527 2.383 10 20 HECD Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NCc1ccc2c(c1)CCCN2C 746181896 JJEDBEOTODFMBU-UHFFFAOYSA-N 424.545 2.302 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccn(-c3cccc(F)c3)n2)c1 748876684 IMFHJKDSBKVXKQ-UHFFFAOYSA-N 405.407 2.446 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C)nn3C(C)(C)C)CC2)cc1F 754210967 CHGCIPOCVLTEQA-UHFFFAOYSA-N 417.485 2.382 10 20 HECD COC(=O)[C@]1(C)CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759809134 IFIRKHVCNONQMT-QHCPKHFHSA-N 406.438 2.428 10 20 HECD C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 760204516 MOSNYAFKSZPJGE-CQSZACIVSA-N 415.469 2.085 10 20 HECD C[C@@]1(c2ccccc2)NC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 761126838 UVPVHKKIBNSNTI-SBUREZEXSA-N 406.486 2.356 10 20 HECD COCCOCc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 762246571 ZPWKTAZCKARNBQ-UHFFFAOYSA-N 411.461 2.468 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)N(C)Cc2ccc(N(C)C)cc2)s1 772631060 PMSXDAHJBNUHIM-UHFFFAOYSA-N 410.565 2.242 10 20 HECD O=C(NCc1ccccn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774473875 TVDRCGQDAZYWBH-OAHLLOKOSA-N 404.417 2.084 10 20 HECD C[C@H](C(=O)Nc1ccccc1S(C)(=O)=O)N1CCOc2cc(N(C)C)ccc21 774752827 MPHYICJFHKTUGJ-CQSZACIVSA-N 403.504 2.382 10 20 HECD COC(=O)[C@@H](C)SCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 777504226 RGDUQUIEZMPBMS-CYBMUJFWSA-N 410.517 2.219 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)NC(=O)c1cccs1 777826874 UFXSRTRCMSKCTO-NSHDSACASA-N 410.879 2.427 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 780417975 ZNSHMTKDBNOWEL-SJLPKXTDSA-N 416.522 2.014 10 20 HECD COC[C@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)n(-c2ccccc2C)c1C 780573343 NNYVZYFWOVTZGC-AWEZNQCLSA-N 401.463 2.420 10 20 HECD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)OCC(=O)c1ccc(O)c(O)c1 782548257 IDNYUPPQGUSBHS-UHFFFAOYSA-N 416.342 2.120 10 20 HECD CCCNC(=O)[C@@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413970 RRVLUHSBHMTSTE-LLVKDONJSA-N 412.489 2.326 10 20 HECD Cc1ccc(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(=O)n1C 787002293 VXBBNOBXVWFKGO-IYBDPMFKSA-N 416.497 2.446 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(N2CCCC2)nc1 787180213 JINLQMMYBPORTN-UHFFFAOYSA-N 407.518 2.215 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N(CCO)[C@@H]1CCc2ccccc21 788912151 TWGIYXKISSCZIN-JOCHJYFZSA-N 407.514 2.411 10 20 HECD CCC(CC)N(CCOC)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840181 GQCSBIAOCXVUAX-UHFFFAOYSA-N 423.529 2.067 10 20 HECD C[C@H]1CCC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842462 CQPZUOPYXWHXFB-JKSUJKDBSA-N 405.514 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](c4ccccn4)C3)CC2)cc1 799065047 AMIQNDWIXZLZCL-YXBWYFRISA-N 420.513 2.311 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NCC3(OCCO)CCOCC3)c2C)cc1 800667200 NFBAKBXPYIRRDJ-UHFFFAOYSA-N 402.491 2.391 10 20 HECD CCC(CC)NC(=O)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C 800738074 OLXAFYHHGLJANP-UHFFFAOYSA-N 404.490 2.208 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1 801631054 JGGCOOJXPLFKGR-UHFFFAOYSA-N 415.494 2.282 10 20 HECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 803688255 NXUIDIPMDZNMGI-INIZCTEOSA-N 411.502 2.278 10 20 HECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H](C)C1 804379476 LVOJHLXJHYMSFQ-ZDUSSCGKSA-N 409.533 2.421 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ncnn3C(C)(C)C)cc2)CC1 805026029 ZGUFZYQFPRWMHT-UHFFFAOYSA-N 412.538 2.202 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3COC(=O)N(C)CC)nc12 805761621 CLANLCMPDMFWGI-OAHLLOKOSA-N 419.482 2.054 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 806512845 VMRMKJPGMKZIKW-RDJZCZTQSA-N 401.429 2.226 10 20 HECD COC[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807448610 UPQKYNALTGJHNU-RHSMWYFYSA-N 413.465 2.160 10 20 HECD CN1CCCC(C)(C)[C@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809866052 JFKGWDKQXJJPII-UYAOXDASSA-N 417.550 2.136 10 20 HECD COc1ccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)n1 811970970 UZOMRESCHCLGFG-UHFFFAOYSA-N 404.442 2.278 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)C1 914905233 GTHFUQIBHDLTCV-QGZVFWFLSA-N 413.474 2.448 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)c2ccccc2S1(=O)=O 915115489 RCHKWXMWNOTBAD-UHFFFAOYSA-N 415.515 2.334 10 20 HECD COc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1N1CCCC1=O 919810409 RTRUIXPMIHCZDN-UHFFFAOYSA-N 419.459 2.151 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(-c2nnco2)c1)c1ccc(N2CCOCC2)cc1 920926899 RMYAWCGKCROJMR-HNNXBMFYSA-N 421.457 2.389 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](c3nc(C)no3)C2)c1 921050326 ZWMIRPBGFIKOSF-KRWDZBQOSA-N 414.506 2.498 10 20 HECD Cc1cc(NC(=O)c2ccc(C3=S=CC=C3)s2)n([C@H]2CCS(=O)(=O)C2)n1 1254501474 POFDQLHIRCHXOJ-LBPRGKRZSA-N 407.542 2.491 10 20 HECD CNC(=O)c1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1319149891 LEOFTUWZIJEHBZ-CYBMUJFWSA-N 404.417 2.441 10 20 HECD C[C@@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 1341765103 CZNJMJBTXVPEAI-MRXNPFEDSA-N 420.529 2.235 10 20 HECD CC1(C)NC(=O)N(CCCNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1=O 1351536009 KVFOOIGPQYRCKP-UHFFFAOYSA-N 414.462 2.418 10 20 HECD O=C(Cn1ccnc1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787485021 LJSQCKITYQOGJX-UHFFFAOYSA-N 407.430 2.137 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1=CCCC1 1806213140 IMYJMWZGVZLHEN-OXJNMPFZSA-N 408.458 2.318 10 20 HECD CCC(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808468813 YNWOJZPXRQTZQK-HTAPYJJXSA-N 419.485 2.290 10 20 HECD O=C(CC1CCC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1814115968 POGBIULTGCZQLR-KKSFZXQISA-N 410.474 2.398 10 20 HECD CCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429544 WNBWIHXPCMVXCZ-KRWDZBQOSA-N 405.495 2.153 10 20 HECD CCN(C(=O)CN(C)Cc1ccc(N2CCCCC2)cc1)[C@H]1CCS(=O)(=O)C1 15571659 YEGZKAKRHHZRDS-FQEVSTJZSA-N 407.580 2.144 10 20 HECD Cc1c(CNC(=O)N2CCN(c3nccn4cnnc34)[C@@H](C)C2)n(C)c2ccccc12 472228521 DTFDHLNYWLDUAF-HNNXBMFYSA-N 418.505 2.345 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3c(C)nc4ccccc4c3=O)CC2)cc1 726563993 WWGUDDHHINMZKG-UHFFFAOYSA-N 406.486 2.499 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 727177128 CJBCAZMEJSAHFX-FLIBITNWSA-N 421.363 2.200 10 20 HECD CC(C)Oc1ccccc1/C=C1/SC(=S)N(CCNS(C)(=O)=O)C1=O 727177471 KHPRXSJMULURGC-GXDHUFHOSA-N 400.547 2.224 10 20 HECD CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 729325352 UIVDXGNADZVXLI-QFIPXVFZSA-N 411.477 2.252 10 20 HECD Cc1ccccc1-n1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 732656542 MNGPLFONPNBPGD-UHFFFAOYSA-N 424.526 2.346 10 20 HECD COc1ccc(O)c(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 734019111 XOFAABFRMPNIAA-UHFFFAOYSA-N 401.375 2.314 10 20 HECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1[N+](=O)[O-] 740610404 ZFLCMUSYSXCGMA-UHFFFAOYSA-N 418.475 2.406 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(C[S@@](C)=O)c3)CC2)cc1 742921593 UNYAHAFFUGUHOO-GDLZYMKVSA-N 415.559 2.126 10 20 HECD CCc1cccc(C)c1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743442572 NJKOGUVIHPDYHT-UHFFFAOYSA-N 424.545 2.443 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C3CC3)[C@H](C)O)c2C)c1 745739612 JGOSFAGVIXFOGU-HRAATJIYSA-N 412.486 2.404 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 746420707 BOTJRKKKBLEWLY-AWEZNQCLSA-N 421.448 2.362 10 20 HECD CCS(=O)(=O)N1CCC(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 751303191 WIAFSWIYNYROIZ-UHFFFAOYSA-N 413.503 2.397 10 20 HECD CCOC(=O)CC[C@H]1CCCN(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)C1 752051219 RJUTWWIAHSZIFN-CQSZACIVSA-N 404.467 2.167 10 20 HECD Cc1oc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 753593367 PFJPQUIKCOQFLW-CQSZACIVSA-N 421.519 2.166 10 20 HECD COC(=O)c1cc(Cl)ccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 753773698 ZJOXOLXSIQUKIW-UHFFFAOYSA-N 418.880 2.299 10 20 HECD Cc1cc(C(=O)CN(C)C[C@@H]2CCC[C@@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 755060032 VXOFSLZAINALAE-JXFKEZNVSA-N 419.547 2.017 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(Br)nn3C)cc2F)CC1 757930721 AIDMJAHAUGCKPM-UHFFFAOYSA-N 424.318 2.394 10 20 HECD COCCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 758545543 NTEIFSQYMODXGS-UHFFFAOYSA-N 423.510 2.311 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)NC4(CCSCC4)C3=O)CC2)cc1 760947908 AHOMXJUHLKSOOG-UHFFFAOYSA-N 418.563 2.025 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCS[C@@H]3COCC[C@H]32)c1 767784563 DEHHXKFNCQMXBK-WOJBJXKFSA-N 406.548 2.133 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 768172861 ZUIKQWSNHQMOMR-UHFFFAOYSA-N 410.449 2.159 10 20 HECD NS(=O)(=O)c1cccc2c(C(=O)NCCCSc3nccs3)nccc12 770491494 YALXPFONORFOCW-UHFFFAOYSA-N 408.530 2.251 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NC(=O)NCCCSc2nccs2)CC1 777744516 PREDYNPNZBLGLJ-UHFFFAOYSA-N 420.626 2.375 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CCO)C3CCOCC3)cc2F)C[C@H](C)O1 780312514 PJTKNBKPTFDIQB-HOTGVXAUSA-N 409.502 2.122 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2cn(CC(C)C)cn2)c(C)n1-c1ccccn1 782704974 IXSJTRZCHOEZRR-UHFFFAOYSA-N 401.492 2.460 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n(C)n1 784765703 BJCYGKNADLKGNF-INIZCTEOSA-N 419.913 2.061 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc4c3O[C@@H](C)C(=O)N4)cc2)CC1 786659484 LFMSBIMBFIVALY-HNNXBMFYSA-N 422.485 2.005 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)CN1CCCCC1 789863070 DIJOADGOPZPVCQ-GOSISDBHSA-N 418.607 2.094 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1F 796769694 UYZHLBNRFJBRPK-UHFFFAOYSA-N 418.400 2.242 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c(O)c1 797389174 TUKNRXTWJWIOKN-UHFFFAOYSA-N 417.849 2.436 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2C 799261063 LBQZCVJQZVWHBB-UHFFFAOYSA-N 424.501 2.484 10 20 HECD C[C@@H]1CCCN(c2ccc(CNS(=O)(=O)CCS(C)(=O)=O)cc2Cl)C1 800149239 XENYUOFCGXTXNC-CYBMUJFWSA-N 408.973 2.040 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCCOC3)C2)cc1F 804852692 MDGXVTVWDIQHLH-AOMKIAJQSA-N 421.513 2.085 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1 807481072 GTAPGYNAVPLUQL-GOSISDBHSA-N 418.538 2.131 10 20 HECD Cn1c(=O)oc2cc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)ccc21 807511843 XXIHADMMLKDYCD-UHFFFAOYSA-N 410.213 2.399 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C[C@H](C)O1 918201059 CFZUURJNJDUHRN-OALUTQOASA-N 418.582 2.194 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CC34CCS(=O)(=O)CC4)cc2F)C[C@@H](C)O1 1325807619 HZMMPCVVPZDTRP-INMHGKMJSA-N 424.538 2.270 10 20 HECD Nc1ccccc1/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1796102603 SSRANNMZPOFWNR-ORIYUZMUSA-N 408.458 2.040 10 20 HECD O=C(CC1CCOCC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500969 JTDNEBFGRUAFAA-UHFFFAOYSA-N 408.882 2.385 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccccc3C2)C1 1846091842 UGOOPSHWEKINLT-QGZVFWFLSA-N 407.470 2.115 10 20 HECD NS(=O)(=O)c1cnc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 301417699 BMLWFUGLJGNTAC-SNVBAGLBSA-N 404.464 2.473 10 20 HECD Cc1cc(C(=O)N(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 729342086 XGORFUIWJAELTN-QZTJIDSGSA-N 417.531 2.297 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732572718 XZSLDMFVVJPEKW-XJKSGUPXSA-N 414.428 2.047 10 20 HECD C[C@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1C(=O)NC2(CCCC2)C1=O 735517073 HCPRARXNCIZKPX-WBVHZDCISA-N 415.490 2.153 10 20 HECD COc1cccc(CNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1O 737284666 PYXVFJNWRNUGOW-UHFFFAOYSA-N 405.248 2.369 10 20 HECD CCC[C@H](O)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 740982569 NFHBCOIPAPMCCM-UXLLHSPISA-N 410.486 2.150 10 20 HECD Cc1c(C(=O)Nc2cccc(N3CCCC3)c2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 746135030 SDZVEGLBZMXOLB-UHFFFAOYSA-N 404.448 2.403 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 749629970 WLYXXLVONNACIF-UHFFFAOYSA-N 418.519 2.111 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CC(=O)N1CCCC1 749902876 OSSLTZBTQOCEDS-OAHLLOKOSA-N 419.481 2.343 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2c(C)n[nH]c2n1 750670817 YHQPOBBPSOQTSX-MRXNPFEDSA-N 406.490 2.206 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4oc(=O)ccc4c3)CC2)cc1F 754039711 DKORTGWAGVNXEU-UHFFFAOYSA-N 418.446 2.452 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C)nc3C)cc2F)CC1 756176623 CFZXBLYSNLYOSY-UHFFFAOYSA-N 413.497 2.234 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(Cl)cc(F)c2O)C1=O 757908038 XNVJRKISKVPOHJ-UHFFFAOYSA-N 420.828 2.290 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](C)Cn3cccn3)CC2)cc(OC)c1OC 759236942 GPRHJTGMIRRQRZ-MRXNPFEDSA-N 417.510 2.077 10 20 HECD CCCCS(=O)(=O)NCC(=O)N(CC)Cc1cc(Br)ccc1O 761175851 POXFASBYSHUTEE-UHFFFAOYSA-N 407.330 2.223 10 20 HECD COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 761271243 KOSWZTSFKRDHEP-UHFFFAOYSA-N 406.416 2.248 10 20 HECD Cc1nnc(S)n1-c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 763255411 SAZROHSAQAMLRD-UHFFFAOYSA-N 419.488 2.194 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccc(C)cc3)CC2)cc1 778225090 KJKWIFGZVWLNHP-QXMHVHEDSA-N 423.513 2.404 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(S(C)(=O)=O)cc1 783153278 UGGCLFLJCPHPID-NSHDSACASA-N 413.473 2.085 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-c4n[nH]c(C)n4)cc3)cc2)CC1 787321432 FKJHKYODEXLRLO-UHFFFAOYSA-N 418.501 2.379 10 20 HECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)o1 787917268 IOMZHDMWSBVGRO-UHFFFAOYSA-N 424.545 2.095 10 20 HECD C[C@@H]1CCCC[C@@H]1OCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787987618 LLVDLDHDYKFSFM-NQIIRXRSSA-N 417.550 2.193 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCc1nnc2n1CCOC2 790680261 PQPHQDLKHNTCBJ-UHFFFAOYSA-N 410.272 2.008 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCCNCc2c(O)ccc(Cl)c2F)cc1 790958463 PONQKGXTPWKPSB-UHFFFAOYSA-N 403.819 2.161 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c(O)c1 797390770 QLUQJIXIESZNCM-HNNXBMFYSA-N 413.474 2.049 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)CN3CCCCC3)CC2)cc1 804317752 OSQLKRZQHWIHTF-SFHVURJKSA-N 416.566 2.018 10 20 HECD CC[C@@H](CO)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289922 MYJSZSDXYUAASS-NRFANRHFSA-N 407.514 2.479 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C12CCC2 807609267 LJLSHDFPNCDGSY-MISYRCLQSA-N 416.518 2.364 10 20 HECD C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 809401522 UCGZJYWYMNELJU-JTSKRJEESA-N 424.545 2.473 10 20 HECD COc1cc(N2CCN(C(=O)c3c[nH]nc3-c3ccccn3)CC2)cc(OC)c1OC 811045338 OKPROFBJCPHUAB-UHFFFAOYSA-N 423.473 2.460 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCc2nc[nH]c2C1 816651814 QOTNQKQMHSLBLA-UHFFFAOYSA-N 404.473 2.176 10 20 HECD COC(=O)c1ccc(CN(C)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 914789025 XNTPPYLAOCZJRH-UHFFFAOYSA-N 411.502 2.262 10 20 HECD CN(C)c1ccc(CN(CC(=O)N2CCN(C(=O)c3ccco3)CC2)C2CC2)cc1 917074201 UKODIYGAYFYXQG-UHFFFAOYSA-N 410.518 2.295 10 20 HECD O=C(CCC(=O)c1cccs1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918336051 TVGSHAYUDKWAOH-UHFFFAOYSA-N 406.529 2.262 10 20 HECD CCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918466055 XRTOLRLQPSBQIT-GOSISDBHSA-N 408.502 2.206 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)S(C)(=O)=O)c2C)cc1 919344906 GGJQNEBWZOILOM-CQSZACIVSA-N 421.471 2.040 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CC(=O)N(C)c2ccccc21 1116060326 HKBIYHYZRBEJDU-LJQANCHMSA-N 409.486 2.405 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 1320436400 KATSZPHDILWYLZ-DHINHOHASA-N 400.387 2.310 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCC=C1F)c1cc(O)nc(O)c1 1804561929 OWOPLCHHABRLRJ-MWBIGIAMSA-N 407.417 2.490 10 20 HECD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)CC1 1816665789 QANVTXYVHHBVQA-LBPRGKRZSA-N 421.548 2.062 10 20 HECD C[C@@H](CN)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817228286 OWMKKDVUFPGSRI-IINYFYTJSA-N 421.885 2.375 10 20 HECD CCc1ccccc1NC(=O)CNC(=O)CN1CCN(c2ccc(OC)cc2)CC1 7354703 WBNORNNHEQRSGT-UHFFFAOYSA-N 410.518 2.135 10 20 HECD CCOC(=O)N1CCN(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 108217410 PPIGWEBOMXCJJY-UHFFFAOYSA-N 424.567 2.128 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnc4c(c3)c(C)nn4C)CC2)cc1 726600588 BOXYWKHBQJZHLT-UHFFFAOYSA-N 415.519 2.233 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 727159946 UBCWYJATMWOHAS-NSHGMRRFSA-N 418.557 2.226 10 20 HECD CCOc1cc2c(cc1CNC=C1C(=O)N(CC)C(=S)N(CC)C1=O)O[C@H](C)C2 730970968 JISYIYGAZJQBCN-CYBMUJFWSA-N 417.531 2.378 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1F 731408271 IETYGCZOYOCITJ-UHFFFAOYSA-N 414.437 2.258 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@@H]3CCC[C@@H](C)C3)CC2)cc1 733016260 AVCUGSVTQSVXRE-YLJYHZDGSA-N 404.507 2.482 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N(C)C)cc2C)cc1 734471610 QJHQDUUNPJCCNO-HNNXBMFYSA-N 405.520 2.053 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c1O 737286212 SKSSAAOTHCZXIH-GJZGRUSLSA-N 413.474 2.269 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@@H](O)COc1ccc2c(c1)OCO2 741090204 DVBLHAKXPRJRFD-GOSISDBHSA-N 411.458 2.031 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 743162416 XWJBGOSYGWKOMH-UHFFFAOYSA-N 418.519 2.095 10 20 HECD Cc1ccc(N2CC[C@H](OC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2=O)cc1 744855319 YBVAQRFVAQXSIH-KRWDZBQOSA-N 404.444 2.034 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCc3ccccc3)[C@H]3CCOC3)nc12 752347866 OSVJBMALASCMLU-SFHVURJKSA-N 410.474 2.445 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCCO[C@H]3CCOC3)cc2F)C[C@@H](C)O1 756924782 PVXLCYQNLBZVEH-NUJGCVRESA-N 409.502 2.434 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 760141037 GBHXUJNISWGRHX-LBPRGKRZSA-N 406.460 2.368 10 20 HECD CN1CCc2ccc(NC(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc21 776034123 ZOIULXJBGGCLCJ-UHFFFAOYSA-N 414.531 2.235 10 20 HECD Cc1csc2ncc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c(=O)n12 776465340 HAPFZGWSKJOOAX-UHFFFAOYSA-N 412.515 2.203 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3CCO[C@H](C(C)C)C3)nc12 781791125 RWEBHGJYCJKSPS-BBRMVZONSA-N 405.451 2.496 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C3CN(C(=O)OC(C)(C)C)C3)cc2F)CC1 784662609 WCMQFIZZUUOUNJ-UHFFFAOYSA-N 420.529 2.451 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785434861 VNCGPSCKNYLMSR-GCJKJVERSA-N 408.546 2.396 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccnc1-n1ccnc1 787447304 FRAUHXVAQZZCAC-UHFFFAOYSA-N 407.474 2.418 10 20 HECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789825664 NJJUVWIXDVRODC-OFVDUGFESA-N 421.513 2.129 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@@H](c2ccco2)C1 789841473 ZFIZXUINKKFZFL-MRXNPFEDSA-N 415.465 2.012 10 20 HECD CCCN1CCC(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 793827270 WCAWQMJSGMKGTO-UHFFFAOYSA-N 400.567 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@](O)(C(F)(F)F)CC3)CC2)cc1 796450981 ZORDQPMISIZIER-IBGZPJMESA-N 415.456 2.123 10 20 HECD CC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 804317005 QBACFPZWFYVSKZ-FQEVSTJZSA-N 403.523 2.102 10 20 HECD CN(C)CC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C 806388236 BZXCNVCHEISJIJ-UYAOXDASSA-N 419.566 2.382 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809378287 YQSVRFJKINQNTF-INIZCTEOSA-N 415.490 2.329 10 20 HECD COC(=O)C1(CS(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCCC1 809809956 GHZJJMOYXPNTOW-INIZCTEOSA-N 410.536 2.237 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1O 810327931 DWFCRMKINIZMOZ-UHFFFAOYSA-N 400.456 2.149 10 20 HECD CN(C)S(=O)(=O)c1ccc(NNC(=S)Nc2ccc3c(c2)OCCCO3)cc1 812260679 DQTBJDDCXGYGOT-UHFFFAOYSA-N 422.532 2.412 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(C[C@@H]3CCOC3)C3CC3)cc2)C1 918117689 PVSLGBYRMAWYDZ-ZWKOTPCHSA-N 400.523 2.099 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)CC2)cc1 1319859292 RWEAILCTUXGCPM-HSZRJFAPSA-N 422.485 2.102 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3csnn3)CCC2)cc1)c1cc(O)nc(O)c1 1788425260 LCPXQEPNQPYXOY-UHFFFAOYSA-N 411.443 2.406 10 20 HECD O=C(CCNC1=NS(=O)(=O)c2ccccc21)NCc1ccc(N2CCCC2)cc1 46686508 MLCANEHIVIDOAL-UHFFFAOYSA-N 412.515 2.032 10 20 HECD O=C(c1ccccc1NS(=O)(=O)c1cccc2nsnc12)N1CCC[C@@H](O)C1 55628583 VAZDMDQVLLFRRM-GFCCVEGCSA-N 418.500 2.089 10 20 HECD Cc1ccc(S(=O)(=O)NCCNCc2ccc(N3CCOCC3)c(F)c2)cc1 237849091 BKVDZWKBIXAUHF-UHFFFAOYSA-N 407.511 2.039 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(=O)n(-c2ccccc2)n1 303037774 VNKRDMVTTKXXFP-UHFFFAOYSA-N 418.497 2.371 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](N4CCCC4)C3)cc2F)CC1 303250143 AQUACAPTYHXFRM-IBGZPJMESA-N 403.546 2.347 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 727226016 WUMNTJNPCMVLPV-JKIFEVAISA-N 416.501 2.153 10 20 HECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2cccc(OC)c2O)c(OC)c1 729861480 PGMQPDZTWAFMJH-KRWDZBQOSA-N 414.458 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)cc1F 731502787 QEYBJIFSWOOBBF-UHFFFAOYSA-N 421.561 2.414 10 20 HECD Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)c4cc(O)cs4)CC3)cccc2c1 732268653 JRFRPLYHRUTSCR-UHFFFAOYSA-N 417.512 2.457 10 20 HECD Cc1ncc(/C=C\C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 732867258 KPZVARZYCBSBBE-HYXAFXHYSA-N 419.478 2.300 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccnc3Cl)CC2)cc1 738353207 OLBPVVGZNQMTNI-UHFFFAOYSA-N 424.954 2.234 10 20 HECD C[C@@H](NC(=O)N(CCO)CCOCC(F)(F)F)c1ccc(N2CCOCC2)cc1 745779825 QMILRRZVFKOGLV-OAHLLOKOSA-N 419.444 2.167 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1nc(-c2nc[nH]n2)no1 752659606 NMEVBPCRMXEZHC-CQSZACIVSA-N 402.434 2.256 10 20 HECD CCOC(=O)[C@@H]1CCCCN1C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 756337336 UDSJHJIDMJKSCI-OALUTQOASA-N 404.507 2.317 10 20 HECD Cn1nc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 759355658 GIAKWMUKQVDHIY-KRWDZBQOSA-N 420.517 2.274 10 20 HECD CS[C@H](CO)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769340489 KYAPEHMKDRCJLO-IINYFYTJSA-N 416.546 2.097 10 20 HECD Cc1cc(C)nc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 773460828 KLABXQIOCURWSV-UHFFFAOYSA-N 421.545 2.485 10 20 HECD CO[C@@H]1[C@H](C)[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1(C)C 775772659 VPZIICLKFLVTSM-TWKWOARYSA-N 402.539 2.247 10 20 HECD CC[C@@H](C)NC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 785428821 SLYZQMWBMCANLI-MRXNPFEDSA-N 410.518 2.214 10 20 HECD COCCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 786276914 WWTHNIKHYFBVFS-UHFFFAOYSA-N 415.465 2.106 10 20 HECD COc1nc(Br)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 789554813 KVBXLRNPKLYNAF-UHFFFAOYSA-N 407.268 2.174 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CSc2ccccc21 789800830 PVGZYVVHDJMZQD-KRWDZBQOSA-N 415.490 2.242 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccco3)cc2F)C[C@@H](C)O1 789821346 SEXRBMRHPTYXNC-GASCZTMLSA-N 403.454 2.307 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)O1 789825376 LOKWNEOGKLLYRB-KYHPRHEASA-N 421.513 2.081 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@]2(CCCOC2)C1 789856545 VSRJBNKMKNZVHP-JOCHJYFZSA-N 417.575 2.275 10 20 HECD CCc1nc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 789860227 KGTHEKRFLQDSAU-UHFFFAOYSA-N 418.588 2.234 10 20 HECD COC(=O)c1cccc(Cl)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 790044860 GGRJSTXTHNHGKT-UHFFFAOYSA-N 418.880 2.299 10 20 HECD COC(=O)[C@@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CCO2 809561643 DTILNWDAWCVLPN-QFIPXVFZSA-N 411.502 2.150 10 20 HECD Cc1ccc(O)cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 811311289 IGBBIMZMHOBDPA-UHFFFAOYSA-N 402.422 2.150 10 20 HECD Cc1cnn([C@@H]2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 812009962 LEIZFRFKRLVNTL-AZUAARDMSA-N 410.522 2.050 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccccc2)cc1 918203194 XNPOMYLJWKPYPP-UHFFFAOYSA-N 404.536 2.311 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)c1ccccc1F 918206854 OTDIWLMAIUNYCV-FQEVSTJZSA-N 405.445 2.459 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1ccc(OC)cc1 1338288949 SXNZLMJIKOBWFX-INIZCTEOSA-N 405.472 2.489 10 20 HECD Cn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715602 ILMRIRGMGQYSJC-CLLJXQQHSA-N 404.854 2.050 10 20 HECD Cc1ncoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816536693 WSHLPSJOGDKBPG-CYBMUJFWSA-N 412.406 2.132 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2ccccc2)C1 1842696041 TVWYUQHQQNAYMB-UHFFFAOYSA-N 416.481 2.225 10 20 HECD COc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc(Br)c1O 13343668 DSTMPHJEFHUXQE-WTKPLQERSA-N 404.263 2.449 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 437026133 NZQULPDUZAFCNX-UHFFFAOYSA-N 405.432 2.104 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)c1 729064503 SKPQSFYPUGJRCB-CQSZACIVSA-N 411.458 2.339 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N(C)C)C3)cc2F)C[C@@H](C)O1 732205317 OJPIMTWNHMHWSG-ZHALLVOQSA-N 406.546 2.082 10 20 HECD NC(=O)c1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 741942597 FRQOEPJYZVNWTL-UHFFFAOYSA-N 416.349 2.116 10 20 HECD CC(=O)Nc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 743641192 AAFUUQYBXJRFQY-IBGZPJMESA-N 423.517 2.346 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)o1 751388205 FIUOZBCXILXSSP-OAHLLOKOSA-N 408.476 2.023 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(C(N)=O)nc1 753941736 YNFXGASEUVADMY-UHFFFAOYSA-N 407.268 2.380 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCCN3C3CC3)cc2)C1 764848916 FOIIZGADHSFQNK-WIYYLYMNSA-N 413.566 2.204 10 20 HECD Cc1nc2nc(N)nn2c(C)c1CCC(=O)NCc1cccc(Br)c1O 765748595 XJPKOWKAYSCMDC-UHFFFAOYSA-N 419.283 2.040 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC(F)(F)CO 768644635 HITHQNZMZBOGQY-YRNVUSSQSA-N 406.501 2.473 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](CCO)c3ccco3)cc2F)CC1 769506714 GNVASIFXJIBWDH-SFHVURJKSA-N 404.486 2.484 10 20 HECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772901164 CDECMBPIMVKPQN-UHFFFAOYSA-N 401.438 2.177 10 20 HECD NC(=O)c1cc(Cl)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772905633 ZMAWBDXZPLAKRQ-UHFFFAOYSA-N 420.872 2.143 10 20 HECD C[C@@H](NC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21)c1ccc(N(C)C)cc1 773027513 WRXKTIUDLOJPKY-CQSZACIVSA-N 400.504 2.011 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccncc3)cc2F)C[C@@H](C)O1 774177577 IQUPICVTPHFCRP-HZPDHXFCSA-N 414.481 2.109 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2cccc(N3CCS(=O)(=O)CC3)c2)c1O 774933812 QMCLFMAWIQAAIA-UHFFFAOYSA-N 407.448 2.156 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccccc3OC)CC2)cc1 775056262 VMDFXCLVEGPXNR-UHFFFAOYSA-N 411.502 2.148 10 20 HECD CCCCn1c(=O)nc(O)c2c1nc(CN[C@@H](C)c1cc(OC)ccc1O)n2C 775369135 KOUFKWVOCKOKSR-LBPRGKRZSA-N 401.467 2.201 10 20 HECD CN1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H](CNC(=O)OC(C)(C)C)C1 775419803 BJWXTERKQKASQN-INIZCTEOSA-N 423.533 2.242 10 20 HECD C[C@@](O)(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 777747528 FCPFYGYOLOTDQP-NTKDMRAZSA-N 424.545 2.485 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)C(=O)Nc4ccccc43)CC2)cc1 779225012 JNMUYEZVNZROFW-QUCCMNQESA-N 424.545 2.273 10 20 HECD Cc1cc(C(=O)NN2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1Br 779279731 IZNQMDHVMSKMDL-UHFFFAOYSA-N 405.252 2.395 10 20 HECD NC(=O)COc1cccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)c1 784106269 JJXGBSOBSQCQEP-UHFFFAOYSA-N 410.474 2.295 10 20 HECD CCN(C)C(=O)c1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786257161 NPBVWYFOUVYDSH-UHFFFAOYSA-N 422.529 2.377 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc(OC)c1O 787324329 BMCPAIDBVVBRLY-UHFFFAOYSA-N 413.474 2.008 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)cc1 788928264 CWUZZNUILNTLKD-IAGOWNOFSA-N 402.539 2.055 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC(C)(C)C3)cc2F)C[C@H](C)O1 789822078 VNPWKXGPBZHIEJ-GJZGRUSLSA-N 423.554 2.410 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cn3ccc4ccccc4c3=O)cc2)C1 790542166 OPABKHWONDAXID-IBGZPJMESA-N 418.497 2.020 10 20 HECD COc1cc(OC)cc(N2C[C@@H](C(=O)NCc3ccc(OC)cc3O)CC2=O)c1 794377050 LDJZUAXZZATJFY-AWEZNQCLSA-N 400.431 2.087 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc4c(n3)CCCC4)CC2)cc1 804318366 ISQYEHDNGXTJPF-UHFFFAOYSA-N 422.529 2.370 10 20 HECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCc1cc(Cl)cc(Cl)c1O 805187179 ZAKYCSIKZYBNQR-OAHLLOKOSA-N 417.337 2.441 10 20 HECD C[C@@H](CCc1cccn1C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807651418 YZECZROBJZLGQP-FXAWDEMLSA-N 413.518 2.376 10 20 HECD CC[C@@H]1CCC[C@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808736611 WSANCWYIPGNQPI-NVXWUHKLSA-N 419.522 2.056 10 20 HECD O=C(COC(=O)c1n[nH]c2c1CCC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919333594 UEYFUBWWSFUUTD-UHFFFAOYSA-N 415.405 2.469 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCCC[C@@H]3N(C)C)CC2)cc(OC)c1OC 1116594732 NAMBYDVAXDRVCA-MSOLQXFVSA-N 420.554 2.417 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=Cc2cc(F)ccc2OC1 1325764820 XEESOEWHFOAERI-INIZCTEOSA-N 401.390 2.303 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N(C)C)cc1C 1343415268 UCIZUFCQVLQXHO-UHFFFAOYSA-N 407.448 2.234 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccco1)C1=NN(c2ccccc2)C(=O)C1 1794960942 UUAKXAJTUVJRAB-ACHSLPGTSA-N 406.442 2.324 10 20 HECD O=C(Cc1ccccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817638654 HDRCDPZFFZXNRS-INIZCTEOSA-N 422.445 2.160 10 20 HECD CCCc1nnc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 8978224 WJFVBYQTKNIFHC-UHFFFAOYSA-N 421.482 2.451 10 20 HECD Cc1cc(C)cc(C(=O)NCC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 27071007 DGRHWLGSKXURSQ-UHFFFAOYSA-N 411.502 2.301 10 20 HECD CCN(CC)c1ccc(CNC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1F 236958644 URFPOHHXPIURCL-UHFFFAOYSA-N 423.558 2.348 10 20 HECD CCOC(Cn1cc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)nn1)OCC 726627116 FHFDJOGDBNSEGO-UHFFFAOYSA-N 417.510 2.085 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCc2cccc(OC)c2O)c1 729859209 MHVWWJMXOYZZHX-UHFFFAOYSA-N 422.503 2.370 10 20 HECD CC[C@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H](C)O1 732443564 HYBHMGYTJOTHMM-ICSRJNTNSA-N 404.555 2.416 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N(CCN(C)C)[C@@H]2CCS(=O)(=O)C2)cc1 733367951 ODGCVWIESDAZEQ-HXUWFJFHSA-N 403.548 2.285 10 20 HECD CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 742557647 VOPTTZGJZXBJGN-UHFFFAOYSA-N 415.469 2.367 10 20 HECD COC(=O)CN(CC(=O)NCc1cccc(OC)c1)Cc1cc(Cl)ccc1O 744401613 FJAZKLHXGVSFRS-UHFFFAOYSA-N 406.866 2.346 10 20 HECD Cc1cc(-n2cncn2)ccc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 745415180 YRLYREFDYHVJOQ-UHFFFAOYSA-N 407.474 2.457 10 20 HECD Cn1cc([C@H](O)CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 745906366 ZOBLFBWFQGLWGH-WMLDXEAASA-N 409.437 2.023 10 20 HECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 746173841 WWNIPKKVECETEG-FQEVSTJZSA-N 423.517 2.484 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cnn(Cc2ccccn2)c1 746433302 PVPSEMFXKCFQFX-UHFFFAOYSA-N 402.505 2.020 10 20 HECD Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227390 ICXCVRNIPIBQOU-UHFFFAOYSA-N 423.466 2.482 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H](Cn2ccnn2)C1 752651727 PEAXNYTYGZDQIB-SFHVURJKSA-N 400.552 2.453 10 20 HECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](CC)CN1C(C)=O 752901577 CLDYHAXSBNTFTL-PMACEKPBSA-N 402.539 2.454 10 20 HECD CCc1onc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 758967695 GQOMZQLNTNYPQD-UHFFFAOYSA-N 400.479 2.009 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 760568467 JERILKLXTGPWCV-UHFFFAOYSA-N 405.476 2.282 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)N(C)CC(F)(F)F)CC2)cc1 763972596 MXVDCCCBNOCEKH-MRXNPFEDSA-N 416.488 2.206 10 20 HECD O=C(NCc1cccnc1N1CCOCC1)NCc1cccc(Br)c1O 764760478 GJCDPOXOFULRTI-UHFFFAOYSA-N 421.295 2.386 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 765658972 MMMBLPOOATWKLR-KKBFJZEXSA-N 406.502 2.153 10 20 HECD NC(=O)[C@@H]1CCC[C@@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 768130144 OBIQQYNXYHZUSR-VXGBXAGGSA-N 421.409 2.144 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(S(N)(=O)=O)ccc3C)c2)CC1 770285951 IQFJMOMZCIPCPO-UHFFFAOYSA-N 402.520 2.037 10 20 HECD CC(C)N(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(C)C 774786715 BMVLRYIUYQVYSO-IBGZPJMESA-N 405.539 2.135 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCCO[C@H]3CC(C)C)CC2)cc1 775870485 MOFRANTYFDODBW-PUHATCMVSA-N 405.583 2.361 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 778930635 WGEIDOJSAQGSTO-FOIQADDNSA-N 402.447 2.444 10 20 HECD Cc1cc2c(cc1NC(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)OCO2 781457747 NUJPXSFMAYPYPW-OAHLLOKOSA-N 411.458 2.376 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NC(C)C)cc1 784562342 DSARAODLBAJIQO-UHFFFAOYSA-N 413.474 2.452 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784767566 PVJPMBKIXMFZHV-QGZVFWFLSA-N 402.882 2.468 10 20 HECD Cc1ccncc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768387 XEGBGDRZUCPHPF-MRXNPFEDSA-N 402.882 2.468 10 20 HECD Cc1cc(Br)ncc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296858 JUQDOGVGSYBSMA-JTQLQIEISA-N 408.252 2.250 10 20 HECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 787709568 XWOBXCJRHPJUIY-KDURUIRLSA-N 400.567 2.387 10 20 HECD Cc1cc(Br)cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)c1O 789775458 UPZYQDUIFQAIPP-HNNXBMFYSA-N 403.342 2.463 10 20 HECD O=C(NC[C@H](CO)[C@@H]1CCOC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797445273 SHZDLZURAVSZFV-HUUCEWRRSA-N 413.465 2.201 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1c1ccccn1)c1ccc(N2CCOCC2)cc1 803309992 FGMAQZZJGSIBLY-LAUBAEHRSA-N 408.502 2.459 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(F)ccc3F)CC2)cc1F 803661478 CRUBPKHPJOIRHX-UHFFFAOYSA-N 420.435 2.135 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@H]1CCCO1 803678146 ZBXYEUCQTHYBDV-NHCUHLMSSA-N 417.550 2.382 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(C)cc(Cl)n3)CC2)cc1 804317112 SEOSDXPYZVTWPQ-UHFFFAOYSA-N 416.909 2.453 10 20 HECD CO[C@H](C)CN(C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 804839185 ZPFWDFPMEPYVPI-GFCCVEGCSA-N 423.447 2.208 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)C[C@@H](C)C3)cc2F)CC1 805006991 BYHUFFSVASBPPL-CALCHBBNSA-N 404.530 2.088 10 20 HECD COC1(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CCOCC1 807062728 JSAUNOWFUINDBB-UHFFFAOYSA-N 404.507 2.365 10 20 HECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](COc2ccccc2)C1)c1ccc(N(C)C)cc1 807673485 UMUQTBCWUYXISL-LAUBAEHRSA-N 411.502 2.236 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 917926577 HJMITYYGHNVSFO-UHFFFAOYSA-N 423.560 2.014 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1ccc(F)c(F)c1 918280576 HDZQLWHJVAKSOT-UHFFFAOYSA-N 403.429 2.190 10 20 HECD COC(=O)C1CCN(S(=O)(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 919722228 HSVPJBOYEULVJS-UHFFFAOYSA-N 419.547 2.356 10 20 HECD COCc1ccccc1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 920254754 OBOVVSHYVLUHAD-QXMHVHEDSA-N 423.513 2.363 10 20 HECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3)CC2)c1 920257306 MIUPYIOJWDSGSW-UHFFFAOYSA-N 419.547 2.276 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)Cc3nnc4n3CCC4)cc2F)C[C@@H](C)O1 1337618469 FPVFSXAWRHEHFU-GASCZTMLSA-N 416.501 2.319 10 20 HECD COCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781754374 ZILXAZYRNZDRSC-QHCPKHFHSA-N 411.502 2.184 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCCS3)CC2)C1 1810550310 JALGYUTWQRKINR-OAHLLOKOSA-N 405.520 2.233 10 20 HECD Cc1nocc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426819 ILZYFTNHNSBAMT-KRWDZBQOSA-N 414.462 2.336 10 20 HECD CCC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 146055194 MQMFHDRMLCEOTE-UHFFFAOYSA-N 403.504 2.350 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 195561358 YXSBDILSTOXGTM-QFIPXVFZSA-N 418.582 2.051 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])nc12 725934629 GMLBXWUCWXKIQT-UHFFFAOYSA-N 422.300 2.155 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 728154380 HMGXVFWSQCMNFU-UHFFFAOYSA-N 417.393 2.248 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1 728979553 ZECVOLKJTYGEIL-HNNXBMFYSA-N 418.515 2.122 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](C)CN3CCCC3)cc2F)CC1 730119298 IVHXWACNHTXCSL-SFHVURJKSA-N 405.562 2.499 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c1 734016800 HQVOGYUOKGECOI-QFIPXVFZSA-N 409.442 2.016 10 20 HECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1 742279756 YDRNESNKSPPRMY-UHFFFAOYSA-N 412.519 2.296 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N1CCC[C@H](C(N)=O)C1 743874196 VXLKBWXZWXGUSS-OLZOCXBDSA-N 412.328 2.089 10 20 HECD CC(C)CO[C@@H](C)c1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 744854785 MRXMJYNTZFBJCG-NSHDSACASA-N 413.452 2.237 10 20 HECD COc1cccc(CNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1O 745680118 GGUPVUKTCHDAQV-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@@H](CN2CCCC2)C1 746414358 CONJHLSNVPLBRJ-SFHVURJKSA-N 404.530 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H]3C(=O)Nc4ccccc43)CC2)cc1 746608905 DCKFUGBBFWFVMB-IBGZPJMESA-N 423.469 2.013 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 751387846 XZTTXRILZAMUTF-UHFFFAOYSA-N 415.465 2.296 10 20 HECD C[C@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1cc(F)cc(F)c1O 757621404 OTSKMJHPTNDWNO-LBPRGKRZSA-N 412.462 2.320 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 763282582 GIJFBLIUYOPPFO-MAUKXSAKSA-N 418.515 2.388 10 20 HECD C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 771308863 BBCHZICQSJUAKW-LJQANCHMSA-N 417.598 2.300 10 20 HECD CCc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1S(N)(=O)=O 771944665 BFPYWAZFGMMOPW-UHFFFAOYSA-N 423.878 2.224 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(Cl)nc3)CC2)cc1 778242874 YSRFLCJYSWBIHJ-HJWRWDBZSA-N 414.893 2.265 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3c(C)noc3C)CC2)cc1 778278628 YYJCWGPRURCWEW-FEAKQIBJSA-N 412.490 2.382 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCOCC1CC1 785527680 CFHIHMXHVVSUPI-UHFFFAOYSA-N 413.312 2.436 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)cc3)cc2)CC1 786659386 JTUIVLNXXZEORJ-UHFFFAOYSA-N 403.486 2.471 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cccc(OC)c3)CC2)cc1 787157798 RGOLDVPJJGSLKQ-UHFFFAOYSA-N 411.502 2.101 10 20 HECD COc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OC)c1OC 787307880 VKHGUYLNDMWKND-CQSZACIVSA-N 415.490 2.272 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 787558268 HAKDGDZRXYSLMN-HNNXBMFYSA-N 409.490 2.407 10 20 HECD CC(C)N(CCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803312274 WPQYULIAEXALLK-LJQANCHMSA-N 418.582 2.326 10 20 HECD CCOC(=O)C1CCN(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 805135553 NXAGOOYVNCHDQA-UHFFFAOYSA-N 411.307 2.309 10 20 HECD CN(C)C(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806510895 AXJUFZBQRJMOIP-IBGZPJMESA-N 404.511 2.286 10 20 HECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289871 LIRAQBIQHGEXCK-UHFFFAOYSA-N 407.470 2.456 10 20 HECD CCO[C@H]1C[C@H](NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)C12CCC2 807607850 KVCUVPXVAREOGR-PMACEKPBSA-N 415.534 2.198 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 811695778 DQFOZQKLAZCKRD-UHFFFAOYSA-N 402.428 2.023 10 20 HECD COC(=O)c1cc(C(C)(C)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 812007277 QAMLCGCMIAOUHV-UHFFFAOYSA-N 420.441 2.171 10 20 HECD CCS(=O)(=O)N[C@@H](CCSC)C(=O)NCc1cc(Cl)cc(Cl)c1O 813684993 AEYUBPZLBWEVKA-LBPRGKRZSA-N 415.364 2.376 10 20 HECD CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(N(C)C)c(F)c3)cc2)CC1 863994168 UKUGCULZIKWHLE-UHFFFAOYSA-N 406.527 2.440 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1 913146530 AORWBZCDLIWEQD-UHFFFAOYSA-N 412.509 2.356 10 20 HECD NC(=O)C1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 914070262 ZDIKGVAARSHOCX-SDNWHVSQSA-N 423.585 2.453 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1 918461459 CZFBYHRQSIHDEY-UHFFFAOYSA-N 410.474 2.331 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]4OCCC[C@@H]4C3)CC2)cc1 1319263011 QAPOFYVOAKHFOU-DENIHFKCSA-N 416.566 2.418 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(C2CCCCC2)C1 1320399883 VBWWFODALHSJAP-WMZOPIPTSA-N 404.507 2.343 10 20 HECD Cc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816512252 KYSSCFAPSSYDRO-CQSZACIVSA-N 412.406 2.132 10 20 HECD C[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1822180357 UYFNNYWDNNKSJS-NOZJJQNGSA-N 408.842 2.161 10 20 HECD CCC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987417 SMLICWPPNZZNOK-UHFFFAOYSA-N 418.538 2.114 10 20 HECD CC(C)[C@@H](CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)N1CCOCC1 139999484 VVIAWRYXHPRKIW-GHTZIAJQSA-N 404.555 2.240 10 20 HECD CNC(=O)CNC(=O)c1cccc(NC(=O)NCc2c(C)c3ccccc3n2C)c1 505831537 MWRAUCCAGCCIJX-UHFFFAOYSA-N 407.474 2.284 10 20 HECD COc1ccc(N2CCC(Nc3ccc(S(N)(=O)=O)cc3[N+](=O)[O-])CC2)cc1 726594301 OMKWPDDFYOAEMK-UHFFFAOYSA-N 406.464 2.332 10 20 HECD Cn1nccc1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 727350476 NRRKDIXEMKBRJM-LBPRGKRZSA-N 424.548 2.070 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N(C)Cc3cnn(C)c3)ccc21 728637702 FAZLAXYJPGDJFO-UHFFFAOYSA-N 412.490 2.453 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1 728978852 QQQHXKSWIWGYFC-VIFPVBQESA-N 404.897 2.271 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1 729061579 IJSQAHZTRDQMGK-LBPRGKRZSA-N 415.421 2.483 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(OC)cc3)cc2F)CC1 730269455 YHBXQMJUMOGCJO-UHFFFAOYSA-N 407.511 2.455 10 20 HECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)C1 731217567 FEFCEXDQINYXSQ-ICSRJNTNSA-N 415.582 2.275 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1 741097400 QAQKPRPVASZYPM-UHFFFAOYSA-N 404.470 2.210 10 20 HECD CCOC[C@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 747947857 HFXBZYHBIJYSKX-IBGZPJMESA-N 404.555 2.275 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3nc4ccccc4n3C)CC2)cc1 748048654 PBHUQXVEDPAPBR-UHFFFAOYSA-N 407.518 2.363 10 20 HECD CNS(=O)(=O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC(C)CC2)cc1 749569135 NCEMZJXVMGMAMF-IBGZPJMESA-N 408.568 2.146 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnccc3SC)CC2)cc1 750253963 VKAYZINBBXAEHW-UHFFFAOYSA-N 400.504 2.490 10 20 HECD CCn1nc(C)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 751227724 KHQJWMVIJISNPG-UHFFFAOYSA-N 410.515 2.099 10 20 HECD CC[C@H](C)OCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 751875967 RVYPZDVLSRJRKE-HRCADAONSA-N 410.486 2.414 10 20 HECD COc1ccc(C(=O)CCC(=O)NCCc2ccc(O)c(O)c2)c(OC)c1OC 752595946 ITGRKVRQHBXFEW-UHFFFAOYSA-N 403.431 2.445 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 758231329 LLKYIFAZRMCKJB-GOSISDBHSA-N 405.426 2.304 10 20 HECD Cc1c(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cnn1C 760808917 VKVHTCNSNKGCEK-UHFFFAOYSA-N 406.489 2.226 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cc2C1=O 761143871 ZMSCYDBCFOZJDH-UHFFFAOYSA-N 407.470 2.154 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 763653184 CUFIMGRQSQPFCM-ZDUSSCGKSA-N 407.492 2.259 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccco3)cc2F)C[C@@H](C)O1 767515693 OYIRGLMXOFKEFB-GASCZTMLSA-N 404.438 2.434 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 773740485 PIVUKUMRSYEATI-SJLPKXTDSA-N 412.486 2.463 10 20 HECD CC(C)(C(N)=O)N1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 774444791 ARCHWZGWBQSLPK-UHFFFAOYSA-N 422.489 2.449 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(C2(C(=O)OC)CC2)cc1 775286056 ARBBGHLCTOZMLI-UHFFFAOYSA-N 405.428 2.184 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](OC)C(C)(C)C)CC2)cc1 778295895 XQTDBFFRGYCRKP-VYENPZKTSA-N 403.523 2.077 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCc4ncsc4C3)CC2)cc1 782561605 JRIOOLUIDFOSII-UHFFFAOYSA-N 401.536 2.042 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3nc4ccccc4[nH]3)cc2)CC1 786257787 SZFSWDOXQZLNPL-UHFFFAOYSA-N 405.502 2.480 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)[C@H](C)c3ccc(C)cc3)cc2)CC1 787318408 DOJJVYVMQWVEHM-JPYJTQIMSA-N 409.530 2.444 10 20 HECD CCC(CC)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788318574 FDIDPLQSAHWIJB-TZIWHRDSSA-N 417.550 2.239 10 20 HECD CCCN(CCC)S(=O)(=O)N1CCN(Cc2c(O)ccc3ccncc23)CC1 792715687 KQLVDIAJLXSVMH-UHFFFAOYSA-N 406.552 2.425 10 20 HECD CC(C)OC1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803296429 CNLVZIWFSIORTP-KRWDZBQOSA-N 403.523 2.116 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc2n1CCCCC2 804103953 ZOXZTENXEKEHST-LJQANCHMSA-N 422.533 2.264 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CC2 804363227 WQMKLQLTICOTJP-QGZVFWFLSA-N 411.506 2.085 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)NCc2cc(OC)ccc2O)c1 813673010 OYJJLDKVDQRKTI-UHFFFAOYSA-N 409.460 2.202 10 20 HECD Cc1cc(Cn2nnc(C(=O)NCc3cccc(Br)c3O)c2C)on1 816496505 MJLMLIURKGJXGZ-UHFFFAOYSA-N 406.240 2.329 10 20 HECD COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)CO2 917833928 VSHXJCBFLJUDBR-MJGOQNOKSA-N 423.513 2.264 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918294925 NHPJRAZTNRTRHT-IBGZPJMESA-N 411.458 2.497 10 20 HECD O=C(Nc1ccc2c(c1)OCCO2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295963 USNKOCKMSMUAAE-QGZVFWFLSA-N 412.442 2.310 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(CN(C)C)c3)CC2)cc1 918461458 CZCMQTQVJBJMLC-UHFFFAOYSA-N 410.518 2.434 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)Oc3ccc(F)cc3)nc12 918971910 BCZHJCZXTNINDG-LLVKDONJSA-N 403.366 2.261 10 20 HECD CCN1CCC[C@@H]1CN(CCN(C)C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1325714133 RJHKIEZYMSAESC-OAQYLSRUSA-N 405.606 2.425 10 20 HECD CCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1806328391 AYFTVAKLHNJVRS-JTSKRJEESA-N 419.485 2.290 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426119 LEUXZXVLUJQGOP-NQYLQCIDSA-N 418.538 2.100 10 20 HECD C/C=C(/C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831352430 JTFYAUBCTPCWQW-FUYANPBUSA-N 423.604 2.433 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccc2c1OCCO2 725819731 YBLDHEDXDGTEAC-UHFFFAOYSA-N 404.488 2.115 10 20 HECD O=C(CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)NCC(F)(F)F 726614282 VRPOMOZWLRWOQY-UHFFFAOYSA-N 424.370 2.235 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2CCCS2(=O)=O)cc1 732115153 UFJVGXPAYSUJLE-UHFFFAOYSA-N 417.531 2.330 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)c1 734070303 ZLDLQVVYVQCFQZ-UHFFFAOYSA-N 412.490 2.069 10 20 HECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738898417 GJJGMCSNRDQAQH-UHFFFAOYSA-N 417.487 2.030 10 20 HECD C[C@@H](C(=O)N1CC(=O)Nc2ccccc21)N(C)Cc1ccc(N2CCOCC2)cc1 741734405 FCYHROJHUJBJSX-KRWDZBQOSA-N 408.502 2.329 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NCc1cccc(OC)c1O 743179567 OVJAMERQTQGWEH-UHFFFAOYSA-N 423.491 2.372 10 20 HECD COC[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 743769735 KCWQAWQTRRLAJC-HOFZKYPUSA-N 414.574 2.243 10 20 HECD CCOC(=O)c1c(NC(=O)C(=O)NCc2cccc(OC)c2O)sc2c1CCC2 743916178 TXMVEPSYCDASHH-UHFFFAOYSA-N 418.471 2.383 10 20 HECD O=C(NCCNS(=O)(=O)c1cccs1)NCc1ccc(N2CCCC2)cc1 746715087 WYKKUFHJYVSHSL-UHFFFAOYSA-N 408.549 2.126 10 20 HECD CCN(CC)CCO[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 746760655 YSMMETRLWWZGRT-IBGZPJMESA-N 422.545 2.305 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)cs2)cc1 749153914 JKVDQHCJNGTMCZ-UHFFFAOYSA-N 404.491 2.097 10 20 HECD COC(=O)c1coc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)c1 753918093 FSRPBRPJHHYABG-UHFFFAOYSA-N 411.417 2.105 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCC(=O)NC3CCCC3)cc2F)CC1 755878849 QVQDSBLDITUDBN-UHFFFAOYSA-N 404.530 2.423 10 20 HECD C[C@H](NC(=O)N1CCN(c2ncc(F)cn2)CC1)c1ccc(N2CCOCC2)cc1 759246444 KGISFKVXORISHL-INIZCTEOSA-N 414.485 2.045 10 20 HECD COC(=O)[C@H](c1cccnc1)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759871373 AKHYGFNSTYOAOB-IBGZPJMESA-N 401.463 2.144 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)NCCCSc3nccs3)C2)nn1 763138206 DCCFKWQMGSLSLO-LBPRGKRZSA-N 410.525 2.050 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 768817444 OXTCIYKQVOUPTQ-SFHVURJKSA-N 419.522 2.455 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)CC2)cc1 769157646 XRGREONCMCHGHJ-FGZHOGPDSA-N 416.566 2.295 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(NC4CC4)s3)CC2)cc1 770084485 SRIVIBATSMLOIA-UHFFFAOYSA-N 416.503 2.232 10 20 HECD Cc1nn(C)cc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773889091 KAJMPCIDSDERAY-UHFFFAOYSA-N 406.489 2.226 10 20 HECD O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775157909 BNXHYBWIOSAQEN-UONOGXRCSA-N 401.290 2.210 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc21 776038000 BNUJDLSUVVCKEZ-UHFFFAOYSA-N 422.529 2.143 10 20 HECD CCO[C@@H](CCNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 778300495 UHJWHVKAZIUEIS-ZJVMWOEPSA-N 417.550 2.467 10 20 HECD O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NCc1ccc(O)c(O)c1 778917692 GYIXOSRRKNCFGT-UHFFFAOYSA-N 418.515 2.352 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](OCC4CC4)C3)cc2)C1 779536188 KRZFPZHFNMVTCQ-CTNGQTDRSA-N 414.550 2.489 10 20 HECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 781715185 GORDZPVRUDNZRZ-UHFFFAOYSA-N 405.520 2.168 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1 783317228 IVQRCQBPSPLNCP-OAHLLOKOSA-N 413.474 2.362 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ncn1 786115480 CNBWVQVGNJFCRW-GASCZTMLSA-N 416.453 2.011 10 20 HECD CC1(C)CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789843431 LCWXFZHZSUKWAI-INIZCTEOSA-N 405.514 2.488 10 20 HECD CN(Cc1nccn1C(F)F)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856614 WSOPGZZXVMKFOP-UHFFFAOYSA-N 423.489 2.106 10 20 HECD COCCN(C)c1ccc(/C=C2\SC(=S)N(C3CCN(C)CC3)C2=O)cn1 790107763 KLRQBKNKWSZPIY-VBKFSLOCSA-N 406.577 2.460 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3c(F)cncc3F)CC2)cc1 796626705 PMSNIEWKCDXDGM-NVXWUHKLSA-N 406.477 2.202 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 797432599 KGAJUVMEMVHKPO-VTJXTGGHSA-N 406.502 2.107 10 20 HECD C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800570318 KPLLSXHQGGTWFJ-TYILLQQXSA-N 407.942 2.468 10 20 HECD Cn1nnc2c(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ccnc21 800847816 MCRUMJAMRULOQU-UHFFFAOYSA-N 420.395 2.149 10 20 HECD CCCN1CCC(N(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803299654 NEYIQSWBCBPXFD-SFHVURJKSA-N 416.566 2.033 10 20 HECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665054 WANADLLAXFBUQX-MRXNPFEDSA-N 401.438 2.157 10 20 HECD CSCCCN(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855732 IBGAYEKDDQHQTD-UHFFFAOYSA-N 418.607 2.046 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1F 810362458 UWLOUOZYUJJLPM-SECBINFHSA-N 408.357 2.282 10 20 HECD CCCCN(C)C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 811929578 HCXJSMJAEPQZST-IEBWSBKVSA-N 403.571 2.308 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 912980555 OZTWBZKRYWYQSN-UHFFFAOYSA-N 405.841 2.421 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CN(C)S(=O)(=O)c2cccnc2)cc1 915141068 UNSGTPVUELQIMZ-UHFFFAOYSA-N 404.536 2.207 10 20 HECD CN(C)C(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918028378 WGQLAXXTHIGEBE-SFHVURJKSA-N 423.517 2.412 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3COc4ccccc4C3)cc2)C1 918123538 YROQJMLTDQSOHP-RTBURBONSA-N 408.502 2.191 10 20 HECD CCCN1CCCC[C@H]1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 1339413442 HADPUIWUFSIFKR-FQEVSTJZSA-N 403.523 2.152 10 20 HECD C[S@](=O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1357681310 NHFVFRBCMBGISC-MHZLTWQESA-N 407.458 2.110 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc21 109190891 GXPQNBKJLPHVCF-HNNXBMFYSA-N 422.485 2.037 10 20 HECD C[C@@H](NC(=O)CCNS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 145513559 MTYOAVZFUGBOFY-QGZVFWFLSA-N 417.531 2.069 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(c3nccs3)CC2)n(C)c2ccccc12 552185419 QYUCFXMQPHXBSV-UHFFFAOYSA-N 411.531 2.345 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1 729279045 YPZISCZMPMBQIZ-WFASDCNBSA-N 410.517 2.493 10 20 HECD COC(=O)c1sc(NC(=O)COC(=O)c2cc(O)cs2)c(C(=O)OC)c1C 732354688 QHTVZSSZTZAVRJ-UHFFFAOYSA-N 413.429 2.192 10 20 HECD CN(C)CCOC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 734269502 LVJCOMOUJUYZBV-UHFFFAOYSA-N 422.545 2.039 10 20 HECD NS(=O)(=O)Cc1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 735516934 BQDGGRZJFVXPQX-GOSISDBHSA-N 404.488 2.002 10 20 HECD O=C(c1ccc(CN2C(=O)CNC2=O)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 735517610 LGTKOXDKDUKBKK-IBGZPJMESA-N 423.469 2.265 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccc(CNS(C)(=O)=O)cc3)ccc21 735578315 ZAHBCCJXDSRLFF-UHFFFAOYSA-N 402.520 2.440 10 20 HECD CN1CCCC[C@@H]1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741145285 QVINNCLFCYTXQF-LJQANCHMSA-N 406.438 2.428 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 744357401 QMOFMIJHPZMRDF-JLTFKRJCSA-N 413.518 2.042 10 20 HECD CCC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCOCC1 745690826 DZBKRVUXDFUKBN-GOSISDBHSA-N 402.539 2.394 10 20 HECD Cc1nc(SCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n[nH]1 746130906 IJIMJUBWAFJVJH-UHFFFAOYSA-N 415.441 2.377 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCS(=O)(=O)N3CCOCC3)c2C)c1 749364164 RTZMNYREVXXRAO-UHFFFAOYSA-N 419.547 2.103 10 20 HECD Cc1nc(-c2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2)n[nH]1 749730737 CPSJYWOIBZALMW-UHFFFAOYSA-N 402.505 2.474 10 20 HECD C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC1 751063525 BMWLXWDAGWGFSW-ZDUSSCGKSA-N 409.533 2.469 10 20 HECD COc1ccc(N(C)CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c(OC)c1 752125615 UKVYMROVPNTFTG-UHFFFAOYSA-N 401.419 2.260 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1 752464902 XOFKFPPLPYIZHO-UHFFFAOYSA-N 411.474 2.358 10 20 HECD C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)c(F)cc1O 756562065 FKLCJQJKWUKEFU-NSHDSACASA-N 423.348 2.453 10 20 HECD CCCn1c(=O)n(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 758198538 SQTIGJYPPNPCNX-HXUWFJFHSA-N 424.545 2.405 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)C[C@@H]3CCOC3)CC2)cc(OC)c1OC 759288983 VNYKFTKXJNBLFH-CVEARBPZSA-N 407.511 2.359 10 20 HECD Cn1cc(C(=O)NCC2CCN(C(=O)NCCCSc3nccs3)CC2)cn1 759601193 KROZAZXGRDHWHY-UHFFFAOYSA-N 422.580 2.210 10 20 HECD CCc1nc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 765403468 ZGLVUABAVVRHPC-SNVBAGLBSA-N 421.504 2.426 10 20 HECD CC(C)(C)OC(=O)N1CC(OCC(=O)NCc2cccc(Br)c2O)C1 765731215 ZLJYQUIETSGQIT-UHFFFAOYSA-N 415.284 2.407 10 20 HECD CC(=O)Nc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772876946 SGQDVYUBHPLZNZ-UHFFFAOYSA-N 401.438 2.316 10 20 HECD CCC[C@@]1(COC)CCCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 773956866 BNQUNGHLQHIBJB-GMAHTHKFSA-N 405.583 2.459 10 20 HECD O=C(Cc1csc(N2CCOCC2)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 774067516 XBOGDCJDIAXLKI-GOSISDBHSA-N 417.531 2.436 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC3CCCCC3)cc2F)CC1 774500316 YHVPLXJFKDLOQG-UHFFFAOYSA-N 404.530 2.280 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCn2nc(C)cc2C)cc1F 774807453 JSPWGITYDABNSQ-UHFFFAOYSA-N 403.502 2.308 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3nc(C)cs3)CC2)cc1 778238899 RIJREIWMSFONAI-BQYQJAHWSA-N 414.531 2.024 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](CCO)CC(C)C)CC2)cc1 778324004 AQQDASWKYBXKJB-OLHLWXQYSA-N 417.550 2.061 10 20 HECD O=C(CSc1nnc2ccccn12)NCc1ccc(N2CCC(O)CC2)c(F)c1 782718204 XBQQCGXACLPINC-UHFFFAOYSA-N 415.494 2.238 10 20 HECD O=C(COC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc(O)c(O)c1 783824672 QGBALLKDQPTKGR-MRXNPFEDSA-N 413.426 2.141 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCC3(C)C)CC2)cc1 785529131 VOBVTGMMTFBDIH-FQEVSTJZSA-N 416.566 2.018 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@H]1CCN(Cc2ccccc2)C1=O 789525296 LFZATPULAMSQSB-QFIPXVFZSA-N 408.546 2.444 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(c3ccccc3)CCOCC2)cc1F 789754449 RCFBOTOEVLAQKI-UHFFFAOYSA-N 413.493 2.373 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1ccc(S(C)(=O)=O)nc1 795067783 LNEZTDMHEWYBOY-UHFFFAOYSA-N 423.560 2.296 10 20 HECD CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1ccc(N2CCOCC2)cc1 795159433 WYPFBKBFDNNMPG-UHFFFAOYSA-N 410.474 2.453 10 20 HECD Cc1oc(S(N)(=O)=O)cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 798321579 CPUDSWMWSVNXBC-KRWDZBQOSA-N 421.519 2.123 10 20 HECD C[C@@H](NC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(N(C)C)cc1 799976113 UXUCKYNZIIJWQW-MRXNPFEDSA-N 408.568 2.413 10 20 HECD Cc1c(C(=O)NCCc2ccc(O)c(O)c2)nnn1CCOc1ccc(F)cc1 800518927 KAILREOSXODZFY-UHFFFAOYSA-N 400.410 2.188 10 20 HECD CCOCc1nnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1CC 801923551 KHXDPLYIMFNGNW-UHFFFAOYSA-N 405.499 2.187 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)c2)CC1 801957820 QKWXBFMJRWICLL-UHFFFAOYSA-N 401.398 2.237 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2ccccc21 803685925 PEUVMQYUBMJAJM-QGZVFWFLSA-N 406.530 2.253 10 20 HECD C[C@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccccc1 803688614 WULJYJRDXUMFCK-LAUBAEHRSA-N 409.530 2.356 10 20 HECD CNC(=O)CC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806458583 YVMHDRFJIQZKKG-QGZVFWFLSA-N 406.502 2.253 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc4c(n3)CCCC4)CC2)cc1 807573505 UBOAPQQZOAHUIH-UHFFFAOYSA-N 422.529 2.324 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 809129390 AMJJYYRSRVJHTK-AVRDEDQJSA-N 403.523 2.054 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918439734 NCZGSSOBQOMKLZ-UHFFFAOYSA-N 413.499 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3cccc(C)c3)CC2)cc1 920252784 PFDJVRMACBUVNA-KHPPLWFESA-N 423.513 2.404 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)nn1C 1800715847 SHTZRUGXMITYQN-BTTYYORXSA-N 418.881 2.359 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C2(F)CCC2)[C@H]1c1cccnc1 1813682783 NKZPCECQTBHCLW-RDTXWAMCSA-N 414.437 2.100 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)CN3CCC(=O)NC3=O)c2C)c1 215245411 PFRURUZJVDUSCO-UHFFFAOYSA-N 411.458 2.379 10 20 HECD O=C(NCCCN1CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726718285 LEWGEHFJNMFFQG-UHFFFAOYSA-N 412.481 2.278 10 20 HECD Cc1noc2ncc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(Cl)c3)cc12 726766498 CKCVGXBBVPGSRH-UHFFFAOYSA-N 416.868 2.357 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(CN(C)C)CC3)cc2F)C[C@@H](C)O1 727932156 WIDDSZSHCUFYHZ-QZTJIDSGSA-N 420.573 2.329 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCN3CCSCC3)cc2F)C[C@@H](C)O1 732887501 JLVVHCMHBCVOBB-HZPDHXFCSA-N 410.559 2.287 10 20 HECD C[C@H]1CCCCN1C[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 733806468 DFTPVPOIEIJLFO-JKSUJKDBSA-N 409.552 2.490 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCCCSc2nccs2)cc([N+](=O)[O-])c1 733975154 XNQLCZRGVWHEFC-UHFFFAOYSA-N 401.491 2.367 10 20 HECD COCCN1CC[C@@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 736664821 KIEUINCVQMZIGZ-MRXNPFEDSA-N 412.481 2.277 10 20 HECD Cc1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 742278930 BXYUDSPUOUGSJJ-INIZCTEOSA-N 405.495 2.314 10 20 HECD Cc1nc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1C 742334670 RNIRLPMYZOQRQP-ZDUSSCGKSA-N 400.451 2.277 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)ncn4C)CC2)cc1 743896410 WWLQCSIDOODJGS-UHFFFAOYSA-N 407.474 2.259 10 20 HECD CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 748819169 GLEJZUMJUBODLU-UHFFFAOYSA-N 401.488 2.446 10 20 HECD Cn1ccnc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1=O 754618378 WMPRQYHASUVHGO-ZRDIBKRKSA-N 420.541 2.462 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cnc2N)cc1C 754747643 SRAAUCYEOSFEKR-UHFFFAOYSA-N 404.901 2.188 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(c2ncccc2F)C1 755128273 UZLTVHUYABPLLV-INIZCTEOSA-N 417.460 2.275 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 755973638 AKAADADLRXVOOS-UHFFFAOYSA-N 411.867 2.175 10 20 HECD Cc1cnn(-c2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc2F)c1 757646850 OXRAMRGYAKZAGB-UHFFFAOYSA-N 424.479 2.492 10 20 HECD COC(=O)c1cc(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc(S(C)(=O)=O)c1 758647211 AYWTWBWQKAHYFB-NSHDSACASA-N 422.459 2.474 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)c3nnc(C)s3)CC2)cc(OC)c1OC 759314900 RXHHLCVVSWFEGS-GFCCVEGCSA-N 421.523 2.465 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc2n(n1)CCCO2 761580586 VRXWMYLWDKOXFF-UHFFFAOYSA-N 410.396 2.451 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 766255935 GLGIZANXNFULTD-GOSISDBHSA-N 424.549 2.219 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCS[C@H]3COCC[C@H]32)c1 767784560 DEHHXKFNCQMXBK-UXHICEINSA-N 406.548 2.133 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1 772471579 LBURLOPZVOLNTD-GOSISDBHSA-N 408.502 2.391 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F)c1ccc(N(C)C)cc1 773847133 ODZXTNJSSGPHAZ-GFCCVEGCSA-N 407.467 2.111 10 20 HECD CC[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(Cl)c(Cl)c1O 775499291 QLCILCDDLIQYCF-AWEZNQCLSA-N 410.367 2.317 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cccc(Cl)c3O)CC2)cc1 775686253 GPHXDMWABMMUCZ-UHFFFAOYSA-N 423.966 2.450 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cc(C)oc3C)CC2)cc1 776301063 MMIIRBIWCGUIEY-UHFFFAOYSA-N 407.536 2.396 10 20 HECD C[S@@](=O)Cc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 776848742 SUUJXFRNQBRDTE-GDLZYMKVSA-N 419.522 2.269 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cn(CC(=O)C(C)(C)C)nn1 777827664 FLYNKJGCQXUTKC-UHFFFAOYSA-N 422.869 2.068 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c(OC)c1 779499271 NKAKQWNWFPDDLA-XBXARRHUSA-N 412.442 2.113 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(CC)C[C@@H](O)C(F)(F)F)cc2F)CC1 779557692 GEVWYWBETVGTRP-QGZVFWFLSA-N 420.451 2.422 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 781458713 STZLXMPXKRWCMT-HNNXBMFYSA-N 411.458 2.126 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 781458716 STZLXMPXKRWCMT-OAHLLOKOSA-N 411.458 2.126 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(N)=O)c(F)c1 783317444 VDFJHARWYNGEHC-UHFFFAOYSA-N 400.454 2.366 10 20 HECD Cn1nc(Br)cc1CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 785432540 UWOAVCSXXCXFKG-CQSZACIVSA-N 406.328 2.174 10 20 HECD O=C(NCc1ccc(O)cc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786628253 UVGSDHHNPCJZKG-OAHLLOKOSA-N 419.428 2.395 10 20 HECD CCS[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319163 AZISYPMAHJBTNA-MJGOQNOKSA-N 405.564 2.320 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(CO)c(F)c3)CC2)cc1 791301343 QLXIOYIAMLGVAW-UHFFFAOYSA-N 401.482 2.269 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)n3)cc2F)C[C@H](C)O1 792956103 JOTAPBXEXGWKII-STQMWFEESA-N 404.417 2.228 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c(O)c1 794376191 DIUHOKSQHYVSGQ-QFIPXVFZSA-N 409.442 2.016 10 20 HECD CNC(=O)[C@@]1(C)CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 797525218 FTUATLPEALUJDA-BSEYFRJRSA-N 419.481 2.247 10 20 HECD CNC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803677106 FXOFXZZEMDNLLM-QHCPKHFHSA-N 414.550 2.056 10 20 HECD C[S@](=O)C1(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CCC1 809897332 YSZLBJZQZDWREG-NDEPHWFRSA-N 406.548 2.471 10 20 HECD Cn1nc(C2CC2)nc1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472005 DMCMKSBNCLNCIQ-INIZCTEOSA-N 403.914 2.375 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456543 IITPJLKZGQARTL-UHFFFAOYSA-N 424.423 2.391 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)[C@@H](C)N2CCN(c3ccc(OCC)cc3)CC2)C1 1319715410 RROPQSRBNNKJBR-MOPGFXCFSA-N 417.550 2.398 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)C(F)F)C2)CC1 1809142567 KMGRLSIDGQGVRP-UHFFFAOYSA-N 418.444 2.276 10 20 HECD CC1(C)CC(=O)c2cc(C(=O)NCc3ccc(N4CCOCC4)cc3)c(=O)[nH]c2C1 111151883 UYYSAOJDRJUOPO-UHFFFAOYSA-N 409.486 2.297 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(CC(F)F)CC1 142811300 WFJBPSCESMQPLP-UHFFFAOYSA-N 414.472 2.316 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1OC(F)F 147128068 QZFCZYNOAMKGFV-UHFFFAOYSA-N 405.401 2.380 10 20 HECD CCC[C@@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CCN1CCOC 673314310 DNJMAIHWIOLWFV-GOSISDBHSA-N 414.550 2.062 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCOc2ccccc21 728189015 ZAIJHNPFOKEZMT-IBGZPJMESA-N 400.500 2.104 10 20 HECD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 728518278 DZOVQDGVTUYOOG-OAQYLSRUSA-N 414.550 2.199 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(O)nn2)NC(=O)OC(C)(C)C)cc1 742752822 HKXDXTSJLSYVIG-MRXNPFEDSA-N 401.467 2.244 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1 743203678 JQQZTVQYJSLCLH-UHFFFAOYSA-N 407.540 2.438 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)Cc2ccon2)c(C)n1-c1ccc(F)cc1 750081220 RUYSYWZHSOVZHG-UHFFFAOYSA-N 420.466 2.071 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C)nc3N(C)C)CC2)cc1 750232539 HUVUFQVLDWBCDV-UHFFFAOYSA-N 411.506 2.188 10 20 HECD COCCn1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 751249656 XXMQNIKDCCVUIH-UHFFFAOYSA-N 420.381 2.465 10 20 HECD C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758390333 VMVYPPYKGIGWFC-FXAWDEMLSA-N 415.582 2.260 10 20 HECD COc1cc(N2CCN(C(=O)NCCOCC(F)(F)F)CC2)cc(OC)c1OC 759222917 ZBXGQLKPVKCMLU-UHFFFAOYSA-N 421.416 2.123 10 20 HECD COc1cc(N2CCN(C[C@@H](O)COc3ccccc3)CC2)cc(OC)c1OC 759878232 JJTUHCBGASYZQV-GOSISDBHSA-N 402.491 2.274 10 20 HECD Cc1cc2c(=O)n(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc2s1 760315732 JPWVBACYUPEMFE-UHFFFAOYSA-N 416.478 2.059 10 20 HECD COC(=O)C1CCC2(CC1)NC(=O)N([C@H](C)c1ccc(N3CCOCC3)cc1)C2=O 761155439 DLZSONIYVOGSEW-RMQYNXQMSA-N 415.490 2.238 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)cc1 763215253 PXKUNZOEMVFGLM-UHFFFAOYSA-N 415.515 2.201 10 20 HECD CS(=O)(=O)Nc1ccc(OCCNCc2ccc(N3CCOCC3)c(F)c2)cc1 773425553 IULSQKMERWSIEU-UHFFFAOYSA-N 423.510 2.202 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)N3CCCCC3)CC2)cc1 774890588 PXFYYYSSPLTVFD-UHFFFAOYSA-N 416.566 2.115 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc(C4CC4)nc3)CC2)cc1 778258329 QALFMPBOQSITFB-CMDGGOBGSA-N 407.474 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cc(F)ccc3F)CC2)cc1 778264101 WICPKSFLTYCBCF-CMDGGOBGSA-N 415.440 2.495 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1 784023575 DMIWFYBZIBLAQP-UHFFFAOYSA-N 413.474 2.237 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(N(C)C)cc1 786121018 SMBIPVOHNIQZQH-QGZVFWFLSA-N 405.502 2.474 10 20 HECD Cc1cnc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 789840608 KLACGQGLKDPECR-CYBMUJFWSA-N 420.510 2.045 10 20 HECD O=S(=O)(c1ccnc(NCc2ccc(N3CCOCC3)cc2)c1)N1CCCC1 791407387 HTYVMBRCMOEMKY-UHFFFAOYSA-N 402.520 2.315 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1O 792340878 LPFDTBRFIPHOMI-UHFFFAOYSA-N 400.435 2.058 10 20 HECD O=C(COC(=O)CCc1cnccn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 795921401 FSOIMTXCABCDGC-UHFFFAOYSA-N 415.405 2.367 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 797618995 SUTGTXNPVKQJMR-AWEZNQCLSA-N 419.503 2.085 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451259 IATWDXKZHDCWHA-UKRRQHHQSA-N 411.449 2.057 10 20 HECD O=C(N[C@H]1CCc2c(O)cccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804399652 AYORWTIQPJMRKQ-APWZRJJASA-N 410.470 2.409 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1F 806044124 YMVAGYCYWKWGHH-UHFFFAOYSA-N 410.493 2.196 10 20 HECD COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1cc(Cl)cc(Cl)c1O 807834800 RCBPEDIUZRRMAZ-UHFFFAOYSA-N 405.259 2.285 10 20 HECD CC[C@@H]1C[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852474 UQQLFBOIWXUQDX-WIYYLYMNSA-N 412.578 2.482 10 20 HECD COC(=O)CC[C@]1(C)NC(=O)N(CN(C)Cc2ccc(N3CCCCC3)cc2)C1=O 811730722 LLDPHFLZIQMOHV-QFIPXVFZSA-N 416.522 2.330 10 20 HECD O=C(CN1CCC(F)(F)[C@@H](CO)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 812859717 KJRJCLJXLSWGPK-CYBMUJFWSA-N 414.408 2.350 10 20 HECD CN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1cc(Cl)cc([N+](=O)[O-])c1O 816624916 LFVOWTMXOVGIHL-UHFFFAOYSA-N 415.855 2.112 10 20 HECD O=C(CN1CCO[C@@H](c2ccccc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 917047697 CRHJQXIZYGUOMN-JOCHJYFZSA-N 413.493 2.352 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COc4ccccc4C3)cc2)C1 918117374 DAJMOSBKDNTWAT-QUCCMNQESA-N 422.529 2.439 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cccc(N4CCNC4=O)c3)c2)CC1 1116108996 LHPAWSBRGDCEJP-UHFFFAOYSA-N 407.474 2.170 10 20 HECD CCOc1ccc(N2CCN(C(=O)CN3C(=O)c4ccc(C)cc4C3=O)CC2)cc1 1319626430 WAETYEWKFNRSFV-UHFFFAOYSA-N 407.470 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)cc1 1335807898 DVUGSYSHBOOYQY-INIZCTEOSA-N 419.547 2.122 10 20 HECD Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)o1 1788193421 APYZMSWKNDWZAD-UHFFFAOYSA-N 423.429 2.175 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1C[C@@H]1C1CC1 1796931199 SYOIHEJPXVSAQK-JUSBFGHESA-N 420.513 2.464 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccncc3F)CC2)C1 1810551383 JGIHRILXFJBRRC-UHFFFAOYSA-N 414.437 2.186 10 20 HECD O=C(Cc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425847 AZKRYSILUDHNCG-LJQANCHMSA-N 424.501 2.364 10 20 HECD CCc1n[nH]c(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)n1 11715725 ANVYMKQTYOAKRW-UHFFFAOYSA-N 419.532 2.397 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc2c(c1)OCCO2 15360916 RWJZRPZSHYFVQT-UHFFFAOYSA-N 404.488 2.115 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCn1cnc2ccccc2c1=O 27156100 JSHWCRSFSZOXPL-UHFFFAOYSA-N 406.486 2.282 10 20 HECD O=S(=O)(NC[C@H]1CCCO1)c1ccc(CNCc2ccc3c(c2)CCO3)cc1 238053815 UURQREGEZDMVSP-LJQANCHMSA-N 402.516 2.369 10 20 HECD C[C@H](c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1)N1CCOCC1 729784816 ULMVLKKKBMCUHK-QGZVFWFLSA-N 410.518 2.401 10 20 HECD CCC(CC)N1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 731808114 GQLWOQNRWAJMEP-INIZCTEOSA-N 405.514 2.440 10 20 HECD CCn1nccc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 746422029 LUIRZLVDMSXROA-ZDUSSCGKSA-N 407.421 2.228 10 20 HECD C[C@@]1(c2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)NC(=O)NC1=O 748041338 YJSBQZNMMFSUAP-MBSDFSHPSA-N 423.469 2.268 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4ccccc43)cc2)C1 748626356 LMBOSTYLSBJZMW-QFBILLFUSA-N 406.486 2.131 10 20 HECD O=C(N[C@@H]1CCN(C2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751062346 DAWUHJNATZZTMY-CYBMUJFWSA-N 407.517 2.221 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(OC(C)(C)C)CC3)CC2)cc1 754060804 JXXZKXYOGZUUSV-FQEVSTJZSA-N 405.583 2.458 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H]1C 754388866 WMZSTBXDWISQGY-KURKYZTESA-N 406.546 2.082 10 20 HECD CNS(=O)(=O)c1ccc(N(Cc2ccccc2O)C[C@H]2CCCO2)c([N+](=O)[O-])c1 762180805 WSHJFIZIJNIZLG-OAHLLOKOSA-N 421.475 2.394 10 20 HECD COc1ccc(O)c(CN2CCN(C(=O)c3ccc(OC)c(OC)c3OC)CC2)c1 775735623 YZGRQUBRTZPRGT-UHFFFAOYSA-N 416.474 2.385 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)C1=O 777459320 NUTUDLXLXJRJBM-INIZCTEOSA-N 406.502 2.061 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc4c(c3)COC4)CC2)cc1 778389020 CCZZFICYLOTDFA-CMDGGOBGSA-N 421.497 2.247 10 20 HECD CCOCCC1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778394662 WUHNSDRJAYXEHF-HJWRWDBZSA-N 415.534 2.223 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@H]3CCO)CC2)cc(OC)c1OC 779710227 AAUKHGYCSZCNFV-DOTOQJQBSA-N 407.511 2.095 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccnc2-n2cncn2)cc1 784108515 YURJWKHKKYURNR-UHFFFAOYSA-N 405.462 2.406 10 20 HECD COCC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 785933553 RQGRRRGBJFQDFT-UHFFFAOYSA-N 413.497 2.375 10 20 HECD CC(C)CCOC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788312841 NGLHSFGXWVXBJJ-UHFFFAOYSA-N 417.550 2.193 10 20 HECD CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813306 SQMRUWJKJSCLGQ-LJQANCHMSA-N 413.493 2.416 10 20 HECD CCOC(=O)[C@]1(C(C)C)CC(=O)N(CN(C)Cc2ccc(N3CCOCC3)cc2)C1 795400342 IYFNBUIVMKQOSC-HSZRJFAPSA-N 417.550 2.350 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@H]2CCN(Cc3cc4c(cc3O)OCO4)C2)CC1 795741937 GEUFDCQHJPOBAX-INIZCTEOSA-N 405.495 2.248 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3c(F)cncc3F)CC2)cc1 796626706 PMSNIEWKCDXDGM-RDJZCZTQSA-N 406.477 2.202 10 20 HECD CC(C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 796680172 ZCMPGSSZTKBYRN-HUUCEWRRSA-N 417.485 2.472 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H]4NC(=O)OC[C@H]4C3)cc2F)C[C@@H](C)O1 798373297 VUPLPAWHUZEJDK-SZXPJGKVSA-N 420.485 2.079 10 20 HECD CNC(=O)CNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCC3)cc2)c1 800596747 PUDWGAJBDLUENK-UHFFFAOYSA-N 409.490 2.084 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@](F)(CO)C1 801996146 GGUOSMJSFCJNOB-QGZVFWFLSA-N 405.392 2.158 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCc2ccccc2OC1)c1ccc(N2CCOCC2)cc1 803309223 RVRGEJSJBKDHFT-PXNSSMCTSA-N 423.513 2.210 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)C3CCCCCC3)CC2)cc1 803747529 QZIXXMVPRYLECK-UHFFFAOYSA-N 416.566 2.115 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)CC[C@@H]3C)cc2F)CC1 805007939 VNEZMCLHGBGJFW-SJORKVTESA-N 404.530 2.231 10 20 HECD CCN(CC)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805019394 GESYFYXBBDEJKE-NRFANRHFSA-N 400.567 2.482 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 808079148 QKHDQJNOAYWGSZ-FXAWDEMLSA-N 417.550 2.444 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cc(C)n(-c3ccccn3)c2C)NC(=O)N[C@H]1C 914908182 XVZCJEPSBXSDCR-ZDUSSCGKSA-N 412.446 2.164 10 20 HECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 920036951 JSTSVQGBYOBDLN-XGCMIMOYSA-N 407.470 2.154 10 20 HECD CC(C)CN1C(=O)/C(=C/Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)C(=O)NC1=S 920980142 YYLZXKGNSKJPJM-MDWZMJQESA-N 414.447 2.180 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCCN2C(=O)NC(C)(C)C2=O)cc1 1263758042 NBHRWDXTAFMITN-UHFFFAOYSA-N 403.527 2.395 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]c(Br)c3)cc2)CC1 1323326394 DUTXWZTXRYEDND-UHFFFAOYSA-N 405.296 2.376 10 20 HECD O=C(Cn1cccn1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426392 IPEZUOTXQMSDQV-UHFFFAOYSA-N 407.430 2.137 10 20 HECD CC1=CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC1 1797701311 YKYWTWLAKBCTLF-JONQDZQNSA-N 421.588 2.231 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(O)cc1 1804288806 JCWJGSPEFBRNRV-FUEIOIHSSA-N 424.453 2.474 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C23CC(C2)C3)[C@@H]1c1cccnc1 1813642771 QNNZHFTVLXGWBO-YUABNYNKSA-N 408.458 2.008 10 20 HECD CCc1nc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)co1 1844528919 GAPKYKIOGFVEJK-UHFFFAOYSA-N 405.838 2.432 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2C=CCN2)C3)cc1 1845398487 SRXJPTDNFFAOLB-NRFANRHFSA-N 404.514 2.439 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CC(=O)N2CCCC2)c([N+](=O)[O-])c1Br 22077626 IMDRNHJUYSCVDY-UHFFFAOYSA-N 417.216 2.333 10 20 HECD O=C(NCC(=O)N1CCCc2ccccc21)NCc1ccc(N2CCOCC2)cc1 726236711 QTAKXSNTQBIGAC-UHFFFAOYSA-N 408.502 2.302 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(C)c(C(N)=O)c3)n2)c[nH]1 727247572 CYHVVNNUJUDGDU-UHFFFAOYSA-N 420.472 2.133 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1 728943986 HCOUPOODQVDPAP-OAHLLOKOSA-N 413.474 2.434 10 20 HECD Cc1cc(C(=O)COC(=O)C2(O)CCOCC2)c(C)n1-c1ccc2c(c1)OCCO2 729023470 CUGAKALCSOTBDC-UHFFFAOYSA-N 415.442 2.133 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)c1 734067260 MQIJWWCFRMRLRN-UHFFFAOYSA-N 421.519 2.477 10 20 HECD CCc1ccccc1NC(=O)CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 741735812 MXKXMKAFHQBRBB-UHFFFAOYSA-N 424.545 2.272 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1c(F)cc(F)cc1F 743887381 KVSHMXNGSPPZBX-UHFFFAOYSA-N 411.355 2.335 10 20 HECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccc(F)cc21 744423870 PKYMRLCXWVEDGG-UHFFFAOYSA-N 416.472 2.374 10 20 HECD Cc1cc(C(=O)CN2[C@H]3CC[C@H]2CC(=O)NC3)c(C)n1-c1ccc2c(c1)OCCO2 748828663 BKSNKONBNQCSSS-WMZOPIPTSA-N 409.486 2.401 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1 749239233 HSUBCIHGUAWSOY-CQSZACIVSA-N 420.491 2.156 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)c(OC)c1 752108941 DLPOAJZYNADRFS-QGZVFWFLSA-N 424.563 2.488 10 20 HECD C[C@H]1NC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NN(c2ccccc2)C1=O 752149429 MHBOHCPTWBQWNA-APWZRJJASA-N 422.485 2.238 10 20 HECD COc1ccc(N2CCN(C(=O)CCOc3ccc(C(N)=O)cc3)CC2)cc1F 753730323 HLAJPVOFBFDKDQ-UHFFFAOYSA-N 401.438 2.051 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNc2ccccc2C(N)=O)cc1 754295454 WNUGQDSOOXBRCB-IBGZPJMESA-N 410.518 2.471 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(OCCO)CC1 757123525 ZCDCSOFHLITYRH-HNNXBMFYSA-N 422.481 2.262 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(S(C)(=O)=O)c3ccccc3C2)cc1F 764374175 WJYMHBWHHJTMFF-UHFFFAOYSA-N 420.510 2.383 10 20 HECD C[C@@H](NCCc1ccc(S(N)(=O)=O)cc1)c1ccc(N2CCOCC2)c(F)c1 764807243 CVLYPBOALKGKDQ-OAHLLOKOSA-N 407.511 2.203 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)cn1C 774144771 JPNAJNBSVNDGCG-UHFFFAOYSA-N 400.479 2.303 10 20 HECD O=C(Cn1ccnc1[C@@H](O)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 777526933 ODTRDXUZABXOSQ-QFIPXVFZSA-N 424.476 2.257 10 20 HECD COCCOc1ccc(F)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 786724829 SAVBOVOEHOZUAS-UHFFFAOYSA-N 418.468 2.023 10 20 HECD C[C@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 787909233 LDGJDGQFMLYYHU-SFHVURJKSA-N 400.567 2.314 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2ccccc2F)CC1 788936972 LPBDUBMCBNBWIX-UHFFFAOYSA-N 410.493 2.391 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](CC(=O)NC)c2ccccc2)cc1 788951396 JTLLEWLOTLNGHT-HXUWFJFHSA-N 410.518 2.143 10 20 HECD COC(=O)Cn1ncc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)c1C 797065961 OCSHUXCVIQBVSH-UHFFFAOYSA-N 413.478 2.109 10 20 HECD O=C(NC[C@H](CO)[C@@H]1CCOC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 797466763 QTAPMTHDBWZIJL-BZUAXINKSA-N 413.465 2.201 10 20 HECD CC(C)C[C@@H]1C[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803297687 CXGRSAVAFANRSM-YFVAEKQCSA-N 417.550 2.410 10 20 HECD COC(=O)N1CCC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1 804016073 JOBREOTULQZJLK-KRWDZBQOSA-N 417.506 2.401 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1 807096922 LUHYAJWAGHMZKU-INIZCTEOSA-N 418.538 2.050 10 20 HECD Cn1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(C(F)(F)F)n1 807387518 MEVMGNVINGQWCN-UHFFFAOYSA-N 421.173 2.162 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1cccc(N2CCNC2=O)c1 807511829 XIIUHKQZDYZMFT-UHFFFAOYSA-N 423.256 2.484 10 20 HECD NC(=O)[C@@H]1CC(C(=O)NCc2cc(Cl)cc(Cl)c2O)=NN1c1ccccc1 807838843 SGLLUTFPZAPKLA-HNNXBMFYSA-N 407.257 2.435 10 20 HECD CC(C)CN(C(=O)/C=C/c1cnn(C)c1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 917109375 LVAJJCDVIFJTJM-MDZDMXLPSA-N 422.489 2.015 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1323425290 IWHLNXMHJDHZDT-UHFFFAOYSA-N 404.511 2.031 10 20 HECD CC(C)O[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798548756 MIUXNPIKBVTTKN-MAOAGRFFSA-N 418.490 2.268 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1Cl)c1cc(O)nc(O)c1 1798671406 HLYGXQRDHVUCCM-CLLJXQQHSA-N 402.838 2.107 10 20 HECD CC(=O)C[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291209 GNWMQQZJYFPHQN-JSJFOREKSA-N 416.474 2.070 10 20 HECD Cc1cscc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804333676 OXAGQSCVERJIGQ-CLLJXQQHSA-N 423.585 2.169 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)C1 1810554624 QFYXVXMBLMBIAH-QGTPRVQTSA-N 415.515 2.213 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cscn2)CC1 1825986521 CJEHJXWHIWYQCT-MRXNPFEDSA-N 416.503 2.496 10 20 HECD O=C(/C=C/c1cccnc1)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848241360 YVCFTOYUNAGWDR-AFYZHXHOSA-N 421.453 2.127 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)Cc2ccc([S@](C)=O)cc2)n(C)c2ccccc12 564604188 PGPAGFXGJQRFRH-LJAQVGFWSA-N 411.527 2.499 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729032963 FIMKPXMULLSWNZ-GFCCVEGCSA-N 401.419 2.186 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 734404567 LFFRBBXRAKQLIQ-JOCHJYFZSA-N 412.465 2.284 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 734702320 WOVIHSQSFXJPSN-HXUWFJFHSA-N 424.501 2.433 10 20 HECD CCOc1ccc(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c(O)c1 735087112 WVRHEBUMUHAIAY-UHFFFAOYSA-N 419.547 2.017 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CC(=O)N(CCN4CCOCC4)C3)c2C)c1 735822629 FXZVCNCTSWTYNX-FQEVSTJZSA-N 424.545 2.065 10 20 HECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741096679 AKQCKFIWRDSIBX-UHFFFAOYSA-N 406.486 2.376 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@](C)(O)c3ccco3)CC2)cc1 745349464 IHLHFJBNQKCZCA-JOCHJYFZSA-N 416.522 2.007 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCCN1CCC[C@H](C(N)=O)C1 745831990 ZAZVJYSVTAFFSJ-FQEVSTJZSA-N 415.582 2.406 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(CN2CCOC2=O)cc1 749730808 FIEWPOLICHNGTK-UHFFFAOYSA-N 420.516 2.332 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)c4ccccc4oc3=O)nc12 754613078 GFNYCPKEMQSSEH-UHFFFAOYSA-N 423.381 2.383 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(OCCO)CC1 757122164 VVKFODUVEQKQTM-OAHLLOKOSA-N 422.481 2.262 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-c4nnc(C)o4)cc3)nc12 758973108 UAOANRAPWIHNRY-UHFFFAOYSA-N 423.385 2.327 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)[C@]12CCCO2 759321593 YAYIYHRAGRIZDF-SFHLNBCPSA-N 407.486 2.393 10 20 HECD CC(C)OC(=O)[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759793803 YGBIHJOEMXNWNK-BBWFWOEESA-N 423.529 2.327 10 20 HECD CCCNC(=O)CCCC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760088475 VKKCHFQPVWZWSY-UHFFFAOYSA-N 407.511 2.058 10 20 HECD CN(C)C(=O)NCCN(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 763111409 VLYNZNKPGRFYSS-AWEZNQCLSA-N 413.469 2.169 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](O)c3cccc(OC)c3)cc2F)CC1 764997872 REPBPBWKRATYBX-OAQYLSRUSA-N 401.482 2.326 10 20 HECD COCCNC(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1Cl 765053104 IREOMZSBGIQWOR-UHFFFAOYSA-N 410.839 2.053 10 20 HECD C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769957277 KQUOZXBBOKUYKR-KXBFYZLASA-N 417.531 2.404 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 774362884 GTRLCOJMVOPHRZ-UHFFFAOYSA-N 407.430 2.058 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCC(C(=O)NCCCOC(C)C)CC2)c1O 774836565 SSTKWTAWNNAFEP-UHFFFAOYSA-N 409.483 2.452 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 775122178 QRCFKUXYVHQJCU-UTKZUKDTSA-N 407.514 2.374 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1 785425205 YIRNWJYYXUANJN-KRWDZBQOSA-N 418.538 2.132 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3C)cc2)CC1 786122573 UGFWOWMEFJUDDC-UHFFFAOYSA-N 401.532 2.283 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCCN1CCc2ccccc2C1 787707487 GJGYECXLMXHZGL-UHFFFAOYSA-N 418.588 2.306 10 20 HECD C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788311218 RXKAVFXPYHIKBA-DYESRHJHSA-N 408.502 2.144 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788911625 PWAVWKKNZIRWLQ-HSZRJFAPSA-N 415.534 2.341 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 789840185 GRDSGMDKIWJWIA-RCCFBDPRSA-N 417.525 2.488 10 20 HECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 789969609 WOAGZCZRNGSOBC-NQIIRXRSSA-N 416.566 2.018 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C 790009134 BHKKEJUJTFHRET-AWEZNQCLSA-N 424.803 2.250 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc4c[nH]nc4cc3C)CC2)cc1F 792241837 KGRCTLMSBJOHIC-UHFFFAOYSA-N 411.437 2.306 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3[C@@H]4[C@@H]5[C@H]6[C@H]7C[C@@H]5[C@H]3[C@@H]7C[C@H]64)nc12 796322710 LRWMPCGDSBUDSE-NNLVBVCTSA-N 409.442 2.049 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c(O)c1 797390487 HGJBYPCGNTVPTE-UHFFFAOYSA-N 421.881 2.250 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCN(C2CCC2)C1 803663130 KDOBERMXLMDTLG-NVXWUHKLSA-N 404.530 2.277 10 20 HECD O=S(=O)(NCc1cc(Cl)cc(Cl)c1O)c1ccc(-n2cnnn2)cc1 805135139 HAEFIYGSNXNLMM-UHFFFAOYSA-N 400.247 2.153 10 20 HECD NC(=O)c1cc(OC2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)ccn1 809750874 ANICVYJSGCSGJD-UHFFFAOYSA-N 406.826 2.491 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 810404768 XQHPCLLCLCGBBY-UHFFFAOYSA-N 419.286 2.302 10 20 HECD CC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 914788201 BUKBPSVFDFTFNT-KRWDZBQOSA-N 405.520 2.035 10 20 HECD CNC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 918455851 FODAGDCRDBHUEB-UHFFFAOYSA-N 408.502 2.171 10 20 HECD CCOC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 919969332 JVWQEYKFPIFBJZ-INIZCTEOSA-N 407.486 2.272 10 20 HECD NC(=O)[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccccc1 920058676 AZSMAKGMKNCTOA-OAQYLSRUSA-N 420.492 2.259 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(Cc2ccccc2)n1 1321366273 IQRUWCWIXYYFAS-SFHVURJKSA-N 409.442 2.247 10 20 HECD C[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294894 VKZLNSKFPQNWJF-RNCFNFMXSA-N 408.842 2.161 10 20 HECD COc1ccc(N2CCC(NC(=O)CCNC(=O)c3n[nH]c4ccccc34)CC2)cc1 728078456 ZUZMXBYORMNJFI-UHFFFAOYSA-N 421.501 2.477 10 20 HECD Cc1cc(C(=O)N2CCN(CC(N)=O)CC2)c(C)n1-c1cccc(Br)c1 729344423 HBRNVVVYEMMBRC-UHFFFAOYSA-N 419.323 2.100 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1 729535258 OIKSPSYPRDXJRV-CRNXPOROSA-N 420.531 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nc(=O)ccn3C3CC3)CC2)cc1 729820508 KOKPSFIXBUNPJI-UHFFFAOYSA-N 400.504 2.028 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 730281222 RGPPQTIKIGDZLH-HNNXBMFYSA-N 423.517 2.135 10 20 HECD CCN1C(=O)c2ccc(C(=O)NCc3ccc(N(C)C)cc3C)cc2S1(=O)=O 734405151 FJDWWIGQXHEHEQ-UHFFFAOYSA-N 401.488 2.155 10 20 HECD C[C@@H](OC(=O)c1ncccn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 741037216 PYEDLBJJIQOABW-GFCCVEGCSA-N 401.378 2.436 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 742563124 FLPDAOICKJEYFA-VURPSTOHSA-N 413.518 2.042 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C3CC3)[C@H](C)O)c2C)cc1 745741227 AOBKNWZHBALZHT-KKSFZXQISA-N 412.486 2.404 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(-c4ccccn4)no3)cc2)C1 746146685 IXOLKQWMMQNMSV-MRXNPFEDSA-N 405.458 2.368 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1C(=O)N(C)C 751816618 BDUSXOTWPMJLIN-UHFFFAOYSA-N 400.454 2.157 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC([C@]3(C)NC(=O)NC3=O)CC2)cc1 754362001 IXFLMFNOGKZMPZ-NRFANRHFSA-N 401.511 2.053 10 20 HECD CN(C[C@H](O)C(F)(F)F)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758478070 LAPYGVAJIDBZSB-LBPRGKRZSA-N 424.422 2.250 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1S(C)(=O)=O 758959831 CNXWVDPCYZSYJF-UHFFFAOYSA-N 415.515 2.254 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCN(C4CC4)C3)CC2)cc(OC)c1OC 759278288 LWNWSZZDTHVGAY-INIZCTEOSA-N 418.538 2.028 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@@H](N(C)C)C3)CC2)cc(OC)c1OC 759293353 KHRKTDAMECKNND-IAGOWNOFSA-N 420.554 2.417 10 20 HECD CO[C@@](C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1F 760147615 FXDUQCTTYUGWOP-OAQYLSRUSA-N 420.506 2.239 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)CC2)cc1 760910235 UHPRCKYIYURCFB-YPAWHYETSA-N 416.566 2.464 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 764681660 DTGIQFNEICKVKK-YRNRMSPPSA-N 423.529 2.416 10 20 HECD O=C(NCC1(N2CCOCC2)CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 764832453 YCGFLBCJWVHUOK-MRXNPFEDSA-N 424.492 2.421 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC2(C1)OCCO2 764876063 LDQXOSAGEJWAQB-UHFFFAOYSA-N 424.500 2.234 10 20 HECD CCC[C@H]1C(=O)NCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 766257101 NTCYBXISWGFLIU-SFHVURJKSA-N 405.454 2.001 10 20 HECD CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1cc3c(cc1O)OC[C@H]3O)CCC2 768462601 OAWJQIXRKJOLQF-LJQANCHMSA-N 404.488 2.021 10 20 HECD CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769732910 SONJLRYFJMILKY-UHFFFAOYSA-N 409.483 2.107 10 20 HECD COC1(CO)CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 770495394 MXIPKZMKEVDAEN-UHFFFAOYSA-N 413.465 2.440 10 20 HECD CC(C)C[C@H]1OCCC[C@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775868920 FNKRTLZHHPVAGN-TZIWHRDSSA-N 407.530 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)CC(=O)N4)CC2)cc1 778277881 QKHBSPWVCMZUCE-HJWRWDBZSA-N 420.469 2.033 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)Cc3cccc(O)c3)CC2)cc1 778388170 CPDHZZYDGCTPDS-LENZSSGSSA-N 423.513 2.353 10 20 HECD COCc1nc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)no1 782177236 XSYZQSMJBLHNGV-UHFFFAOYSA-N 423.337 2.257 10 20 HECD CCOC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785302737 FOYLHMXOQWHGJW-LBPRGKRZSA-N 401.419 2.352 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC[C@@]1(N(C)C)CCSC1 788257013 ZNBQNYSOGFJSFV-QFIPXVFZSA-N 418.607 2.189 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccccc1F)C1CC1 788309603 FFDRUEVSMIHENQ-UHFFFAOYSA-N 411.477 2.470 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCc4c3cnn4C)cc2)CC1 789591360 NPVYMRKCBLDPGO-FQEVSTJZSA-N 409.534 2.466 10 20 HECD COc1cc(N2CCN(C(=O)c3cn(C(C)(C)C)nn3)CC2)cc(OC)c1OC 790889035 OAJFNOZDUILAFA-UHFFFAOYSA-N 403.483 2.021 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)N1CCN(C)CC1 791250273 OWQYQRVJNIWJAM-QGZVFWFLSA-N 404.555 2.011 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1C(N)=O 797021489 POSDWGYFDIYNFF-CQSZACIVSA-N 412.490 2.455 10 20 HECD COc1cncc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 798429974 UZBRUPTVWYSYOE-ZIAGYGMSSA-N 409.483 2.321 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@H]1OC 803298243 RQQJIXGPGMVIRJ-PWIZWCRZSA-N 417.550 2.410 10 20 HECD CO[C@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 803448545 TYIYRVQBUCIMHB-QGZVFWFLSA-N 413.465 2.160 10 20 HECD CO[C@H](C)c1nc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cs1 803686333 HVGKLCBCZHJMAF-CYBMUJFWSA-N 402.520 2.166 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806276744 TVHNRHVZTCTCDG-GOSISDBHSA-N 413.565 2.179 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)C12CCC2 807607852 KVCUVPXVAREOGR-VQTJNVASSA-N 415.534 2.198 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1)c1ccc(N(C)C)cc1 807672892 JZYCWFZMAITVHW-WYTFLKLQSA-N 410.518 2.271 10 20 HECD CC(C)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccnc1 809248020 LYDFEMIVVQFWNF-QFIPXVFZSA-N 424.545 2.433 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1 809325863 FOLVOLPCSCNRFL-UHFFFAOYSA-N 424.545 2.443 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNCc3cnc(C4OCCO4)s3)cc2)C1 809632320 NYEBIWPIEHLVGI-OAHLLOKOSA-N 402.520 2.180 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1F 810362459 UWLOUOZYUJJLPM-VIFPVBQESA-N 408.357 2.282 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1C 815062562 MLUXVTPCGXUAEO-KBPBESRZSA-N 403.454 2.494 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c1O 815510328 RYNKDFUFIQAUBG-ACJLOTCBSA-N 411.458 2.417 10 20 HECD O=C(CNS(=O)(=O)c1ccccc1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364590 JKZQVOUBDITEIE-INIZCTEOSA-N 422.478 2.017 10 20 HECD CCC(=O)N1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 917406264 PNABKUQEYRLQNO-UHFFFAOYSA-N 419.481 2.345 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3nnc4n3CCCC4)cc2F)C[C@@H](C)O1 918216071 LRZOSJXZPHYZGD-HUUCEWRRSA-N 416.501 2.367 10 20 HECD Cc1ncncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800716672 SNMOQAPKETWVRY-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)c3nc[nH]n3)C2)CC1 1810377772 AZYGGBURHDRPHA-UHFFFAOYSA-N 419.869 2.028 10 20 HECD C/C=C(/C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499535 LOWIMTQVSOMPQM-BXVXIVLCSA-N 421.548 2.228 10 20 HECD CCN(C)[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429699 PCIJYPUZZKDUDI-QAPCUYQASA-N 418.538 2.066 10 20 HECD CC(=O)O[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(C)C 1844164315 FUIPRRLYHKXYHL-QGZVFWFLSA-N 424.881 2.156 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(=O)c4ccccc4o3)CC2)cc1 38588379 TVLBGXQJQGRHID-UHFFFAOYSA-N 407.470 2.354 10 20 HECD CCN(CCCNC(=O)NCc1ccc(N2CCC(C)CC2)cc1)S(C)(=O)=O 303411637 UYSRARJFORFCPJ-UHFFFAOYSA-N 410.584 2.394 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N2CCOc3cc(N(C)C)ccc32)c1 437010538 QNZHOJGGLQYELA-UHFFFAOYSA-N 417.531 2.463 10 20 HECD COCC[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 725899528 LVTCTUJXGXPUCE-GFCCVEGCSA-N 423.447 2.256 10 20 HECD CSc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 727227129 GPKQXVUPCRWXFX-AWEZNQCLSA-N 400.504 2.456 10 20 HECD COC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 728516369 QPJYSCSJRINMHP-UHFFFAOYSA-N 417.487 2.030 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](O)c1c(F)cccc1F 740908392 ZCOOYHUAGAAWGX-SFHVURJKSA-N 409.408 2.473 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1 747548442 CGWKAXMCVZCQDN-UHFFFAOYSA-N 423.517 2.320 10 20 HECD O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227044 AXLXIGFJGZHTHY-UHFFFAOYSA-N 423.466 2.315 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 751715377 OSKUIHYGZUXEGA-BBWFWOEESA-N 422.497 2.415 10 20 HECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 752809947 ZZZCLJJCTPIDSR-FFZOFVMBSA-N 413.518 2.045 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)o1 754805213 LNFSDNPENBRVEX-UHFFFAOYSA-N 422.503 2.062 10 20 HECD C[C@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)cc(F)c1O 756583658 PUQQQPWJKFECSK-DZGCQCFKSA-N 416.335 2.351 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)OC[C@@H]3CCCCO3)CC2)cc(OC)c1OC 759242095 SKNHBYXFRCOVRR-WMZOPIPTSA-N 422.522 2.335 10 20 HECD Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 759595772 LYIOSFRGRQUCOT-WKTRQSJXSA-N 412.442 2.414 10 20 HECD C[C@@H](NC(=O)N[C@H]1CS(=O)(=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 763021920 YMARWZAESOOQGC-BEFAXECRSA-N 415.515 2.412 10 20 HECD C[C@@]1(c2ccc(C(=O)NCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 765747688 QJUMHHLYCZFLFS-SFHVURJKSA-N 418.247 2.139 10 20 HECD COc1ccc(O)c(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 769541091 YSQBVKMOVPWNHK-UHFFFAOYSA-N 418.515 2.434 10 20 HECD CC1(C)CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCS1(=O)=O 774681808 APRKEKGECAAVFN-UHFFFAOYSA-N 411.593 2.349 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@]3(C)CCCO)CC2)cc1 776123536 SUBSSBRKCJMLFZ-QFIPXVFZSA-N 404.555 2.154 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc4c(cc3C)OCO4)CC2)cc1 781446911 GLLIXZXSAIILGE-UHFFFAOYSA-N 411.458 2.410 10 20 HECD COc1cccc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 786768520 KTPJSNVDHLJJDE-KRWDZBQOSA-N 411.502 2.368 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc2c(c1)CC(=O)N2C 788934754 YXJYKDKRYQHBBY-INIZCTEOSA-N 420.513 2.299 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1 790911642 JCFSASYVHGOJDS-QGZVFWFLSA-N 413.522 2.415 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793685784 KBAJVXIWCDNXEB-FXAWDEMLSA-N 412.486 2.484 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(F)c1 795079579 FMFNLILCTXQBKE-CQSZACIVSA-N 422.478 2.488 10 20 HECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NCc2ccc(OC)cc2O)cc1 797630208 OSVVABLZWBWAOU-CYBMUJFWSA-N 415.446 2.404 10 20 HECD CCc1ccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 806494640 SSFPTBHRRROPTC-UNMCSNQZSA-N 424.545 2.484 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCOc1cccc(C(F)(F)F)n1 807097087 NQQIWYPGWQGUPB-UHFFFAOYSA-N 424.423 2.286 10 20 HECD COc1ccc(C(=O)OCC(=O)C(C)=O)cc1S(=O)(=O)Nc1ccc(C)cc1 808483945 ZQNCZAWTVHGYJT-UHFFFAOYSA-N 405.428 2.119 10 20 HECD CCCN(CCC)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808855036 QIXWWTRLWNRPSD-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COC[C@H](C)CS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 809809452 YHNSQAYAXVJIOB-ZDUSSCGKSA-N 410.458 2.244 10 20 HECD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)c1 917898392 VATKIOANDHPRKJ-UHFFFAOYSA-N 413.502 2.454 10 20 HECD C[C@@H]1CN(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 921231726 KSMSQBDTHOQJEY-KNKQGSTJSA-N 402.583 2.285 10 20 HECD CNS(=O)(=O)c1cc(NCc2ccc(N3CCN(C)CC3)c(F)c2)ccc1C 1117110801 WQWVMIGJDPHQJB-UHFFFAOYSA-N 406.527 2.406 10 20 HECD CC[C@@H](C)[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793623756 NNUWBIYAXBNUOM-LHNVCGPYSA-N 410.898 2.410 10 20 HECD CC(C)O[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798548758 MIUXNPIKBVTTKN-ZLGQELQPSA-N 418.490 2.268 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848507 NRMNNIDPWQRJNW-GDAOTKPNSA-N 423.832 2.446 10 20 HECD O=C(c1ccc(Cl)nn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501630 KCMZKVBXHROTOQ-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)n(C)c2ccccc12 472774786 HEMDVUMWXFWATG-UHFFFAOYSA-N 411.483 2.071 10 20 HECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C12CCOCC2 673314924 BPDNKUSESCRNBH-PMACEKPBSA-N 413.518 2.193 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(-c4ccccc4)nc3C)nc12 726673532 GIYGCKBSIFZQTF-UHFFFAOYSA-N 421.413 2.463 10 20 HECD NC(=O)CN1C(=O)/C(=C/c2csc(-c3ccc4c(c3)OCO4)n2)SC1=S 728609900 BGFSCMOLTPSULZ-QCDXTXTGSA-N 405.482 2.225 10 20 HECD O=C(Cn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1)c1ccc(O)c(O)c1 734979740 BIWITGRPDJBUOJ-UHFFFAOYSA-N 407.430 2.167 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)c1 749572608 HFEZKYIPKAJGJZ-UHFFFAOYSA-N 422.529 2.309 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCCS1(=O)=O 753497498 HRLAYBSUTACVBE-XJKSGUPXSA-N 402.463 2.340 10 20 HECD CCN(CC(=O)Nc1cc(S(N)(=O)=O)ccc1C)c1ccc(OC)c(OC)c1 759692194 YXWBCBQFWYTNSN-UHFFFAOYSA-N 407.492 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H]3CSCCS3)CC2)cc1 759806187 XNJNMIUFUZNHCM-QGZVFWFLSA-N 410.561 2.126 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)cc(OC)c1OC 760097325 QHABJIMDJBWHRS-SJORKVTESA-N 418.538 2.171 10 20 HECD COc1cc(Cl)cc(CNC2CCN(S(=O)(=O)C3CCOCC3)CC2)c1O 761206522 ISKKRPIXSPHKAL-UHFFFAOYSA-N 418.943 2.117 10 20 HECD COc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ncc1Br 763225015 ZCTXGTOACVZION-UHFFFAOYSA-N 416.253 2.182 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCC[C@H]1N1CCOCC1 763660799 UVOSGTFOSWCDOB-FGZHOGPDSA-N 416.566 2.308 10 20 HECD O=[S@@](Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1)C1CCOCC1 765089597 JBYCBBXRQZVQMG-MHZLTWQESA-N 421.500 2.451 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1 766048381 SBPGOWWRHZZRBJ-UHFFFAOYSA-N 419.381 2.026 10 20 HECD O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NCCc1ccc(O)c(O)c1 768904299 SPOFGGFPHGNZNG-UHFFFAOYSA-N 413.499 2.497 10 20 HECD CC(=O)C[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 770087927 TXAPFCYIRMKZRO-NSHDSACASA-N 421.431 2.199 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1 771103661 LGVHTKKRHNYFHD-UHFFFAOYSA-N 402.520 2.252 10 20 HECD CN1CCN(c2ccc([C@@H]3NC(=O)c4cc(N5CCOCC5)ccc4N3)cc2)CC1 771522007 YHWRJMKRSIZEEG-QFIPXVFZSA-N 407.518 2.129 10 20 HECD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773741523 JPEKJMLXDCWECH-AWEZNQCLSA-N 422.503 2.374 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CCc3cccn3C)CC2)cc1 778295084 NHCBLXZQPIKMOP-HYSAVQALSA-N 424.545 2.376 10 20 HECD O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NCc1ccc(O)c(O)c1 778916343 FHVJXFNASROFIK-UHFFFAOYSA-N 414.277 2.092 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)Cc1ccccc1 782940008 RWJFODCBODERMP-SFHVURJKSA-N 401.482 2.190 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)CN1C(=O)OC(C)(C)C 785439949 XULHRAMRTJEIQU-HOTGVXAUSA-N 418.538 2.225 10 20 HECD Cc1ccncc1/C=C/C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 786920417 RULCIBIXGJBASM-HWKANZROSA-N 413.449 2.239 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCSC(C)(C)C)cc2F)CC1 788371237 KTPMPHYMTNKUOJ-UHFFFAOYSA-N 424.586 2.232 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@@H](C)CN3CCOCC3)cc2F)C[C@@H](C)O1 788882354 BZHPYRXFRVNCPL-OKZBNKHCSA-N 422.545 2.301 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc2c(c1)OCCCO2 788930452 SQLHMGYENKGIQQ-UHFFFAOYSA-N 409.486 2.381 10 20 HECD CSC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823046 YDRIOKVPXOLNCJ-HLLBOEOZSA-N 423.554 2.410 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4nccnc4cc3F)cc2)C1 791532134 HTOVYBXOXYIYAV-OAHLLOKOSA-N 407.449 2.401 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(F)cc2C)cc1 793363770 OVDOFBKCLIXSLY-UHFFFAOYSA-N 416.452 2.395 10 20 HECD CN1CCN(Cc2ccc(N3CCOCC3)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 793604150 OSNJGGNZTNXUGP-FQEVSTJZSA-N 404.555 2.164 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCc2cccc(F)c2C1)c1ccc(N2CCOCC2)cc1 803305588 NCLXHQFUJQCTIA-MRXNPFEDSA-N 411.477 2.424 10 20 HECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 804083362 NWRRJEPDBMNYBL-LJQANCHMSA-N 424.545 2.362 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)C[C@H]1CCOC1 807602542 FGCXWYXXTQYWQC-QWHCGFSZSA-N 413.312 2.435 10 20 HECD CNC(=O)C[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)c1ccccc1 807733469 VHMJPQZJUPRZDE-OAQYLSRUSA-N 424.545 2.483 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)n3)cc2F)C[C@@H](C)O1 814476215 PBUDZJACZLYDQU-OKILXGFUSA-N 417.437 2.013 10 20 HECD COCCN1C[C@H](C(=O)OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)CC1=O 914661825 CJIDAGDPASXBAX-MRXNPFEDSA-N 416.449 2.454 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC[C@@H](CO)C1 916631867 LGQRBODXFJQBNV-CQSZACIVSA-N 401.429 2.456 10 20 HECD COc1ccc2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)[nH]c2c1 916676856 HINBSNSNPICTKI-UHFFFAOYSA-N 413.499 2.341 10 20 HECD Cn1cccc1[C@@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917052334 MAYSBZCJJKWBPP-NRFANRHFSA-N 400.498 2.454 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4cccc(F)c4)=NO3)cc2)C1 917835101 ZMINOVKQPREGSX-UWJYYQICSA-N 424.476 2.337 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 918286662 JQPXCBYGJGYGMO-ZIAGYGMSSA-N 416.453 2.098 10 20 HECD CCOCCOc1ccc(Br)cc1C=C1C(=O)N(C)C(=O)N(C)C1=O 921261006 KHPJHFFFRLEMPD-UHFFFAOYSA-N 411.252 2.298 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1323792542 QYLXYKPAQSJFKB-OAQYLSRUSA-N 412.490 2.102 10 20 HECD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1795036732 BPKCZNCCJMXJJX-NCSHHQJSSA-N 423.469 2.472 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769042 LBCIELWLNYVZEJ-IHBSRNJCSA-N 408.882 2.001 10 20 HECD CCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)COC1 1831274743 GNSVAUUEDIFWSI-QGZVFWFLSA-N 417.506 2.153 10 20 HECD C[C@H](NC(=O)NCCNC(=O)c1cccs1)c1ccc(N2CCOCC2)cc1 140999778 PSNUQTJLMVQZPM-HNNXBMFYSA-N 402.520 2.375 10 20 HECD NC(=O)[C@H]1CCCN(CCCNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 729684878 YBUWDLCTGJXUJS-SFHVURJKSA-N 403.527 2.262 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCOC[C@H]3CCCO3)cc2F)CC1 730114807 FFBITYCVOJVLMZ-LJQANCHMSA-N 422.545 2.353 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1C 731215523 IXMMBRKCQBYPRA-UHFFFAOYSA-N 404.488 2.097 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1 732256402 BSSLWIUKGVKBLD-UHFFFAOYSA-N 404.536 2.490 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)C(C)(C)C)cc2F)C[C@@H](C)O1 732715849 LBULGJJJXNWTHL-PJIJBLCYSA-N 410.486 2.006 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)CC2)cc1 737175332 YAALSFOKPAIRLW-GDLZYMKVSA-N 415.515 2.156 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCSC[C@H]3S(C)(=O)=O)ccc21 742178847 IPRCXUXHHFRNCD-GOSISDBHSA-N 410.561 2.464 10 20 HECD Cc1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742278937 BXYUDSPUOUGSJJ-MRXNPFEDSA-N 405.495 2.314 10 20 HECD CCCS(=O)(=O)N1CCC(NC(=O)NCc2c(O)ccc3c2CCCC3)CC1 743537022 XSCRZBRWSYYOLZ-UHFFFAOYSA-N 409.552 2.274 10 20 HECD CCN1CCO[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 746315745 DAPDVNQUZDDOJR-MOPGFXCFSA-N 420.554 2.155 10 20 HECD CNS(=O)(=O)C[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 749517355 RLCNAFRFKDDHGE-QGZVFWFLSA-N 405.520 2.257 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 753644460 OBRTYYGUTSALSQ-CYBMUJFWSA-N 422.478 2.382 10 20 HECD COCCS(=O)(=O)c1ccc(CNCc2ccc(N3CCN(C)CC3)cc2)cc1 758501624 MLHNUBOFWAUVMJ-UHFFFAOYSA-N 417.575 2.148 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1 767793202 AQGWIRCTBYLHMH-AWEZNQCLSA-N 406.504 2.227 10 20 HECD CC(=O)NC1(c2noc(CCC(=O)NCc3ccc(O)c(O)c3)n2)CCCCCC1 768915044 WFWGEKNRZPLNLD-UHFFFAOYSA-N 416.478 2.415 10 20 HECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)no1 769023878 MDUVQYKGCXDDJT-UHFFFAOYSA-N 411.506 2.024 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(CO)CCCC3)CC2)cc1 771294233 CPNIKOGWJICSKT-UHFFFAOYSA-N 404.555 2.059 10 20 HECD CCOC(=O)CNC(=O)C1CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 771864553 QKQSQYBUXJEBSE-UHFFFAOYSA-N 400.475 2.445 10 20 HECD CCOc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1OCC(=O)OC 773740277 JNVUTDBQDQPYEI-CYBMUJFWSA-N 403.431 2.409 10 20 HECD CN1CCN(c2ccc(CN3CCN(Cc4cn5ccccc5n4)CC3)cc2)CC1 775644501 JQLGIMVVXZEVDL-UHFFFAOYSA-N 404.562 2.404 10 20 HECD NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(Br)cc2)cc1 783714996 NORCIAHRKGRTHC-UHFFFAOYSA-N 401.311 2.410 10 20 HECD CC[C@H]1CCC[C@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785526987 HPHNRYPGOXHMAA-GHTZIAJQSA-N 416.566 2.018 10 20 HECD C[C@@H](NC(=O)Cc1ccccc1S(C)(=O)=O)c1ccc(N2CCOCC2)cc1 785956561 RZPDLWMUPAMOAB-MRXNPFEDSA-N 402.516 2.347 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCCCC3)cc1)C2 786672610 IIUODRUCAIIBPB-HXUWFJFHSA-N 421.545 2.407 10 20 HECD COC(=O)[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[C@H]1C 787325976 GWFUMAJCSYTLRI-KBPBESRZSA-N 406.438 2.284 10 20 HECD Cc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324374 VOCKZOCVZPEONE-GOSISDBHSA-N 411.502 2.032 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CCS(=O)(=O)c4ccccc43)CC2)cc1 790113551 VEWSJFFKDUYGFS-IBGZPJMESA-N 400.500 2.305 10 20 HECD CCOC(=O)C(NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)C(=O)OCC 798120600 NPXQNJOGZXFCQJ-UHFFFAOYSA-N 402.447 2.327 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CN(C)CC3CC3)C2)cc1F 804852088 YTSNHNRDVUDGMJ-IBGZPJMESA-N 418.557 2.478 10 20 HECD COCc1cnc(NC(=O)C(=O)NCc2cccc(Br)c2O)s1 807057777 IEQDORKPVWLVMW-UHFFFAOYSA-N 400.254 2.013 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287714 MJZDHDMZNOSYKH-MNAPGUCWSA-N 411.546 2.467 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(Cc2cc(Br)ccc2O)CC1 809728678 FIPHFNOXUGLUBE-SFHVURJKSA-N 404.308 2.499 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3CCn4c(cnc4C)C3)CC2)cc(OC)c1OC 811045362 AFZHTVVYEVZSMV-INIZCTEOSA-N 414.506 2.129 10 20 HECD NC(=O)COc1cccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 916681030 NLYMCQOFOACTAJ-UHFFFAOYSA-N 412.490 2.081 10 20 HECD COc1ccccc1CN(CCO)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918222242 UUNBCGXZRFWUJJ-UHFFFAOYSA-N 417.481 2.375 10 20 HECD Nc1nc2nc(CSc3ncc(-c4ccccc4)n3C[C@@H]3CCCO3)cc(=O)n2[nH]1 920245354 JTRWBWLYEBAEFY-HNNXBMFYSA-N 423.502 2.335 10 20 HECD Cc1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccn1 1796598733 BXDRSKREMMIQSN-BCDXTJNWSA-N 410.474 2.081 10 20 HECD COc1cccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c12 1843250866 XDCMKDDAXLVQQC-UHFFFAOYSA-N 422.441 2.114 10 20 HECD O=C(c1ccccc1OC(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251224 ITIIJTCUKXUAEN-UHFFFAOYSA-N 419.384 2.225 10 20 HECD CSCC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1847843195 BDAMJEGUATWSPH-CJKAQPIMSA-N 420.531 2.408 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CNC(=O)O2)cc1 1847851377 BOKOOVXIPIMRNK-UFYCRDLUSA-N 422.485 2.018 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC(N(C)S(C)(=O)=O)CC3)ccc21 486662627 HNNKXRMDFSZIHB-UHFFFAOYSA-N 421.563 2.401 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)Cc3c(C)noc3C)CC2)cc1 738462494 UXLAJZJIXQERGV-INIZCTEOSA-N 415.538 2.352 10 20 HECD CCc1nncn1CCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 743554683 KEDYOYJDTVIYMO-HUUCEWRRSA-N 404.490 2.093 10 20 HECD C[C@@H](Cn1ccnc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751064386 JMOLBSNNQTZEKC-LBPRGKRZSA-N 406.489 2.270 10 20 HECD CCc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(C)nn1 759242833 RUJDOYCWJSAVRP-UHFFFAOYSA-N 400.479 2.336 10 20 HECD O=C(CCSc1ccccc1)NC(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 759588467 LPFKGTCCBVTVTD-CLFYSBASSA-N 401.440 2.479 10 20 HECD COc1ccc(CN(C)C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 759590608 XIHPBZDGPORJJR-RMKNXTFCSA-N 401.415 2.330 10 20 HECD Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 760555956 WUMGWOSWVBMFBG-UHFFFAOYSA-N 418.425 2.278 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCCc4c[nH]nc43)CC2)cc1 766845904 MKVNEOWJGAKVEQ-HXUWFJFHSA-N 412.538 2.307 10 20 HECD CN1CCC2(CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)C1=O 770246220 QWHIXONFTGNTQN-UHFFFAOYSA-N 402.564 2.394 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1cc(-n2cnnn2)ccc1Cl 774753831 QMYNVJCCBRZGNS-UHFFFAOYSA-N 413.869 2.219 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(O)nc(C(C)C)c3)CC2)cc1 775042283 LUZXQGCKQVZNIX-UHFFFAOYSA-N 413.474 2.425 10 20 HECD CCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 776901825 OFOURCSLMOCANB-UHFFFAOYSA-N 417.531 2.316 10 20 HECD C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ncn2nccc2c1=O 777822739 KIRIRTLMWCDPMD-INIZCTEOSA-N 403.442 2.387 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)ncn4C)CC2)cc1 778295482 STWCHJMDQCHVIZ-MDZDMXLPSA-N 419.485 2.425 10 20 HECD CCC[C@@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786656774 RECRJTYNBDIYKT-YLJYHZDGSA-N 414.550 2.008 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccnc2-n2ccnc2)cc1 787466703 QXBWQCWDPATZIG-UHFFFAOYSA-N 406.490 2.046 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@]2(CCO[C@H](C)C2)O1 788940660 YEHOCNPEEPVYQS-IEGUWTFLSA-N 415.534 2.088 10 20 HECD COc1ccccc1CC(=O)N1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 789966337 MYRKRIWNKPZROE-UHFFFAOYSA-N 402.422 2.209 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)cc1 793636397 KDWCSOMXQHOHEU-QGZVFWFLSA-N 411.502 2.104 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3[C@H]4CC[C@H]3CC(c3ccnn3C)C4)ccc21 803686517 BXNBMUZLCSNFKC-PMACEKPBSA-N 421.545 2.356 10 20 HECD CCN(CCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 804258214 PKDDGOAHIBDESI-HNNXBMFYSA-N 406.527 2.303 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](C3(C)OCCO3)C2)cc1F 804852127 ZXZQKRNSHUWMLK-QGZVFWFLSA-N 421.513 2.290 10 20 HECD Cc1cnc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807652193 OBCXGHWFLNRSNN-CYBMUJFWSA-N 424.473 2.454 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C 809404980 MCCWTFXZNSSJRF-BLLLJJGKSA-N 424.339 2.102 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)CN(C)C(C)C)CC2)cc1 811930984 OEHYXXAXJZBKKX-IBGZPJMESA-N 405.587 2.235 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1)C1CC1 815612798 XDVMFTWOPPCJSM-CYBMUJFWSA-N 411.458 2.299 10 20 HECD CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969286 IISPXOFHPVNAPO-LJQANCHMSA-N 405.514 2.440 10 20 HECD Cc1ncsc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1808464930 FQQPGCAIMNEIHB-UHFFFAOYSA-N 416.503 2.416 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c[nH]1 1808774850 HFAQZTYGECWNSD-MGPUTAFESA-N 421.457 2.158 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1 1846205809 JVSDAPOIZPCGED-IOASZLSFSA-N 406.866 2.136 10 20 HECD CCN1C(=O)C(=CNc2cccc(Cl)c2N2CCOCC2)C(=O)N(CC)C1=S 10352818 NADXYOLJNXVSCH-UHFFFAOYSA-N 422.938 2.468 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1 56966090 MVTGNNBTELXALS-UHFFFAOYSA-N 403.548 2.413 10 20 HECD Cc1cc(CN2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)on1 141038881 NHUZFNYGWNPKPZ-SFHVURJKSA-N 413.522 2.408 10 20 HECD O=C(CCN1CCOCC1)Nc1cccc(CNCc2cc([N+](=O)[O-])ccc2O)c1 725847004 RJZSBXKWHAWBJZ-UHFFFAOYSA-N 414.462 2.251 10 20 HECD C[C@]1(c2ccc(CNCc3cc(Cl)cc([N+](=O)[O-])c3O)cc2)NC(=O)NC1=O 726189870 PMMOTYTTZBELSQ-GOSISDBHSA-N 404.810 2.298 10 20 HECD CC[C@@]1(C)NC(=O)N(CC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 728839630 KKTBUNVECWDKDO-GOSISDBHSA-N 414.428 2.364 10 20 HECD CCN1C(=O)c2ccc(C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc2S1(=O)=O 728981470 AZEQRPPDLGGFCN-NSHDSACASA-N 404.444 2.056 10 20 HECD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729052549 MMNJQYYYAUFTNA-OLZOCXBDSA-N 407.492 2.430 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cccc(CO)c3)cc2F)CC1 730125816 KOXJTLGDNBTKAA-UHFFFAOYSA-N 400.498 2.459 10 20 HECD COC[C@H]1CN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CCO1 742413642 WEMWQUZFORQCTD-MRVPVSSYSA-N 406.189 2.126 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C(=O)c2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 742754968 SRKRREDUWLUTEV-QGZVFWFLSA-N 415.494 2.051 10 20 HECD COc1cccc(CNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1O 745783433 RKFIVQUYRCUXIJ-SFHVURJKSA-N 403.454 2.413 10 20 HECD Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cnc2c1c(=O)n(C)c(=O)n2C 747809758 ONCKFSJDKAKHKM-UHFFFAOYSA-N 423.517 2.057 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 751229547 XYEXNUGFBSXSPF-UHFFFAOYSA-N 412.458 2.413 10 20 HECD CCN(CCS(C)(=O)=O)CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 753202806 HLCXYXGMTKDCPL-UHFFFAOYSA-N 420.531 2.430 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](c4ccco4)C3)cc2)C1 753928300 FZZUROMJFYRNLE-FXAWDEMLSA-N 412.490 2.264 10 20 HECD CCc1ncc(S(=O)(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 763575050 PQIKBMXVBDPSQT-UHFFFAOYSA-N 424.592 2.205 10 20 HECD COc1cc(OC)cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 767717110 XDRAMNYCSVSWLZ-UHFFFAOYSA-N 419.503 2.206 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 768846582 LVAARLXXHZAGII-UHFFFAOYSA-N 411.505 2.344 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)c1cc(Cl)ccc1CS(C)(=O)=O 774776423 SFUMODDIQKWZJL-UHFFFAOYSA-N 403.909 2.411 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 775402460 BRLDSTFRHWTHCK-CABCVRRESA-N 405.520 2.305 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3ccc([S@](C)=O)cc3)CC2)cc1 775620438 YXKRCVLUBSSWFD-ADKRDUOOSA-N 415.559 2.432 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCn4ccnc4C3)cc2F)C[C@@H](C)O1 777460538 YJJDKKPWHNVQFS-HLLBOEOZSA-N 401.486 2.450 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(F)cc3F)CC2)cc1 778233471 GVNMLDDWZPUDCV-CMDGGOBGSA-N 415.440 2.495 10 20 HECD CCOC[C@H]1CCCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 778277585 NAMNIQWKEXKYFF-GDWUOILNSA-N 415.534 2.175 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(O)(C(F)F)CC3)cc2F)CC1 779558541 RIOMBCSVCGDSFX-UHFFFAOYSA-N 414.472 2.269 10 20 HECD O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc(O)c(O)c1 783375459 OKNWDHSQDDXVMY-OAHLLOKOSA-N 423.425 2.252 10 20 HECD CCCCCCNC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785439082 KPQCMUAJUFCEIP-IBGZPJMESA-N 416.566 2.304 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 790139940 XFBHLGMWXDPAIO-KRWDZBQOSA-N 417.462 2.174 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C2 790833584 FMFWBFMNIYSFEU-HNNXBMFYSA-N 416.547 2.490 10 20 HECD COc1ccc(CNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 792875281 ZXIFRCJOEHEDJP-UHFFFAOYSA-N 422.526 2.143 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(CC(F)(F)F)C1 803380556 AJOPJAMKUJHYDJ-INIZCTEOSA-N 414.472 2.242 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2)CC(C)(C)O)cc1F 803661679 JPFDQFVQJAAGEX-UHFFFAOYSA-N 401.482 2.308 10 20 HECD O=C(NC[C@@H]1CCCS1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806917933 RHJBOERVRQIHEE-BBRMVZONSA-N 413.490 2.385 10 20 HECD Cc1cc(C)c(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2=O)c(C)c1 808213236 OZOPCWHIPGADKJ-FQEVSTJZSA-N 422.529 2.216 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1COc2ccccc21 809536216 JAZYQJDNJXZUOH-DYESRHJHSA-N 423.513 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)c3ccc(Cl)cc3)CC2)cc1 811282641 NWECFLNWPRLQER-HXUWFJFHSA-N 418.877 2.274 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c1 815496499 KJERDHMILCGETK-YJYMSZOUSA-N 411.458 2.417 10 20 HECD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 816029090 VKIULIQJLRELFJ-BTYIYWSLSA-N 400.475 2.365 10 20 HECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n[nH]1 919087373 KLKXIIAKFQWUGJ-KBPBESRZSA-N 418.469 2.198 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2ccc(N3CCCC3)cc2)c1 1318348417 KTMWDEJSKVCTQK-MRXNPFEDSA-N 416.547 2.312 10 20 HECD CC(C)(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785508751 KSVPPSXWUIRMAL-YHCZKZFASA-N 418.490 2.083 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807998743 NXXFYOSNNCCREL-OFGRBQKGSA-N 410.474 2.420 10 20 HECD Cc1ccccc1CN1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 55286669 NZHOKZPJCWTTRX-UHFFFAOYSA-N 417.531 2.467 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 728207415 PVPJAZKOFBAGPA-MRXNPFEDSA-N 421.501 2.429 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)c1 728985442 WLZUKXCEPBEPQR-IAGOWNOFSA-N 418.515 2.251 10 20 HECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 734943449 YTUKPJCNIWEESR-DYESRHJHSA-N 422.533 2.364 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc1 736539326 JJCNIIIFBASJPF-UHFFFAOYSA-N 415.468 2.347 10 20 HECD COC(=O)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741096712 CPLPSVTUNLXHSK-UHFFFAOYSA-N 423.469 2.260 10 20 HECD COC(=O)CCCS(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333975 BRZUVVXOFZXPBS-ZDUSSCGKSA-N 406.451 2.129 10 20 HECD C[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)n1cncn1 742750827 QFGWDQFGOLNDEL-WMLDXEAASA-N 402.499 2.287 10 20 HECD CCn1c(=O)c2ccccc2n(CC(=O)NCc2c(O)ccc3c2CCCC3)c1=O 743718470 CJOCDCKOCQQKTJ-UHFFFAOYSA-N 407.470 2.084 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(N2CCCNC2=O)c1 743918437 VMUAFQPEQVJUMN-UHFFFAOYSA-N 419.485 2.237 10 20 HECD COCCn1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1=O 750874535 LJUOQFUUJCNXAD-OAQYLSRUSA-N 413.518 2.382 10 20 HECD CCN(CC)C[C@H](C)NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759278575 OUVRMWDBMHSZBS-INIZCTEOSA-N 408.543 2.274 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCCC[C@H]3N3CCOCC3)CC2)cc1F 763660129 QASQZOUWGVSKQC-WOJBJXKFSA-N 420.529 2.309 10 20 HECD Cc1cccc(O[C@@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c1 768444405 AXDCAWAAUDNZGX-HRAATJIYSA-N 412.486 2.238 10 20 HECD Cc1csc(CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 769498362 CTAQDAPTIYCFKH-UHFFFAOYSA-N 421.494 2.219 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2OCCn2ccnc2)c1 769721487 AEIAEUNGSICTOW-UHFFFAOYSA-N 416.459 2.292 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccn(-c2ccccc2Cl)n1 774368891 GUTMFEWNVNPOTH-UHFFFAOYSA-N 400.822 2.234 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)CN2CCN(c3ccccn3)CC2)c1O 775028485 RKFYKJXBRQZSEA-HNNXBMFYSA-N 401.467 2.004 10 20 HECD COC(=O)/C=C1\SCC(=O)N1CCCN[C@H](C)c1ccc(N2CCOCC2)cc1 775256195 WXQKRHUUYCNPTH-ZHTGWBIJSA-N 419.547 2.154 10 20 HECD CN1CCN(c2ccc(CN3CCN(CC(=O)Nc4ccccc4)CC3)cc2)CC1 775647811 AYBWXFBDUJDEOY-UHFFFAOYSA-N 407.562 2.195 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C(C)=O)ccc3O)CC2)cc1 778422809 GICZMOJGZQHWIG-MDZDMXLPSA-N 423.469 2.447 10 20 HECD CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)/C=C/c1ccc(O)c(O)c1 779507064 VYYIMEJNVLFBTH-CSKARUKUSA-N 405.472 2.442 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2cccc(N3CCCC3=O)c2)cc1 784555064 DVYNWKGHIHSFRR-UHFFFAOYSA-N 411.458 2.440 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)O[C@@H](C)C2 786626740 MUNLIFIWEKNLGS-HNNXBMFYSA-N 411.502 2.359 10 20 HECD COc1ccc(F)cc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311217 RWVMRJFXMVPLNM-OAHLLOKOSA-N 415.465 2.165 10 20 HECD CC(C)N(CCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)C 789860167 IQNVLNZYTBWWOW-UHFFFAOYSA-N 420.623 2.481 10 20 HECD O=S(=O)(C[C@@H]1CCCOC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792757501 MMXRXOYVSKGERO-PBHICJAKSA-N 402.944 2.356 10 20 HECD C[C@@H](Oc1ccc(C=O)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795396977 NOBIBWNUAWGYRT-APWZRJJASA-N 409.486 2.285 10 20 HECD CCOC(=O)c1ccc(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 795804058 PCYHSKIWZAYAKY-UHFFFAOYSA-N 422.478 2.318 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1Cl 797389984 IOGNJFMKCVIXLQ-UHFFFAOYSA-N 408.838 2.334 10 20 HECD CN1CCC(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 803377390 ABQRZQMTWMPFHB-UHFFFAOYSA-N 400.567 2.483 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C 807103885 WTNREGQHHJXYJH-UHFFFAOYSA-N 406.527 2.050 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@H](c2ccccc2F)C1 807292428 XQPYCKGLVBFHPV-NRFANRHFSA-N 409.461 2.418 10 20 HECD CC(C)C[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCO1 808076088 MHQZPYCRYQDZLU-FPOVZHCZSA-N 417.550 2.192 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1 814996407 YOGZIZWOBZEEEP-UHFFFAOYSA-N 418.441 2.349 10 20 HECD CCCN(CC(N)=O)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 817056708 QUZLRHBTGLLKBQ-JLHYYAGUSA-N 411.574 2.453 10 20 HECD CCc1ccccc1OCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335196 MMKZMDJNWJAOAE-UHFFFAOYSA-N 402.516 2.179 10 20 HECD CCC(C)(C)NC(=O)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 920635083 CKGPYLJXSXUFET-HNNXBMFYSA-N 400.497 2.250 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1ccc(N(C)C)cc1 920636294 QNOMRYWOUPPIAQ-LBPRGKRZSA-N 421.475 2.014 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(S(C)(=O)=O)c(Cl)c2)c1 1323327496 DXJNARGCLIGWLA-UHFFFAOYSA-N 418.880 2.073 10 20 HECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1nnnn1C 1518425712 UIMVMXQYALWFET-WJEYQPDNSA-N 422.561 2.130 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCCC1)c1cc(O)c(O)c(Cl)c1 1795869473 OOATXVWCJWUWIM-MUJYYYPQSA-N 421.925 2.489 10 20 HECD C/C(=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)C(=O)O 1800719242 DFTQYJTVTJPTGC-MWYMOPEQSA-N 408.838 2.034 10 20 HECD CNC(=O)NC(=O)[C@@H](C)OC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 6460354 JVVZZIXMLMJLQD-SECBINFHSA-N 414.801 2.116 10 20 HECD OC[C@@H]1CCCCN1c1cc(NCc2ccc(N3CCOCC3)c(F)c2)ncn1 302106090 NQOFNGVAEMHQRR-KRWDZBQOSA-N 401.486 2.416 10 20 HECD COc1ccc(N2CCC(NC(=O)CCNS(=O)(=O)c3ccccc3)CC2)cc1 726562135 CHRAIQFZYTUJRM-UHFFFAOYSA-N 417.531 2.149 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 728977838 FGTOXGHMROYWPT-SNVBAGLBSA-N 405.432 2.377 10 20 HECD CN1CCN([C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 729259218 KUYMXTSMBQNUSR-XMMPIXPASA-N 422.573 2.470 10 20 HECD CC(C)CN1C(=O)/C(=C/NCc2cc(Cl)c3c(c2)OCCCO3)C(=O)NC1=S 730970820 OCSXJBUPRRPMON-UKTHLTGXSA-N 423.922 2.374 10 20 HECD CCCN(CC(=O)Nc1ccccc1OC)C(=O)COC(=O)c1cc(O)cs1 732352969 IVTFMUBYOWVXBA-UHFFFAOYSA-N 406.460 2.496 10 20 HECD NS(=O)(=O)Cc1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 735516935 BQDGGRZJFVXPQX-SFHVURJKSA-N 404.488 2.002 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1S(=O)(=O)NC(C)(C)C 740496287 WGSIZNHNPFHGCG-UHFFFAOYSA-N 419.503 2.032 10 20 HECD CC(=O)NC[C@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 742614915 OJCNDDULZRXFTC-MRXNPFEDSA-N 419.481 2.249 10 20 HECD O=C(Nc1cc[nH]n1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743321595 XSVJWXJCRKSDSP-UHFFFAOYSA-N 403.376 2.077 10 20 HECD COC(=O)[C@@](C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 746474209 FGFBCHCOFIKNLC-QHCPKHFHSA-N 406.438 2.332 10 20 HECD CN(Cc1cnn(C)c1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748022816 TZCRHJSOYGCRRR-UHFFFAOYSA-N 406.489 2.260 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)cc1 751362162 XCUHYTQXDWQFMD-UHFFFAOYSA-N 424.544 2.434 10 20 HECD NS(=O)(=O)c1ccc(CC(=O)N(Cc2ccco2)Cc2ccccc2O)s1 752086336 JTPVXFYONGOAFE-UHFFFAOYSA-N 406.485 2.466 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3c3cn(C)nc3C)CC2)cc1 754058474 AWTJLASFVZVZKJ-NFBKMPQASA-N 413.566 2.057 10 20 HECD C[C@@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc(F)ccc1O 756587856 DCAFWVAHJHTZGF-OAHLLOKOSA-N 407.511 2.318 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CC[C@@H](CO)CC3)CC2)cc1 757586315 VELZYYIBOBDNEN-KDURUIRLSA-N 404.555 2.058 10 20 HECD Cc1nnc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)s1 758338024 JOFOSCKDAZGGLR-UHFFFAOYSA-N 413.482 2.032 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1scnc1C1CC1 763115366 AFMUCBQIIQEZCZ-UHFFFAOYSA-N 404.467 2.251 10 20 HECD O=C(NCC1(N2CCOCC2)CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 764835937 RWQGATJXQIQUBP-UHFFFAOYSA-N 424.492 2.421 10 20 HECD CCOC(Cn1cc(C(=O)NCc2cccc(Br)c2O)nn1)OCC 765732810 SWLGIFNTJQGDHU-UHFFFAOYSA-N 413.272 2.075 10 20 HECD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCCCCC2)cc1 765758886 MQNCJHONGRGADW-LJQANCHMSA-N 408.612 2.295 10 20 HECD Cn1cnnc1[C@@H]1CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767758390 ZNIULIKBQMQXBB-SFHVURJKSA-N 415.453 2.366 10 20 HECD C[C@H](NC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(N2CCOCC2)cc1 767937856 ITAUBUZZSPPNKS-BULFRSBZSA-N 416.566 2.261 10 20 HECD CC(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769024582 NUONKCPICBTQJU-UHFFFAOYSA-N 424.549 2.251 10 20 HECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2O)cc1F 769651773 JSJCJFMLQBNVNT-UHFFFAOYSA-N 402.469 2.162 10 20 HECD CC[C@@H]1CN([C@H](CC)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCO1 773979986 RDGDWVXNDQAQHV-FGZHOGPDSA-N 403.567 2.401 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1 774076875 MMUPVIIRPFZMKT-UHFFFAOYSA-N 424.910 2.032 10 20 HECD CC(C)CCNC(=O)C1CCN(C(=O)CN2CCOc3cc(N(C)C)ccc32)CC1 774753833 QOEHJEUHNLBGPU-UHFFFAOYSA-N 416.566 2.352 10 20 HECD COc1ccc(O)c(CNCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 776083073 NRROTIHDAXAXLU-GOSISDBHSA-N 406.504 2.148 10 20 HECD Cc1ncsc1/C=C/C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 777099703 XUUQKPAVTWDOSU-SNAWJCMRSA-N 419.478 2.300 10 20 HECD Cc1cc(C(=O)CN2CCO[C@@H](C(C)C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778243054 QWUUHDDZDNSPEW-OAQYLSRUSA-N 419.547 2.281 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NCc2ccc(O)c(O)c2)cc1 778917112 XDZLHRVIUBSULP-UHFFFAOYSA-N 406.504 2.377 10 20 HECD O=S(=O)(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccco1 782461159 VQVTYMLBKJEFMA-UHFFFAOYSA-N 417.466 2.014 10 20 HECD COCCCN(CCO)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 782574730 BYEAGQAMSSFAEN-UHFFFAOYSA-N 402.491 2.379 10 20 HECD CC(C)(O)CCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 787138832 FPLDVRWGPJXAFB-UHFFFAOYSA-N 401.486 2.110 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccccc1 788931343 DMQBTWSMNVWTLC-FGZHOGPDSA-N 406.530 2.465 10 20 HECD CC(=O)N1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 795788992 RYTLLXYFXCEYLL-OAHLLOKOSA-N 419.481 2.343 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 797432598 KGAJUVMEMVHKPO-VFCRVFHLSA-N 406.502 2.107 10 20 HECD O=S(=O)(CCNCc1ccc(N2CCOCC2)c(F)c1)CCc1ccccc1 800311993 QHJHYFXHJSRQIT-UHFFFAOYSA-N 406.523 2.409 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1c1cccn1C)c1ccc(N2CCOCC2)cc1 803303423 NAXLZTOOQVYEKZ-LAUBAEHRSA-N 410.518 2.403 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](Cn3cccn3)c3ccccc3)ccc21 803686046 UKBOQOSNXPLDPB-NRFANRHFSA-N 417.513 2.439 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C[C@]2(CCOC2)O1 804853266 VIQWDXJNMUWETK-VGSWGCGISA-N 421.513 2.085 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](Oc2ncccc2F)C1 807100050 GYFWMARUQCOOHV-GOSISDBHSA-N 414.481 2.281 10 20 HECD COCCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291733 MRGRDMRUTHNLSN-UHFFFAOYSA-N 407.514 2.397 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccc(C)cc2)C1=O 807585943 KDADLJOGCONSTR-NRFANRHFSA-N 422.529 2.331 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(N(C)C)cc1 807674681 PEERIEWQAGEETB-GOSISDBHSA-N 424.545 2.425 10 20 HECD CS(=O)(=O)c1ccc(N(C/C=C\c2ccccc2[N+](=O)[O-])CCN)c([N+](=O)[O-])c1 809727871 AJJDVONWJDIQBT-XQRVVYSFSA-N 420.447 2.385 10 20 HECD COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917918415 QBQVUKVNTBYYHP-UHFFFAOYSA-N 422.478 2.069 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cscn1)C1=NN(c2ccccc2)C(=O)C1 1795161366 PGXIPBDZYFDJNI-RBVVOMGSSA-N 423.498 2.188 10 20 HECD C/C=C/C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1812548129 GMUKUDFBEGHSNL-WZXFWBCVSA-N 423.469 2.494 10 20 HECD CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846047 GLMCPCLZDRDUPX-WFASDCNBSA-N 417.466 2.335 10 20 HECD CC1(C)Cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c2O1 1843249922 QQTHXLBEXXNXDR-UHFFFAOYSA-N 423.469 2.337 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 303475499 RSFBXASNXQGHIP-MRXNPFEDSA-N 414.428 2.080 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 734217246 UTQUXHYGQZDBSU-DLBZAZTESA-N 406.502 2.109 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1 734701592 HQLJIPMOJXGLSQ-UHFFFAOYSA-N 423.561 2.063 10 20 HECD CS(=O)(=O)N[C@H]1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 735200567 LPAFRRKJOIVMHK-KRWDZBQOSA-N 415.475 2.191 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCC[C@@]34NC(=O)NC4=O)c2C)cc1 744623927 AUMBGTJNZTWZQB-IVZQSRNASA-N 410.474 2.211 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)NC3CCCC3)cc2F)C[C@@H](C)O1 746725252 DIHKRJPFOCVHOO-GASCZTMLSA-N 406.502 2.297 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN(c4ccccc4)CC3)CC2)cc1 754014745 NZSCEYZXMXDPDF-DEOSSOPVSA-N 424.589 2.390 10 20 HECD C[C@@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1O 756531643 AYQOSSZXNBTKPC-MRXNPFEDSA-N 400.483 2.343 10 20 HECD C[C@@H](NC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 756812672 OPKUMPIIBDVGBC-MZNJEOGPSA-N 423.513 2.107 10 20 HECD COC(=O)C[C@H](C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759006315 WEXUCTMTZOWFMT-LBPRGKRZSA-N 409.394 2.143 10 20 HECD CNc1c(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cccc1[N+](=O)[O-] 765418293 VDFUXVBIFPGNGF-UHFFFAOYSA-N 413.478 2.197 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC4(CCC4)C3)CC2)cc1 766241197 COKMLVRWGWIZHA-UHFFFAOYSA-N 402.539 2.172 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C(=O)OC4)c2)CC1 769848902 QZVPIPGIKTVBBV-UHFFFAOYSA-N 401.488 2.300 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](n4cncn4)C3)cc2F)C[C@@H](C)O1 776854825 ARKQBJSIVBQTOU-UXLLHSPISA-N 402.474 2.187 10 20 HECD O=C(NCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 778922951 MQTUZAIEVWGEBP-RAXLEYEMSA-N 416.499 2.427 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccccc1CN1CCCC1=O)c1ccc(N(C)C)cc1 787433856 RJMBPCOEMPNZEE-QGZVFWFLSA-N 422.529 2.369 10 20 HECD COc1cccc(F)c1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321544 XCIJHYALXTZXON-OAHLLOKOSA-N 415.465 2.165 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 788324883 ZEHRTCKDDMJHRE-YADHBBJMSA-N 423.513 2.176 10 20 HECD CC(C)[C@@H](NCc1cc(Cl)cc(F)c1O)C(=O)N(C)Cc1nnc2n1CCC2 793247517 QAUGNPYFRKDVMW-QGZVFWFLSA-N 409.893 2.495 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2cccc(C(=O)NCC(=O)NC)c2)cc1 800595578 BCPOYKMCURIYOH-UHFFFAOYSA-N 411.506 2.330 10 20 HECD COC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309647 BTLPUKCNLUKOJE-APWZRJJASA-N 415.490 2.106 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@H](c4ccccc4)C3)CC2)cc1 804316215 SYNAWKFKDORGNL-QFIPXVFZSA-N 423.513 2.380 10 20 HECD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@H]1C 808851780 KLBSRWSQLAYUOX-OALUTQOASA-N 412.578 2.482 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](n4cccn4)C3)cc2F)CC1 813062757 HMJZZTZNBCGWFN-GOSISDBHSA-N 400.502 2.321 10 20 HECD Cc1ccc(NC(=O)C2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)nc1 918187278 BVRYPFUGSCKADG-UHFFFAOYSA-N 409.534 2.423 10 20 HECD C[C@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H](C)O1 918199581 IJTONFNBIRCPQK-IRXDYDNUSA-N 422.545 2.349 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Br)cn1 1116592317 UGVBYXHRNLACDN-ZDUSSCGKSA-N 409.236 2.160 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccnn1C[C@H]1CCOC1 1320717504 KNUYCTSMFNTLMN-MRXNPFEDSA-N 417.485 2.342 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@@H](CO)CC3CCOCC3)CC2)cc1 1320962844 ULJBJPYWCOSSMK-SFHVURJKSA-N 405.539 2.388 10 20 HECD O=C(Cc1cnccn1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786225153 LVFYHQRBJQTXLC-UHFFFAOYSA-N 419.441 2.273 10 20 HECD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c[nH]1 1807995754 IHOGWSQSFKLLTD-MGPUTAFESA-N 421.457 2.158 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1 1815285875 YECXAFPHVDDRAN-LJLKPOLSSA-N 415.425 2.414 10 20 HECD CC(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826308787 WFQNYBQYDQDGTB-OAHLLOKOSA-N 411.593 2.122 10 20 HECD CN(C)c1ccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)cc1 24378400 RAUBHTCQMYSYMU-UHFFFAOYSA-N 407.561 2.458 10 20 HECD Cc1cc(C(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1-c1ccc(C#N)cc1 303694028 MUSNSLLBNOZEJA-FQEVSTJZSA-N 402.458 2.235 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)n(C)c2ccccc12 559569100 OLJVQCUZAZHGPJ-UHFFFAOYSA-N 422.485 2.117 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2c(C)c3ccccc3n2C)n1 561628883 VFTXKAGYAXYWMT-CQSZACIVSA-N 413.478 2.242 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 726626940 AQTRBGDSNSABAT-UHFFFAOYSA-N 412.446 2.118 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCNC(=O)c1n[nH]c2ccccc12 728065041 LBZWHFYLYBLYGE-UHFFFAOYSA-N 421.501 2.178 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1 729064973 XFMGWJGDWRMSTG-NSHDSACASA-N 415.837 2.451 10 20 HECD COC(=O)c1ccc(OC)cc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 731496259 HLKORVNLKLYCNY-UHFFFAOYSA-N 413.474 2.251 10 20 HECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 734015092 YXUHTWMCJHRFOK-UHFFFAOYSA-N 418.515 2.426 10 20 HECD NC(=O)C1(c2ccccc2)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 734525201 MAACABLHBGWFCU-UHFFFAOYSA-N 422.529 2.252 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(CNS(C)(=O)=O)cc3)CC2)cc1 735577509 PLOYWLHOLZBZKB-UHFFFAOYSA-N 418.519 2.099 10 20 HECD CN(c1ccc(CNC(=O)NCC2(O)CCS(=O)(=O)CC2)cc1)C1CCCCC1 741407378 COXKIGQYZHRILV-UHFFFAOYSA-N 423.579 2.194 10 20 HECD COCc1ccccc1CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742948504 VFIBMTJWIUZHNR-UHFFFAOYSA-N 412.534 2.463 10 20 HECD O=C(NCCC(=O)N1CCCCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 748343520 JRMOGOSVUCDDRE-UHFFFAOYSA-N 416.566 2.487 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H]1CC(=O)N(C2CC2)C1 750649553 CBURGVAUSLMUJH-UONOGXRCSA-N 408.449 2.319 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCc2c(F)cccc21 763382385 NTFPIJGTKUVRCN-UHFFFAOYSA-N 411.477 2.240 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 765756878 NUOBSNULSAFSAT-CABCVRRESA-N 423.307 2.212 10 20 HECD CC(C)(C)n1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 772364894 QNDKJVSQYCNBPG-UHFFFAOYSA-N 405.524 2.195 10 20 HECD O=C(COc1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 772877891 ZBOBLTDULRMHDS-UHFFFAOYSA-N 402.422 2.129 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1OC 773745674 QFIGDVCRIMSXEJ-CYBMUJFWSA-N 423.487 2.026 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccoc1C1(O)CCOCC1 773979436 PSKKIFDMTUJPNJ-UHFFFAOYSA-N 414.502 2.416 10 20 HECD O=C(NCc1ccncc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774118233 TYNZFCNPDYYJJZ-HNNXBMFYSA-N 404.417 2.084 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@H](C)O1 774357688 XTCKQKNZGZIZPX-GJZGRUSLSA-N 413.474 2.009 10 20 HECD CC(C)CCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774538930 CZTQAZKECZTFKL-IEBWSBKVSA-N 416.566 2.336 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCC2(N3CCOCC3)CCCCC2)c1 775370553 HMGZNYLIEBJOGH-QGZVFWFLSA-N 405.539 2.203 10 20 HECD Cc1nccc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 776493205 HFCQSSOUSWTARR-UHFFFAOYSA-N 422.468 2.362 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCNc3ccccc3)CC2)cc1 778285371 HKJNKILJYWYEJD-QXMHVHEDSA-N 408.502 2.128 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H](C)C1=O 779527881 GPFAPWVDMVAACC-INIZCTEOSA-N 420.529 2.185 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccccc3[N+](=O)[O-])CC2)cc1F 784160037 INHVMDRISCCJIS-MRXNPFEDSA-N 405.426 2.304 10 20 HECD CSc1cc2c(cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)OCCO2 785297370 NPRFUYSEMVMBEM-NSHDSACASA-N 418.471 2.277 10 20 HECD Cc1csc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 788604385 IMICPUIDHSMFAW-MRXNPFEDSA-N 403.504 2.024 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]2CCCC[C@@H]12 789798977 HAAFWNQCVGINSW-HHXXYDBFSA-N 403.498 2.316 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789827618 TXPZZBJFQJMYCI-OKILXGFUSA-N 409.527 2.067 10 20 HECD Cc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789843795 PHQOYYZFCKTBIP-UHFFFAOYSA-N 413.493 2.070 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCc3ccccc3C(N)=O)CC2)cc1 791474643 FIBKOFJBOKYBGC-UHFFFAOYSA-N 424.545 2.055 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@](C)(O)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791632099 MCWMFGUWZODWNY-OAQYLSRUSA-N 419.547 2.161 10 20 HECD COc1cc(Br)cc(CNC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1O 796480351 CZNZWAVINUWCNG-SMDDNHRTSA-N 421.357 2.361 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccccc3F)C2)cc1F 803663539 RRPUOJCWYFPTTH-IBGZPJMESA-N 403.429 2.247 10 20 HECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687218 AAGBBLGIVZZSDB-IBGZPJMESA-N 409.486 2.334 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)C1CCOCC1 807548678 BEVWKNRPJZZFCN-LBPRGKRZSA-N 413.312 2.435 10 20 HECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 808039444 BGKVDMKTKKVQRH-AEFFLSMTSA-N 418.538 2.084 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCO[C@@H](C(C)(C)C)C1 808080910 KIHQNIVOYRYCSR-AZUAARDMSA-N 417.550 2.192 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@H](c4ccccc4)OC3=O)CC2)cc1 809679955 JFAKRPVVKHMGRD-FGZHOGPDSA-N 423.513 2.238 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@H](C)OC 812907003 OPWADRXXJVOWJM-HNNXBMFYSA-N 407.536 2.281 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](n4cccn4)C3)CC2)cc1 813032080 LKMIMSUTIYJSKK-HXUWFJFHSA-N 412.538 2.060 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COc3cccnc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917180768 GLQHENXEPVJIKQ-ZIAGYGMSSA-N 418.425 2.438 10 20 HECD CC(=O)c1cccc(OCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 917832047 HGFPGEVCDANEJL-IBGZPJMESA-N 409.486 2.286 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)O1 918201174 GFLVLVVFBAAOGT-CALCHBBNSA-N 422.545 2.085 10 20 HECD CN1CCN(c2ccc(CN3CCC(C(=O)NCC(F)(F)F)CC3)cc2F)CC1 1116441701 NWRLLZRZDYRQPH-UHFFFAOYSA-N 416.463 2.468 10 20 HECD Cc1ocnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819943942 ORPPCCUBEZJEQI-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)CCOc2ccccc21 24775933 AMNRWUISMLVIFJ-UHFFFAOYSA-N 409.486 2.297 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCC(=O)N1CCN(c2ccccn2)CC1 482497100 YJVCVBPOGXIIHN-UHFFFAOYSA-N 423.517 2.002 10 20 HECD Cc1ccc(/C=C\S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 726976760 OSPCQLBBDGOPIA-RAXLEYEMSA-N 420.556 2.320 10 20 HECD COc1cc(C(=O)NCc2cccc(OC)c2O)ccc1OCC(=O)NC(C)C 729859090 IALGGMLHOSQLAQ-UHFFFAOYSA-N 402.447 2.243 10 20 HECD COc1cccc(CNC(=O)[C@@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c1O 729859334 PFNGTEBIKYETLZ-GFCCVEGCSA-N 423.447 2.070 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1 734016194 FZGQXVRYWQTLAY-OAHLLOKOSA-N 410.517 2.240 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2 734402073 GCRIIJUZUUCOST-UHFFFAOYSA-N 418.515 2.312 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1 735199398 QAPWZOPQVNAIES-UHFFFAOYSA-N 415.446 2.290 10 20 HECD CCN(CC)c1ccc(CN(C)CC(=O)Nc2cccc(S(N)(=O)=O)c2)cc1 741677843 DASAUGDJYVHDOM-UHFFFAOYSA-N 404.536 2.251 10 20 HECD COC[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 741795184 OQNQINNKHIWZSC-HUUCEWRRSA-N 408.454 2.136 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCN(C)c3ccccc3)CC2)cc1 742940824 ZBGMMXDKPLSAOH-UHFFFAOYSA-N 411.550 2.253 10 20 HECD COc1cc(OC)c(OC)cc1CNC(=O)CN1CCOc2cc(N(C)C)ccc21 746492216 DYLVPFSYIFUXPF-UHFFFAOYSA-N 415.490 2.294 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1(C(=O)NC2CC2)CC1 749732143 CSOGXEXDRJWJRY-UHFFFAOYSA-N 411.424 2.217 10 20 HECD CC(C)(C)N1C[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1=O 750639768 XOUTVQVKCBQBTF-GOSISDBHSA-N 402.539 2.094 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)nn3)cc2F)C[C@@H](C)O1 750871896 JGQBVFWCTXBYOK-GASCZTMLSA-N 410.453 2.345 10 20 HECD O=C1OCc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc21 751136702 KVEMSTAEWAQPTM-INIZCTEOSA-N 403.456 2.433 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CSCN3C(=O)C(C)(C)C)CC2)cc1F 753741546 KLDCXTIJUOLOQY-INIZCTEOSA-N 409.527 2.431 10 20 HECD COC[C@@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 754347554 MSEOLWBDCPMXQK-PZJWPPBQSA-N 403.523 2.057 10 20 HECD CCS(=O)(=O)N1CCC(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)CC1 757705572 PSAXDEMXFSDFGP-MRXNPFEDSA-N 413.559 2.375 10 20 HECD CCCN1C(=O)N(Cc2ccc(N3CCN(CC)CC3)c(F)c2)C(=O)[C@@H]1COC 761277518 IXYJOHJDQODGPZ-IBGZPJMESA-N 406.502 2.157 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1ccc(F)cc1 764321454 WDVIBBHNKVXIGN-UHFFFAOYSA-N 408.813 2.116 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CCSC)NS(=O)(=O)CC 764896429 ZXAIUACHRQTMMK-KRWDZBQOSA-N 401.598 2.162 10 20 HECD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1cccc(Br)c1O)C2=O 765752502 WZRKGRIWAYGDBF-VOJFVSQTSA-N 424.295 2.272 10 20 HECD Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)N(C)Cc1ccccc1O 769282106 JTFSKGHTHOIYDA-UHFFFAOYSA-N 419.547 2.203 10 20 HECD CN(C)CCCOc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 769818993 YJVIDWYDSRIOJX-UHFFFAOYSA-N 407.492 2.347 10 20 HECD COc1cc(OC)cc(N2C[C@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)c1 773740768 SWAHVFLHQPHEKB-DZGCQCFKSA-N 414.458 2.215 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](c3ccccc3)N(C)C)CC2)cc1 780089542 HPEOQLZLRIQFTI-JOCHJYFZSA-N 411.502 2.190 10 20 HECD CC[C@]1(CO)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 784389243 NPICQLAADMOEIB-PNLZDCPESA-N 407.530 2.292 10 20 HECD Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 786112744 XUQTVFSEYLVNOQ-LJQANCHMSA-N 401.482 2.374 10 20 HECD CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 789909803 HVQLWVUQZPRFPA-BBRMVZONSA-N 401.429 2.404 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1 792702140 NMTNRLKQXWWYCS-UHFFFAOYSA-N 402.519 2.165 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2cccc(Br)n2)c1 795351598 IDNUQUHGGCUGNE-UHFFFAOYSA-N 401.238 2.278 10 20 HECD CC[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)CC(=O)OC 799169412 IXQRYUUGCKDANO-ULQDDVLXSA-N 423.529 2.329 10 20 HECD Cc1nc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)sc1S(N)(=O)=O 801667618 QSSTYAIHARXCHO-QWRGUYRKSA-N 414.528 2.464 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)cc1F 803661742 LHCMDDLUKKPGJU-IRXDYDNUSA-N 413.497 2.179 10 20 HECD COc1ccc(Cn2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cn2)cc1 803728339 XYKCFVDYHJHHDT-UHFFFAOYSA-N 416.459 2.269 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)c3ccncc3)CC2)cc1 805763051 HIGPCQKLCNZODR-UHFFFAOYSA-N 410.518 2.223 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](Cn1cccn1)c1ccccc1 806164617 YIBDUHFNKNPDMP-OAQYLSRUSA-N 405.502 2.431 10 20 HECD COC[C@@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 806779971 UOXOLIVMJNLGHX-LJQANCHMSA-N 415.490 2.139 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 807096779 KGNLMDZDJLDMLW-INIZCTEOSA-N 416.472 2.351 10 20 HECD Cc1noc(C)c1S(=O)(=O)NCC(=O)NCc1ccc(N2CCC(C)CC2)cc1 810369088 DOISSZWGQJLAHM-UHFFFAOYSA-N 420.535 2.122 10 20 HECD Cc1cc(C(=O)NC[C@]2(N3CCOCC3)CCSC2)c(C)n1-c1ccccn1 917119624 PIEBXXYJZSXDOM-OAQYLSRUSA-N 400.548 2.427 10 20 HECD CCOC(=O)C1=S=c2nc(/C(Cl)=C\c3ccc(C(=O)OC)o3)nc(O)c2=C1C 1322223585 WFGLTSYIHXSCJZ-JXMROGBWSA-N 422.846 2.202 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cnn(-c2ccccc2)c1 1342915764 KSYRRRXRDGJATP-SFHVURJKSA-N 409.442 2.117 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777848382 SHBSCNIMYBRNSM-KXXRBXEXSA-N 417.506 2.057 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778900726 FAYVXCKUBYUCHP-MSLCTRMTSA-N 417.506 2.057 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1ccc[n+]([O-])c1 1786999254 LFAYXHIOXWQIRU-UHFFFAOYSA-N 420.425 2.188 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807999166 RQJJDBIUAGUYCR-AMMHHYFNSA-N 408.458 2.340 10 20 HECD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nc1 1843592378 MBRZIEFFPXODPY-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=C1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CN1CC(F)(F)F 97576260 GGTFXZSNELGVNL-CABCVRRESA-N 400.397 2.311 10 20 HECD Cc1cc(NC(=O)CSCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)no1 148448560 REBUIKJUGDPSOJ-OAHLLOKOSA-N 418.519 2.369 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 726627411 JWBMEXOLTRXDMM-UHFFFAOYSA-N 419.503 2.171 10 20 HECD CN1CCCc2cc(CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)OCc3ccccc3)ccc21 729285053 SVVDJMFSWXGDCX-IRLDBZIGSA-N 423.513 2.457 10 20 HECD CC[C@@]1(C)NC(=O)N(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 730971629 ZLIVSHVQKRBMAC-HXUWFJFHSA-N 424.448 2.094 10 20 HECD COC(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 733134833 CSGCDRKTMQKTIE-INIZCTEOSA-N 410.474 2.497 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4cc[nH]n4)C3)cc2)C1 734272129 DHMWOOPTSJFUNT-ZWKOTPCHSA-N 410.522 2.201 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2c(F)cccc2Cl)c1 741288553 CJMRZPKIFPQKSO-CQSZACIVSA-N 402.831 2.020 10 20 HECD CCOC(=O)N1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 748296998 OWTJKVOVHRAWMS-UHFFFAOYSA-N 419.522 2.091 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754039948 GQVQQISDQRIWAY-UHFFFAOYSA-N 414.480 2.193 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1csc([C@H]2CCCO2)n1 755586329 KEQSQBAFGCYXFW-QGZVFWFLSA-N 421.544 2.159 10 20 HECD CCOCCOc1cc(C)ccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 755860931 YNDYXSGSADCEJN-UHFFFAOYSA-N 422.503 2.417 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(OC)cc3[N+](=O)[O-])CC2)cc1 758226614 YPXKHEBTBSQOLH-KRWDZBQOSA-N 417.462 2.174 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]([C@H](C)O)C3)cc2F)C[C@@H](C)O1 760877847 ZSNGRJUTKJIWDE-ZMMAXQRCSA-N 407.530 2.148 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 763282549 YSILYPMXNALALI-GFCCVEGCSA-N 414.487 2.401 10 20 HECD C[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(-n2cnnn2)c1 765241843 DTBDVUNBOGINLR-VQIMIIECSA-N 405.506 2.215 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3cccc(CS(N)(=O)=O)c3)c2)CC1 767383723 QFZQDRMJABXBCW-UHFFFAOYSA-N 416.547 2.258 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 769751919 JSHJNKOAWZQCAQ-UHFFFAOYSA-N 419.503 2.436 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C(=O)OCC)CC1 775027117 MIWKANAQRARCRR-UHFFFAOYSA-N 405.495 2.258 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCN(C)c3ccccc3)CC2)cc1 778221313 BQNKUPOVASTOHF-SEYXRHQNSA-N 422.529 2.153 10 20 HECD CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785296050 BFBDVGOVVJPCNR-KBPBESRZSA-N 413.474 2.312 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1cccnc1 786650487 YJCAUKBTAGEHTK-UHFFFAOYSA-N 406.280 2.257 10 20 HECD Cc1cc(C(=O)COC(=O)CCn2ccnn2)c(C)n1-c1ccc2c(c1)OCCO2 787628178 MYHLEJJJRXILFZ-UHFFFAOYSA-N 410.430 2.273 10 20 HECD O=C(NCCCc1c[nH]c2ccccc12)C(=O)NCc1ccc(N2CCOCC2)cc1 788334680 ZHXKYOKKSNJKLK-UHFFFAOYSA-N 420.513 2.370 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(C3(C)OCCO3)CC2)cc1 788963271 IFYXXQKCDZRRJU-UHFFFAOYSA-N 403.523 2.151 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC(=O)N(CC2CC2)C1 789377115 GUOHKJKDBOTWGX-CQSZACIVSA-N 417.465 2.301 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]2CCCC[C@H]12 789798982 HAAFWNQCVGINSW-SZVBFZGTSA-N 403.498 2.316 10 20 HECD CCc1cc(O)ccc1NS(=O)(=O)c1ccc(CCNS(=O)(=O)CC)s1 790415493 HDDIAJUXSNDCES-UHFFFAOYSA-N 418.562 2.299 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC(=O)N(C2CC2)C1 790461883 CYIIFQCDXNROTM-ZDUSSCGKSA-N 403.438 2.053 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)c(O)c1 797389267 XQQIPDRODVUCFD-UHFFFAOYSA-N 421.453 2.174 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@H]2CCS(=O)(=O)C2)n1C 800767368 YPTAZQXQXMXYMV-KRWDZBQOSA-N 403.552 2.344 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncc(-n2ccnn2)c1 801927850 DNSPPJQLLXXCKT-QGZVFWFLSA-N 412.881 2.416 10 20 HECD Cn1nccc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 802013179 WFBIYWOSWKEYGR-MOPGFXCFSA-N 424.549 2.211 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 806279691 WWKSTKMTEWFGGO-HNNXBMFYSA-N 418.544 2.053 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(c2ccccc2F)CC1 806282950 YZPUXXMSGOOPEB-UHFFFAOYSA-N 408.524 2.229 10 20 HECD CN(C)C(=O)c1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387095 ZATCSFYRMGSCQM-UHFFFAOYSA-N 420.263 2.111 10 20 HECD O=C(COC(=O)c1ncoc1C1CC1)NCc1ccc(N2CCOCC2)c(F)c1 815323722 PHVDSHLDJZRNSN-UHFFFAOYSA-N 403.410 2.001 10 20 HECD CCOC(=O)c1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)nc1 815951874 SBQVEJRDAKSWLJ-UHFFFAOYSA-N 406.822 2.433 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 912980761 SHNWSBHDYUEFTE-UHFFFAOYSA-N 405.841 2.421 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(=O)(=O)c1cccnc1 915147494 IRANDGSMMNPYQX-UHFFFAOYSA-N 404.536 2.205 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)CC(C)C)CC2)c1 1317993917 HBDNRXDNPBCSTO-UHFFFAOYSA-N 417.550 2.117 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccs1 1794622600 IQHKIVANXLIKIM-DRXBFXEBSA-N 422.890 2.330 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2cccs2)C1 1843066490 ZEAGFRJFBZXCKA-FNORWQNLSA-N 414.483 2.324 10 20 HECD O=C(c1cccc2ncsc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250174 RPCKUALNUPYSSK-UHFFFAOYSA-N 410.455 2.233 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=S)NCCCN(C)c2ccccc2)cc1 726446987 OBDLJEZJLHHBQB-UHFFFAOYSA-N 414.531 2.402 10 20 HECD C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(=O)N1CCCC[C@H]1C 726616170 ZWBVTWQWHOQBAX-QZTJIDSGSA-N 402.539 2.454 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)c(OC)c3)CC2)cc1 726725809 JGWBDPLJEOVXFA-UHFFFAOYSA-N 413.474 2.436 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 726977192 YGILJKSQOCTFLR-UHFFFAOYSA-N 408.545 2.017 10 20 HECD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729052550 MMNJQYYYAUFTNA-QWHCGFSZSA-N 407.492 2.430 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1Cn1cncn1 742689933 LRYXBDFAMVROHX-UHFFFAOYSA-N 405.502 2.465 10 20 HECD CN1CC[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751695 VVNVDLUILOXVHO-AEFFLSMTSA-N 418.538 2.303 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cn3c(C)nc4ccccc43)CC2)cc1 742919874 KZGBRPYWVBXYKE-UHFFFAOYSA-N 407.518 2.292 10 20 HECD Cc1ccc(N2CC[C@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 743559892 PKZGIZYCGVDAHX-NRFANRHFSA-N 408.502 2.436 10 20 HECD C[C@H]1CC[C@H](CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)O1 745708366 KTFZTZWQUSQKKI-DOTOQJQBSA-N 408.470 2.169 10 20 HECD CCc1ncc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 747482362 OSIWMIRYWDRMRQ-CYBMUJFWSA-N 419.432 2.364 10 20 HECD CCN1CCC[C@H]1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748018916 GOHUFUXFGRDEQN-AWEZNQCLSA-N 409.533 2.469 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c(F)c(F)cc(F)c1F 748524215 JBYWVUZBNQPDSE-UHFFFAOYSA-N 416.396 2.408 10 20 HECD COC(=O)c1csc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 749257463 WECGWPOTZUXPLG-CYBMUJFWSA-N 410.517 2.411 10 20 HECD COc1ccc(NC(=O)C(=O)NCCCSc2nccs2)c(OC)c1OC 749731708 YGFDJLBAKDDTLJ-UHFFFAOYSA-N 411.505 2.406 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(Cn2ccnn2)CC1 753572517 PELDWNOKEADREI-UHFFFAOYSA-N 416.501 2.000 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 753642701 FPRMENCFDBHPHY-XJKSGUPXSA-N 424.453 2.234 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C(=O)COc2ccccc2)CC1 753644865 OJGQUGZEGMCALK-MRXNPFEDSA-N 412.486 2.463 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1F 753740018 XXUMHQUMUOILAB-UHFFFAOYSA-N 421.494 2.047 10 20 HECD C[C@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1cc(Cl)ccc1O 756442833 QPMHQSYXRLTRCB-HNNXBMFYSA-N 424.954 2.243 10 20 HECD Cc1ccc(S(=O)(=O)n2ccc(C(=O)NCCc3ccc(O)c(O)c3)c2)cc1 762267368 HEYXHLYFCLSMCT-UHFFFAOYSA-N 400.456 2.417 10 20 HECD CCc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc12 762516861 DHDYUBQPILSAEU-UHFFFAOYSA-N 420.466 2.239 10 20 HECD C[C@@H](NC(=O)N1CCN(C(=O)NC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 773248504 ZXGMQOSABBITII-QGZVFWFLSA-N 417.554 2.420 10 20 HECD CCn1nccc1NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 776022603 DXUDXZFNELKDHO-UHFFFAOYSA-N 424.484 2.480 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O 780445779 RCNFQXCXKPYERT-SFHVURJKSA-N 401.438 2.157 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1 784026689 YLWYUJLXDGAUOQ-UHFFFAOYSA-N 404.488 2.314 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1 785427333 CTPKQBOVKBVANJ-NJDAHSKKSA-N 411.502 2.110 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CC1(N2CCOCC2)CCCC1 786102584 XZTDTMRCVHXRCJ-UHFFFAOYSA-N 417.550 2.289 10 20 HECD CN(Cc1nccn1CC(F)(F)F)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788930928 BQSZPQQAXPPUTK-UHFFFAOYSA-N 423.439 2.320 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)CCN1CC(F)F 788973934 ATDLJILUOIAQIZ-KRWDZBQOSA-N 410.509 2.337 10 20 HECD C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793822863 FGORDYTXKZYVFM-OXQOHEQNSA-N 412.486 2.353 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](NC(=O)C3CC3)[C@@H](C)O)cc2Cl)C1 800570316 KPLLSXHQGGTWFJ-LPMFXHHGSA-N 407.942 2.468 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H]1c1ccccn1)c1ccc(N2CCOCC2)cc1 803309994 FGMAQZZJGSIBLY-UTKZUKDTSA-N 408.502 2.459 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@](C)(O)C(F)(F)F)CC2)cc1F 803662116 RTAKFDBNTFPNLS-SFHVURJKSA-N 419.419 2.060 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1 804319309 NTTFCMUFCZNBGR-PXNSSMCTSA-N 417.550 2.490 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN(CC2CC2)C1 804734146 XHEOKTSXNJXPJW-INIZCTEOSA-N 424.339 2.104 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCCCCCC3)cc2F)CC1 805006624 ZLLQPBQWHAWUJS-UHFFFAOYSA-N 404.530 2.377 10 20 HECD CCn1c(O)nnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917185463 ZMLFBBFODPHBPF-BETUJISGSA-N 423.514 2.165 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-n2cccn2)c(F)c1 920194518 FBYUCGJSNCFJBH-UHFFFAOYSA-N 423.448 2.103 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3N3CCCC3=O)CC2)cc1 1320276249 VRXISWDRLGTSKW-UHFFFAOYSA-N 422.529 2.374 10 20 HECD C[C@@H](CO)NC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1325695314 GYZIARKJZRWNIZ-INIZCTEOSA-N 400.498 2.300 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(Cl)ccn1 1796600752 JAXUAYUPIUDPEA-BTTYYORXSA-N 402.838 2.107 10 20 HECD CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1802424372 WLNCHTDKBDWZML-KXBFYZLASA-N 410.474 2.398 10 20 HECD Cc1ncsc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543047 OKTDKWFTYHCHLS-UHFFFAOYSA-N 416.503 2.416 10 20 HECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1C 1818299199 RGRWDOCMLVBRKQ-INIZCTEOSA-N 424.461 2.483 10 20 HECD CC(C)(C)OC(=O)CC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1841744513 WRLVAVGNIAQNAF-UHFFFAOYSA-N 424.881 2.300 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037760 TUTPREMTMNATCW-JNYVMKGUSA-N 400.475 2.456 10 20 HECD Cc1c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cnn1C 13296906 ASHZTILMQGLNOP-UHFFFAOYSA-N 403.394 2.299 10 20 HECD CN1C[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 726537723 PPLBRONLVLVPGB-NASPGAHYSA-N 409.558 2.076 10 20 HECD CC[C@H](Nc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 729860936 JYMRNLAIKLUFKV-FQEVSTJZSA-N 401.532 2.428 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C)c3nnc4n3CCC4)cc2F)CC1 730937638 SGXYBWHQLNAGSO-OAHLLOKOSA-N 415.517 2.066 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN(C(=O)c2ccncc2)C1 742054616 BRKLKVYRCCUXKK-FQEVSTJZSA-N 408.502 2.087 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCN(C(C)C)C(C)C)CC2)cc1 743363977 ZFZCTKPYDNGCOS-UHFFFAOYSA-N 405.587 2.235 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCN(CCOC)C1 745832286 DDDYHHOYJQVEPG-OAHLLOKOSA-N 400.317 2.407 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)NS(C)(=O)=O)cc1 746244483 PTRFELQMNRLJPC-OAHLLOKOSA-N 405.520 2.232 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)NCc3ccc(N(C)C)cc3C)C2)nc1 753191189 OTBFUQLMQQQVCE-UHFFFAOYSA-N 411.506 2.321 10 20 HECD COc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)NC(C)C 753645477 UBVIDBCPJCPCAR-CYBMUJFWSA-N 422.503 2.154 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)[C@H](C)CS(C)(=O)=O)c2C)cc1 754653226 POPAFAROXGOVEN-OAHLLOKOSA-N 420.531 2.428 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H]3[C@H](CCCN3C)C2)c1 765105777 KUUDMXIDLWEAHE-XMSQKQJNSA-N 401.551 2.343 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O 766270012 NSJZTKRDVWQASP-UHFFFAOYSA-N 414.506 2.370 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCCC4(C3)OCCO4)cc2F)C[C@H](C)O1 768042138 ZIINQPXIQHDKTB-HOTGVXAUSA-N 407.486 2.488 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCOC4(CCC4)C3)cc2)C1 769037951 PINOQPVSXHSYBV-ZWKOTPCHSA-N 400.523 2.289 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1 769636670 FAQURRKVIAYXKK-UHFFFAOYSA-N 414.447 2.004 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ncc1Br 773721664 JUOAICKELJKCDQ-JTQLQIEISA-N 408.252 2.250 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)O 780443009 KIZMJBBOQXQISL-OAHLLOKOSA-N 403.401 2.450 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCCCN(C)C)cc1 785293264 FUTSYLAMWDXOEU-HNNXBMFYSA-N 415.490 2.114 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1NC(=O)OC(C)(C)C 785424640 RXSIILKNKHSZIQ-CRAIPNDOSA-N 418.538 2.131 10 20 HECD COc1ccc(OCCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 785557153 BNHNSTDPQAZZCG-UHFFFAOYSA-N 411.502 2.447 10 20 HECD CO[C@@H]1CCOc2c(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cccc21 790966018 NWAZNENEIGRBNR-KPZWWZAWSA-N 400.431 2.254 10 20 HECD COc1ccc(CNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c(O)c1 794371207 YSOPKMCXVKPYOX-UHFFFAOYSA-N 408.451 2.254 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(N)c3OC(C)C)nc12 798703320 YWTNQBDOTARPTE-UHFFFAOYSA-N 414.418 2.338 10 20 HECD CSC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803450795 REOIIOWWTYHBGY-UHFFFAOYSA-N 413.490 2.385 10 20 HECD COC(=O)c1cc(C)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c(Cl)c1 806907989 SQQOILPKJXQYNV-UHFFFAOYSA-N 406.822 2.404 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(CCN(C)C)Cc1cccc(F)c1 807102059 XFRCCUFYPZUMHY-UHFFFAOYSA-N 414.525 2.407 10 20 HECD CC(C)c1csc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 808305275 NNWINMNGQOUILH-UHFFFAOYSA-N 416.547 2.378 10 20 HECD CCOCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)no1 812009822 SKAUZFOJPRJINR-OAHLLOKOSA-N 417.510 2.375 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H](O)c1ccccc1 812010211 NFBVERROQIHTOK-LDQXTDLNSA-N 410.518 2.310 10 20 HECD CC(C)N(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 916608777 KXSKVRLZAMELJU-UHFFFAOYSA-N 407.444 2.166 10 20 HECD COC(=O)Cc1csc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 916669499 BJOAWSSPDXTKLZ-UHFFFAOYSA-N 422.482 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(N4C(=O)CN(C)C4=O)c3)CC2)cc1 916688994 NPKYNHKKWBABTP-UHFFFAOYSA-N 423.473 2.448 10 20 HECD COc1cc(C=O)ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917166727 CUAHFRVWDOMPPD-UHFFFAOYSA-N 402.422 2.179 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(-c4ccncc4)on3)cc2)C1 917836543 PGKLCMYXDUXKHG-QGZVFWFLSA-N 405.458 2.368 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOc4ccccc4C3)cc2)C1 918122464 LGINBYZPJWWCMK-IBGZPJMESA-N 408.502 2.493 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(-n3cncn3)nc2)cc1 918311004 QSZFFQBLLFQKNQ-UHFFFAOYSA-N 407.478 2.106 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)CCC(=O)N4)cc2)C1 918372660 OTRZUCOMLCNMOR-GOSISDBHSA-N 406.486 2.203 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2COC3=O)cc1Cl 918728276 SSWGDLAYMRSSMJ-UHFFFAOYSA-N 416.864 2.183 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4nc(O)[nH]c4c3)CC2)cc1 920251612 DSTFTCUCCFLKDD-CMDGGOBGSA-N 421.457 2.121 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(OC)c(O)c1 1331881786 SKKFAQABDWCYAY-PPYMECGQSA-N 401.415 2.116 10 20 HECD O=C(c1cc2cc(F)ccc2[nH]1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249351 BGKKPPAOUSSGOU-UHFFFAOYSA-N 410.405 2.244 10 20 HECD Cc1c(CNC(=O)C(=O)NCCN2CCc3sccc3C2)n(C)c2ccccc12 478911704 LAMTXQHWBUTFDQ-UHFFFAOYSA-N 410.543 2.339 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(Cc4cc(C)on4)CC3)CC2)cc1 726715400 RAIITDZOAOLTKF-UHFFFAOYSA-N 413.522 2.488 10 20 HECD CC(C)N1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 727940749 NMLKNFVHEHPOMQ-IBGZPJMESA-N 401.555 2.014 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1F 728761116 IZHRQVOFMQSMAD-INIZCTEOSA-N 412.465 2.091 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1 729033791 RHFVUEUVOSNLPE-STQMWFEESA-N 408.480 2.148 10 20 HECD NS(=O)(=O)c1ccc(OCCN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731845027 UGAGPUCPBWOHLQ-SFHVURJKSA-N 406.504 2.100 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 743160703 HDNCUGICZSTTCP-UHFFFAOYSA-N 420.560 2.470 10 20 HECD CCC[C@@H](O)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 750242502 PQFOLMDZKGTGNU-QGZVFWFLSA-N 401.486 2.110 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)c1 751319027 QZCRQQIKSRCAAP-CYBMUJFWSA-N 413.517 2.461 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C/c2scnc2C)cc1 753063670 QUOJBZHBILYLFU-MDZDMXLPSA-N 409.533 2.395 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCS(=O)(=O)C[C@H]3C)c2C)cc1 754661176 XBLOJSURXDXRSY-OAHLLOKOSA-N 418.515 2.182 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058847 FMICKLQVHLARGN-OAHLLOKOSA-N 401.511 2.375 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@]4(CCOC4)C3=O)c2C)cc1 755820453 FXFVXGRVDJPTSF-JOCHJYFZSA-N 411.458 2.386 10 20 HECD C[C@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc(F)ccc1O 756713007 UGHMZKYPEQQMPA-DOTOQJQBSA-N 401.486 2.478 10 20 HECD Cc1ccc(OC(F)F)c(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 756774515 IXWZOOWHZYZXKU-XYOKQWHBSA-N 422.500 2.347 10 20 HECD O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1cccc(Br)c1O 765754928 YHIBGUBYQUDTES-STQMWFEESA-N 409.280 2.336 10 20 HECD COc1ccc2c(c1)CCCN2Cn1nc([C@H]2CCS(=O)(=O)C2)n(C)c1=S 766341142 NZUVHIYXOKEHFB-AWEZNQCLSA-N 408.549 2.272 10 20 HECD NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 766758370 HNRAVPWOWXTITP-UHFFFAOYSA-N 423.922 2.283 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(-c2ccncc2)c1 768714900 CEACUGLSQFTLSV-UHFFFAOYSA-N 422.514 2.075 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(-c3ccccn3)cs2)c1 769785460 YAKHPGSKIZGOGI-UHFFFAOYSA-N 418.500 2.255 10 20 HECD COC(=O)C1=S=c2nc(/C(Cl)=C\c3cccc4nccn34)nc(O)c2=C1C 771281160 JSMZIMCCIHAQIK-DHZHZOJOSA-N 400.847 2.080 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774210957 SBHJIEKPMMIQFD-UHFFFAOYSA-N 421.448 2.308 10 20 HECD O=C(NCCc1ccc(F)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 774711227 HHVFXZIXBXGKBW-IBGZPJMESA-N 400.450 2.398 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 775258097 QHMJHGJBISXRFV-NLWGTHIKSA-N 417.550 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](F)Cc3ccccc3)CC2)cc1 778203457 VXBKZUWUUZQPBL-FQEVSTJZSA-N 400.450 2.468 10 20 HECD COC(=O)COc1ccc(N(C)Cc2nnc3n(C)c(=O)c4cc(C)ccc4n23)cc1 784563807 LCUJVMMHANOFMV-UHFFFAOYSA-N 421.457 2.078 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cn4cccc(C)c4n3)cc2)CC1 786660106 VXKUZWKBGYKJIQ-UHFFFAOYSA-N 405.502 2.170 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCn2cnc3ccccc32)cc1F 786988522 XANKSZHHTVIHCV-UHFFFAOYSA-N 411.481 2.454 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@@H](C)C3)cc2F)CC1 787322541 LOUGCCUXJOGCPD-AEFFLSMTSA-N 404.530 2.279 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311510 WMUVEAUQQWMKDY-UHFFFAOYSA-N 411.502 2.284 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@]3(CO)CC(C)C)CC2)cc1 789512702 BDFWFASRFXZUHY-GGAORHGYSA-N 405.583 2.051 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 790220536 YCFAQNINWVPHGY-NUJGCVRESA-N 418.513 2.346 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)ccc2[nH]1 792338860 OMQZVRLZMRUGFC-UHFFFAOYSA-N 407.474 2.157 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 792702384 RXYMTLAIDWGTBB-LLVKDONJSA-N 422.484 2.352 10 20 HECD CO[C@]1(C)CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 792893351 RSVFGULNDNAWJB-XMSQKQJNSA-N 402.539 2.489 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c(O)c1 797387873 PYNTZFKLHFMJEH-UHFFFAOYSA-N 411.458 2.200 10 20 HECD C[C@@](O)(CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)(F)F 798406871 ZHQVAOHWBUNZFD-GOSISDBHSA-N 413.419 2.345 10 20 HECD COc1ccc(COCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803687901 QTCVTVNIFDMKDU-UHFFFAOYSA-N 411.502 2.027 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@H](C(C)C)C3)CC2)cc1 804315959 WIIVDPFSQLHYLI-XLIONFOSSA-N 403.523 2.100 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 804317327 ZVGARVJRYXGUCM-AVRDEDQJSA-N 403.523 2.100 10 20 HECD CO[C@H](C)c1nc(CNC(=O)C(=O)NCCCSc2nccs2)cs1 806280611 GNKWWSGPNQFKSL-SNVBAGLBSA-N 400.551 2.222 10 20 HECD CC[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808854280 BCBMZNDIWCUUHS-XMMPIXPASA-N 412.578 2.483 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)C2CC2)cc1 809495369 MIZXVPSKKYMDJG-VGSWGCGISA-N 417.575 2.415 10 20 HECD Cc1nn(C)c2ncc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc12 918035354 AGVFCEWMIDGFGS-MRXNPFEDSA-N 421.505 2.300 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(N2CCCC2)nc1 918311850 WFYPVQUYHJVRBN-UHFFFAOYSA-N 423.517 2.116 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CC(=O)N(Cc2ccco2)C1 919968290 AJADJNBRAZJWNV-IBGZPJMESA-N 411.502 2.153 10 20 HECD CS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969073 WEWMTDSIOSPMOW-UHFFFAOYSA-N 417.531 2.197 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1317929411 KZMHJCCAZQOVOW-HDICACEKSA-N 420.573 2.472 10 20 HECD Cc1cc(-c2nnc(N3CCC(OCC(N)=O)CC3)n2C)c(C)n1-c1ccccc1 1339967317 PUGMGYIUXDKJEL-UHFFFAOYSA-N 408.506 2.360 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3F)CCC2)cc1 1792316303 YZKHIVVIGPRBBE-KBPBESRZSA-N 421.519 2.339 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C23CC(C2)C3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998120 IRMTUYUZKHNUPU-VKTDNDKKSA-N 408.458 2.008 10 20 HECD O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1814446464 PULCOWGXZHBHTH-MRVPVSSYSA-N 416.381 2.128 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1C[C@]1(F)Cl 1822502395 RCGSGLGXWRNQLU-KWFDTGPKSA-N 423.832 2.446 10 20 HECD Cc1ccc(SCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1843827146 YINZUNRELXHFTN-UHFFFAOYSA-N 413.499 2.411 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(CNC(C)=O)cc3)CC2)cc1 24088930 VUJOULLDKDXXSN-UHFFFAOYSA-N 424.545 2.273 10 20 HECD Cc1csc(N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)n1 563909123 JUYCJFQHQCGDNW-UHFFFAOYSA-N 411.531 2.217 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nnc(Cc3ccccc3)s2)c1 728208185 MEBHPKSTUQEDHN-UHFFFAOYSA-N 404.473 2.458 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1 728983169 VKCURWQCWZOBQQ-GFCCVEGCSA-N 418.471 2.445 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCNS(C)(=O)=O)cc1 732115126 SIDQXASIWORZHF-UHFFFAOYSA-N 405.520 2.234 10 20 HECD O=C1CCCN1C[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 732450254 PXPYBIWAWGGPGH-GOSISDBHSA-N 418.513 2.349 10 20 HECD CN1CCC(N2CC[C@H](NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)C2)CC1 734281464 KXVGHJKJRDGKHL-PZJWPPBQSA-N 416.566 2.251 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1 740494277 BGPQRUIMMKUBNI-DYVFJYSZSA-N 400.431 2.384 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 746039710 VGNPYNNQXBWBKL-UHFFFAOYSA-N 412.837 2.154 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1 749641618 CLQDFGWKJCZZPE-ZDUSSCGKSA-N 420.487 2.399 10 20 HECD C[C@@H](Cn1cccn1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065109 MEHDCPZLSGSQJB-LBPRGKRZSA-N 406.489 2.270 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751239603 LHUIFUDPTAARNO-UHFFFAOYSA-N 418.515 2.160 10 20 HECD Cc1cc(C(=O)CN(C)C[C@H](O)CN2CCOCC2)c(C)n1-c1cccc(F)c1 751485737 PWJIOGDEYPTFTC-FQEVSTJZSA-N 403.498 2.041 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCCn3cc([N+](=O)[O-])ccc3=O)cs2)cc1 751944732 JSGABFGONJBBAD-UHFFFAOYSA-N 400.416 2.243 10 20 HECD COc1cc(OC)cc(N2C[C@H](C(=O)NCc3cccc(OC)c3O)CC2=O)c1 752797072 NGYGFNPPRQFNLG-CQSZACIVSA-N 400.431 2.087 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C\c2cncc(F)c2)cc1 753061941 IEEGCKNYVZLHAN-WTKPLQERSA-N 407.467 2.164 10 20 HECD COc1cc(NC(=O)NCc2ccc(N(C)C)c(F)c2)ccc1S(=O)(=O)N(C)C 757915043 XLFYUPWEPMCFAU-UHFFFAOYSA-N 424.498 2.472 10 20 HECD COc1cc(N2CCN(C(=O)c3nnc(O)c4ccccc34)CC2)cc(OC)c1OC 759405446 MZGNLQVJMQQVTB-UHFFFAOYSA-N 424.457 2.324 10 20 HECD CCCN1CC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 761119256 IYCSROOPSOUHEQ-UHFFFAOYSA-N 412.469 2.117 10 20 HECD O=[S@](Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1)C1CCOCC1 765089595 JBYCBBXRQZVQMG-HHHXNRCGSA-N 421.500 2.451 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)[C@@H]4CCCN4C)CC3)c2C)cc1 766333132 GPEAZLFNASTCPK-QFIPXVFZSA-N 424.545 2.481 10 20 HECD Cc1cc(C(=O)CSc2n[nH]c(CO)n2)c(C)n1-c1ccc2c(c1)OCCO2 767077073 ARWRDAOYRUUHSF-UHFFFAOYSA-N 400.460 2.451 10 20 HECD CN(Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C1CCN(S(C)(=O)=O)CC1 770327079 VGPVXENNOQIGEC-UHFFFAOYSA-N 410.540 2.441 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 772701037 NJQBYEWWFGCQTA-YQVWRLOYSA-N 411.520 2.435 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773845952 LIUBCGJOIBNZSI-AWEZNQCLSA-N 412.490 2.279 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)c1 774769148 DYAKPQLJLQCBJF-UHFFFAOYSA-N 419.908 2.077 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)Cc1ccccc1 774918458 JMJMIAGDGUJUEN-QFIPXVFZSA-N 408.546 2.192 10 20 HECD CN1CCN(CCCN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 779330805 AXFWLXXAZWEQDQ-UHFFFAOYSA-N 405.612 2.019 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)cc1 786005926 LEVIRPVCAZKTSA-UHFFFAOYSA-N 406.490 2.046 10 20 HECD O=C(NCc1ccc(O)cc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 786627175 OTKSZJIFKGQPDQ-UHFFFAOYSA-N 419.428 2.395 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(F)cc1F 786982662 VRZPGSUQFIZYTN-UHFFFAOYSA-N 405.470 2.451 10 20 HECD CCc1csc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 789377056 GZIOWSDJRZFSKH-UHFFFAOYSA-N 402.520 2.169 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1F 793911416 BPHJSIJLQLOPGO-UHFFFAOYSA-N 413.428 2.149 10 20 HECD Cc1noc(C)c1C(C)(C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 797709720 IBKCWCQYECJGEE-UHFFFAOYSA-N 405.520 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cc1 797916074 LXQKZIXYWIZXBT-UHFFFAOYSA-N 408.499 2.012 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 799932083 KAJUPTFFSUUYNI-UHFFFAOYSA-N 406.486 2.200 10 20 HECD Cc1cc(CC(=O)NC2CC(NS(C)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 801462085 BUNFEUHZHZMKBY-UHFFFAOYSA-N 409.939 2.486 10 20 HECD CCOC1CC(N(C)CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 805818978 OSHUOSIBHSQTIK-UHFFFAOYSA-N 419.547 2.424 10 20 HECD CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 806855346 IOQCLQQMPLCGSG-UHFFFAOYSA-N 412.490 2.270 10 20 HECD CC[C@H]1COCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768467 KKZUUJLOHYAQBB-GJZGRUSLSA-N 411.449 2.010 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H](CNC(=O)C(F)(F)F)C1 810067637 XJXHIAJFCWHIJY-MRXNPFEDSA-N 414.472 2.102 10 20 HECD O=S1(=O)N=C(N2CCN(Cc3cc(Cl)c(F)cc3O)CC2)c2ccccc21 816491491 NVGNKRXWPAJDIA-UHFFFAOYSA-N 409.870 2.451 10 20 HECD CN(CCO)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 864049574 KVRKNBGSOWZWIZ-WQLSENKSSA-N 415.334 2.101 10 20 HECD CC(C)N(CC(N)=O)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 914405953 DCGKMHMSFOWSPP-LCYFTJDESA-N 411.574 2.452 10 20 HECD CNS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CCCC3)cc2)c1 915744048 SXMBLPXODMYCIE-UHFFFAOYSA-N 402.520 2.194 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)NC(=O)CO4)cc2)C1 918031066 IVUZEUYOXVANNQ-HNNXBMFYSA-N 423.473 2.041 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1Cn1cncn1 918204999 XKVDAVVUFRISCS-UHFFFAOYSA-N 424.480 2.302 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 918463196 IMGKJJLCPSTIIP-GOSISDBHSA-N 408.502 2.260 10 20 HECD COc1ccc(-n2nnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2C)cc1 919765979 VEZMJSLTWCKEQJ-UHFFFAOYSA-N 407.474 2.351 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 920250079 BBTCXGBOWJQECA-CMDGGOBGSA-N 423.469 2.310 10 20 HECD COC(=O)c1c(N/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)sc2c1CCC2 920978614 MXDJDPQXRSWSJF-YRNVUSSQSA-N 407.517 2.219 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 998931666 KYNPWSZQAQBYHT-KMSCNQLFSA-N 423.473 2.134 10 20 HECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(C)c(O)c1O 1116514444 GOYMKHSLZHRUSB-CQSZACIVSA-N 408.451 2.031 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 1319624713 VTRLBNBPQBSFLY-PMACEKPBSA-N 413.518 2.299 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2c(F)cccc2Cl)C1 1841206080 GCZIVIKOZQZMOL-UHFFFAOYSA-N 419.840 2.345 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1C 7201586 FXHXSKSSHZRXOA-SJORKVTESA-N 418.515 2.251 10 20 HECD C[C@@H](NC(=O)NCCc1nnc2n1CCCCC2)c1ccc(N2CCOCC2)cc1 65435118 WQRFPWRYHGDDFX-QGZVFWFLSA-N 412.538 2.444 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1cccc(-n2cnnn2)c1 139492641 UCWWALXTQAIMFL-UHFFFAOYSA-N 412.519 2.473 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 141686715 KXEVQHDKOGETRY-HNNXBMFYSA-N 411.458 2.126 10 20 HECD CNC(=O)C[C@H](NC(=O)C(=O)NCc1c(C)c2ccccc2n1C)c1ccccc1 569641631 UDYOSYPZYGYJMA-SFHVURJKSA-N 406.486 2.097 10 20 HECD O=C(O)c1ccn(-c2ccccc2NS(=O)(=O)c2cccc3nsnc23)n1 605613608 WLCSNWJDJRCQOT-UHFFFAOYSA-N 401.429 2.376 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1F 728014484 BCLSBECWRHDIJT-UHFFFAOYSA-N 402.425 2.005 10 20 HECD COC(=O)C(C)(C)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 730967916 IQJDKKVKYCONRB-UHFFFAOYSA-N 410.382 2.394 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1 735764265 GJIGHJMQBXXJQA-UHFFFAOYSA-N 408.414 2.487 10 20 HECD C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 739082299 VOXBYDWGTNPMFL-OAHLLOKOSA-N 414.481 2.372 10 20 HECD CC(C)OCCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 748645780 BFROQSRDPFNCBG-UHFFFAOYSA-N 410.458 2.386 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)nc12 749845174 PFLLYXSKOCQLPX-AWEZNQCLSA-N 419.482 2.053 10 20 HECD O=C(CC[C@H]1CCOC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 751244855 MLNFRSKGJFPTML-KRWDZBQOSA-N 413.497 2.375 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1 752725213 BBXNOLYMJKYLNR-NSHDSACASA-N 403.410 2.058 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccn(Cc2ccccc2)n1 759029389 UUTBUDRPNGRPFJ-UHFFFAOYSA-N 419.485 2.023 10 20 HECD Cn1nc(Br)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 760352603 RFYXLNPTHKASAP-UHFFFAOYSA-N 407.312 2.321 10 20 HECD Nc1ncncc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 761987687 ZIXUOFNNBPRXFD-QPEQYQDCSA-N 419.557 2.418 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC(=O)N(Cc3ccccc3)C2)c1 763313367 SDIPNPJIUFTPLQ-UHFFFAOYSA-N 423.513 2.229 10 20 HECD COC(=O)Cc1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765903184 HIZVDPFSHQYAQB-UHFFFAOYSA-N 421.247 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](CC(=O)OC(C)C)C3)CC2)cc1 766904981 JCIAPQQOEOMDHV-IBGZPJMESA-N 417.550 2.398 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(OC)c(C)cc3O)CC2)cc1 768437578 AEHGNOCZWIMUSW-UHFFFAOYSA-N 406.504 2.224 10 20 HECD COCCn1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1=O 771065582 NRUWQZAYSVQJTA-SFHVURJKSA-N 419.909 2.248 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)n1 774162125 CMHQODFAZAEERM-ZDUSSCGKSA-N 418.881 2.396 10 20 HECD COC(=O)c1ccc(OC[C@@H](O)CN2CCOc3cc(N(C)C)ccc32)c(OC)c1 774754456 SPTNBHCCDJHREL-KRWDZBQOSA-N 416.474 2.187 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3cccc(O)c3)CC2)cc1 778326774 RFELADOELFHWST-KHPPLWFESA-N 409.486 2.264 10 20 HECD Cc1ccccc1C(=O)NC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785438658 DKNLRDKMUHULML-UHFFFAOYSA-N 422.529 2.098 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccnc(N3CCCC3)c2)cc1 786507189 UTBOTWQPBROAJK-UHFFFAOYSA-N 409.534 2.461 10 20 HECD COC(=O)[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[C@H]1C 787325978 GWFUMAJCSYTLRI-UONOGXRCSA-N 406.438 2.284 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCCc1nc2ccccc2[nH]1 788458270 CAZZKKCXQWYNCF-UHFFFAOYSA-N 403.533 2.367 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c[nH]nc3-c3ccoc3)CC2)cc1 789080191 BMGZXRCBXNXYJO-UHFFFAOYSA-N 410.430 2.184 10 20 HECD Cc1c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cccc1NC(=O)N(C)C 792556098 ZPKKCBPBVNOFSV-UHFFFAOYSA-N 406.464 2.418 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)N(C)CC(F)(F)F)cc2F)CC1 793456813 YMUVKDSCVPVXJB-CQSZACIVSA-N 404.452 2.466 10 20 HECD CN1CC[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 793929742 MJSMELPGETVLKX-POKNLVKOSA-N 423.585 2.467 10 20 HECD Cc1c(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cnn1C 795866312 KYILJMODLRCJQI-UHFFFAOYSA-N 417.421 2.228 10 20 HECD CCn1ncc2cc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)c(C)nc21 799371813 LUDUDSGXEGOOKY-UHFFFAOYSA-N 420.517 2.358 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)cc1F 803662561 XWAIUSZOVSUZIW-HNNXBMFYSA-N 420.435 2.181 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)CCSC)cc2F)CC1 805009555 LVUYECMGUWLDLX-MRXNPFEDSA-N 424.586 2.184 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccn1 807010270 XTUIZJUDCRGSTD-INIZCTEOSA-N 418.881 2.169 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)CCc3cccn3C)CC2)cc1 807649125 AEWKWZUIGAAUIZ-GOSISDBHSA-N 412.534 2.210 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674491 LVSTUZDIXFVBNZ-HNNXBMFYSA-N 406.527 2.303 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCO[C@]2(CCOC2)C1 808115037 MGABDYJPRDVSPD-AUSIDOKSSA-N 415.534 2.090 10 20 HECD COC(=O)C1(CS(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCCC1 809814585 RSAREWWLECBOKE-UHFFFAOYSA-N 410.536 2.317 10 20 HECD NC(=O)NCCCCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 918611803 CPAQNKFRJSNOHI-UHFFFAOYSA-N 416.444 2.387 10 20 HECD CCc1c(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cnn1C 919699676 VYJNPGJAIUSBDA-UHFFFAOYSA-N 423.496 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1 920251923 UVQOOHUTYSZAOR-VAWYXSNFSA-N 422.485 2.497 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3COc4ccc(F)cc4C3)cc2)C1 1320297235 NZPZFTKTICYADK-FUHWJXTLSA-N 411.477 2.395 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cccc([N+](=O)[O-])c1 1337827114 WQNIEMDDRGNBJU-INIZCTEOSA-N 402.403 2.229 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccs1)C2)c1cc(O)c(O)c(Cl)c1 1799767411 NHNIHJNVEDIBDY-DRXBFXEBSA-N 422.890 2.330 10 20 HECD CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1799770256 HAUSYAWLBSZHCY-BJWYYQGGSA-N 411.458 2.457 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccccn1 1816364155 JSLLGFDFGYVYCA-OAHLLOKOSA-N 408.418 2.231 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1)c1cc(O)nc(O)c1 1827286729 YYDQQBMTYYFSGY-JQWIXIFHSA-N 420.516 2.071 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)n2)C1 1844453632 MTBXLUISTTUNNR-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1c(CNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)n(C)c2ccccc12 473268472 IHFLAOWVKLGBOL-UHFFFAOYSA-N 406.446 2.499 10 20 HECD CCn1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 727012646 XNJZRSNSGUMOJH-UHFFFAOYSA-N 400.479 2.034 10 20 HECD C[C@H]1CCCC[C@@H]1OCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 733567991 JLXAORZHBBYYMM-JXFKEZNVSA-N 422.497 2.417 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1C 737079996 WHTPUGCPMCVLRU-UHFFFAOYSA-N 418.519 2.078 10 20 HECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741099987 OXAZCZVQVNATHT-UHFFFAOYSA-N 419.529 2.070 10 20 HECD CCn1nc(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1Cl 741913524 KCXQYHMUXNQOCD-OAHLLOKOSA-N 403.914 2.497 10 20 HECD Cc1c(F)cccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 743256995 ALTLWJFMVPNCCV-UHFFFAOYSA-N 402.425 2.005 10 20 HECD O=C(CNC(=O)c1ccncc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743735056 CHJLYEXTBBCCNM-OAHLLOKOSA-N 404.417 2.198 10 20 HECD Cc1nn(C)c(C)c1C[C@H](C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 745277151 RTEYKIKYEKWWFW-HNNXBMFYSA-N 400.523 2.483 10 20 HECD Cc1ccc(C(=O)N2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)c(O)c1O 751533151 KXORXISWUCXRJR-UHFFFAOYSA-N 408.451 2.082 10 20 HECD COc1cc(N2CCN(C(=O)c3cnc4n3CCCC4)CC2)cc(OC)c1OC 759237341 JJPSXVJTMXOULT-UHFFFAOYSA-N 400.479 2.208 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)C[C@H]3CCOC3)CC2)cc(OC)c1OC 759288988 VNYKFTKXJNBLFH-JKSUJKDBSA-N 407.511 2.359 10 20 HECD COc1cc(N2CCN(C[C@H](O)COc3ccccc3)CC2)cc(OC)c1OC 759878233 JJTUHCBGASYZQV-SFHVURJKSA-N 402.491 2.274 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](n3cc(C(=O)OC)nn3)C2)cc1 762567490 FSXMCUYOSZRWMJ-SFHVURJKSA-N 414.510 2.458 10 20 HECD C[C@@H](NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 765626632 QDULTBMLUIRWKN-DYESRHJHSA-N 406.546 2.256 10 20 HECD C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 765902736 FRWHTETWPTVHBL-HNNXBMFYSA-N 409.446 2.092 10 20 HECD CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 766005016 IHXCJHNBOOCUSW-KRWDZBQOSA-N 415.456 2.215 10 20 HECD COC(=O)c1cn(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 768517534 CMGUOLFWOYLKBA-ZIAGYGMSSA-N 418.469 2.047 10 20 HECD O=C(NCc1nnnn1CC1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770501007 RVNWLPNNBMBCDB-CQSZACIVSA-N 421.452 2.153 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N3CCCC3)cc2)s1 771963330 OUOLOYNNGRLSHP-UHFFFAOYSA-N 422.576 2.434 10 20 HECD C[C@H](N[C@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(N2CCOCC2)c(F)c1 773024536 IJMOVMRUTAGGLL-YJBOKZPZSA-N 401.486 2.242 10 20 HECD C[C@@H](NCC(=O)N1CCN(Cc2ccco2)CC1)c1ccc(N2CCOCC2)cc1 775253782 FEVIEJMVCYCXEL-LJQANCHMSA-N 412.534 2.111 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@H](C(C)C)C3)CC2)cc1 778297060 FXQKWZYCFRCYLP-GWQNQTGSSA-N 417.575 2.500 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](O)COc1ccccc1Br 779533274 HZTWRADNRLIZKS-WOLRVDTOSA-N 408.248 2.430 10 20 HECD CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785294075 KMTACMMZQAULOF-JTQLQIEISA-N 405.838 2.396 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnn(-c2ccc(F)cc2)n1 786142534 ARLQADCAHGSGGE-UHFFFAOYSA-N 411.437 2.288 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCNC(=O)OC(C)(C)C)cc2)CC1 786255173 KHFCQHCQIDHNEE-UHFFFAOYSA-N 418.538 2.276 10 20 HECD COCc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 787519335 MIIVPDOEFOEWGI-FQEVSTJZSA-N 412.486 2.363 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)[C@@H](C)O1 789821016 RSCZQQNWTSDNHH-NQNKBUKLSA-N 421.513 2.080 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H]1CCCO1 789832625 BLQQSLVMBCUJOC-OFVDUGFESA-N 421.513 2.129 10 20 HECD O=C(NC[C@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793792730 HREJQZVHQUBBRW-QGZVFWFLSA-N 411.449 2.058 10 20 HECD C[C@@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccc(N2CCOCC2)cc1 803301984 DOEPZINBARAALD-GOSISDBHSA-N 411.502 2.033 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@H](Cc4ccccc4)C3)ccc21 803685350 DWURJVCYXNXDTE-OAQYLSRUSA-N 407.514 2.155 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)NCCCSc1nccs1)O2 806277874 LTKAMEGZOSHQDX-FVRSWCFKSA-N 413.565 2.180 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(N(C)C)cc1 807671688 SBYYJZDKSNSXCE-MRXNPFEDSA-N 400.548 2.336 10 20 HECD O=C(N[C@H]1CCOC2(CCC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809458814 XZDRLSMCTVEABH-ROUUACIJSA-N 402.491 2.118 10 20 HECD CC[C@@H]1CN(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 818978480 WFVFOGYBVJDKBA-CQSZACIVSA-N 409.533 2.421 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(C)c1NC(C)=O 1325764968 ZNWZAZCVZJXYHT-INIZCTEOSA-N 400.431 2.269 10 20 HECD C[C@H](OC(=O)[C@]1(F)CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1328754434 YKBMHIJSLXXECG-YTEVENLXSA-N 411.385 2.461 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1C[C@@H]1C1CC1 1792851526 CSYZLMBKVHMVMP-FQRJBHLQSA-N 420.893 2.001 10 20 HECD O=C(/C=C/C1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804335965 NZYDPRFKJFLKMP-PYNLGSQFSA-N 421.588 2.231 10 20 HECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)c[nH]1 1817754177 VRSJZIWRILRFKF-GFCCVEGCSA-N 413.459 2.125 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c(O)n1 1844772413 JSZHNFPEXMAPAX-UHFFFAOYSA-N 417.849 2.291 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c1O 729859335 PFNGTEBIKYETLZ-LBPRGKRZSA-N 423.447 2.070 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NC2CCN(CCS(C)(=O)=O)CC2)cc1 731650309 AXXBCOZBWUBHAM-UHFFFAOYSA-N 403.548 2.333 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN(C[C@@H]2CCCO2)CC1 734269019 GOHKACPTKALDQB-IBGZPJMESA-N 420.529 2.105 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](CCO)c3cccs3)CC2)cc1 741083598 UNHIRYRAWRFHDQ-IBGZPJMESA-N 418.563 2.302 10 20 HECD O=C(NCc1ccccc1O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 748346572 NBXPOWXOUKHNMP-HNNXBMFYSA-N 419.459 2.018 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C3(S(C)(=O)=O)CCCC3)cc2F)C[C@H](C)O1 749794474 NRNYBAMJAZKDFN-GJZGRUSLSA-N 412.527 2.413 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCn4nc(C)nc4C3)c2C)cc1 750058827 YBPYGBKUMQFVQD-UHFFFAOYSA-N 407.474 2.479 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(S(=O)(=O)N(C)C)oc3C)CC2)cc1 753214849 KDSCOMYEZYYRFE-UHFFFAOYSA-N 421.519 2.246 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(OCCO)CC3)cc2F)C[C@H](C)O1 757626925 FTZDRTGXVZTSJE-HOTGVXAUSA-N 409.502 2.122 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(OCC(F)F)c3)nc12 758633698 OEZZKFUIVLWNSW-UHFFFAOYSA-N 422.344 2.008 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccn(CCc2ccncc2)n1 759023848 ZWJUXXVLRJCCKV-UHFFFAOYSA-N 406.490 2.184 10 20 HECD COc1cc(N2CCN(CCCS(=O)(=O)C(C)C)CC2)cc(OC)c1OC 759872362 IEWNGOBATSQOEV-UHFFFAOYSA-N 400.541 2.048 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@H](CC(F)(F)F)C3=O)cc2F)CC1 761284317 UIBMVPIMPQMDJC-CQSZACIVSA-N 402.392 2.340 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 769540207 GSOKWAUJLNUFDA-IXDOHACOSA-N 420.531 2.314 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12 775287279 XWWBIGIQIBNVEW-UHFFFAOYSA-N 403.372 2.436 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1 784559577 GDSHWSHESLGBBM-UHFFFAOYSA-N 413.474 2.150 10 20 HECD C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424606 RAJGCKLGOSTNPO-NVXWUHKLSA-N 418.538 2.273 10 20 HECD O=C(c1ccc(NCCCSc2nccs2)nc1)N1CCS(=O)(=O)CC1 786782503 VKTBKIOWXBRDQT-UHFFFAOYSA-N 412.562 2.003 10 20 HECD COC(=O)CCCCCS(=O)(=O)NCc1ccc(N2CCSCC2)cc1 788034726 URASLWSSZXFYRM-UHFFFAOYSA-N 400.566 2.393 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC(=O)c4ccccc43)CC2)cc1 789297173 SVRFABHMWLVJED-HXUWFJFHSA-N 408.454 2.257 10 20 HECD CC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 789823027 CFZPETDAWSBBQL-XCGNWRKASA-N 421.513 2.083 10 20 HECD CN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842660 FNFPWLCBOVTUIS-UHFFFAOYSA-N 417.456 2.201 10 20 HECD COc1ccc(CC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1 790023065 DOUUUGYJRCTCPS-UHFFFAOYSA-N 401.463 2.007 10 20 HECD C[C@@H](CCC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793719165 LEYLDVQBGTUYQZ-FUHWJXTLSA-N 416.566 2.336 10 20 HECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccco1 793847416 PJESYYIBKFFZNY-IBGZPJMESA-N 400.523 2.470 10 20 HECD COc1ccc(CNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)c(O)c1 794371255 ZXPFGZWREGUXNE-UHFFFAOYSA-N 408.476 2.026 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c(O)c1 794388455 UWRBQBNKBNHDRV-INIZCTEOSA-N 408.458 2.446 10 20 HECD CCn1ncnc1COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 801193795 DHTZSLQAYWTYLB-UHFFFAOYSA-N 406.354 2.339 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@]2(CCCOC2)C1)c1ccc(N2CCOCC2)cc1 803308793 KDTZJIHLGSNXEP-WZONZLPQSA-N 415.534 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)cc1F 803665148 USVWTJCRILLWFG-UHFFFAOYSA-N 422.501 2.072 10 20 HECD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665176 YDAYJFZWRGAOBG-OAHLLOKOSA-N 424.480 2.308 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(Cc3ccco3)C[C@H]3CCCO3)ccc21 803685479 BFXTVCVDGHESQK-HXUWFJFHSA-N 411.502 2.486 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1nccs1 808816483 NVQYANUNPOROGC-GOEBONIOSA-N 403.504 2.276 10 20 HECD COc1cc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1OC 914563810 FWFVQAHYIYQMSL-UHFFFAOYSA-N 400.478 2.185 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(-n4cnnn4)cc3)cc2F)C[C@H](C)O1 917712117 HEMZVOJXUXQOGC-HOTGVXAUSA-N 424.480 2.274 10 20 HECD CCc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1C(C)(C)C 918645374 SPPUFJSIVZEXOW-UHFFFAOYSA-N 418.563 2.365 10 20 HECD CCc1ccc([C@H](C)NC(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920638334 WGRFZSZPNZTDMI-ZDUSSCGKSA-N 420.487 2.360 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CN)CCO3)cc1 1781753178 DTUMZCOUBPLDII-BXKMTCNYSA-N 424.545 2.132 10 20 HECD C[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1791426552 IUCPLSHPYHSRCF-OAHLLOKOSA-N 420.469 2.294 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 105162273 APPINYXMCLYLME-UHFFFAOYSA-N 404.488 2.131 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c1 728977598 AVTSPHFOGOQRDZ-CQSZACIVSA-N 419.503 2.074 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1 734702966 FRDFDTFMBWFWIV-UHFFFAOYSA-N 408.502 2.438 10 20 HECD COc1ccc(CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccncc2)cc1 740694578 GQQOYYVGCKAIDY-UHFFFAOYSA-N 424.482 2.121 10 20 HECD CCN(CC)C(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 745811408 FMRJTCXLJHUWSC-UHFFFAOYSA-N 421.561 2.368 10 20 HECD Fc1cc(CNCc2cnc3cnccn23)ccc1N1CCN(c2ncccn2)CC1 746465862 HEWQZJLPPLULEQ-UHFFFAOYSA-N 418.480 2.275 10 20 HECD COc1cc(C[C@H](CO)CNCc2ccc(N3CCOCC3)cc2)cc(OC)c1 747622180 MMBPOZQMMKUTCD-FQEVSTJZSA-N 400.519 2.481 10 20 HECD COc1cc(C[C@@H](CO)CNCc2ccc(N3CCOCC3)cc2)cc(OC)c1 747622182 MMBPOZQMMKUTCD-HXUWFJFHSA-N 400.519 2.481 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cc(C(N)=O)c[nH]2)NC(=O)OC(C)(C)C)cc1 749401960 FXFMCFPSQGTAKK-KRWDZBQOSA-N 415.494 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)c3c[nH]c(C(=O)N4CCCC4)c3)CC2)cc1F 753742101 OEDRCBJTVRSGNL-UHFFFAOYSA-N 400.454 2.361 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(c4cc(C)[nH]n4)CC3)CC2)cc1 754096147 ASZYOAZOOMPDTM-OAQYLSRUSA-N 413.566 2.089 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 756811172 FGPGHKTUFLVWNJ-DEOSSOPVSA-N 423.513 2.141 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccsc3)CC2)cc(OC)c1OC 759410760 VCQVOXGQIAZRSI-UHFFFAOYSA-N 405.476 2.061 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCS(=O)(=O)c2ccc(OC)c(OC)c2)c1 761971714 AWOLXGMUYIVHEJ-CYBMUJFWSA-N 423.487 2.459 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CC(=O)N2 762000902 RELOMMDBMCKWDG-UHFFFAOYSA-N 405.432 2.261 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccn(C)c3)cc2F)C[C@H](C)O1 764117106 DZTRHCWOTNTURQ-GJZGRUSLSA-N 403.454 2.251 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 776040497 DLCSUEDVMFXGTQ-PXNSSMCTSA-N 409.552 2.068 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1CS(C)(=O)=O 784027361 PBUHGKHMNAGNSC-UHFFFAOYSA-N 404.488 2.314 10 20 HECD COc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccc1O 785632518 MNZCYOKZCQRGJX-UHFFFAOYSA-N 402.447 2.389 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(Br)cn3)cc2)CC1 786263491 YEMYJYKRSCUUIR-UHFFFAOYSA-N 417.307 2.443 10 20 HECD CN(CCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 788889731 QGFQWSVJTYKNEE-UHFFFAOYSA-N 406.527 2.084 10 20 HECD CN(C)C(=O)CNC(=O)c1ccc(NCc2cc([N+](=O)[O-])ccc2O)cc1Cl 789891180 TYXQZJMLFSLSEH-UHFFFAOYSA-N 406.826 2.384 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c(O)c1 797389241 WONSPLJALNZCJU-SFHVURJKSA-N 400.431 2.214 10 20 HECD COCC[C@H](CO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 799086454 BFYPKMLMIBCBLT-XTCQQWIJSA-N 414.574 2.243 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(c4ccccc4F)CC3)ccc21 803688235 NCVRAEJTHPZNSC-UHFFFAOYSA-N 410.493 2.173 10 20 HECD CC[C@@H]1CCCCCN1C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803748258 ZQQGKJKQLZQWHG-LJQANCHMSA-N 416.566 2.115 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804060159 MUYODYRLNPYAJN-WOJBJXKFSA-N 415.534 2.033 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)c1cnn(C)c1 805733469 MXVTVADJGDJDTF-LLVKDONJSA-N 409.284 2.114 10 20 HECD O=C(NCc1ccc(Cl)cn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806722009 UKZDYQAWLWOFEL-QGZVFWFLSA-N 403.866 2.265 10 20 HECD O=S1(=O)CCN(c2ccc(CNc3nnc(-c4ccccn4)s3)cc2)CC1 807959055 LUWILPUGZRBQDS-UHFFFAOYSA-N 401.517 2.447 10 20 HECD Cc1onc(N)c1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 809821411 RYGOFPJNYYJILF-LLVKDONJSA-N 402.423 2.114 10 20 HECD CCc1nnc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 811967093 JPVXUFKQIAHBGN-UHFFFAOYSA-N 418.567 2.121 10 20 HECD NS(=O)(=O)c1ccc2onc(NCc3ccc(N4CCC(O)CC4)c(F)c3)c2c1 820635056 STZOZTQQQRIZGI-UHFFFAOYSA-N 420.466 2.188 10 20 HECD CCOC(=O)N[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 918220403 DZCNXUIMWQIXRD-INIZCTEOSA-N 422.501 2.207 10 20 HECD CCN1CCN(Cc2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)CC1 918444686 ULHBVLGQYMJDPF-UHFFFAOYSA-N 410.518 2.127 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)oc(=O)n4C)CC2)cc1 1341344019 ZOQIGEJCNAOBJH-UHFFFAOYSA-N 417.487 2.041 10 20 HECD O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806837929 QMVOUDILPMRDDD-SJKOYZFVSA-N 424.379 2.160 10 20 HECD COC[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 303519795 CNGWMFAPKPEJRN-LJQANCHMSA-N 404.555 2.275 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1 729786903 AAFMBYWMNGXIHM-UHFFFAOYSA-N 401.316 2.321 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3CCN(C4CC4)C3)cc2F)CC1 730118325 WKNQROZIPQJAIN-GOSISDBHSA-N 403.546 2.251 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cc(O)cs2)NC(=O)N[C@H]1c1ccccc1 731910957 XNVWZGZIUFEFLM-INIZCTEOSA-N 402.428 2.482 10 20 HECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2CCCN(C(=O)c3cc(O)cs3)C2)CC1 732276190 WHTYYYPTDNFEQQ-CQSZACIVSA-N 423.535 2.385 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1C(=O)N(C)C 741096222 USKIUWAVPJHXFS-UHFFFAOYSA-N 408.502 2.334 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1 742267457 WPBIHKNSONZWIT-UHFFFAOYSA-N 413.503 2.095 10 20 HECD COC(=O)c1ccsc1N1CC[C@@H](NC(=O)N(C)Cc2ccccc2O)C1=O 746782900 ZEWCNZWUZHPTMU-CQSZACIVSA-N 403.460 2.187 10 20 HECD CC[C@H]1CN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)[C@H](CC)CN1C(C)=O 752095429 UYTMDYRALHDKBG-UXHICEINSA-N 416.566 2.065 10 20 HECD COC(=O)[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 752332023 KXWKMVOOABBGPZ-JXXFODFXSA-N 421.513 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1F 753033535 QWFYWPWTWRNLND-KRWDZBQOSA-N 415.513 2.497 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1 769978413 NWTRWAMTNSRJRW-UHFFFAOYSA-N 413.455 2.226 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCC1CCN(C2CC2)CC1 770260137 COROKDNWMQWHGP-UHFFFAOYSA-N 404.530 2.460 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc([C@H]2CNC(=O)C2)c1 772474721 PCFNYZZWUZOUFZ-GOSISDBHSA-N 408.502 2.343 10 20 HECD CCCCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774652755 LFXCZHCFCCSOPZ-AEFFLSMTSA-N 402.539 2.090 10 20 HECD COCCO[C@@H]1C[C@H](CO)CN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 774850732 RJRTYRPRADVBCJ-RBBKRZOGSA-N 419.566 2.478 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N(C)C)c1 774947120 MUYXSIGFJHWMBA-IERDGZPVSA-N 412.534 2.358 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 779515804 CBBNUQDIEYGPFJ-GXVATQTDSA-N 407.470 2.061 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] 784126301 WMYSOEBGYCFZEI-LJQANCHMSA-N 401.463 2.303 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(Br)cn1 785423291 VQNNIEVJARFBRT-GFCCVEGCSA-N 405.296 2.404 10 20 HECD COCCc1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 786204303 CWPGXQGYIFYORY-UHFFFAOYSA-N 417.531 2.432 10 20 HECD COCc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 787507011 ZQRYWCRZCXALNA-HXUWFJFHSA-N 412.486 2.363 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1 787734637 CHYWIZCFGKUCNW-OAQYLSRUSA-N 422.529 2.191 10 20 HECD CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NCc1ccc(N2CCOCC2)cc1 795494638 SMYHIVWSEWVAQK-IBGZPJMESA-N 419.522 2.165 10 20 HECD COc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCCC3)cc1)OCC(=O)N2 797442794 JTBNJZGIUCHBSV-UHFFFAOYSA-N 417.487 2.105 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCCCSc1nccs1)c1cccc(F)c1 806275907 ZEJOBYWBQVAYGF-OAHLLOKOSA-N 410.540 2.300 10 20 HECD COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)n1 913075413 ZMFFFOPHGOMOTP-UHFFFAOYSA-N 406.489 2.365 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 920924731 DVXWRFIROPRDEX-MRXNPFEDSA-N 424.501 2.041 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1ccccc1)N(C)CC 1116591798 JSBQIWBYTWSLGV-PXNSSMCTSA-N 400.475 2.381 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c[nH]nc1-c1ccsc1 1320821594 HLVYNIQQJPFQDR-AWEZNQCLSA-N 401.444 2.454 10 20 HECD Cn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787408699 JDDLHYXRVKBWCZ-UHFFFAOYSA-N 407.430 2.288 10 20 HECD O=C(Cc1cnccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712676 QMJWYWYVTDSBQU-YOWGUQMCSA-N 416.865 2.036 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C1)C2)C1=NN(c2ccccc2)C(=O)C1 1803371826 WLTJMUVQWBZTFG-IKKABONKSA-N 406.486 2.218 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CSc1nnnn1C1CCCC1 11264551 ZONBNHHZPQKNEV-UHFFFAOYSA-N 416.551 2.376 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 141682125 CSAQRLPKCPWFBE-KRWDZBQOSA-N 410.518 2.401 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(NC(C)=O)c3)CC2)cc1 726726478 SEUQIWFTERWDAH-UHFFFAOYSA-N 410.474 2.377 10 20 HECD COc1ccc(C(=O)NCc2cccc(OC)c2O)cc1S(=O)(=O)N1CCCC1 727761353 WKHDVMKVBDOBCT-UHFFFAOYSA-N 420.487 2.124 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(OC)c(C(N)=O)c2)cc1F 731356667 NIKMAPSRHGLVJY-UHFFFAOYSA-N 409.483 2.258 10 20 HECD O=C(COC(=O)CC[C@H]1CCCCO1)NCc1ccc(N2CCOCC2)c(F)c1 732380749 BSHBNBFHYTWNNZ-QGZVFWFLSA-N 408.470 2.171 10 20 HECD COC(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 733135515 DMJRPUJNNYWQSL-UHFFFAOYSA-N 417.487 2.030 10 20 HECD C[C@@](CO)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 741054242 LNJGEZVDBFZKSD-QFIPXVFZSA-N 407.530 2.199 10 20 HECD C[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(S(N)(=O)=O)c1 743506026 JDSRHUBALMBALV-CYBMUJFWSA-N 403.504 2.479 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3CCN(C(=O)OC(C)(C)C)C3)nc12 745986947 UNXWEOVMMOCSPZ-AWEZNQCLSA-N 419.482 2.053 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 749405862 KQRSWMKVTFMJDX-UHFFFAOYSA-N 417.393 2.354 10 20 HECD Cc1cc(C(=O)Oc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 755336309 VLQYLORTYUETED-GOSISDBHSA-N 404.426 2.459 10 20 HECD COc1ccc(S(N)(=O)=O)cc1NC(=O)CN(C)c1ccc(OC(C)C)cc1 759928697 PNONXHBDSRULEK-UHFFFAOYSA-N 407.492 2.205 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)CN(Cc4ccccc4)C3=O)cc2)C1 761119729 KBNUCBYXNXMDHW-IBGZPJMESA-N 406.486 2.353 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C=C1CN(C(=O)OC(C)(C)C)C1 766150428 UXFAWXPOROQFJJ-UHFFFAOYSA-N 417.506 2.431 10 20 HECD C[C@@H](OC(=O)C[C@@H]1COC(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767603369 UKPDEEFDWBJGDA-CHWSQXEVSA-N 421.405 2.285 10 20 HECD Cn1cnc(-c2ccc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2)n1 779855564 WCNDARXYBGLHFC-IBGZPJMESA-N 418.501 2.114 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCC(=O)[C@@H](C)C3(C)C)nc12 781312490 GCGVOEYLSBMSJV-RISCZKNCSA-N 403.435 2.296 10 20 HECD COc1ccc(OC(F)F)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785298645 XHGMSOPRGZTITH-SNVBAGLBSA-N 410.373 2.394 10 20 HECD O=C(NCCc1cccc(F)c1)C(=O)NCc1ccc(N2CCSCC2)cc1 785539992 OEHOBFHIDQYZFP-UHFFFAOYSA-N 401.507 2.354 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cscn3)cc2F)C[C@@H](C)O1 789822978 BZPBPNZRIMYBJI-OKILXGFUSA-N 420.510 2.171 10 20 HECD CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCOCC3)cc1)CC2 792176373 BBWXOPCAORNWSV-UHFFFAOYSA-N 401.532 2.336 10 20 HECD C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(S(N)(=O)=O)cn1 798337480 PGJODZRNMWGEDT-OAHLLOKOSA-N 414.487 2.026 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(CC(F)(F)F)CC3)cc2)CC1 800887010 LDEGHTYCXMGCLT-UHFFFAOYSA-N 405.486 2.038 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1cccnc1 802257472 KPCZDDPLSZRFAE-UHFFFAOYSA-N 406.508 2.077 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 804279962 VWPUODQVHOVZHX-QFIPXVFZSA-N 418.541 2.317 10 20 HECD CN(Cc1ccccc1)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806278494 SYHMGSLHJKBSIG-QGZVFWFLSA-N 418.588 2.474 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H]1C[C@H](O)c1ccco1 806282424 KRWGAJNZEMWIDB-KBPBESRZSA-N 409.533 2.449 10 20 HECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 806520793 WLPNTHBLRUIYNZ-MRXNPFEDSA-N 416.522 2.099 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3snnc3C3CC3)CC2)cc1 809971204 WTOOVXAFULQDOE-UHFFFAOYSA-N 401.536 2.366 10 20 HECD O=S(=O)(C1CCOCC1)N1CCC(NCc2cc(Cl)c(F)cc2O)CC1 816552519 OSWQPWCTMJUIIZ-UHFFFAOYSA-N 406.907 2.248 10 20 HECD COC(=O)c1ccc(F)c(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 897171283 UXJIAZWIWDKXJA-UHFFFAOYSA-N 401.438 2.382 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3nc4ccccc4n3C)CC2)cc1 1335880492 CMQUOBBFNMPDPT-AZUAARDMSA-N 423.561 2.416 10 20 HECD CCc1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)s1 1796600912 PTVDSDOLDLFMBJ-CLLJXQQHSA-N 402.476 2.077 10 20 HECD O=C(CN1CCCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715299 GZAXNDLGMJTJKZ-MUJYYYPQSA-N 421.925 2.489 10 20 HECD O=C(Cc1cncnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715701 LZZLTMBCWBGPNZ-QDMKHBRRSA-N 416.865 2.036 10 20 HECD Cc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283537 AZFNNXJIECDFOZ-FJXIAYRNSA-N 423.469 2.472 10 20 HECD Cc1cc[nH]c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283953 QQKWYNGVMKMEEZ-NCSLWMNCSA-N 411.458 2.405 10 20 HECD O=C(Cc1ccccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285699 OFOAUCQJUPIOGX-VYMNDLDVSA-N 423.469 2.093 10 20 HECD O=C([C@H]1C[C@H]1C1CC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441195 RBAGMIMXOLMXJD-ROUUACIJSA-N 406.486 2.029 10 20 HECD Cc1cc(NC(=O)COC(=O)c2ccc3c(c2N)C(=O)c2ccccc2C3=O)no1 10959028 RTATXNXMZMQMGE-UHFFFAOYSA-N 405.366 2.136 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc2c1OCCO2)c1ccc(N2CCOCC2)cc1 65715982 FTFUCPLRCVWLPO-HNNXBMFYSA-N 411.458 2.110 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1 728137912 KSUUSRQBXPIULI-UHFFFAOYSA-N 414.481 2.325 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccnc3)cc2)C1 730422791 DCLKAQHOBCOWMM-KRWDZBQOSA-N 404.474 2.103 10 20 HECD C[C@H](NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)C(=O)N(C)C 731036767 PYBSJWKHNFEEHH-HNNXBMFYSA-N 418.538 2.057 10 20 HECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N(C)C)c(F)c1 731543373 JLPQVYFSWWHUNA-HXUWFJFHSA-N 424.480 2.231 10 20 HECD O=C(CCn1nnc2ccccc2c1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 731858839 OIHDWKIHNOGEMV-QGZVFWFLSA-N 408.458 2.095 10 20 HECD COC(=O)c1c(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)n[nH]c1C 732216697 SNIUVCPOLSTHGI-UHFFFAOYSA-N 406.508 2.316 10 20 HECD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)c1 732526429 RDKLPDMSOXJQQH-UHFFFAOYSA-N 409.533 2.338 10 20 HECD CCN(CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 734320798 XQERATVWUBYSIK-KRWDZBQOSA-N 418.538 2.262 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1O 737286020 QDXVSLOYYLBQGL-HNNXBMFYSA-N 413.474 2.049 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 741092983 MDFWIWLDROHSSN-LPHOPBHVSA-N 409.552 2.273 10 20 HECD O=C(CCN1C(=O)c2ccc(Br)cc2C1=O)NCc1ccccc1O 748353149 MNCZZKIIGOWALB-UHFFFAOYSA-N 403.232 2.457 10 20 HECD COc1ccc(N(C)CCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F 757851737 DFINHLYXAFRERA-UHFFFAOYSA-N 424.494 2.370 10 20 HECD CCN1CCC[C@H]1CNC(=S)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 758918123 BLZNMLKTRSMWLW-INIZCTEOSA-N 422.595 2.193 10 20 HECD COC(=O)[C@]1(C)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 759810838 SDBFKIYXWNEIDC-WCJKSRRJSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCCN(C(=O)NCCCN3CCCO[C@H](C)C3)CC2)cc1 764585170 UDYQUFHHLFXRLM-LJQANCHMSA-N 404.555 2.418 10 20 HECD CN1CCCc2cc(CNC(=O)N(CCO)CCNC(=O)OC(C)(C)C)ccc21 768299546 HOJJEABNLCSWJW-UHFFFAOYSA-N 406.527 2.098 10 20 HECD Cc1cnoc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 768613186 NPFMGYBHYXEPIR-OKILXGFUSA-N 405.426 2.209 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1F 774541006 ICOBRONKZJVPQG-UHFFFAOYSA-N 412.509 2.289 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O 775287011 VINHSSNWWNKQQB-UHFFFAOYSA-N 404.444 2.279 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 775372450 BIVPTFYARZKTGA-ZIAGYGMSSA-N 421.519 2.329 10 20 HECD CCCc1cc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)n(C)n1 778420556 XAIODEINWCAHBV-ZHACJKMWSA-N 411.506 2.225 10 20 HECD Cc1cc(Br)cc(CN[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 779432531 UHUMEEDTXGPTAS-ZBFHGGJFSA-N 404.326 2.289 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc2n[nH]cc12 779623521 PFEBKYKHAUBPDO-UHFFFAOYSA-N 413.503 2.428 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc(OC4COC4)cc3)cc2)C1 782092606 HXVXQNJQJAZDEI-QGZVFWFLSA-N 424.501 2.488 10 20 HECD Cn1ncc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C(F)(F)F 782099965 LFKQAJJGSYUHIN-CYBMUJFWSA-N 424.427 2.462 10 20 HECD Cc1nnnn1-c1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 783316462 NAGPYOQWUNZPDJ-UHFFFAOYSA-N 421.505 2.412 10 20 HECD CN(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 785626335 ZEXGANLFWZWIBZ-UHFFFAOYSA-N 412.559 2.109 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)C2 786675382 UCXLSODJHOWZIU-GOSISDBHSA-N 420.469 2.286 10 20 HECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788937937 PLWWWIOKEKURDN-GOSISDBHSA-N 406.530 2.470 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)C1 788979469 WFWBECVMAWPUNN-IBGZPJMESA-N 416.566 2.304 10 20 HECD Cc1cccc(F)c1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813247 QTGHHNMCNUEHLR-UHFFFAOYSA-N 403.429 2.042 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCOCC(F)(F)C(F)F)cc2)CC1 790950642 AZYZVKXYFYJPHY-UHFFFAOYSA-N 419.419 2.278 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1 806897684 NWDCPXWFDWZEIZ-UHFFFAOYSA-N 418.421 2.353 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 807290286 HBJCEAJWGHKZFR-VWLOTQADSA-N 417.509 2.380 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCC(C1CC1)C1CC1 807661084 ITBPTMHDNVOBLV-UHFFFAOYSA-N 424.589 2.387 10 20 HECD O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)NCCc1ccc(O)c(O)c1 849156405 NOFFLAIGJTZIFY-UHFFFAOYSA-N 419.441 2.224 10 20 HECD C[C@@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 917698914 MUMSSBGXBXGNDC-CYBMUJFWSA-N 416.389 2.279 10 20 HECD C=CC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 917836464 NYZBPLGNQLOUSI-GOSISDBHSA-N 406.486 2.443 10 20 HECD C[C@H](CN1CCCCC1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117080 GKIPCXUFECYABX-IEBWSBKVSA-N 401.555 2.062 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](CO)Cc1ccc(F)cc1 918207696 JFYUABLQPABWDA-GOSISDBHSA-N 419.472 2.452 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)C1 1810550132 AEJPGTCUCGHSJS-BFUOFWGJSA-N 411.861 2.262 10 20 HECD O=C(C1=CCCC1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837615373 DSXJLAMKIOMJSD-UHFFFAOYSA-N 415.490 2.215 10 20 HECD O=C(c1ncccc1F)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501693 QEYSNDYXBZNOQH-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COC(=O)c1cc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)oc1C 28964696 GYBPWWBWJAVKPD-PTNGSMBKSA-N 410.517 2.298 10 20 HECD COCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 115715464 RWNZCIGVYKZSDM-UHFFFAOYSA-N 420.531 2.335 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C4CCC(C)CC4)CC3)nc12 303725258 SKNPRRVTFHAPSO-UHFFFAOYSA-N 401.511 2.308 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)n(C)c2ccccc12 580232912 CJKMCXZOWCOCTM-MRXNPFEDSA-N 408.506 2.469 10 20 HECD COCCCN(C(=O)/C=C/c1cnc(C)s1)c1c(O)nc(=O)n(CC(C)C)c1N 732729950 OGIRGVVFXWJKCH-VOTSOKGWSA-N 421.523 2.035 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c1 734072900 TXMCWGGTEJLZIO-GJZGRUSLSA-N 413.474 2.269 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4[nH]ccc34)cc2)C1 737139837 UCJJVSOYPBIVPP-MRXNPFEDSA-N 419.485 2.125 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1 737183233 KJJMRWPJIWUTGJ-GFCCVEGCSA-N 417.487 2.184 10 20 HECD CCn1nc(C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Cl 742051525 VODGBMMYCPMVGN-UHFFFAOYSA-N 410.927 2.030 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)OC)c2)cc1 743255009 XJJLSFPLZBYSJH-UHFFFAOYSA-N 404.491 2.097 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1 743328141 KQKVAYFMPYBKTH-UHFFFAOYSA-N 418.515 2.307 10 20 HECD O=C(CN1CCOC[C@@H]1c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 743871331 BQEVQIKGQDNBRV-JOCHJYFZSA-N 413.493 2.352 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)c(O)c(F)c3)CC2)cc1 748482206 LFZMTPOWAZKNRB-UHFFFAOYSA-N 406.385 2.185 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C[C@H](O)C[C@H]3C(=O)OC)c2C)cc1 749840753 QSAHHTCVBQXYPU-XLIONFOSSA-N 400.475 2.284 10 20 HECD Cc1cc(C(=O)CN2CCS(=O)(=O)C[C@@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 749846422 ZLYPVKGCDFPPNF-HNNXBMFYSA-N 418.515 2.167 10 20 HECD Cc1cc(-n2c(C)cc(C(=O)CN3C[C@H](O)[C@H](O)C3)c2C)ccc1Br 750838887 RMXSIVNZYDTQRO-KDURUIRLSA-N 407.308 2.385 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 753643989 FFEGBVPAMRNFHV-CQSZACIVSA-N 419.494 2.333 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1F 753835084 ZJSVPUZDXSPOBO-IAGOWNOFSA-N 408.518 2.165 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1 754923313 SGRQDZNOZXJGKX-UHFFFAOYSA-N 407.478 2.106 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccnc3Br)CC2)cc1 758201340 KKCRKJYAHDKODV-UHFFFAOYSA-N 419.323 2.405 10 20 HECD COC(=O)Nc1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758232349 QEVVXSOQXKPLBW-IBGZPJMESA-N 415.490 2.435 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)/C=C\c2ccc(O)c(O)c2)cc1 759581439 VQUPBSKSZXAQGX-WMZJFQQLSA-N 419.455 2.477 10 20 HECD O=C(NCCCSc1nccs1)NC[C@@H](O)COc1ccc2c(c1)OCO2 759602857 NDETZSZZUSKGRO-GFCCVEGCSA-N 411.505 2.093 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1 760841721 RKGSERZECKWPBA-UHFFFAOYSA-N 424.442 2.145 10 20 HECD CCCN1C(=O)N(Cc2ccc(N3CCN(CC)CC3)c(F)c2)C(=O)[C@H]1COC 761277520 IXYJOHJDQODGPZ-LJQANCHMSA-N 406.502 2.157 10 20 HECD Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 763944456 HKXNSFKSYFOOSJ-AWEZNQCLSA-N 404.536 2.071 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2scnc2C(=O)OC)cc1F 765116211 ZDMKTLQCMASTOS-UHFFFAOYSA-N 401.485 2.394 10 20 HECD COC[C@@H]1CCCCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 768662630 CWWYPBRIVIRAIG-OEIFXAAASA-N 415.534 2.175 10 20 HECD CCOc1cccc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1O 769024824 SXFRYIURXQZMNQ-UHFFFAOYSA-N 416.503 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4ccc(O)cc4)n3)CC2)cc1 771058822 WHEFMHRQFQSHLE-UHFFFAOYSA-N 422.485 2.460 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F 774356672 KNZRELPVVADIRH-UHFFFAOYSA-N 416.327 2.475 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 774765196 XNEXTVCHZRECKM-NVXWUHKLSA-N 419.522 2.056 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(OC)c(C(=O)O)cc1Cl 775287044 HFTIKGPTIHIUSI-UHFFFAOYSA-N 415.807 2.340 10 20 HECD COc1ccc(N2CCN(CCCN[C@H]3CCCC[C@H]3S(C)(=O)=O)CC2)cc1 775365051 OLFXTXAEPYNGSX-LEWJYISDSA-N 409.596 2.153 10 20 HECD Cc1cccc2c(=O)c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c[nH]c12 776120308 WGBLKFWRYPLIBI-QGZVFWFLSA-N 418.497 2.468 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](OC)c3ccccc3)CC2)cc1 778228951 TWYUUQCMNNPCOM-GNNUASRNSA-N 423.513 2.404 10 20 HECD CCN(C(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCCCC1 783153315 VMBYJZGHRKEERC-CYBMUJFWSA-N 412.508 2.490 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)cc3F)cc2)CC1 786121668 JPGUCHIUILHWCW-UHFFFAOYSA-N 405.495 2.281 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 788505826 KSFWBPKSHRABJI-WIYYLYMNSA-N 409.596 2.153 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 788773617 CDYZSIWMLWKGGH-INIZCTEOSA-N 414.472 2.102 10 20 HECD O=C(NCCN1CCc2sccc2C1)C(=O)NCc1ccc(N2CCCC2)cc1 788931312 CWPMUYPGPLQCHF-UHFFFAOYSA-N 412.559 2.139 10 20 HECD C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801770 UBBUQERWTWVZMI-AYBZRNKSSA-N 403.498 2.458 10 20 HECD CCCN(CC(C)(C)O)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828928 ZENDTESXWLYDTN-IYBDPMFKSA-N 423.529 2.065 10 20 HECD COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)c1cccc(O)c1O 790514605 XOLWMROXVQGQCO-OAHLLOKOSA-N 401.415 2.418 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@](C)(O)CC3)cc2F)C[C@@H](C)O1 791625522 ASXWZMKVHPRXPP-HYFFOGBASA-N 407.530 2.292 10 20 HECD CC(=O)N1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 795784195 LVAUQGYLYDCIDV-HNNXBMFYSA-N 419.481 2.343 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c(O)c1 797390771 QLUQJIXIESZNCM-OAHLLOKOSA-N 413.474 2.049 10 20 HECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664319 KLIBWQMVTGOYMJ-QGZVFWFLSA-N 401.438 2.157 10 20 HECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 804083061 IBKRVNLKFOPHHN-GOSISDBHSA-N 424.545 2.329 10 20 HECD C[C@@H]1C[C@H](N2CCOCC2)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 804968634 HLQSBRGCNRJNFD-XLIONFOSSA-N 404.580 2.244 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCCN(c2ccccc2)C1 806426913 RGAIHDCZVIPQCJ-FQEVSTJZSA-N 404.514 2.464 10 20 HECD O=C1COc2cc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)ccc2N1 807513268 XAGWWMXXEZFOCZ-UHFFFAOYSA-N 410.213 2.285 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](N3CCCC3)[C@H]2C)c1 808193796 XNUDVRQTZSUOBT-VGOFRKELSA-N 401.551 2.486 10 20 HECD COCCn1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)cn1 808831183 ANWDVXYNSITZJS-UHFFFAOYSA-N 414.506 2.213 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cncc(C(F)(F)F)c1 809615614 JOSIMOUJAOTVFR-UHFFFAOYSA-N 413.421 2.265 10 20 HECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cc(Br)ccc2O)CC1 809711474 CFUSPWVGNBKQIQ-UHFFFAOYSA-N 420.325 2.097 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1 813660829 RUYKXCNOJSSRCQ-UHFFFAOYSA-N 410.467 2.303 10 20 HECD CN(C)c1ccc(CN(C(=O)CCNS(=O)(=O)c2cccnc2)C2CC2)cc1 914859897 ALBTWRZCTJWCCM-UHFFFAOYSA-N 402.520 2.007 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1-n1cnnn1 916677790 LOUSLOAYRSSSCN-UHFFFAOYSA-N 411.441 2.268 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C(F)(F)F)cn3)nc12 918876498 UDKCNZAWAOJJRA-UHFFFAOYSA-N 410.308 2.382 10 20 HECD CC(C)c1ncncc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919392308 GEJGYCUEEIRBSH-UHFFFAOYSA-N 416.453 2.049 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cc(Cl)c3c(c2)OCCO3)c1 919812393 BFGNAOPPVZFKPN-UHFFFAOYSA-N 412.851 2.118 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccc(O)cc4C4(CC4)C3)CC2)cc1 1261214134 LHNRRENAWRFWAT-JOCHJYFZSA-N 423.557 2.431 10 20 HECD O=C(CC1CC1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898629 TWPSGIAPVMRLTL-INIZCTEOSA-N 423.604 2.267 10 20 HECD Cc1noc(C)c1CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500752 LBRVEOSQJPIBBX-UHFFFAOYSA-N 419.865 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)[C@@H](C)N(c4ccccc4)C3=O)CC2)cc1 21931749 IAWZTPHSLUJQSX-QGZVFWFLSA-N 422.485 2.201 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 54284228 SKYLDAKEVBICCM-INIZCTEOSA-N 415.440 2.471 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1-c1ccccc1 54284822 PGQJVTMFFWNBMV-UHFFFAOYSA-N 404.470 2.308 10 20 HECD CN(C)C(=O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 63839977 XKZPMGSPCYOWJY-QBFSEMIESA-N 411.574 2.324 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 65277639 JXLIPIGUWZYSSQ-OAHLLOKOSA-N 404.488 2.349 10 20 HECD COCCOc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 731978652 ZMOLPVDRXJUTNY-UHFFFAOYSA-N 404.488 2.199 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1 734501630 JBHJOVAFQUCRTN-UHFFFAOYSA-N 400.497 2.082 10 20 HECD CCn1ncc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc21 737117665 KFKHEQYMOVXISG-UHFFFAOYSA-N 421.501 2.490 10 20 HECD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751229105 TURJHQYRSPXAIG-UHFFFAOYSA-N 423.466 2.482 10 20 HECD COC(=O)C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 754039463 XETSSRKKXBZNMS-AWEZNQCLSA-N 424.500 2.326 10 20 HECD COC[C@H](C)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 756664174 CBVJNFUZXJIKJQ-PMPSAXMXSA-N 410.486 2.271 10 20 HECD COC(=O)[C@]1(C)CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 759782571 BFXTVBUBRGOCLD-HSZRJFAPSA-N 406.438 2.286 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C1 763281680 WOXWOQTZFWBOPT-KDOFPFPSSA-N 411.458 2.343 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(F)c(C(=O)O)c2)cc1 763282098 WRGRNHVWFOGZLG-UHFFFAOYSA-N 416.452 2.395 10 20 HECD C[C@H](N[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765422607 ANNPSGPFZRBLTE-LSDHHAIUSA-N 401.960 2.251 10 20 HECD C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NCc1cccc(Br)c1O 765731948 NFZXMQHOOCWHOF-LJQANCHMSA-N 419.275 2.178 10 20 HECD C[C@@]1(c2cccc(C(=O)NCc3cccc(Br)c3O)c2)NC(=O)NC1=O 765747093 LIQWFPFOPMGBJQ-SFHVURJKSA-N 418.247 2.139 10 20 HECD Cc1cn2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc2n1 765904347 RNFJXZRKSUCMIX-UHFFFAOYSA-N 403.236 2.366 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cnn(-c3ccncc3)c2)C2CC2)cc1 768714812 AGRBHKPGCRPCEL-UHFFFAOYSA-N 404.474 2.463 10 20 HECD COc1ccc(N2C[C@@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)c(OC)c1 773741765 XRUVKSKUOCVKRO-HIFRSBDPSA-N 414.458 2.215 10 20 HECD COC1(CO)CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 773934498 JZWGEYNIQACKQK-OAHLLOKOSA-N 422.481 2.262 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccccc3)c(NC(C)=O)s2)cn1 775206618 DYEMTPHMLUBYDI-UHFFFAOYSA-N 421.504 2.412 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(-n2cccn2)n1 777826938 VJPYSYIMAOKJEH-UHFFFAOYSA-N 400.822 2.442 10 20 HECD Cc1ccc(S(=O)(=O)n2ccc(C(=O)OCC(=O)c3ccc(O)c(O)c3)c2)cc1 783710362 JXVSRMGAZITWFU-UHFFFAOYSA-N 415.423 2.484 10 20 HECD O=C(COC(=O)c1ccc(I)c(O)c1)c1ccc(O)c(O)c1 784710723 HBYRIQMQSFJSBB-UHFFFAOYSA-N 414.151 2.448 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ccnc3[C@H](O)c3ccc(F)cc3)CC2)cc1 786762486 WUCZWUNIXXIVCC-JOCHJYFZSA-N 424.476 2.461 10 20 HECD CC(C)Oc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 786825173 AVTRSDUJMXIAML-UHFFFAOYSA-N 411.502 2.243 10 20 HECD Cc1c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cccc1N1CCNC1=O 787500878 KMHGRUSSQODQNU-UHFFFAOYSA-N 422.485 2.364 10 20 HECD CCOC1CC(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 788747635 VPUBFAIGIMVYIB-QPIRBTGLSA-N 402.539 2.393 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)ccc1C(N)=O 789371979 QELTTZPZCJRWHI-UHFFFAOYSA-N 424.501 2.428 10 20 HECD CSc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccn1 789863898 LFJQKALKJZKIJD-UHFFFAOYSA-N 416.572 2.289 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(-c2ccoc2)n1 789905630 OPOXPTGINGDZBZ-MRXNPFEDSA-N 407.474 2.312 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@]4(CCc5ccccc54)C3)ccc21 803686473 BCQXYVPNBHSNTI-RUZDIDTESA-N 419.525 2.386 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc4ccccn4n3)CC2)cc1 804378054 ZWCHXMZZYUAWKB-MDZDMXLPSA-N 405.458 2.186 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3n[nH]c4c(OC)cccc34)CC2)cc1 809152415 QOSJWSGULYXKBU-UHFFFAOYSA-N 409.490 2.132 10 20 HECD CSc1nnc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)s1 809608973 ZIUBNKCSODTRRH-UHFFFAOYSA-N 418.500 2.404 10 20 HECD CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@](C)(C(F)(F)F)O1 818189681 NWGHQTCRGDEKNU-OAHLLOKOSA-N 410.414 2.336 10 20 HECD Nc1cc(-c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)ncn1 820975213 NPYSFQFGHJSAKL-UHFFFAOYSA-N 416.444 2.344 10 20 HECD CC1CCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc2)CC1 917371608 KBDWDFBHLKAZCY-UHFFFAOYSA-N 418.515 2.491 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2cc(F)c(F)cc21 918284881 SURMRGGVJPXSOT-UHFFFAOYSA-N 419.403 2.146 10 20 HECD COc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918286340 HBWIJEMLJAYEAM-ZIAGYGMSSA-N 416.453 2.098 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 918437377 GJUVBUBDQMNRKB-UHFFFAOYSA-N 413.499 2.266 10 20 HECD Cc1cc(C(=O)COC(=O)CCN2CCCS2(=O)=O)c(C)n1-c1cccc(F)c1 919439160 LKLZBBDTNPGSKC-UHFFFAOYSA-N 422.478 2.385 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 919973129 MBHANTRUHXQQKX-MRXNPFEDSA-N 421.471 2.469 10 20 HECD C[C@@H](OC(=O)[C@@]1(F)CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1117344684 CIQQFIFPDNJBMN-VERVWZFWSA-N 411.385 2.461 10 20 HECD Cc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336149 XUWMUMFJWNAPTI-QDMKHBRRSA-N 417.556 2.107 10 20 HECD O=C(c1cnoc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428049 YKMNVBSNOPVUIN-INIZCTEOSA-N 400.435 2.028 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ncccc2C(F)(F)F)C1 1844530546 FMYXVPQBTHIWTK-UHFFFAOYSA-N 422.363 2.037 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(c3ccccc3)CCC2)C1 1846309588 VBSIMEONBMZFJC-UHFFFAOYSA-N 407.470 2.432 10 20 HECD Cc1noc(C)c1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848102567 UCWCFEZCZCDZID-HOTGVXAUSA-N 419.865 2.414 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)c1ccc(Br)o1 471384450 ZCADPUBTZNFHSS-UHFFFAOYSA-N 408.252 2.264 10 20 HECD Cc1cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 728937738 JJFVVTWOXWZGKG-ZBFHGGJFSA-N 422.478 2.082 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(CNC(N)=O)cc3)cc2F)CC1 730234983 HGNRIKSQWDDDKI-UHFFFAOYSA-N 413.497 2.066 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1C(=O)CCc2ccccc21 732376162 UVMGPLDRRYTSHF-UHFFFAOYSA-N 409.486 2.234 10 20 HECD CC(C)NC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 732451560 WFHKXVXZVGFZFP-SFHVURJKSA-N 401.555 2.060 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@@H]3CC(C)C)CC2)cc1 733802173 XOSABIQVKATIFR-FQEVSTJZSA-N 404.555 2.274 10 20 HECD Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 737166088 LPRFQQHHBHEDCJ-UHFFFAOYSA-N 411.437 2.346 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1 741099499 AXSAVYHURQFMGJ-UHFFFAOYSA-N 424.476 2.293 10 20 HECD C[C@@H](NC(=O)NCc1ccc2c(c1)C(=O)NCC2)c1ccc(N2CCOCC2)cc1 754162622 GIXZAYQKAHODAM-MRXNPFEDSA-N 408.502 2.370 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 755274420 AWJGPUFLACZXJI-AWEZNQCLSA-N 424.517 2.499 10 20 HECD CCN(C1CCN(C(=O)NCCCSc2nccs2)CC1)S(C)(=O)=O 759590547 OUHHPXHPNSHRTG-UHFFFAOYSA-N 406.599 2.081 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(N(C)C)n1 765926675 OZAUSDWIMYUAJV-UHFFFAOYSA-N 407.268 2.179 10 20 HECD COc1cccc(O)c1CN1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 768200618 ORMOTBFULLOZQL-UHFFFAOYSA-N 421.475 2.035 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769701219 HQBGLKHDBIOUBM-UHFFFAOYSA-N 401.448 2.294 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)n1 770433984 HOEYHAPNYHXYGP-UHFFFAOYSA-N 418.473 2.276 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(S(N)(=O)=O)cc(C)c3C)c2)CC1 771634943 ASZHXPXADYADET-UHFFFAOYSA-N 416.547 2.345 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773844716 FNOAEXSWDKYJGH-ZDUSSCGKSA-N 400.454 2.409 10 20 HECD COC(=O)CCNC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1 775178788 XJKWSIYSYATOAG-UHFFFAOYSA-N 410.518 2.343 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 778930643 WGEIDOJSAQGSTO-YWZLYKJASA-N 402.447 2.444 10 20 HECD NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779493258 LUAOCFNZICSAEV-GSNSJMIKSA-N 415.877 2.135 10 20 HECD COc1ccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cn1 780144661 YUWURZBCKCHBNM-RIYZIHGNSA-N 421.525 2.139 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1 785298545 VSZICGHFGBZZDC-ZDUSSCGKSA-N 408.414 2.366 10 20 HECD CC(=O)[C@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398488 IMSKGIVUGCSOOW-NSHDSACASA-N 408.388 2.236 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 785423189 SOVJJIAMULLOSF-UHFFFAOYSA-N 404.854 2.289 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(c3ncc4n3CCCC4)CC2)cc1 785438277 BJCDNUSTBOLSPO-UHFFFAOYSA-N 409.534 2.308 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(Cn4cccn4)o3)cc2)CC1 786659759 NWMSFTQOJHDQEW-UHFFFAOYSA-N 407.474 2.123 10 20 HECD Cc1ccccc1[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788318865 IXPLQHJGKPJCSF-FQEVSTJZSA-N 407.514 2.464 10 20 HECD CSC[C@@H](C)C(=O)N1CCC(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 799412310 UGGIYSQTWJNAQC-QGZVFWFLSA-N 419.591 2.377 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2c(F)cccc2F)N(C)C)cc1F 803661886 CPCVHAJXKFXIJU-GOSISDBHSA-N 422.451 2.205 10 20 HECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688109 VJDPINAQDSUCKL-UHFFFAOYSA-N 409.486 2.463 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccnc(NC(=O)C2CC2)c1 803904674 HLUMFAYTTQCPCB-UHFFFAOYSA-N 410.474 2.312 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3c3cccn3C)CC2)cc1 804316778 IZEAXMXDGUPLAA-OAQYLSRUSA-N 410.518 2.482 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807676360 FHDLUBICLDHGCJ-SJLPKXTDSA-N 410.518 2.334 10 20 HECD Cc1nn(C)cc1S(=O)(=O)Nc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1 808528241 ZQUOUUZQDHOXBC-UHFFFAOYSA-N 412.518 2.056 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCc2nncn2C1 814320563 VWPWYLSPJFKQSS-AWEZNQCLSA-N 409.412 2.012 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NCc1cc(OC)ccc1O 815835491 VKMBUQDDGAENBH-QHCPKHFHSA-N 423.469 2.406 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(N2C(=O)CNC2=O)c1 916688844 JTUWEPSQAKRHFS-UHFFFAOYSA-N 423.473 2.243 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccccc3F)cc2)C1 918116920 CIJQOLNOKNIFKR-OXJNMPFZSA-N 414.481 2.060 10 20 HECD C[C@@H](CC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1327238126 KVRTXBVTTUCBJM-RDJZCZTQSA-N 418.538 2.308 10 20 HECD Cc1occc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721495 MEHFFMBJHSBTRQ-NSHDSACASA-N 414.443 2.390 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1 1828375738 YPBBBTYMJHMLOT-HUUCEWRRSA-N 409.433 2.381 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1 726609290 QFUXNHPIAOYGFH-UHFFFAOYSA-N 404.492 2.133 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCN3CCOCC3(C)C)cc2F)C[C@@H](C)O1 728396676 UKHRJEXVVIGBBK-IAGOWNOFSA-N 422.545 2.349 10 20 HECD CNC(=O)CCN(C)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 729369446 ZNVQBXAZSZKBAU-ACCUITESSA-N 411.574 2.324 10 20 HECD C[C@@H](NC(=O)NCCn1c(=O)oc2ccccc21)c1ccc(N2CCOCC2)cc1 730124492 ZCYQHGCJXGWGIB-MRXNPFEDSA-N 410.474 2.492 10 20 HECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 736070359 UDFAFGKJKMFBIJ-UZLBHIALSA-N 420.529 2.499 10 20 HECD CC(=O)Nc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 736626017 QSZIQIYRGNSFFI-UHFFFAOYSA-N 421.494 2.441 10 20 HECD CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2)CC1 739081800 SLZAWFHAIXXEAD-UHFFFAOYSA-N 410.518 2.425 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3F)cc2F)C[C@@H](C)O1 741380779 VUZQGSGVEKJXED-OKILXGFUSA-N 419.428 2.447 10 20 HECD O=C(CNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCC(F)(F)F 743558665 VXKFJTKYSQFSRM-LLVKDONJSA-N 424.370 2.235 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](Cn3cccn3)c3ccccc3)nc12 746468628 HNWPEAUFEVZQKN-SFHVURJKSA-N 406.446 2.339 10 20 HECD CN(C)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 746693683 ICCPZTLMPGNFBZ-INIZCTEOSA-N 411.911 2.450 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1F 747011603 CRQRVSVPRPQGPC-UHFFFAOYSA-N 422.460 2.357 10 20 HECD CN1CCCc2cc(CNC(=O)CNC(=O)NCc3ccc([N+](=O)[O-])cc3)ccc21 748230485 QWAVVRXDRLGLNR-UHFFFAOYSA-N 411.462 2.093 10 20 HECD CN1CCC[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 748582245 QXEOWEJLPPGRBR-KECPUOCWSA-N 423.585 2.467 10 20 HECD CCN1CC[C@@H](N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 748961871 XHVZXBOWCRETAK-TZIWHRDSSA-N 417.598 2.331 10 20 HECD CN1CCN(c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2Cl)CC1 750352549 JLRVZXVMBQIQSK-UHFFFAOYSA-N 416.909 2.395 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2c(C)n[nH]c2n1 750670813 YHQPOBBPSOQTSX-INIZCTEOSA-N 406.490 2.206 10 20 HECD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 751066705 AQBGQZQUNAEQOB-OLZOCXBDSA-N 409.533 2.467 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CC3(O)CCCC3)CC2)cc1 752641478 OJTCEVFQMHMFDF-UHFFFAOYSA-N 404.555 2.154 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)c3ccc(OC)c(OC)c3)CC2)cc1 754020026 YBEUFZZDOLOXNA-HXUWFJFHSA-N 415.534 2.332 10 20 HECD C[C@H](Nc1ccn(CCO)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 754814408 DKDCANGKCXZBQN-ZDUSSCGKSA-N 404.426 2.090 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CC2)cc1F 755954203 FNKQPHQZYYRDFJ-UHFFFAOYSA-N 410.442 2.339 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(Br)c3)cc2)C1 758175305 BLRIRGIDCRYTEA-HNNXBMFYSA-N 417.307 2.476 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])cc3F)CC2)cc1 758226727 ZFSRUAXLHLLNDE-QGZVFWFLSA-N 405.426 2.304 10 20 HECD COc1cc(N2CCN(C(=O)Nc3cccnc3OC)CC2)cc(OC)c1OC 759198945 JKHVHCREHFMAMA-UHFFFAOYSA-N 402.451 2.470 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(-n4cccn4)nc3)CC2)cc(OC)c1OC 759221698 FKDWOYJMJYDDOZ-UHFFFAOYSA-N 423.473 2.256 10 20 HECD O=C1CC[C@@]2(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)SCCN12 761983399 RELDXXKSULOSOE-KXBFYZLASA-N 409.939 2.192 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCO[C@]2(CCOC2)C1 771421746 NLZUJIYHUUBLCL-SIKLNZKXSA-N 403.523 2.033 10 20 HECD C[C@@H](NC(=O)C(=O)NCC(C)(C)N1CCCCC1)c1ccc(N2CCOCC2)cc1 774889599 LCJZNSICMOHOKW-GOSISDBHSA-N 416.566 2.081 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4ncn(C)n4)cc3)CC2)cc1 779892078 SLGDWQQGQQVUGZ-UHFFFAOYSA-N 420.517 2.043 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OCCN(C)C)c1 785295818 ZWHXRUOXMCTOCY-HNNXBMFYSA-N 415.490 2.033 10 20 HECD COc1cccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 787156941 NTWNYSRJAHDQKO-KRWDZBQOSA-N 411.502 2.068 10 20 HECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 788405141 ZYWQMRYHONGJCU-INIZCTEOSA-N 411.502 2.278 10 20 HECD CN(C)CCCC1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788938491 SBKQJLGNGLPCNT-UHFFFAOYSA-N 400.567 2.483 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCc2ccc(O)cc2C1 789847800 VJRUPJDRVVXJOV-UHFFFAOYSA-N 411.527 2.147 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCCC12CCOCC2 789863445 GZJOENGSQUMOHF-LJQANCHMSA-N 417.575 2.322 10 20 HECD Cc1cc[nH]c1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 797910060 AFMOPCAMDIFTPH-UHFFFAOYSA-N 415.471 2.418 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C 801551986 VZJPIZSMZCMHFW-UHFFFAOYSA-N 410.474 2.089 10 20 HECD CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCSC1 803451456 LJLHJYQRYLEAKA-HNNXBMFYSA-N 413.490 2.337 10 20 HECD CC[C@H]1CN(C(=O)c2ccccc2SCC(=O)NC(C)C)C[C@@H](C)S1(=O)=O 805392837 NOVNZDUTGQVVCF-CABCVRRESA-N 412.577 2.341 10 20 HECD C[C@H](OC(=O)[C@](C)(O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805581060 UAJLYZNMJQOVCI-DAOPMYJZSA-N 407.422 2.493 10 20 HECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 806879055 SVCODYIVGOAKPQ-UHFFFAOYSA-N 408.502 2.416 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 807689786 KHYMMPHSUJCBIH-SFHVURJKSA-N 410.518 2.115 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCC[C@@H]1CCO 809558729 ARCADCLVFGCUEG-IUODEOHRSA-N 413.312 2.171 10 20 HECD O=C(C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCN(c2ccccc2)CC1 812504189 PHMAQSZNRJTSGB-OAQYLSRUSA-N 423.513 2.249 10 20 HECD O=C(C[C@H]1C=CS(=O)(=O)C1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916458121 VWZLUIHVOPLAQQ-CYBMUJFWSA-N 418.437 2.107 10 20 HECD Cn1cc(/C=C\C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 917238764 XTMHCMWAYRNBHK-KTKRTIGZSA-N 415.405 2.391 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1C 917758402 VPEBUHPRSLEBSC-UHFFFAOYSA-N 404.491 2.317 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c1 919805996 IKCOXYOBKGQJRQ-UHFFFAOYSA-N 423.922 2.375 10 20 HECD CCC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823714041 WWXHXQGTYQRVNZ-VIFPVBQESA-N 423.878 2.413 10 20 HECD Cn1c(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cc(=O)n(C)c1=O 24907620 KIBMMRLEEJQLBS-KRWDZBQOSA-N 412.515 2.419 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)ccc1C 542923033 FZLHJTNTMBUTBP-UHFFFAOYSA-N 404.492 2.400 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2F)CCNC3=O)n(C)c2ccccc12 560185114 NVECXSKIJRNKLR-UHFFFAOYSA-N 408.433 2.167 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 734406193 PVKXMFICGNMZSR-UHFFFAOYSA-N 416.547 2.173 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](OCCO)C1 734485159 BLLATDVBAVFFGT-HZPDHXFCSA-N 422.481 2.262 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1 734657302 ZCUFJEMDTLTWON-OAQYLSRUSA-N 409.534 2.115 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3cccc(F)c3)cc2)C1 734660410 PTTURHSIQNPDST-XLIONFOSSA-N 414.481 2.060 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 734702383 ZZFPLLTYKOJYHZ-UHFFFAOYSA-N 419.489 2.304 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cnn(-c2ccccc2F)c1 742282411 GZTULHRQPQAZTM-UHFFFAOYSA-N 416.478 2.327 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCC(NC(N)=O)CC3)c2C)cc1 750826247 SSJNFAIIVBHWLE-UHFFFAOYSA-N 412.490 2.196 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)cc3C)ccc2O1 751992203 OHIMIZGGHLVGJH-HXUWFJFHSA-N 418.515 2.406 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 753133443 NMSIGMKQVSIRNU-INIZCTEOSA-N 405.520 2.114 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc1F 753732700 VQXLDVGWOQOWGV-UHFFFAOYSA-N 407.467 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(OC(C)C)n3)CC2)cc1 755006375 ZBEPWHPVBDUAIF-UHFFFAOYSA-N 413.474 2.383 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@](C)(O)C3CC3)cc2F)C[C@@H](C)O1 756331797 YYZAIZYNMIPGJU-ZCCHDVMBSA-N 422.497 2.150 10 20 HECD COc1ccc(O)c([C@H](C)N[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756710841 FOZRYIIZXSNKHL-DLBZAZTESA-N 413.522 2.347 10 20 HECD COC(=O)[C@H](C)c1c(C)nn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 757342841 NXSYCKAVUDLCHY-OAHLLOKOSA-N 414.506 2.134 10 20 HECD COc1cc(N2CCN(C(=O)c3cc4c(nc3O)CCC4)CC2)cc(OC)c1OC 759219987 ADBOGLKEVHRSJV-UHFFFAOYSA-N 413.474 2.264 10 20 HECD C[C@@H](NCCNS(=O)(=O)Cc1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765278523 IVUTUIXZBGWWJY-QGZVFWFLSA-N 421.538 2.433 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](CC(=O)OC(C)C)C3)nc12 766910242 NHGHWLBABJTMSP-AWEZNQCLSA-N 404.467 2.165 10 20 HECD Oc1cc2c(cc1CN1CCC[C@@H](CN3CCN(c4ccccn4)CC3)C1)[C@H](O)CO2 768443504 FLKOGMYPDYSXPY-PGRDOPGGSA-N 424.545 2.247 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 768944233 ZYJODQMQCBSAIA-UHFFFAOYSA-N 415.465 2.298 10 20 HECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1C(=O)NC(C)C 769784850 MTXDDCDMRJMYCO-UHFFFAOYSA-N 405.476 2.463 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)cc1)c1ccc(N(C)C)cc1 773846582 MRTOJZZUDKNWSW-CQSZACIVSA-N 403.504 2.113 10 20 HECD C[C@H](N[C@H](C)C(=O)N1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 775259697 XHRBQNLEPTUKQI-VQTJNVASSA-N 423.561 2.306 10 20 HECD Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)COC(=O)c1cccc(O)c1O 776281531 GSZUYHFYIACCHD-UHFFFAOYSA-N 409.442 2.433 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(C)c4ccccc43)CC2)cc1 778270460 SMJWRCUFIFTFGE-VAWYXSNFSA-N 420.513 2.383 10 20 HECD O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NCc1ccc(O)c(O)c1 778915768 VDTKIRWYLJMFPS-AWEZNQCLSA-N 403.822 2.273 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2 785293823 BRSHTOVRIRQATH-JTQLQIEISA-N 406.822 2.208 10 20 HECD COCC[C@@H](CO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 799086451 BFYPKMLMIBCBLT-GVIGZQTCSA-N 414.574 2.243 10 20 HECD C[S@@](=O)C1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 799364678 LTWQBDVHCPAPIO-MUUNZHRXSA-N 419.469 2.252 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CCc1cccs1)c1ccc(N2CCOCC2)cc1 803299761 AQKFMKXNILMHIA-MRXNPFEDSA-N 401.532 2.463 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)cc1F 804853284 WDSFZBLCEGBTPF-HKUYNNGSSA-N 404.530 2.231 10 20 HECD CN1CCCc2cc(CNC(=O)NC[C@@H](N3CCOCC3)C(F)(F)F)ccc21 805849093 ZOLRAPXQIOZOIZ-QGZVFWFLSA-N 400.445 2.131 10 20 HECD C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806495578 IAYPCKSQKFIMNV-YFVAEKQCSA-N 413.566 2.157 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)n(C)n1 807387140 ASAAQXAMNZFSDC-UHFFFAOYSA-N 409.284 2.342 10 20 HECD COc1ccc(N2CCN(CCCNCc3cnc(C4OCCO4)s3)CC2)cc1 809603785 WFCVHHHAXQWSLG-UHFFFAOYSA-N 418.563 2.499 10 20 HECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1cc(OC)c(OC)cc1O 809719885 RFRXEPVXZKZKIM-OAHLLOKOSA-N 424.494 2.394 10 20 HECD CCOCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 812008840 GIBODJMKBPXVIH-CYBMUJFWSA-N 421.473 2.267 10 20 HECD CCC(=O)N1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 917406313 UIQSNHFNNJABIJ-UHFFFAOYSA-N 419.481 2.345 10 20 HECD COc1ccc(C)cc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917930834 WBMOLWZPZJDZCG-QGZVFWFLSA-N 417.531 2.184 10 20 HECD O=C(CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCCCC1 918120620 DOWZMKPXUKQZFV-UHFFFAOYSA-N 420.529 2.425 10 20 HECD CCCC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 918370782 BNBMRUUYPKQYIB-MOPGFXCFSA-N 414.550 2.043 10 20 HECD C[C@H](NC(=O)CNC(=O)c1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 920890305 VHYNLQVUFOVSPF-AWEZNQCLSA-N 403.429 2.409 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)ccc1O 1254762025 WTJDTTIILQBDNF-ZDUSSCGKSA-N 424.247 2.470 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](O)c1ccc(Cl)cc1 1338288352 QCGXPGFWDDTSBQ-RDJZCZTQSA-N 407.850 2.465 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1C[C@@H]1C1CC1 1796931198 SYOIHEJPXVSAQK-HKUYMTLNSA-N 420.513 2.464 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 302892407 VWADFRKPUAJNSY-XMMPIXPASA-N 420.513 2.495 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3c(C)noc3C)CC2)cc1 730583295 NVQBXHUDWUTTQJ-UHFFFAOYSA-N 415.538 2.354 10 20 HECD O=S1(=O)NC(CN(Cc2ccccc2O)C[C@H]2CCCO2)=Nc2ccccc21 731845391 ZMIHQCIACVOUPW-MRXNPFEDSA-N 401.488 2.395 10 20 HECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 736070356 UDFAFGKJKMFBIJ-JXFKEZNVSA-N 420.529 2.499 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN(C[C@H](C)O)CC3)c2C)cc1 739390883 HKMIMTOMGJIRSG-KRWDZBQOSA-N 413.518 2.062 10 20 HECD CCOc1ccc(N(C)CC(=O)Nc2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1 739927346 VFBDMNMPKXAUBA-UHFFFAOYSA-N 421.519 2.419 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)NCc2c(O)ccc3c2CCCC3)CC1 743719707 PGBHRCFTDDSXAI-UHFFFAOYSA-N 418.534 2.225 10 20 HECD COc1cccc(CNC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)c1O 745794650 ISTRFJHQSFPXPB-UHFFFAOYSA-N 412.490 2.069 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H](O)c1ccccc1 746155587 OAKQIEXLVVOMJC-OAQYLSRUSA-N 421.476 2.292 10 20 HECD COC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 749466006 PIHWWJROKXQTPY-BQFCYCMXSA-N 421.513 2.083 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)c(F)c3)ccc2O1 751981695 VPCUYAXAZWENOF-LJQANCHMSA-N 422.478 2.237 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)cc3C)ccc2O1 751992199 OHIMIZGGHLVGJH-FQEVSTJZSA-N 418.515 2.406 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCCN3S(C)(=O)=O)c2C)cc1 753145060 ZLFFWAWSSUHVFK-QGZVFWFLSA-N 405.520 2.257 10 20 HECD COc1ccc(N2CCN(C(=O)CCOc3cccc(C(N)=O)c3)CC2)cc1F 753740062 ZCAOJEKSTQSQOU-UHFFFAOYSA-N 401.438 2.051 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cncc(Cl)c3)CC2)cc1 754789438 JVVLZUXKRYPNDC-UHFFFAOYSA-N 424.954 2.234 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](CO)CC(F)(F)F)cc2F)CC1 757642466 SPZVXUTZCUHPBD-AWEZNQCLSA-N 406.424 2.080 10 20 HECD COc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc(OC)c1OC 758963835 ILJDQCCOVFUZPF-GOSISDBHSA-N 416.474 2.166 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cccc(C(N)=O)n3)cc2F)C[C@@H](C)O1 761875255 RBXPZBXVGBCXPH-BETUJISGSA-N 401.442 2.255 10 20 HECD CC(C)c1cc(=O)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 762199878 XOHVXLSUFSFVLJ-IYBDPMFKSA-N 416.497 2.436 10 20 HECD CCN(CC)C(=O)CN1CCCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773619678 NOQITFHEGIKAMP-GOSISDBHSA-N 403.571 2.399 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1 773740331 DOBVLSWRQJFUNH-CYBMUJFWSA-N 404.488 2.147 10 20 HECD Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc12 773764035 UERKKASGVKYDKN-CMPLNLGQSA-N 416.503 2.220 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCC(=O)Nc2cc(C)ccc2OC)c1 775369761 QNIZIYRQLGLAKO-CQSZACIVSA-N 401.463 2.123 10 20 HECD CC(C)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C 776028113 MOPPYMCMPPPFIH-HXUWFJFHSA-N 423.529 2.234 10 20 HECD Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3ccc(O)cc3)c(Br)cc21 776745304 JCJRDRLJLYWILI-UHFFFAOYSA-N 412.265 2.146 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3COc4ccc(C)cc43)CC2)cc1 778375982 OAKAPOGAWGFBRF-YUQDSPFASA-N 421.497 2.458 10 20 HECD O=S(=O)([C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)N1CCc2ccccc21 779607916 QNRSBSMKDDYQPQ-KRWDZBQOSA-N 416.499 2.478 10 20 HECD CCn1cc(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 781418657 DFLXASPHJBREEE-UHFFFAOYSA-N 417.421 2.403 10 20 HECD CN(CC(=O)NCCCN(C)S(C)(=O)=O)c1ccc(OCc2ccccc2)cc1 781963572 KMLCOKJXXIBJDX-UHFFFAOYSA-N 419.547 2.100 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccccc3Cl)cc2)CC1 786121277 XNNLMVZNRPHVTK-UHFFFAOYSA-N 407.923 2.487 10 20 HECD Cc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 788205286 PNJWIYYNMFNEGH-UHFFFAOYSA-N 418.444 2.393 10 20 HECD COc1ccc(F)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1OC 788434749 QSIHOQRUWKMDOI-OAHLLOKOSA-N 415.465 2.475 10 20 HECD CC1CCC(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789845036 IWHVDHZWDGKIAD-UHFFFAOYSA-N 405.514 2.346 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N(Cc1cccnc1)C1CC1 789854729 KUCYSSSGIRJDJW-UHFFFAOYSA-N 410.543 2.442 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2oc3ccc(F)cc3c2C)ccc1O 790407557 NSTXFTOEYAASPS-UHFFFAOYSA-N 414.436 2.295 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(OC(C)C)c(C(N)=O)c1 796829443 OEUHDSWYAIVTFG-UHFFFAOYSA-N 412.490 2.202 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCCC34CCOCC4)CC2)cc1 800437513 NOCBMTMUITUOEA-IFMALSPDSA-N 403.567 2.117 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@](C)(C2CCCC2)C1=O 802723884 ISFAGTVZBMEULG-JOCHJYFZSA-N 400.523 2.413 10 20 HECD CO[C@@H](C)CN(C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 804839186 ZPFWDFPMEPYVPI-LBPRGKRZSA-N 423.447 2.208 10 20 HECD CN(C[C@H]1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1)S(C)(=O)=O 804967606 ZITWPWXVVHPFEY-GOSISDBHSA-N 408.568 2.100 10 20 HECD COc1ccc(N2CCN(CCCNCc3cnc(N4CCCC4)nc3)CC2)cc1 916832280 ZHOUIWFJHYAUNJ-UHFFFAOYSA-N 410.566 2.387 10 20 HECD CSCC[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 917355498 GKEMNWKARBPFEY-MRXNPFEDSA-N 414.483 2.174 10 20 HECD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364422 GMZWFMHNKAYGHB-OKZBNKHCSA-N 400.475 2.075 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc([C@@H]2CCCO2)s1 1116669583 VFHFBWCQEUMXRC-WFASDCNBSA-N 406.460 2.310 10 20 HECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc1 1255040346 AZASABDGVNIPAQ-UHFFFAOYSA-N 403.429 2.442 10 20 HECD O=C(CNc1ccc(Cl)cc1C(=O)c1ccc(F)cc1)N[C@@H]1CCS(=O)(=O)C1 1321192595 YWJJEKZATYHYQX-OAHLLOKOSA-N 424.881 2.425 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)CCO2 1782004482 WNLZHRVLHRHHAU-WIEQDCTASA-N 420.893 2.241 10 20 HECD CC(C)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1ccccn1 1802717443 PFAOFYCHGZFNBT-MUJYYYPQSA-N 410.474 2.117 10 20 HECD CCC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1834419986 GVHRPEUNBJSIPT-UHFFFAOYSA-N 409.914 2.346 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2cccc3ncccc23)C1 1841589574 IZFNCZXSHBRCEA-UHFFFAOYSA-N 418.453 2.101 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COc3ccccc3F)CC2)cc1 8009305 TZNFVVFLRMDPIA-UHFFFAOYSA-N 402.422 2.105 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1 728979359 FIOSRWWIEMIPPJ-XUSGNXJCSA-N 415.421 2.184 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)OC(=O)c2cc(O)cs2)c1 732354310 JLGSUTYGDXTPFG-VIFPVBQESA-N 407.400 2.211 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@H]3CC(C)C)CC2)cc1 733802177 XOSABIQVKATIFR-HXUWFJFHSA-N 404.555 2.274 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1 735518134 IKUURVWAHNYYIF-IBGZPJMESA-N 410.566 2.466 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(C1)OCCO2 741779598 YNNBYOWCGPAGDE-CQSZACIVSA-N 406.438 2.238 10 20 HECD COc1cc(N(C)CC(=O)NC[C@@H]2COc3ccccc3O2)cc(OC)c1OC 741798684 JNORBOXNDCSFBU-OAHLLOKOSA-N 402.447 2.105 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(Cn4ccnc4)cc3)CC2)cc1 742920480 QNSZNCCWXMKGFF-UHFFFAOYSA-N 419.529 2.492 10 20 HECD CSC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCOCC1 745692621 YEBXXZPWXYKPBF-QGZVFWFLSA-N 420.579 2.100 10 20 HECD COCCN(CCN(C)C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745906338 YWURTLAJMXZIGQ-INIZCTEOSA-N 414.497 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1 747554123 RRQRKGRJPVZXPY-QGZVFWFLSA-N 422.485 2.255 10 20 HECD COc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 748468415 XBCKKXWBSWTVJT-KBPBESRZSA-N 416.453 2.098 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(Cl)cc3)c2)CC1 748673077 IYJXPUBSHAVXDD-UHFFFAOYSA-N 400.909 2.376 10 20 HECD CCn1nc(C)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 751238235 YRWSYRHDUSSONQ-UHFFFAOYSA-N 406.552 2.207 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCn2cc([N+](=O)[O-])cn2)cc1 751406468 PXAIDMDRUHDBLY-IBGZPJMESA-N 401.467 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C4CC4)n(C)n3)CC2)cc1 753088436 PIVWLXFQXHYYIA-MDZDMXLPSA-N 409.490 2.150 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 753132748 NVRAOOJSCZKJBB-IFMALSPDSA-N 402.539 2.074 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)c2cc(F)cc(F)c2O)c1 756705589 KYUGXTCUOKWGRM-MNOVXSKESA-N 413.446 2.256 10 20 HECD COc1ccc(N(C)CC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1F 757852581 OQQKGLDLVMOOED-UHFFFAOYSA-N 409.483 2.468 10 20 HECD CC(C)OC[C@@H](CO)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 763876437 DYFUQURQQAPMEF-OAHLLOKOSA-N 410.470 2.118 10 20 HECD CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 765975198 UFIPOTXBNFZNAA-INIZCTEOSA-N 401.429 2.185 10 20 HECD CCOC1CC(CNCc2ccc(N3CCOCC3)c(F)c2)(N2CCOCC2)C1 767736186 NULDMSIYVNVWLH-UHFFFAOYSA-N 407.530 2.022 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCCC4(C3)OCCO4)cc2F)C[C@@H](C)O1 768042142 ZIINQPXIQHDKTB-HZPDHXFCSA-N 407.486 2.488 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(-n2cnnn2)c1 768912602 PGZBDCGQNROOKF-KRWDZBQOSA-N 412.881 2.416 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCCC[C@H](S(C)(=O)=O)C3)CC2)cc1 770494302 VGQPGXSGNPWNSP-IBGZPJMESA-N 409.552 2.273 10 20 HECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 772993940 JMQWYPVFRJPJMI-CMJOXMDJSA-N 424.501 2.406 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](Cc2ccccc2)CN2CCOCC2)c1O 775027490 GXFLAKHVHQXYDP-SFHVURJKSA-N 401.463 2.342 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1 777648886 GFZQOCUJQXAFBX-UHFFFAOYSA-N 421.387 2.260 10 20 HECD O=S(=O)([C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2O)C1)N1CCOCC1 779607396 MEYXUKSXEUREMP-AWEZNQCLSA-N 409.335 2.325 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 784027938 PIHPYGOKHQYLLJ-UHFFFAOYSA-N 402.472 2.099 10 20 HECD COc1cccc([C@@H](C)N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 785421466 CMTFDBHKHTVYJJ-GOSISDBHSA-N 424.545 2.283 10 20 HECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785424393 OOACULDBIKDKQA-GOSISDBHSA-N 410.518 2.020 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)OC)[C@@H]3C)cc2F)CC1 786754418 UJOURMDNNXTUGB-DOTOQJQBSA-N 406.502 2.061 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(-c4ncnn4C)cc3)CC2)cc1 790137094 BOMCZZCWAZSJPH-HXUWFJFHSA-N 423.517 2.053 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c(F)cc1C 793067874 MFBTYOVXSCKMIZ-UHFFFAOYSA-N 404.394 2.280 10 20 HECD CN(C)S(=O)(=O)c1ccccc1NNC(=S)Nc1ccc2c(c1)OCCO2 793327015 ONLRGYCFOYWWCV-UHFFFAOYSA-N 408.505 2.022 10 20 HECD Cc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCOCC3)c(F)c1)OCO2 795075347 YSFKEVHPNFYFQP-UHFFFAOYSA-N 408.451 2.178 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c2C)cc1 799247672 TUSRQWBIRQWMSF-IBGZPJMESA-N 415.490 2.448 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H]1c1ccccn1)c1ccc(N2CCOCC2)cc1 803309991 FGMAQZZJGSIBLY-DYESRHJHSA-N 408.502 2.459 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCc1nc2c(s1)CCCC2 804086098 JEMVAJZICPMBOB-UHFFFAOYSA-N 410.590 2.436 10 20 HECD Cc1cnn([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 812010396 WPUIJMZPBMGUCF-QGZVFWFLSA-N 401.486 2.448 10 20 HECD CCN1C(=S)N[C@H](c2ccc(N(CC)CCO)cc2C)C(C(=O)N(C)C)=C1C 839457134 SMBJLAJUPQNCGU-LJQANCHMSA-N 404.580 2.427 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C(=O)N(c4ccc(C)cc4C)C3=O)CC2)cc1 884436963 UBTPHBARAWCDMN-UHFFFAOYSA-N 422.485 2.387 10 20 HECD CCC[C@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1=O 917836356 LTGMWAGLXZHKLJ-YTQUADARSA-N 414.550 2.042 10 20 HECD O=C(NCCCN1CCCCCC1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918186322 BNSPUKLDEORSHO-UHFFFAOYSA-N 420.529 2.379 10 20 HECD CCOC(=O)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 1319832957 SMLWKACRZMEXJP-MRXNPFEDSA-N 424.500 2.326 10 20 HECD O=C(Cn1cc(C2CC2)nn1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1323870801 SMPYHKABYFVTBM-UHFFFAOYSA-N 409.412 2.327 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1CC1(F)F 1804286419 VAFOKARNLPCLKF-PLPCNPGISA-N 408.401 2.110 10 20 HECD C[C@@H](NC(=O)CCn1c(=O)n(C)c2ccccc21)c1ccc(N2CCOCC2)cc1 145617065 IBXLUFFDKWCCMU-QGZVFWFLSA-N 408.502 2.444 10 20 HECD Cc1c(CNC(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)n(C)c2ccccc12 472300073 XLMWEDQMKZLORG-UHFFFAOYSA-N 411.550 2.182 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)ccc1F 549238673 SNQKNJHXUDEEDP-UHFFFAOYSA-N 408.480 2.350 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(N2CCNC2=O)ccc1F 737805788 ZZNQTLUFDBYVEI-UHFFFAOYSA-N 416.428 2.261 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 743566883 KSOGCZUJHNFOCL-HBMCJLEFSA-N 416.566 2.320 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC3(CCO)CCCC3)cc2)C1 745691113 HFSGRLOVJQDJKL-SFHVURJKSA-N 402.539 2.130 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)ccc21 746706180 LDISRXTZGOIVIQ-UHFFFAOYSA-N 407.474 2.443 10 20 HECD CN1CCCc2cc(CNC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)ccc21 746808785 LBCFPZWVOBRAQH-UHFFFAOYSA-N 403.460 2.311 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cc(F)cc(F)c3)c2)CC1 748674848 OQWCXCJMDNOGSV-UHFFFAOYSA-N 402.444 2.000 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@@H]3C(=O)Nc4ccccc43)CC2)cc1 748728937 YGSFUKLSWACNQJ-FQEVSTJZSA-N 408.502 2.059 10 20 HECD CC(=O)N1CCCc2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc21 749271364 GDIAVKXMIDQTOC-UHFFFAOYSA-N 403.460 2.315 10 20 HECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2(CCCCC2)C1 749813198 WUBRPBSMSSEBSB-UHFFFAOYSA-N 418.557 2.229 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cnc2nc(O)nc(O)c2c1 752235756 OGARUWDXRRVTKE-UHFFFAOYSA-N 417.491 2.101 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(C=O)cc3OC)CC2)cc1F 753738717 SMWJJEKKKWOJET-UHFFFAOYSA-N 402.422 2.383 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(-n4cccn4)cc3)CC2)cc1F 754210821 AQQWJCMFUQEFDQ-UHFFFAOYSA-N 423.448 2.307 10 20 HECD CCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 756080551 PXVROSVQRPCIQJ-UHFFFAOYSA-N 406.483 2.061 10 20 HECD COc1cc(NC(=O)NCc2ccc(N(C)C)cc2)ccc1S(=O)(=O)N(C)C 757912881 KRRGNOJKIJTRIA-UHFFFAOYSA-N 406.508 2.333 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCC[C@@H]3OC)CC2)cc(OC)c1OC 759297020 HGOSLHRTZMJXII-RDJZCZTQSA-N 407.511 2.359 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(OCC(F)F)n3)cc2)C1 760391140 VTWAEPBYLIVADO-OAHLLOKOSA-N 418.444 2.357 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Br)nn1C 760492570 VJWOARSBOVQQRP-UHFFFAOYSA-N 416.659 2.357 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3cc4c(c(C(=O)O)c3)OCCO4)ccc21 761287099 XLHOIDJSZAYJQO-UHFFFAOYSA-N 418.471 2.017 10 20 HECD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1cccc(Br)c1O 764935331 RKSHYPKBAYGTAG-UHFFFAOYSA-N 402.226 2.322 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@H](C4CC4)C3)cc2)C1 765315076 ACSPTBDRBJMDAT-GGPKGHCWSA-N 400.523 2.145 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cncc(Cl)c2)cc1OC 768266600 WDUKEPRUHAEMPI-UHFFFAOYSA-N 405.885 2.306 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCOC2(CCOCC2)C1 769029234 TUOUXWHMLKRGOQ-QGZVFWFLSA-N 407.486 2.190 10 20 HECD CC(=O)c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)c(S(N)(=O)=O)c1 769360771 SLUMXLKVCLDWDY-UHFFFAOYSA-N 417.531 2.357 10 20 HECD C[C@H](NC(=O)N1CCN([C@@H](C)C(=O)N2CCCC2)CC1)c1ccc(N(C)C)cc1 773613348 QBKNHPZSVCBFAN-ROUUACIJSA-N 401.555 2.152 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)nc3Cl)CC2)cc1 774153407 NPMKYLKTODVEHC-UHFFFAOYSA-N 418.881 2.430 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1nnc2n1CCCCC2 775225816 QVCGGIJPZVEFQX-UHFFFAOYSA-N 424.549 2.270 10 20 HECD C[C@H](NCC(=O)N(CCC(N)=O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 775257077 FSDFWIHNTPNAQK-IBGZPJMESA-N 424.545 2.078 10 20 HECD C[C@H](NC[C@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccc(N2CCOCC2)c(F)c1 777126322 VEOGIVSDOXQAQZ-PXARDIRTSA-N 404.486 2.033 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1[C@H](C)C1CC1 777361949 XEGKXBXCWBNMSQ-MRXNPFEDSA-N 416.547 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccccc3O)CC2)cc1 778325936 LMUHKZTUPGMVOO-QXMHVHEDSA-N 409.486 2.264 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 779473621 VPCUDRJLFHVDKV-XYOKQWHBSA-N 404.488 2.458 10 20 HECD CC[C@@]1(CO)CCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 784462331 FAALONJMYMYYKX-QFIPXVFZSA-N 404.555 2.154 10 20 HECD C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438672 DUBJKRUSFGUNCC-RDJZCZTQSA-N 418.538 2.131 10 20 HECD O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786648766 MHIYSPUDIAYLDT-MRXNPFEDSA-N 418.444 2.127 10 20 HECD Cc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 786727259 YXACXVRHJAABQA-XLIONFOSSA-N 422.529 2.190 10 20 HECD C[C@@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(N2CCOCC2)cc1 787063960 IROHRQXTWLGBLQ-RTBURBONSA-N 416.566 2.479 10 20 HECD CC1(C)CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840890 QDUKQOCYUSPEET-IBGZPJMESA-N 405.514 2.488 10 20 HECD C[C@H]1c2nncn2CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792371482 LBUOYUVCKKDDGE-ZDUSSCGKSA-N 401.426 2.069 10 20 HECD COc1ccc(CNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c(O)c1 792793101 CKGSJHMWLTXQSG-QGZVFWFLSA-N 404.536 2.250 10 20 HECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 796556997 SWRAMMTZBKTZNE-MYYSRTQBSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCOCc3ccccc3)CC2)cc1 804317480 FAFUKPGFDUELRW-UHFFFAOYSA-N 411.502 2.113 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](C)[C@@H]3C)cc2F)CC1 805006660 AMFGCUNDLNUYLV-SJORKVTESA-N 404.530 2.231 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(Cn4cncn4)CC3)cc2)CC1 805022826 FNYSVNJVIZMBCF-UHFFFAOYSA-N 424.549 2.069 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCN1C 806037516 YONOFKVEXAEREZ-MJGOQNOKSA-N 412.534 2.473 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(c2ccccc2F)CC1 807289082 ILDJZLRCNCNUSQ-UHFFFAOYSA-N 408.477 2.167 10 20 HECD C[C@@]1(c2ccccc2)CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 807291189 ULRHHBHYXRPKJW-DEOSSOPVSA-N 405.498 2.453 10 20 HECD C[C@@H](c1cccnc1)N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807673005 LLDKOGGKKGDCMO-MSOLQXFVSA-N 409.534 2.230 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cn1C 808113531 CDVQLZVMJOAOEH-UHFFFAOYSA-N 404.803 2.070 10 20 HECD CSCC[C@@H](NC(=O)c1ccccc1)C(=O)OCC(=O)c1ccc(O)c(O)c1 916590449 BGCDAYREXRHUJY-OAHLLOKOSA-N 403.456 2.375 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1-c1nnc(C)o1 1254760277 AKDBQVDJJOSZCV-INIZCTEOSA-N 411.414 2.360 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 1319602070 XVVPOBRBCLUEBJ-UHFFFAOYSA-N 415.515 2.481 10 20 HECD Cn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796932655 NVXFYJCLTXQVAO-GGPHIMKMSA-N 419.485 2.070 10 20 HECD Cc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)no1 1845502408 UFLAKPIBTFAJCH-UHFFFAOYSA-N 405.838 2.107 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccccn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 5692727 HPBZVUIFCVMHLQ-UHFFFAOYSA-N 413.455 2.176 10 20 HECD CCn1c(=O)[nH]c2cc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc2c1=O 109180623 GIOLCXHCNPQQQA-HNNXBMFYSA-N 422.485 2.037 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)n(C)c2ccccc12 552516825 GGESGONCYGVJEK-IBGZPJMESA-N 418.497 2.020 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)ccc1F 728503740 ADUAYMHLPNWGKH-UHFFFAOYSA-N 416.452 2.175 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1 734072633 KXSBERDDPCPZIJ-UHFFFAOYSA-N 411.458 2.168 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1cnn(CCOC)c1 751467600 RDOUGRWEVQICFL-UHFFFAOYSA-N 418.313 2.208 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@H]3CCO[C@H](C)C3)CC2)cc1 753150602 PMQVYMVALMNHAD-JNVNVXKGSA-N 415.534 2.221 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOC[C@@H]3c3ccccc3)CC2)cc1 754052704 YBGBWXMCNNJJSD-LADGPHEKSA-N 411.546 2.252 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3cccc(Cl)c3)C(=O)C2)cc1 758769330 WGPBTZXLWPLWBA-UHFFFAOYSA-N 414.937 2.367 10 20 HECD COC(=O)CC[C@H]1NC(=O)N(C2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 761160036 MYQQJYMVMBTBGJ-OAHLLOKOSA-N 411.405 2.130 10 20 HECD CCN(Cc1ccc(OC)cc1OC)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769672445 UXZQULSIIBAAJJ-UHFFFAOYSA-N 408.476 2.443 10 20 HECD O=C(NCc1ccc(O)nc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769880196 BDLZEPRVDZTMEM-UHFFFAOYSA-N 405.457 2.285 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3COc4ccccc4C3)CC2)cc1 778231281 FSXPHVKZZRMEHV-GDWUOILNSA-N 421.497 2.020 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@@H]3CCCC[C@H]3O)CC2)cc1 779338448 UUWMDAXXYGQXES-GHTZIAJQSA-N 404.555 2.010 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 779475412 LQHPGYAQHXVRKF-YCRREMRBSA-N 420.462 2.173 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3N3CCOCC3)c2)CC1 781270786 PKJVAHRJUIYQRK-UHFFFAOYSA-N 408.502 2.444 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1 785298805 ZFTNFFCNSBUQDA-LBPRGKRZSA-N 415.421 2.050 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccnc1OCC(F)(F)F 787277571 HXKVWACXMKZHFQ-UHFFFAOYSA-N 424.423 2.330 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3CCC(=O)c4cccn43)CC2)cc(OC)c1OC 788767488 AVFRIGVCTHHCNB-QGZVFWFLSA-N 413.474 2.380 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 789822461 WQYOXPIPCOTQPA-NUJGCVRESA-N 421.513 2.131 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3(SC)CCC3)CC2)cc1 790076211 DKRNIFLRZVYZSK-CMDGGOBGSA-N 403.548 2.302 10 20 HECD Cn1ccc2ccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cc2c1=O 792993420 AQJZRXHTFZTVBB-UHFFFAOYSA-N 405.454 2.378 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1OC(C)C 799253982 PERFGETVFVFNPN-UHFFFAOYSA-N 416.430 2.230 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1 802609766 JCUOUFINQFCCNF-UHFFFAOYSA-N 423.473 2.044 10 20 HECD CCC[C@]1(C2CC2)NC(=O)N(CN2CCN(c3ccc(OC)c(F)c3)CC2)C1=O 802734556 RYOICFAXJFSEIB-OAQYLSRUSA-N 404.486 2.415 10 20 HECD CN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807386637 CNFDNARWNSSRAP-UHFFFAOYSA-N 420.263 2.111 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)COc1ccc(S(N)(=O)=O)cc1 915795012 IBWDQTHGMIMVCR-UHFFFAOYSA-N 405.520 2.216 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncs3)cc2F)C[C@@H](C)O1 919042766 ZTKKBWJYYWMEGG-BETUJISGSA-N 407.467 2.369 10 20 HECD C[S@@](=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1330730861 NLMMXFNGVUWOSP-HYDGNGQDSA-N 414.531 2.447 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnnc2ccccc12)c1cc(O)nc(O)c1 1797401740 KBSBKHWSVGDJJU-QDMKHBRRSA-N 419.441 2.002 10 20 HECD CC(=O)C[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1802228244 ODXJHUPKEMUXLR-JSJFOREKSA-N 416.474 2.070 10 20 HECD O=C(CCc1cccnc1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1810178987 KROQWFBNZCIXNX-UHFFFAOYSA-N 424.501 2.365 10 20 HECD C/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828198357 XRDKOJYLEIXLTI-XGEGNJEQSA-N 415.471 2.461 10 20 HECD O=C([C@@H]1CCc2ccccc2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250928 CZOKUUADSALOHC-QGZVFWFLSA-N 407.470 2.115 10 20 HECD Cc1ccc2c(c1)C(=O)N(CC(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)C2=O 65561022 USLCYYQMLBALOU-INIZCTEOSA-N 407.470 2.305 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)cc1OC 140299341 CFGAYZXFDHWQSD-KRWDZBQOSA-N 410.536 2.098 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)cc3)cc2)CC1 726975477 BRWWREQBKPSGTP-UHFFFAOYSA-N 414.936 2.053 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCOCC3(C)C)cc2F)C[C@@H](C)O1 728396675 UKHRJEXVVIGBBK-CALCHBBNSA-N 422.545 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 732207229 SFVWKEXKJZBJSO-QGZVFWFLSA-N 420.554 2.189 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCn3cnc4ccccc43)cc2)C1 732591328 BDHDVTNTNOIPIT-GOSISDBHSA-N 420.517 2.237 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(c2ccccc2F)C1=O 732824158 HDCKODJCUNUIFC-IBGZPJMESA-N 412.465 2.267 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 734404547 JWHSRCOGBFRHKS-UHFFFAOYSA-N 417.531 2.012 10 20 HECD O=C1C[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CN1Cc1ccccn1 735517871 GBXJOTSJLSHGNV-ICSRJNTNSA-N 409.486 2.344 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 738500193 KWOWMIDHTFQLPT-KBXCAEBGSA-N 413.522 2.424 10 20 HECD Cc1noc(Cl)c1CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 744326251 GQYPVKBIABXMCE-UHFFFAOYSA-N 411.911 2.120 10 20 HECD CC(C)C[C@@H](CCO)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745699946 ZHRKROIEGOEOKB-MOPGFXCFSA-N 404.555 2.232 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(N(C)C(C)=O)c3)CC2)cc1 746039028 QPZGUDMNACWAIP-UHFFFAOYSA-N 424.501 2.355 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)cc(F)c3)CC2)cc1 747267218 NQBILNXPRPSIAW-UHFFFAOYSA-N 407.511 2.243 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCCCSc1nccs1 749730112 IYDAHAHRDGCWJX-UHFFFAOYSA-N 422.532 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)c3c(C)noc3C)CC2)cc1 750271586 UFRNTMPCGDMYDA-CQSZACIVSA-N 401.463 2.296 10 20 HECD CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 751302609 OEAZLVYZDZLLKY-HNNXBMFYSA-N 413.503 2.397 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cnc4ccsc4c3)c2)CC1 753081790 VAOWNNUYNBDROG-UHFFFAOYSA-N 423.541 2.332 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccccc1CN1CCNC1=O 755252641 AJOPJRBPBVZMEC-UHFFFAOYSA-N 422.485 2.051 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H](C)c3c(C)n[nH]c3C)CC2)cc1 759820825 ZNKOHKWSJHWBED-OAHLLOKOSA-N 414.506 2.421 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(F)cc(F)c3OC)CC2)cc1F 761171238 NMQAHGHOOFTYMC-UHFFFAOYSA-N 423.391 2.408 10 20 HECD Cc1cccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 763383265 QXHVNOXSKGXIGU-UHFFFAOYSA-N 403.429 2.489 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 765802396 QKRLWCLOEDYMBI-KBXCAEBGSA-N 403.504 2.014 10 20 HECD O=C(NC[C@H]1CCCS1(=O)=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765899453 NPZKKPWRTVAAAU-CZUORRHYSA-N 417.478 2.133 10 20 HECD C[C@H](NC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(N(C)C)cc1 775405262 SBESBIPYWXCQOF-INIZCTEOSA-N 416.547 2.426 10 20 HECD CC(C)[C@@H]1NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777615446 AAFQYAHDZRACKN-SFHVURJKSA-N 412.469 2.019 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3nc(C)cs3)CC2)cc1 778238900 RIJREIWMSFONAI-FPLPWBNLSA-N 414.531 2.024 10 20 HECD Cc1cc(C(=O)NCCN2CCNC(=O)C2)c(C)n1-c1ccc(Br)cc1 781210464 FOCIXOWXHQJGJU-UHFFFAOYSA-N 419.323 2.018 10 20 HECD CO[C@H](C)CCC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 782437057 LAMOCJFWIMEWRZ-BZUAXINKSA-N 410.486 2.414 10 20 HECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1C(F)F 782921477 CGHPPCJHEKADNR-UHFFFAOYSA-N 415.441 2.137 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1Cc1ccccc1 785438938 IAUPRUKYAHIEAY-IBGZPJMESA-N 408.546 2.492 10 20 HECD Cc1nc(Cn2cc(C(=O)OCC(=O)c3cc(C)n(-c4ccccc4)c3C)nn2)no1 787166953 PVZQHCGXTLRVNY-UHFFFAOYSA-N 420.429 2.465 10 20 HECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842639 FJVZXFKJAMEOON-NVXWUHKLSA-N 405.514 2.488 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCC(=O)c3cnn(C)c3)cc2F)C[C@H](C)O1 793119431 XZXQFVYNGAFTCU-GJZGRUSLSA-N 402.470 2.452 10 20 HECD C[C@H](CCC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793719172 LEYLDVQBGTUYQZ-SJLPKXTDSA-N 416.566 2.336 10 20 HECD CC(=O)NC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CCO1 800742566 UORZLBFOXLFLIX-LJQANCHMSA-N 408.506 2.231 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccccc4)n3N)CC2)cc1 801871023 DGLZHPNGGWYDOO-UHFFFAOYSA-N 424.530 2.108 10 20 HECD COC(=O)[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 802166669 HNQFMEMWNKSHCK-UKRRQHHQSA-N 422.503 2.360 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3C[C@H](OC(C)C)C3(C)C)CC2)cc1 804317201 WCZYUWFVXBTQND-PMACEKPBSA-N 417.550 2.489 10 20 HECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 806793938 VOQBBQQENDCURK-HXUWFJFHSA-N 407.470 2.328 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)Cc3c(C)noc3C)CC2)cc1 807309932 WBUKRJWZEVSCHW-HNNXBMFYSA-N 414.506 2.086 10 20 HECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2OCC)cc1 808110660 XFDCLQZJFGCWBB-UHFFFAOYSA-N 414.505 2.280 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCn3c(C)cc(=O)cc3C)cc2)CC1 810696702 XNPVAOSNXSZOME-UHFFFAOYSA-N 424.545 2.230 10 20 HECD Cc1cc(C)c([C@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c(O)c1 815562066 WFUBTDILPIENSR-SFHVURJKSA-N 418.563 2.207 10 20 HECD Cc1cc(C(=O)NCCOCCS(N)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 816594981 VFTRICQAKWJSLZ-UHFFFAOYSA-N 407.536 2.252 10 20 HECD COc1cc(CC(=O)O)cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c1OC 906808038 PHCAERSKHSRGDC-UHFFFAOYSA-N 422.503 2.218 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CCNS(C)(=O)=O)c2C)cc1 914650403 FFCOCRGWDNCGKG-UHFFFAOYSA-N 422.503 2.158 10 20 HECD O=C(CSc1nnc(NC2CC2)s1)NCc1ccc(N2CCOCC2)c(F)c1 917191321 GVCIOSZRONNHMZ-UHFFFAOYSA-N 423.539 2.497 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccn(-c2ccccc2)n1 918764038 UIWWTSHNJGNBEO-UHFFFAOYSA-N 419.485 2.306 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(OCC(F)F)c1 1321048319 HLRODGJDRSVTIJ-ZDUSSCGKSA-N 410.373 2.041 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)nsc1NC1CC1 1324995307 OURGGJWYZJHJJG-ZDUSSCGKSA-N 405.476 2.341 10 20 HECD CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)on1 1799448817 PRXMYRPBSKDPDE-BTTYYORXSA-N 400.435 2.170 10 20 HECD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CC1 1823497393 YHBLRVVISOOUJP-LBPRGKRZSA-N 421.548 2.062 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC2(O)CCC2)CC1 1832460049 KQGSTQWQWFFURM-KRWDZBQOSA-N 417.506 2.031 10 20 HECD C[C@H](OC(=O)c1cnn(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 12852070 QIQYHJFNPCVQTL-LBPRGKRZSA-N 403.394 2.380 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O 16878681 RSRBTBDOWHMLBD-NRFANRHFSA-N 408.502 2.076 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NCCCN3CCC[C@H](C(N)=O)C3)c2C)cc1 111080208 XPHGXEXSRDTNHQ-SFHVURJKSA-N 412.534 2.420 10 20 HECD CNC(=O)CN1CCC(NC(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 745520634 DVCAQSZMNCHUHC-UHFFFAOYSA-N 402.539 2.447 10 20 HECD CN(C)CCN(C[C@H]1CCCO1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745646181 BROOENBLQGADDT-LJQANCHMSA-N 422.545 2.039 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1 746793815 IIUFYYLCOAVEAI-ZDUSSCGKSA-N 413.430 2.482 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCOCc3ccccc3)CC2)cc1 747500407 XXNQGORNBPVYKK-UHFFFAOYSA-N 412.534 2.333 10 20 HECD O=C1COc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2N1 751136904 NPLBMUDNPFBAET-HNNXBMFYSA-N 418.471 2.093 10 20 HECD Cc1nnc([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 755137697 AVQFNDSSPSVEIN-HZSPNIEDSA-N 405.474 2.098 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccn(-c2ncccc2F)n1 758964336 XWZNVRRPWITXTC-UHFFFAOYSA-N 408.437 2.262 10 20 HECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)N(C)Cc1ccc(N(C)C)cc1 767205275 ASOJUGXLBMBDCL-UHFFFAOYSA-N 403.548 2.360 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 769302042 LPTQSQVJVQQFLT-GFCCVEGCSA-N 413.858 2.187 10 20 HECD CCN(CC)CC(=O)N1CCN(Cc2cc(Br)cc(OC)c2O)CC1 769317714 WAGMEPOYIZOBSF-UHFFFAOYSA-N 414.344 2.149 10 20 HECD COc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1F 771263115 RAWYZWSNGNENHN-UHFFFAOYSA-N 407.467 2.391 10 20 HECD C[C@@H](NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(N(C)C)cc1 776129122 IUUDVTVEYHRRJL-GOSISDBHSA-N 409.534 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCOC4(CCC4)C3)CC2)cc1 778390214 YKFICENQEJTSFF-LKGOPFMKSA-N 413.518 2.118 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 781606080 GHJSLYOCJZJGJS-UHFFFAOYSA-N 408.462 2.032 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(OCC(F)F)n3)cc2)CC1 786657163 UHXANAWPZNTARQ-UHFFFAOYSA-N 418.444 2.324 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC(=O)N(CC2CC2)C1 789377285 HIAOUWTXJKAOHN-AWEZNQCLSA-N 417.465 2.301 10 20 HECD CN(C)CC1(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCCC1 789856138 OVDHHITYTTWXQT-UHFFFAOYSA-N 418.607 2.094 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c1 790392790 AARZSPVMYOXZIW-XAEMIUIASA-N 418.534 2.195 10 20 HECD C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793916089 WQOGEVXNDMOREI-HZPDHXFCSA-N 406.546 2.381 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 795835738 OILOWGVGAPPRBM-YRVVQQKDSA-N 408.470 2.024 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1F 796791456 SSMPPKMGGSAWNM-VIFPVBQESA-N 408.357 2.282 10 20 HECD Cc1cn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1[N+](=O)[O-] 800870747 SNQGXPBOQZDKPX-OKILXGFUSA-N 405.430 2.169 10 20 HECD CN(C[C@H]1CCCO1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449254 SYGYHEQSOJSVAI-QGZVFWFLSA-N 411.449 2.010 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677985 WCQHXNIZUIROQC-UHFFFAOYSA-N 416.566 2.350 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 807097995 RDBJXRAALWZSMN-GOSISDBHSA-N 423.561 2.414 10 20 HECD CSC[C@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807263055 FQXIDMTXSQJVQU-STQMWFEESA-N 401.479 2.241 10 20 HECD Cn1cc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)c(C(F)F)n1 812219860 RGFRAINABAFEOT-FMIVXFBMSA-N 402.492 2.281 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(F)(F)[C@@H](CO)C3)cc2F)CC1 813063465 SLXLXVAZMZFZIW-MRXNPFEDSA-N 414.472 2.127 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn2ccnc12 815419839 DQBYXROYNZVOJO-INIZCTEOSA-N 407.474 2.295 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)c1ccccc1F 918206855 OTDIWLMAIUNYCV-HXUWFJFHSA-N 405.445 2.459 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1 997638967 CCLPKVGBJFMJNP-ZXLDYLNASA-N 411.462 2.278 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(C(F)(F)F)ccc3=O)CC2)cc1F 1331681173 SLHQDGZJLIXMSS-UHFFFAOYSA-N 413.371 2.364 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cc(F)c[nH]1 1796934995 LMHNKNGRGBXARD-ACHSLPGTSA-N 423.448 2.199 10 20 HECD CCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816823877 NBBGXXLATWVRQU-LBPRGKRZSA-N 409.537 2.062 10 20 HECD C[C@@H](CN)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817228285 OWMKKDVUFPGSRI-HZMBPMFUSA-N 421.885 2.375 10 20 HECD Cn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817843972 LDFTVIVHQOYWCA-OAHLLOKOSA-N 410.434 2.174 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)[nH]n1)c1cc(O)nc(O)c1 1817846466 ZFUJJYAOWFSSSH-HUUCEWRRSA-N 413.434 2.215 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824374433 IGZWKLAQFIFWQL-KRWDZBQOSA-N 417.506 2.341 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 65715894 DVKDQWQAKXXNOR-OAHLLOKOSA-N 410.474 2.298 10 20 HECD CCc1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1N 726013506 VVJFVNCVKBBYFK-UHFFFAOYSA-N 415.465 2.280 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2C(F)(F)F)SC1=S 727178296 UPJSZSFJNPLKFO-FLIBITNWSA-N 410.464 2.456 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(N(CC)S(C)(=O)=O)CC2)cc1 731360241 YGWSEMBHSWZAMX-UHFFFAOYSA-N 410.584 2.488 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1nnc2n(C)c(=O)c3sccc3n12 738299492 QAGKCUNOZIEFLS-UHFFFAOYSA-N 424.530 2.111 10 20 HECD CSC[C@](C)(O)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 738972164 ZWSMNEKERJZWHF-QGZVFWFLSA-N 421.485 2.455 10 20 HECD CS(=O)(=O)NC1(CNC(=O)NCc2ccc(N3CC=CC3)cc2)CCCCC1 741077339 PEMOREACIUSIHX-UHFFFAOYSA-N 406.552 2.114 10 20 HECD Cc1cc(-n2cncn2)ccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742049775 ATJXXNQRBMHABJ-GOSISDBHSA-N 418.501 2.207 10 20 HECD CCC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCOCC1 745690827 DZBKRVUXDFUKBN-SFHVURJKSA-N 402.539 2.394 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1[N+](=O)[O-] 751106825 DMOPLNIDXKPUMM-UHFFFAOYSA-N 405.432 2.091 10 20 HECD COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NCc1cc(OC)ccc1O 753561255 ZJPIGTSCVBPJKU-UHFFFAOYSA-N 404.444 2.381 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl 753640055 HHAQDPSRTDBIQW-NSHDSACASA-N 412.895 2.363 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@]12CCCO2 759323875 UWKLOTRFMOXSOB-MQSCRBSSSA-N 417.550 2.421 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H](Cc3ccc(Cl)cc3)C(N)=O)cc2)C1 760576636 OZHFPRQTERPWSI-YLJYHZDGSA-N 414.937 2.228 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cc(C)ccc3O)CC2)c1 768212628 NJDDAHDNPLZBTB-UHFFFAOYSA-N 410.517 2.055 10 20 HECD CC(C)(C)n1ncc2c(O)nc(NNC(=S)Nc3ccc4c(c3)OCCO4)nc21 769795302 REBGRDSISOGFCM-UHFFFAOYSA-N 415.479 2.372 10 20 HECD COC(=O)CC1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 769956491 CIAYMLSTGAHRLF-UHFFFAOYSA-N 424.500 2.470 10 20 HECD C[C@H]1[C@H](C)CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774753172 IITNFCZLUIBAOF-ZRGWGRIASA-N 405.514 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](O)C(C)(C)C3)cc2F)C[C@@H](C)O1 782583855 OJUNMDYCYQGCDY-GQIGUUNPSA-N 407.530 2.148 10 20 HECD Cc1csc([C@@](O)(CC(=O)OCC(=O)c2ccc(O)c(O)c2)C(F)(F)F)n1 783283663 HCWGWYWXBSINKX-HNNXBMFYSA-N 405.350 2.429 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2)CC1 787324823 KRSACBLGMKLFOO-UHFFFAOYSA-N 414.466 2.040 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1CCC(F)(F)CC1 789813359 UCRMXERXPZVBAW-UHFFFAOYSA-N 413.440 2.220 10 20 HECD CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 791540642 BMGOMYBQBFQYAI-UHFFFAOYSA-N 419.459 2.481 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c(F)cc1C 792981492 AWFLQNUVXFXVBW-UHFFFAOYSA-N 404.394 2.280 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3[C@@H]4[C@@H]5[C@H]6[C@H]7C[C@@H]5[C@H]3[C@@H]7C[C@H]64)cc2)CC1 793924082 IVRNIOZLKPWQKW-OWKPFSRQSA-N 405.542 2.365 10 20 HECD CC(C)c1ncc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 799334741 ZULFTLFVUODDMZ-UHFFFAOYSA-N 415.513 2.324 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccnc1N1CCOCC1 802609499 CANBSSBYPDXVLD-UHFFFAOYSA-N 412.490 2.391 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCCN4C4CC4)C3)ccc21 803685824 MLYZGLKSYKZURY-KNQAVFIVSA-N 410.562 2.161 10 20 HECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)CC2 803687313 ZTUSAZXHUFWVES-IBGZPJMESA-N 409.534 2.136 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(CCCO)Cc3ccccn3)cc2)CC1 805025380 RFHYJDRTQUKWQZ-UHFFFAOYSA-N 424.545 2.345 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)C1 807096923 LUHYAJWAGHMZKU-MRXNPFEDSA-N 418.538 2.050 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)C3CCCCC3)cc2)C1 918120718 BSSQGQJUVNTXMQ-ICSRJNTNSA-N 402.539 2.129 10 20 HECD CC(F)(F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795912443 JJAHYBUZCRIXFQ-YOWGUQMCSA-N 404.417 2.073 10 20 HECD CC(C)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819505326 VVKOVZMPCARZNY-SWLSCSKDSA-N 417.466 2.335 10 20 HECD O=C(c1cocn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426699 AEDLNTSRDMEHEV-INIZCTEOSA-N 400.435 2.028 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831801316 LQUNPSDFPIDQFI-KSSFIOAISA-N 417.506 2.341 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cn1 1847039154 PNFIDZUKPNCYCZ-SOFGYWHQSA-N 409.442 2.037 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1 1847454090 OINKVANDIZEEGS-MHORFTMASA-N 411.433 2.251 10 20 HECD Cc1cccnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1847908990 PUIJKCJADMSFSR-MCXNIAKKSA-N 409.442 2.036 10 20 HECD O=C(CN1CCC(C2OCCO2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 110078221 IYZVJCUZJPFIJT-UHFFFAOYSA-N 420.465 2.485 10 20 HECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2NC1=O 138478434 ZNJHARCDJOIASQ-CYBMUJFWSA-N 408.458 2.043 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1 303958936 LYWCBIDPZIWXPN-OAQYLSRUSA-N 422.529 2.429 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)ccc1S(C)(=O)=O 472804930 HVPVUPGWXBZQFV-UHFFFAOYSA-N 413.499 2.454 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(NCc3ccc(OC)cc3O)CC2)cc1 725849688 UWBABZAUNAZNNI-UHFFFAOYSA-N 406.504 2.352 10 20 HECD Cc1ccc(C(=O)OCC(=O)N2CCC(C(=O)N3CCCCCC3)CC2)c(O)c1O 727003831 HUGAQBUGXJGKHF-UHFFFAOYSA-N 418.490 2.204 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCCC4)nc3)cc2)C1 727103128 CZIMZILVSBTUCV-IBGZPJMESA-N 407.518 2.314 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1 734015255 CTVTWBXSXUKEOS-OAHLLOKOSA-N 408.458 2.446 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H]3c3ccco3)cc2)C1 735188497 ZSOJKAHJFHPZIX-MJGOQNOKSA-N 412.490 2.264 10 20 HECD O=C1CCC(=O)N(c2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)N1 735518320 INKOFSIEXPRUME-LJQANCHMSA-N 423.469 2.372 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1F 747011691 HBGISGAXHZUEIC-UHFFFAOYSA-N 402.401 2.170 10 20 HECD O=C(NCc1ccc[nH]1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 747516899 QLBORIIIXMTVQU-UHFFFAOYSA-N 416.415 2.359 10 20 HECD COc1cc(N2CCN(C(=O)c3c[nH]nc3-c3cccnc3)CC2)cc(OC)c1OC 760091258 YICAQOVFHOIYKG-UHFFFAOYSA-N 423.473 2.460 10 20 HECD Cn1nccc1CCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 762502790 WPQDZEGMJBXJOG-UHFFFAOYSA-N 404.382 2.076 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccnc12 764196864 JXTDNIKYOBOVQN-MRXNPFEDSA-N 424.457 2.433 10 20 HECD Cc1[nH]nc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1Br 768618083 NKVPHDOSQFPNFP-UHFFFAOYSA-N 409.284 2.362 10 20 HECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)c2)CN1 772481788 WBBNGOCOSMBOFP-MRXNPFEDSA-N 407.470 2.129 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772714166 NFLVUKBPMISTGP-WOJBJXKFSA-N 424.563 2.047 10 20 HECD Cc1cccc(CN2CCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1 772770076 QZNVVZQOCVJDFE-VURMDHGXSA-N 410.470 2.307 10 20 HECD C[C@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)cc1Cl 772999465 LLIZVHBJEXMDLD-IFXJQAMLSA-N 403.914 2.366 10 20 HECD Cc1cc(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c(C)n1-c1cccc(Br)c1 773660601 ZUWLNGDWEBFWLF-OAHLLOKOSA-N 404.264 2.344 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)C[C@@H](OC)C4)CC2)cc1 784676579 WCNDQERNYKGRTC-QFIPXVFZSA-N 423.513 2.486 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccsc1 787636457 IBLHQDFXJZASJF-LJQANCHMSA-N 400.548 2.384 10 20 HECD CCO[C@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C1CCCC1 788313032 OEDFGEIXJPGUPS-OAQYLSRUSA-N 417.550 2.241 10 20 HECD CCOC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 789866386 NHKGXUOWSWBHGB-CFGKVWFZSA-N 403.523 2.077 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc1F 789978265 PRLBFLDLTUYZKH-HNNXBMFYSA-N 405.392 2.186 10 20 HECD C[C@@H]1CCC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793722518 UBQCLURHLFCMQX-KPFFTGBYSA-N 414.550 2.042 10 20 HECD O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NCc1ccc(N2CCOCC2)cc1 794244671 NRYGHLZYHHRPQX-UHFFFAOYSA-N 417.412 2.158 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cn1 799643052 SBMMUMLIGQYYIB-UHFFFAOYSA-N 402.520 2.423 10 20 HECD COCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802425129 YYHZXFDKOCSCNH-UHFFFAOYSA-N 408.506 2.460 10 20 HECD COc1cc(C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803301022 XIYFVSZEPIZNMY-KRWDZBQOSA-N 411.502 2.334 10 20 HECD CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661708 KNVTVKNGVVPDIH-HXUWFJFHSA-N 401.482 2.398 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1F 803663304 MPEOQGNBLHFVJI-QGZVFWFLSA-N 403.454 2.309 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@H]3CC(C)C)CC2)cc1 804318727 RVKRDNKYEBPDNZ-LJQANCHMSA-N 403.523 2.054 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)CC3(CO)CC3)cc2Cl)C1 807953143 ONEVCDREMQXDLS-HNNXBMFYSA-N 407.942 2.423 10 20 HECD C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@@H]1C 808851882 KLBSRWSQLAYUOX-RTBURBONSA-N 412.578 2.482 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2c(Br)nnn2C)cc1 810028539 LGGLXXIKPPDPEV-OAHLLOKOSA-N 422.327 2.465 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cn(Cc2ccccc2)nn1 815370725 VMGDBNYQKATLEY-UHFFFAOYSA-N 406.490 2.380 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCN1CCCC1=O)c2[N+](=O)[O-] 821701883 WTHSEFOWARTQDA-UHFFFAOYSA-N 408.366 2.149 10 20 HECD C[C@@H](Oc1ccccc1F)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339306 FJCAVKCFTVPFIQ-OAHLLOKOSA-N 406.479 2.144 10 20 HECD O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969998 NSEWCFZPJNTTGU-OAQYLSRUSA-N 409.486 2.301 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920868934 FVJJEUHBCDGJPN-INIZCTEOSA-N 417.531 2.199 10 20 HECD C[C@H](Cc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602520 OECHAEGHOGOGPN-NKGKWGDASA-N 410.474 2.018 10 20 HECD O=C(c1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426772 GGXOLZDLLZVIFK-SFHVURJKSA-N 410.474 2.435 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030195 DWTWWDORMYIHAH-PEBXRYMYSA-N 417.506 2.151 10 20 HECD O=C(C1CC(F)(F)C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440747 HUQSVMJLBQPNMQ-UHFFFAOYSA-N 416.428 2.028 10 20 HECD Cc1cnn([C@@H](C)C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1 1845502278 IINXLTICDYARNM-ZDUSSCGKSA-N 418.881 2.334 10 20 HECD COc1ccc(N2CCN(C(=O)CSCC(=O)Nc3cc(C)on3)CC2)cc1 8028583 MSPFDWGCRQFSEF-UHFFFAOYSA-N 404.492 2.012 10 20 HECD COc1ccc(N(C)CC(=O)NCc2cc(OC)c(OC)c(OC)c2)cc1OC 109101284 AGONVQFJUSQSNP-UHFFFAOYSA-N 404.463 2.482 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 148595697 JASUKPQXRWUNCO-MRXNPFEDSA-N 417.531 2.312 10 20 HECD COCCOc1ccccc1CNC(=O)C(=O)NCc1c(C)c2ccccc2n1C 476668979 FQVBDFKOMSTUOJ-UHFFFAOYSA-N 409.486 2.445 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)c1 729064751 WJBGBLUEEYFPGY-SECBINFHSA-N 407.373 2.453 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OC)c(NC(C)=O)c2)c1 729064937 WMXUCSWJTHBGRP-NSHDSACASA-N 401.419 2.184 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cccc(CO)c3)CC2)cc1 729587334 RCZDQDTZXKCHPD-UHFFFAOYSA-N 412.534 2.199 10 20 HECD C[C@@H]1[C@@H](C)[S@@](=O)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 736630297 YWVCVMYHEWSIGP-SIJNZQJQSA-N 410.495 2.242 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COc3cccc(C(C)=O)c3)CC2)cc1 742911496 ZDDXWFUOXDJFCN-UHFFFAOYSA-N 411.502 2.215 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 743554093 XMYOSUHMQYRODS-AWEZNQCLSA-N 421.473 2.484 10 20 HECD COCCOC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 745606844 OKHZZPZJHBEMHF-AWEZNQCLSA-N 419.444 2.393 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](N(C)Cc4ccccc4)C3)nc12 746485646 ZKWZAFLFEIVXHH-SFHVURJKSA-N 409.490 2.318 10 20 HECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 747017490 MZLYSXOUNMOTSZ-UHFFFAOYSA-N 421.545 2.076 10 20 HECD NC(=O)C1CCN(c2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)CC1 748694880 WUZVZSCFTBKVAG-UHFFFAOYSA-N 417.516 2.194 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1 749731129 JYLGWBBULPTJQD-UHFFFAOYSA-N 424.523 2.356 10 20 HECD COc1ccc(N(C)CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1 752126733 UKYDDBSOVPSKSP-UHFFFAOYSA-N 414.462 2.397 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3nncn3-c3ccccc3)CC2)cc1F 753863736 XFPKLAXQPGFEFB-UHFFFAOYSA-N 410.453 2.447 10 20 HECD C[C@H](OC(=O)Cc1cc[nH]n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753888960 QFJIBLQEZGSZJQ-LBPRGKRZSA-N 403.394 2.298 10 20 HECD COc1ccc2c(c1)C=C(C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CO2 755215038 ZBPXYZRMMOPSNG-KRWDZBQOSA-N 421.497 2.489 10 20 HECD COCCNC(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(N2CCSCC2)cc1 756672150 MOWYKMDVZOJMGF-IBGZPJMESA-N 422.595 2.216 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCc3nc(COC)nn3C2)cc1F 757688630 NATOUAYSMNCFQJ-OAHLLOKOSA-N 404.490 2.224 10 20 HECD COc1cc(N2CCN(C(=S)NC[C@H]3CCCCO3)CC2)cc(OC)c1OC 758921732 LPQCFJCYYGZEJD-MRXNPFEDSA-N 409.552 2.278 10 20 HECD COc1cc(F)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 759022000 DFIBDPFZIJLTAY-UHFFFAOYSA-N 419.428 2.407 10 20 HECD COc1cc(N2CCN(C(=O)C3=C(C)C(C)(C)OC3=O)CC2)cc(OC)c1OC 759219721 CVNIUNJTDAJQFX-UHFFFAOYSA-N 404.463 2.013 10 20 HECD Cc1nn(C)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1[N+](=O)[O-] 761981113 GHQKJPUXFUJGMS-CQSZACIVSA-N 407.858 2.390 10 20 HECD CCN1CCN(CCc2noc(-c3ccc(-n4c(C)ccc4C)cc3)n2)C(=O)C1=O 763313596 WBBPEYJTFZJJSX-UHFFFAOYSA-N 407.474 2.377 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(N4CCOCC4)CC3)cc2F)C[C@H](C)O1 764762421 FIQFEBREKDICTA-IRXDYDNUSA-N 420.529 2.103 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2COC(=O)C2)NC(=O)OC(C)(C)C)cc1 765684572 PGBKDEGRKDZLSZ-RHSMWYFYSA-N 405.495 2.388 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)N1CCc2ccccc21 768823958 JMPPZNXNINQJFL-UHFFFAOYSA-N 420.557 2.230 10 20 HECD Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc(S(=O)(=O)N(C)C)c1C 773740381 LINMKEJMQZZMCJ-ZDUSSCGKSA-N 406.504 2.326 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCc4nnc(O)cc4C3)cc2F)C[C@@H](C)O1 776119037 ZNKBKJMCUZURRN-ZIAGYGMSSA-N 415.469 2.203 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 784028660 YVPSIQVNRFZWHZ-UHFFFAOYSA-N 404.488 2.481 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1 785295479 HUXZAHSBYVJMBX-LSDHHAIUSA-N 413.474 2.009 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(c4ccccc4)=NO3)cc2)CC1 786656540 NJQOCBLGKKVIAR-QFIPXVFZSA-N 406.486 2.165 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2c(Cl)cccc2C1 788332519 OPGXRGXSUDSOKH-UHFFFAOYSA-N 413.905 2.378 10 20 HECD COCCN(C)c1ccc(/C=C2/SC(=S)N(C3CCN(C)CC3)C2=O)cn1 790107762 KLRQBKNKWSZPIY-FOWTUZBSSA-N 406.577 2.460 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1ccc(OC)cc1O)O[C@@H](C)C2 797389830 ANACSSBOYZWNKL-LBPRGKRZSA-N 400.431 2.378 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cc(Cl)cc(C(N)=O)c3)CC2)cc1 798434733 MWOWSCGZAHJPGJ-UHFFFAOYSA-N 423.922 2.395 10 20 HECD C[C@H](NC(=O)C(=O)NCCC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803303791 AFVIUQJWYXMMKO-FXAWDEMLSA-N 403.523 2.166 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3nc(C(F)(F)F)cs3)ccc21 803686094 VPZWXTMCZVGJHO-UHFFFAOYSA-N 412.437 2.477 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(OCC4CC4)CC3)CC2)cc1 804317884 RSADRBYBCCCKGD-UHFFFAOYSA-N 415.534 2.198 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCCCSc2nccs2)cc1OC 806278323 RAXRAAIMIIXYIH-UHFFFAOYSA-N 409.533 2.417 10 20 HECD C[C@H]1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807008774 HPSYISIEYNMQOR-GHTZIAJQSA-N 412.578 2.387 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@H]4CN(C(C)=O)C[C@@H]43)CC2)cc1F 808354531 HFYIAYNIRUSYRM-XKGZKEIXSA-N 418.513 2.313 10 20 HECD CC(=O)C(=O)COC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1 808484588 FBQKMGNPRFFCGM-HNNXBMFYSA-N 421.450 2.057 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1C 810360886 AJICZFYEXIVXSL-LLVKDONJSA-N 404.394 2.451 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1 810404226 JYPVNARSVRZPPK-UHFFFAOYSA-N 418.393 2.014 10 20 HECD O=C(c1ccc(NCc2c(O)ccc3c2CCCC3)nc1)N1CCS(=O)(=O)CC1 811808697 OYGKCNMYJZRLNH-UHFFFAOYSA-N 415.515 2.149 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)sc1C(=O)O 871822392 WYDLFHJZUQFJSI-UHFFFAOYSA-N 414.480 2.209 10 20 HECD Cc1nc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2nc1C 916676414 LVSSHNLITORNGJ-UHFFFAOYSA-N 424.526 2.411 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCCC(=O)NC3CC3)cc2F)C[C@@H](C)O1 918210487 ZDWKWRWTZSQRMN-GASCZTMLSA-N 406.502 2.297 10 20 HECD CN1CCCN(c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc2)CC1 918305823 LZDKYLUOWVQMPQ-UHFFFAOYSA-N 423.561 2.492 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 918310030 JQZVBBMWCOZJPH-UHFFFAOYSA-N 424.501 2.387 10 20 HECD CCNC(=O)CN1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 918413405 RTQYZCFQCZWYMH-UHFFFAOYSA-N 422.489 2.321 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](CN1CCOCC1)c1ccccc1 919791219 ZGVRCGPXSBMINH-QHCPKHFHSA-N 424.545 2.396 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3csc(C(=O)OC)c3)CC2)cc1 1116410070 RXZJPUANYVHMBF-UHFFFAOYSA-N 410.517 2.444 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793042707 PITBFCLZCHRLBH-LKQDWFRTSA-N 410.898 2.410 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cn[nH]c1)c1cc(O)c(O)c(Cl)c1 1794338698 LOCFIKMMPIRYQA-QDMKHBRRSA-N 418.881 2.359 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCCC1)C2)c1cc(O)c(O)c(Cl)c1 1799770766 DXOXEGIJLMIWJS-XOIINTDNSA-N 406.866 2.065 10 20 HECD O=C(CC1CCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1828107109 OMEUVBBPMJZTSI-GFCCVEGCSA-N 402.476 2.365 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CCC3=O)c2C)cc1 104599442 HBNCDFDQTAQROZ-UHFFFAOYSA-N 412.442 2.368 10 20 HECD CC(=O)NCc1ccc(-c2nc(NS(=O)(=O)c3ccn(C)n3)sc2C)s1 727249255 QHCKGJFTOVGDCM-UHFFFAOYSA-N 411.534 2.350 10 20 HECD CNC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 728516098 OAUVYGOKJBESSL-OKILXGFUSA-N 400.454 2.124 10 20 HECD C[C@@H]([C@@H](C)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N1CCOCC1 729597461 POQLRPYFRSXJAB-TVFCKZIOSA-N 422.545 2.348 10 20 HECD CCc1cc(=NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc(-c2ccncc2)[nH]1 731662799 UTJXTZJTZYSWAZ-UHFFFAOYSA-N 423.542 2.370 10 20 HECD CCN1CCCC[C@@H]1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732250908 MGPZCJISMFDMFA-AZUAARDMSA-N 401.555 2.062 10 20 HECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734701821 JSELVZNTIGIESP-UHFFFAOYSA-N 402.882 2.329 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCCOCC1CCOCC1 740918755 PIBRJEJQGAWONK-UHFFFAOYSA-N 405.539 2.498 10 20 HECD COc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1C(=O)N(C)C 743050667 ZFJJXILZYJEMHU-UHFFFAOYSA-N 421.504 2.055 10 20 HECD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nnn1C 745165600 VTCQOLKQHAZWNK-LBPRGKRZSA-N 418.409 2.083 10 20 HECD CC(C)N1CCC(N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)CC1 749460755 RARHVBHZTVIXBA-UHFFFAOYSA-N 415.626 2.201 10 20 HECD Cc1nnc2n1C[C@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 750795384 OTENBCTUVCVPGL-PBHICJAKSA-N 403.914 2.289 10 20 HECD Cn1c(=O)oc2cc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 751136126 DBORVXGCBXMXNG-HNNXBMFYSA-N 418.471 2.207 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)N[C@H](C)c3cc(OC)ccc3O)ccc2O1 752003335 ZSSOJEHONQZHBD-CWTRNNRKSA-N 421.471 2.307 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)NCc3ccc4c(c3)CCCN4C)C2)nc1 753149629 MHKNRKSKJNJHLQ-UHFFFAOYSA-N 423.517 2.329 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(S(C)(=O)=O)cc1 753295597 ZBODBDCASVUWSG-MRXNPFEDSA-N 402.516 2.347 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C2=O 753636528 NDDKQDXISSVFNL-QQKMHPFRSA-N 403.479 2.036 10 20 HECD CC[C@@H](CN1CCCC1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758713517 UTZJROQHFHIRDZ-OALUTQOASA-N 401.555 2.062 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3ccc(F)cc3)cc2)C1 770302734 YLHGKXVCMQMTJL-XLIONFOSSA-N 414.481 2.060 10 20 HECD COCCC[C@@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771066108 ITKIWCRJBDBTQL-MRXNPFEDSA-N 402.495 2.500 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772714165 NFLVUKBPMISTGP-VQTJNVASSA-N 424.563 2.047 10 20 HECD C[C@H](NC(=O)N1CCN(c2ncnc3c2cnn3C)CC1)c1ccc(N(C)C)cc1 776238387 NQDZWLCJBAXKON-HNNXBMFYSA-N 408.510 2.022 10 20 HECD Cc1ccnn1-c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 784685279 IEWDOTNYDQTDSN-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 785422923 PUDFDCVZFWXBHE-IBGZPJMESA-N 403.429 2.247 10 20 HECD COc1ccccc1OCCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786263301 WMHCGHYOYOMZCU-UHFFFAOYSA-N 411.502 2.449 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)c3cc(OC)cc(OC)c3)CC2)cc1 786440812 HMHQSBMZPVFRJY-HXUWFJFHSA-N 415.534 2.332 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C 787575339 XKPXCXFYKZVKPI-NSHDSACASA-N 400.460 2.246 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc(OC)c3)CC2)cc1 795066687 DZCKMDWJPCXCDA-UHFFFAOYSA-N 419.547 2.194 10 20 HECD CCOC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 799763834 HLOFHXFTWTXTJU-UHFFFAOYSA-N 422.478 2.318 10 20 HECD CN(C)c1ccc(CNC(=O)NCCS(=O)(=O)CCc2ccccc2)cc1F 800064355 SRKFEMDGZBJPJY-UHFFFAOYSA-N 407.511 2.348 10 20 HECD CS(=O)(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 800700718 PKGRWUQCHFXYEO-GOSISDBHSA-N 411.593 2.349 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN[C@H](c3ccccc3Cl)C2)c1 801406417 FNZBQUKZYQCQLV-INIZCTEOSA-N 409.895 2.204 10 20 HECD CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803297231 OAEIMFDXZQPBPO-FFZOFVMBSA-N 417.550 2.362 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCOC[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803298847 FMIBLDMIYCDIAZ-GCJKJVERSA-N 423.513 2.301 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(=O)NCCN1CCOCC1 805968883 ISJOFGIFPOTUOH-INIZCTEOSA-N 405.520 2.149 10 20 HECD CCOC(=O)c1ccc(NC(=S)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1 812262215 YDTPGUDSIGGUBT-UHFFFAOYSA-N 422.532 2.427 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)N(C)C)c(C)n1-c1cccc(C(C)C)c1 816590174 SPKXKRSWXXTHPX-UHFFFAOYSA-N 406.552 2.343 10 20 HECD C[C@@H](CN1CCCCC1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117082 GKIPCXUFECYABX-PKOBYXMFSA-N 401.555 2.062 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1 918247140 YIVQMPXRGKOYDA-UHFFFAOYSA-N 404.470 2.218 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(C(=O)N2CCOCC2)cc1 919776792 WAFAQPUNZIFXKB-UHFFFAOYSA-N 424.501 2.317 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cnc(C)s3)CC2)cc1 920041634 IXJCZGAHSJYJLI-UHFFFAOYSA-N 403.552 2.472 10 20 HECD C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[C@H]1N1CCN(C)CC1 1319827983 BOLHSFDHXJRPFJ-SIKLNZKXSA-N 403.590 2.035 10 20 HECD O=C(Cn1nc2n(c1=O)CCCCC2)Nc1c(-c2ccccn2)nc2ccccn12 1323597382 QLORIULEMSPEJO-UHFFFAOYSA-N 403.446 2.120 10 20 HECD CO[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccccc1 1796599484 OULYXNKOCNGWDH-AXVVYFOYSA-N 411.458 2.132 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1C[C@]1(F)Cl 1822502394 RCGSGLGXWRNQLU-GDAOTKPNSA-N 423.832 2.446 10 20 HECD O=C(c1ccc(F)nc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501712 TVMHPVHNXLWZDB-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CN(CCC(=O)NC(=O)NCc1ccccc1)Cc1ccc(N2CCOCC2)cc1 10056428 IAQOWHIDYBYRRF-UHFFFAOYSA-N 410.518 2.371 10 20 HECD CN(C)CCNC(=O)c1cccc(CNC(=O)NCc2ccc3c(c2)CCCN3C)c1 727479224 DNLFBUBYWZSMFB-UHFFFAOYSA-N 423.561 2.360 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1 729062958 GPWQOEOBGVXRFM-CYBMUJFWSA-N 424.457 2.015 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CN4CCC[C@H]4CO3)cc2F)C[C@@H](C)O1 729497575 VERGULQEHGXEEW-OGWHTMIXSA-N 420.529 2.102 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 734075407 ZTFBUXOUALBXEW-UHFFFAOYSA-N 403.504 2.062 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CC(=O)N(CCN4CCOCC4)C3)c2C)c1 735822630 FXZVCNCTSWTYNX-HXUWFJFHSA-N 424.545 2.065 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 743893411 VHYNLRAGQDLFHH-UHFFFAOYSA-N 419.528 2.343 10 20 HECD Cc1cc(CC(=O)NCCN2CCCS2(=O)=O)c(C)n1-c1ccc(Cl)cc1 747202099 CUSDPFGZSDEUFD-UHFFFAOYSA-N 409.939 2.442 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c(C)nc(C(C)C)nc3O)CC2)cc1 747369707 KAZWTWAAHNLCNQ-UHFFFAOYSA-N 413.522 2.175 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOCc3ccccc3)cc2)C1 747508051 SPHBLGKWEMWWKI-HXUWFJFHSA-N 410.518 2.404 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)CC2)cc1 753926803 WCRDZMZTVMXQCR-RTBURBONSA-N 415.582 2.132 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)NCCCSc2nccs2)cc1 753944543 DSGMWKJCGOPSHZ-UHFFFAOYSA-N 408.505 2.350 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1 758970369 SUBMGFGMDOTKPM-UHFFFAOYSA-N 402.414 2.118 10 20 HECD CCN(CC)CCCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760089165 MCFVLABKAMTUJR-UHFFFAOYSA-N 408.543 2.276 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)cc1F 769025013 USCVRTCYBIWEOA-UHFFFAOYSA-N 417.510 2.275 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 772452081 PPQVRQKYFMFFQQ-RTBURBONSA-N 410.536 2.269 10 20 HECD Cc1cc(C(=O)COC(=O)c2nccs2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 773506327 ZFQBFUPFQICACD-UHFFFAOYSA-N 419.484 2.238 10 20 HECD CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773746166 ZAGMEOMGLQOQRQ-DZGCQCFKSA-N 421.519 2.138 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC(=O)NCC1CC1 778209302 KQFINBQGILYUTJ-NTEUORMPSA-N 423.585 2.372 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(OC(C)C)CC3)CC2)cc1 778259792 CAQJBACRKYLEAB-HJWRWDBZSA-N 415.534 2.316 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3cccc(C)c3)cc2)CC1 786119997 HHLKPHSAEGGCBG-UHFFFAOYSA-N 401.532 2.283 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3nc4c(s3)CCC4)CC2)cc1 789447246 CQSWFEHJRNPTEI-UHFFFAOYSA-N 400.504 2.364 10 20 HECD CCCCN(CCOC)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820359 PYYVXNKQHMRTSG-CALCHBBNSA-N 423.529 2.331 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cnc(CC2CC2)nc1 793062555 UBEICIBZQYFYMX-UHFFFAOYSA-N 405.252 2.152 10 20 HECD O=S(=O)(CCNCc1ccc2c(c1)CCN2Cc1ccccc1)N1CCOCC1 796287398 AAXSILJAFYXBEU-UHFFFAOYSA-N 415.559 2.001 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c(O)c1 797389240 WONSPLJALNZCJU-GOSISDBHSA-N 400.431 2.214 10 20 HECD C[C@]1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803451693 SORIORHHPLDGOY-HXUWFJFHSA-N 411.449 2.058 10 20 HECD Cc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n(C)n1 803462490 SVACPNTXNBIQSJ-UHFFFAOYSA-N 406.489 2.226 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3sc(C)nc3C)CC2)cc1 804317959 UHLUGFDDDGJPPA-UHFFFAOYSA-N 402.520 2.170 10 20 HECD C[C@H](NC(=O)N1CC[C@H](C(=O)N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 804988378 BOGKHQMJYGKAPP-HKUYNNGSSA-N 400.523 2.238 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1 806543848 KTCHDCYQJHMFAV-LLVKDONJSA-N 411.455 2.240 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccc(F)c(F)c1 807095717 QIODAXHJSKBUQL-LJQANCHMSA-N 405.445 2.459 10 20 HECD CCc1cnc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 807770659 RAICZEDMMOQYNW-UHFFFAOYSA-N 402.520 2.069 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCn3ccnc3C2)cc1 809457804 MWOLOOZUANXZQD-GOSISDBHSA-N 421.501 2.202 10 20 HECD NS(=O)(=O)Cc1cccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 820006115 JFDZVEVVUYPUJN-UHFFFAOYSA-N 407.455 2.437 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCNC(=O)c1cccs1 916568793 ZPBHAHPLABHSFG-UHFFFAOYSA-N 402.520 2.156 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cncn1-c1ccccc1 918334442 GNLHTEXYJXRMBQ-UHFFFAOYSA-N 410.499 2.037 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918439122 SMZVOCRNROKWFA-UHFFFAOYSA-N 413.499 2.281 10 20 HECD CS(=O)(=O)Nc1ccccc1CC(=O)NCc1ccc(N2CCSCC2)cc1 1116032605 YUHLWTRYCYDQJY-UHFFFAOYSA-N 419.572 2.470 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1320637639 PKESNWFFZYTXGI-LBPRGKRZSA-N 407.448 2.487 10 20 HECD CN1CCc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)ccc21 1796601256 KSIRALFWIPNQME-BCDXTJNWSA-N 422.485 2.051 10 20 HECD Cc1cnoc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934465 HNMKMHIRYQQQON-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc2cnccc12)c1cc(O)nc(O)c1 1799141738 OJXVHAJFWAAIHR-MUJYYYPQSA-N 419.441 2.002 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C13CC(F)(C1)C3)CC2)c1cc(O)nc(O)c1 1816720553 XYAKOIJNZRREJE-RPEWGDSMSA-N 418.450 2.067 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(-n2ccnn2)cc1 727037497 HEKNGQLOCBAJOF-UHFFFAOYSA-N 422.514 2.075 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(SCC)nc3)nc12 727922136 SGXBSUOQEFSZIE-UHFFFAOYSA-N 402.432 2.476 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)C3CCCCC3)cc2)C1 727940218 DRSKKGDZIZIGHF-QUCCMNQESA-N 402.539 2.129 10 20 HECD CCN(C)[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 728601345 CBQLPSBECGSKAA-OAQYLSRUSA-N 415.559 2.231 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4c(s3)CCOC4)nc12 728645537 YXSXBXXQNCAADU-UHFFFAOYSA-N 403.416 2.103 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1 728977798 DFEPPPLYOQWZOB-CQSZACIVSA-N 421.519 2.405 10 20 HECD COc1ccc(-c2noc(CN3CCN(C(=O)c4cc(O)cs4)CC3)n2)cc1 731866988 MYCYACFUQLJGNQ-UHFFFAOYSA-N 400.460 2.470 10 20 HECD C[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)N(C)C 733164125 ZVDVBUNYSUNYIW-CDDSVFCYSA-N 411.574 2.322 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 742951951 CJDKWSQJEYQYFX-UHFFFAOYSA-N 405.476 2.169 10 20 HECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)N1CCOc2cc(N(C)C)ccc21 742953162 XHGDWUJDJHZVHY-UHFFFAOYSA-N 415.402 2.286 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3cc(OC)ccc3OC)cs2)cn1 747750476 UNCSUZCDBKDNKT-UHFFFAOYSA-N 424.504 2.471 10 20 HECD CN1CCc2cc(/C=C3\N=C(c4cccc(S(=O)(=O)N(C)C)c4)OC3=O)ccc21 751522715 IBUWHZMELWKKBS-PDGQHHTCSA-N 411.483 2.274 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3cc(OC)ccc3O)CC2)cc1 754139101 BJKXRDKQTLGRKU-PKOBYXMFSA-N 415.534 2.243 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 754563005 LNHIINYDNGGLLF-MTNOOBJLSA-N 407.530 2.460 10 20 HECD C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)c(F)cc1O 756562064 FKLCJQJKWUKEFU-LLVKDONJSA-N 423.348 2.453 10 20 HECD Cc1ccc(NC(=O)CN(C)c2ccc3c(c2)OCO3)cc1S(=O)(=O)N(C)C 756653697 NWICTVMQYVTMRC-UHFFFAOYSA-N 405.476 2.049 10 20 HECD C[C@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758390338 VMVYPPYKGIGWFC-XLIONFOSSA-N 415.582 2.260 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)cc1 760519023 BRAODKFHGZIDBF-UHFFFAOYSA-N 400.497 2.116 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCc4ccc(OC)cc4CC3)CC2)cc1 760924858 HMXLKCCOMYFZSZ-UHFFFAOYSA-N 409.530 2.453 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 763280362 RVLLXVFZLKJKGX-CQSZACIVSA-N 406.504 2.489 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 773458487 IHPRTRZBWKTHRM-UHFFFAOYSA-N 423.469 2.084 10 20 HECD COCc1ccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 787503041 DUCDUBNRSUCWBM-UHFFFAOYSA-N 411.502 2.197 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 787741990 YRLFTAZHUSSLMD-DYESRHJHSA-N 422.529 2.410 10 20 HECD O=C(CN1CCc2ccccc2C1=O)NCc1ccc(N2CCC(CO)CC2)cc1 789955447 HOALVUUMXRJAHT-UHFFFAOYSA-N 407.514 2.210 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 793647251 USLJIWRSFRCNPR-IAGOWNOFSA-N 411.502 2.070 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c(O)c1 794382630 DXRGUAXUFWSYJE-BBWFWOEESA-N 420.531 2.314 10 20 HECD Cc1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)sc1C 803301045 XRKZVKVOIRRORF-AWEZNQCLSA-N 402.520 2.090 10 20 HECD CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803301812 ZFONRDSATMQZFG-RHSMWYFYSA-N 402.520 2.424 10 20 HECD CC[C@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007354 JBMFKJUDELFEHZ-QGZVFWFLSA-N 424.586 2.184 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(Cl)nc3)CC2)cc1 806593386 GOKYWLBUJOLEAM-UHFFFAOYSA-N 416.909 2.141 10 20 HECD Cc1ccn(-c2ccccc2CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 807291464 WFTXZDRFEJQZGG-UHFFFAOYSA-N 415.497 2.490 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C 809404982 MCCWTFXZNSSJRF-MLGOLLRUSA-N 424.339 2.102 10 20 HECD CN(C)S(=O)(=O)CCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 810495820 PJCWIRMHOPJWDN-UHFFFAOYSA-N 403.464 2.048 10 20 HECD CCOC(=O)[C@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 915793836 MXRVDYCTJRUSDS-KRWDZBQOSA-N 404.507 2.202 10 20 HECD COC(=O)c1cccnc1SCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917207642 KUXYUVXSFYBWNS-UHFFFAOYSA-N 419.478 2.252 10 20 HECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)Nc1cccc(N2CCOCC2)c1 918371092 CVJFHYZGEDSELX-UHFFFAOYSA-N 414.853 2.413 10 20 HECD Cc1nn(C)c2sc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc12 918643826 QFSYIHVERVHJQY-UHFFFAOYSA-N 418.544 2.108 10 20 HECD Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920865393 AGFOKZSPNKSFDD-AWEZNQCLSA-N 420.487 2.275 10 20 HECD Cn1ccnc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426261 BQHWEXJIAPJFLR-UHFFFAOYSA-N 407.430 2.288 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H]1CCc2ccccc21 1796602884 XFFGCIUPAAZRSP-ZMMAXQRCSA-N 407.470 2.475 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=COCCC1)C1=NN(c2ccccc2)C(=O)C1 1802402057 QMXYMZJVEVKKDZ-GGPHIMKMSA-N 422.485 2.112 10 20 HECD Cn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804283579 FAEHCBURKIVGKK-ZURAMSNBSA-N 411.458 2.107 10 20 HECD O=C(CC1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804332094 MXVGVOADWOVJCA-QDMKHBRRSA-N 409.577 2.065 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cnccc3F)CC2)C1 1810543478 FBZFKMVOPWJQFH-UHFFFAOYSA-N 414.437 2.186 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1cc(O)nc(O)c1 1817844254 VWZOHVCSVAPGDG-CYBMUJFWSA-N 414.447 2.292 10 20 HECD CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827435177 CYESHSFLBJEYNW-MJRJWQSSSA-N 402.476 2.387 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 16134549 UUCZFNHMQYEJOR-WOJBJXKFSA-N 413.518 2.047 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccccc4)n3)cc2F)C[C@@H](C)O1 117529341 UYKCTKCKDCZWPN-IYBDPMFKSA-N 424.480 2.409 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)CCCc3ccccc3)CC2)cc1 302913920 SGBVLURFZXANMZ-UHFFFAOYSA-N 416.543 2.391 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(C2OCCO2)CC1 726706293 GEQJFPODSUIQJA-UHFFFAOYSA-N 407.486 2.081 10 20 HECD Cn1ccc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)n1 727350907 XMSTYWMLMABEBY-GFCCVEGCSA-N 424.548 2.070 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cccc3c2COC3=O)cc1 727359640 WTCSPUKPTPVOMI-UHFFFAOYSA-N 412.471 2.469 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CSc3cccc[n+]3[O-])cc2F)CC1 730235651 KLMLLZWBJFVUBC-UHFFFAOYSA-N 404.511 2.010 10 20 HECD NC(=O)CCNC(=O)c1cccc(NC(=O)NCc2c(O)ccc3c2CCCC3)c1 743142304 XJWSJHOOCSIFRM-UHFFFAOYSA-N 410.474 2.198 10 20 HECD CCN(C)C[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 744424077 SHNKCZNCPVHHAU-GGPKGHCWSA-N 420.573 2.329 10 20 HECD Cc1nccn1C[C@@H](C)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749196928 VKTTYXPWBBHNII-LPHOPBHVSA-N 412.538 2.029 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccnc(O[C@@H]2CCOC2)c1 755430236 QCXUCMUIJCMROL-GOSISDBHSA-N 415.465 2.280 10 20 HECD CCOC(=O)N1CCN(C(=O)CN(Cc2ccco2)Cc2ccccc2O)CC1 756327194 LVGACLXULDIAFK-UHFFFAOYSA-N 401.463 2.288 10 20 HECD Cc1ccccc1CN1CCN(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 759578330 HRUYZOMSBQNIJG-CLFYSBASSA-N 410.470 2.307 10 20 HECD O=C(Cn1cnc(-c2ccccc2)n1)NCc1ccc(N2CCC(CO)CC2)cc1 761768439 NMDLGFGOMKUOJQ-UHFFFAOYSA-N 405.502 2.470 10 20 HECD CC(C)c1cc(=O)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 762199876 XOHVXLSUFSFVLJ-HOTGVXAUSA-N 416.497 2.436 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(Br)cc([N+](=O)[O-])c1=O 767208445 KBKYGTDTBRJOPR-UHFFFAOYSA-N 423.267 2.244 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 767325766 YGSRGWYNIRVHFL-GGAORHGYSA-N 416.566 2.322 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cc3c(cc2O)CCCC3)CC1 768442001 NCQGXKSOHOXAIX-UHFFFAOYSA-N 405.520 2.382 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccccc3)cc2F)CC1 774326238 IBRBIICKNHMEKW-UHFFFAOYSA-N 412.509 2.242 10 20 HECD COCc1c(Br)cccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774363702 KIWZFNGFUKKEBU-UHFFFAOYSA-N 423.263 2.304 10 20 HECD COc1ccc(CCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 774536880 JFSLKNIJRRSBSI-UHFFFAOYSA-N 411.502 2.101 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1F 774959808 DGZCRGODPIMMTF-OAQYLSRUSA-N 412.509 2.461 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](C(=O)O)c1ccccc1 780607521 DKWZIZDJZQPVDT-LJQANCHMSA-N 401.438 2.412 10 20 HECD C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)NC1CC1 785413967 RPXCTTWGPHNJKM-SNVBAGLBSA-N 410.473 2.078 10 20 HECD COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786258396 DMPWIMPVLDYDPM-UHFFFAOYSA-N 412.446 2.202 10 20 HECD O=C(NCc1ccc2c(c1)CCO2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788345344 YPVSEANSFFIAFH-IBGZPJMESA-N 410.470 2.151 10 20 HECD COc1ccc(Cn2cc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cn2)cc1 792947843 FOTISSFVCMBJPM-UHFFFAOYSA-N 407.474 2.261 10 20 HECD O=C(Nc1cnc(CC2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 792959861 RJSAUQHJDKRLOW-SFHVURJKSA-N 410.474 2.281 10 20 HECD CC(C)NS(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249784 VTTOWCTWLFZDMX-MRXNPFEDSA-N 400.545 2.151 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1 797432925 YQJVIIUWKYNXMC-UHFFFAOYSA-N 409.411 2.382 10 20 HECD CCN(CC)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805019395 GESYFYXBBDEJKE-OAQYLSRUSA-N 400.567 2.482 10 20 HECD CCOC1CC(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 805169105 VWPDFHPLHNUVGI-UHFFFAOYSA-N 413.497 2.374 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(CCc2cccs2)CC1 807289926 NCBBLZIREJUQLS-UHFFFAOYSA-N 424.570 2.127 10 20 HECD Cc1nccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 919466731 HPGJZCVTUTZWHI-UHFFFAOYSA-N 401.378 2.356 10 20 HECD CCOC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 920088679 HQMIMBPJDABTPX-IYBDPMFKSA-N 421.513 2.083 10 20 HECD CN(C)[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1321731003 URGKHFONZXDHOV-YZGWKJHDSA-N 401.555 2.060 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CCC2(CC1)OCCO2 1326199357 FWLCPTXYMOEIEA-INIZCTEOSA-N 407.463 2.012 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc(OC)c(O)c1 1331881785 SKKFAQABDWCYAY-AJHXJQRKSA-N 401.415 2.116 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)Cc3nnc4n3CCC4)cc2F)C[C@@H](C)O1 1337618938 FPVFSXAWRHEHFU-HUUCEWRRSA-N 416.501 2.319 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1CCCS1 1804291914 YIMOMONULHNYNM-RGYYZVTFSA-N 418.515 2.350 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807764073 SPGKSGDBRSMFEN-XQSDOELASA-N 410.474 2.254 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)no1 1826049360 WQFNVKJZXGMSGX-QGZVFWFLSA-N 414.462 2.336 10 20 HECD O=C(c1cnn2c1CCC2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502057 JKCPUZSOECRZCV-UHFFFAOYSA-N 416.865 2.025 10 20 HECD Cc1cc(C(=O)CSc2nccn2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 6360490 RIRBZMCIXPLNMS-UHFFFAOYSA-N 404.517 2.450 10 20 HECD COc1cc(N2C[C@H](C(=O)NCc3ccccc3O)CC2=O)cc(OC)c1OC 109677877 DIFSKLOAUSFCIS-CQSZACIVSA-N 400.431 2.087 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@H]3CN(CC(C)C)CCO3)CC2)cc1 110419669 XBWXRRBZYNIOIM-NRFANRHFSA-N 404.555 2.320 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cnn(CC(F)(F)F)c2)n(C)c2ccccc12 573037161 MPBKHTNGNYFMSA-UHFFFAOYSA-N 407.396 2.178 10 20 HECD O=C(c1cccc(NS(=O)(=O)c2cccc3nsnc23)c1)N1CCC[C@@H](O)C1 625085839 IVFUMJMKKALFIP-CQSZACIVSA-N 418.500 2.089 10 20 HECD CC(=O)NC1CCC(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 725876540 QTWAGYRMRRQSJI-UHFFFAOYSA-N 402.539 2.142 10 20 HECD CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1cnn(C)c1 726070687 FMZHWWOYIDKNJG-IAGOWNOFSA-N 417.529 2.311 10 20 HECD NC(=O)CN1C(=O)/C(=C\c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)SC1=S 727177290 ZFYINANCXFQPRM-NTEUORMPSA-N 406.489 2.272 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CC[C@H]2NC(=O)NC2=O)cc1 732114667 KIPNURZRHIXBSW-LJQANCHMSA-N 410.474 2.283 10 20 HECD Cc1cc(C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c(C)n1-c1ccc(F)cc1 734466460 AVZWIHCBJHELBP-FQEVSTJZSA-N 414.525 2.370 10 20 HECD O=C(NC[C@@H](O)C1CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 737049958 SCGLRYVUPOHRQS-GOSISDBHSA-N 413.465 2.344 10 20 HECD CN(C)c1ccc(CNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1F 740702107 LZTFHCPMIOVMBW-NDEPHWFRSA-N 406.479 2.477 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594391 ULIAIDZEEBEBGN-SZVBFZGTSA-N 424.492 2.419 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1ccc2c(c1)NC(=O)C2 752755093 KZIAVWKUACTQQE-UHFFFAOYSA-N 402.834 2.285 10 20 HECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@H]1C 754506560 DWMRUTHSWNINPH-CYBMUJFWSA-N 409.533 2.421 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)cc2)CC1 754937657 LIIASTXPYVLGLS-UHFFFAOYSA-N 419.489 2.154 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)co1 755789087 INHRUIOCWXUACH-GOSISDBHSA-N 421.519 2.075 10 20 HECD COc1ccc(O)c([C@@H](C)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)c1 757621396 OQYMKXUNKSZJFV-CQSZACIVSA-N 406.508 2.051 10 20 HECD CN(C[C@H](O)C1CC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 757623290 MFMBBVBLQMUKOG-KRWDZBQOSA-N 401.429 2.454 10 20 HECD CCO[C@H]1COCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 759206207 APWDQVCSYPOWNT-SJORKVTESA-N 424.409 2.294 10 20 HECD CC(C)C[C@@H]1CCC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 760369733 OZHPCINTNRNIDY-KRWDZBQOSA-N 419.497 2.090 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1C 760542114 VAEQFQPRAWGNMT-HNNXBMFYSA-N 421.519 2.078 10 20 HECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H](C)CN1C 770161571 GPWPVRMGWHVLGG-QWHCGFSZSA-N 409.533 2.419 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC3(CO)CCCCC3)cc2F)C[C@H](C)O1 776592061 XTUSZAGMCLOEIK-IRXDYDNUSA-N 407.530 2.340 10 20 HECD O=C(NCCN1CCCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 782972238 PSFSODQBLWFQNB-INIZCTEOSA-N 412.481 2.278 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(C)(C)S(=O)(=O)C3CC3)cc2F)C[C@@H](C)O1 785885263 AUXYLNPDKMLMPP-ZIAGYGMSSA-N 412.527 2.411 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C2CCN(C(=O)OC)CC2)cc1 788951054 GMZQGOFMSKQPQM-INIZCTEOSA-N 418.538 2.132 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc[nH]1 789826398 PWWHUSJMAZQTIP-KFWWJZLASA-N 402.470 2.261 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 798135237 NZLZUBAGDORJLE-UHFFFAOYSA-N 404.536 2.061 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C 801611478 HQQJJERJDDMCQS-UHFFFAOYSA-N 411.462 2.172 10 20 HECD CC[S@](=O)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803471487 CPCXZWVKWBISSX-AOAWJKDVSA-N 413.451 2.101 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2ccccc2C1 803664647 PIAJTEZSMJDQGM-INIZCTEOSA-N 412.509 2.071 10 20 HECD CCC1(CNC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1 803746770 LACOZMJLPUYNBT-UHFFFAOYSA-N 416.566 2.020 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCC(=O)N2CCCCCC2)C2CC2)cc1 804080738 NXPYWYQGKQWYPO-UHFFFAOYSA-N 414.550 2.153 10 20 HECD Cc1nn[nH]c1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805546759 QGGSGQWQDGVACC-LLVKDONJSA-N 404.382 2.073 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cnn(CC(F)(F)F)c1 807385376 JMYPLJYYXGQXRQ-UHFFFAOYSA-N 421.173 2.168 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 814994690 WGLCZEMLGJEYKW-OAGGEKHMSA-N 400.516 2.285 10 20 HECD CN1CCCc2cc(CNC(=O)c3cnn(C)c3I)ccc21 815151038 JIRYCCASZDVGCX-UHFFFAOYSA-N 410.259 2.337 10 20 HECD CCC[C@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971246 NHHWKBBIDRFXRA-RDJZCZTQSA-N 405.514 2.440 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(SC)ncc1Cl 1116669032 CMPMQYMDAOONGP-NSHDSACASA-N 411.867 2.167 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccncc1 1796932517 GSKZBUZWNXBYBC-GGPHIMKMSA-N 417.469 2.126 10 20 HECD CCN(C)[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831073713 STIWIIJQNDTAOK-YJBOKZPZSA-N 418.538 2.066 10 20 HECD CC(C)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838032388 RBGKGATZVJSIFR-ONEGZZNKSA-N 417.506 2.317 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 7120320 PFWGPZDSDPGZEY-QGZVFWFLSA-N 401.507 2.045 10 20 HECD CCOC(=O)CCCNC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 10877115 XFFPYKJDSBUCGP-UHFFFAOYSA-N 423.421 2.078 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(Cn2cccn2)c1 147120377 GOPZFDZXWSADFU-UHFFFAOYSA-N 419.485 2.023 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 437021336 DXVQSRNPJIMHES-UHFFFAOYSA-N 423.922 2.452 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C(=O)OCc3ccccc3)nc12 731668210 HXSGZVKOWQKTLM-GOSISDBHSA-N 424.457 2.319 10 20 HECD NC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 732432856 TZXGDTCUHUPSBK-UHFFFAOYSA-N 404.417 2.347 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1 732704830 ZUIKAGZYJKEOTL-LBPRGKRZSA-N 415.421 2.483 10 20 HECD COc1ccc2[nH]cc(CCNC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2c1 733364708 QBGQFHUTPXNWSH-UHFFFAOYSA-N 403.460 2.226 10 20 HECD O=C(C[C@H]1OCCc2ccccc21)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 734423368 NWHLHMFTIBMWIA-OAQYLSRUSA-N 414.527 2.242 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1O 737285925 NGUUCFSVAGABOE-UHFFFAOYSA-N 415.515 2.205 10 20 HECD O=C(NCCCN1CCN(c2ccncc2)CC1)NCc1ccc(N2CC=CC2)cc1 740911184 DJZBEOVNQAUHOW-UHFFFAOYSA-N 420.561 2.469 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(N(C)C(C)=O)cc3)CC2)cc1 742266421 KTZQWXUSPBVKSF-UHFFFAOYSA-N 403.504 2.189 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(CS(C)(=O)=O)cc3)CC2)cc1F 753738852 MCWQLRIXYQCLEY-UHFFFAOYSA-N 406.479 2.341 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753884368 SQABEWWSOLGCTO-UHFFFAOYSA-N 422.482 2.097 10 20 HECD CC(C)(CNCc1ccc(N2CCS(=O)(=O)CC2)cc1)NC(=O)OC(C)(C)C 759153391 GLLOAMSIGAWNJQ-UHFFFAOYSA-N 411.568 2.314 10 20 HECD COc1c(F)cc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 761023954 AOYJZHDTXCKDGG-UHFFFAOYSA-N 423.391 2.204 10 20 HECD COc1ccc(N2CCN(C(=O)CN(CC(=O)OC(C)(C)C)C(C)C)CC2)cc1 766267969 BLNJQBQHVQUYMX-UHFFFAOYSA-N 405.539 2.396 10 20 HECD Cc1cc(C(=O)COC(=O)C2(C(N)=O)CCC2)c(C)n1-c1ccc2c(c1)OCCO2 769098815 IZXKERSWEMTZEG-UHFFFAOYSA-N 412.442 2.247 10 20 HECD CCNc1ncc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 770100075 SCHAMMRPSJKPRZ-UHFFFAOYSA-N 422.482 2.024 10 20 HECD CS(=O)(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Cl)s1 770638076 WUPMSKGRNXSPCI-UHFFFAOYSA-N 411.866 2.010 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)CCNC(=O)OCc2ccccc2)cc1F 771741483 BJYYROSXLIBOPV-UHFFFAOYSA-N 409.483 2.238 10 20 HECD CCN(CC)C(=O)CN1CCCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773619681 NOQITFHEGIKAMP-SFHVURJKSA-N 403.571 2.399 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccnc(N(C)C)n3)cc2F)C[C@@H](C)O1 775727478 SUJVMBLSOFXVRY-GASCZTMLSA-N 416.501 2.295 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1COCCN1CC(F)F 776668123 NCGOULRZGVTUGL-CYBMUJFWSA-N 407.255 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc4ccccc4[nH]3)CC2)cc1 778269576 NQDLDHFHMWEDTB-KHPPLWFESA-N 419.485 2.093 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)NCCCSc3nccs3)c(F)cc2N1 778644618 FAGRRJGNYMRCOB-UHFFFAOYSA-N 408.480 2.404 10 20 HECD C[C@@H](CO)N(C[C@@H](C)O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 785873002 RTTBSCJJLJHXPN-UONOGXRCSA-N 401.454 2.030 10 20 HECD COC(=O)c1ccccc1CCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786261414 FQANYQMCGDCILY-UHFFFAOYSA-N 423.513 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCN3C3CCCC3)CC2)cc1 786884433 PPXGVSAUGGJPGQ-NRFANRHFSA-N 415.534 2.294 10 20 HECD CN(Cc1ccc(F)cc1F)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311034 OYNVGKUDFKTKGT-UHFFFAOYSA-N 403.429 2.076 10 20 HECD O=S(=O)(C[C@H]1CCCOC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792757507 MMXRXOYVSKGERO-YOEHRIQHSA-N 402.944 2.356 10 20 HECD COCCn1cc(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 799887275 RVMFCZXVPQLOPQ-IYBDPMFKSA-N 419.501 2.282 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 806276650 HQRJEVYWCVMYSH-ZDUSSCGKSA-N 420.564 2.143 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@H](C)NCc2ccc([N+](=O)[O-])c(OC)c2O)s1 809721037 LODDHLNLJNUJAR-ZJUUUORDSA-N 409.468 2.476 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(Cc2cccc(Br)c2O)CC1 809729774 ZFPFYPVFRJYMLH-QGZVFWFLSA-N 404.308 2.499 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 918305447 IBHINNQRRISCIB-UHFFFAOYSA-N 403.504 2.062 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2C1 919793949 AHOWGSODFAYTDB-FQEVSTJZSA-N 409.486 2.484 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCO2)c1cc(O)nc(O)c1 1803524659 XXADGQQPZQODTH-BCDXTJNWSA-N 423.469 2.383 10 20 HECD Cc1ocnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804289038 UKXJKYIGNQCCBV-PLCSWTFUSA-N 413.430 2.065 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 65715786 JYPQYXFYVPKJFQ-HNNXBMFYSA-N 413.474 2.356 10 20 HECD CSc1nc(C)c(CCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(=O)[nH]1 109180088 DBUXWUYLWMPCEZ-AWEZNQCLSA-N 416.547 2.447 10 20 HECD Cc1ccc(C(=O)OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)c(O)c1O 109997625 CHDYEENXCHMKGN-UHFFFAOYSA-N 402.447 2.358 10 20 HECD O=C1CSc2ncnc(N3CC=C(CCN4C(=O)c5ccccc5C4=O)CC3)c2N1 684598407 XEIUYQPZYBFYSQ-UHFFFAOYSA-N 421.482 2.344 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 728985444 WLZUKXCEPBEPQR-IRXDYDNUSA-N 418.515 2.251 10 20 HECD NS(=O)(=O)c1ccc(OCCN(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731845025 UGAGPUCPBWOHLQ-GOSISDBHSA-N 406.504 2.100 10 20 HECD Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738880364 AAPRWCNTNZSLRP-UHFFFAOYSA-N 418.475 2.460 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)[C@@H](C)c3ccc(C)cc3)nc12 745755548 ZTFHRDWDUORIRJ-UGSOOPFHSA-N 413.430 2.128 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3CN3CCOCC3)c2)CC1 746290254 XVQXCLQVDQSLSY-UHFFFAOYSA-N 422.529 2.473 10 20 HECD CCCCn1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 746354068 CKWIAJLHDXLDSO-UHFFFAOYSA-N 417.485 2.222 10 20 HECD O=C(NCC1(CO)CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 749189550 WUXXRIIJRHMVAD-UHFFFAOYSA-N 413.465 2.345 10 20 HECD Cc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1C(N)=O 751136406 IKTYIFLYZIPXSK-MRXNPFEDSA-N 404.488 2.169 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3occc3Br)nc12 751704861 UQUIXVVICPUVJS-UHFFFAOYSA-N 410.180 2.324 10 20 HECD CC(=O)N1CC[C@H](CN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 755046669 QZAXARLNEMMBNG-MRXNPFEDSA-N 419.481 2.201 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC3CC(C)(C)NC(C)(C)C3)CC2)cc1 758185107 IFLDAVNDZIZIRF-FQEVSTJZSA-N 404.599 2.077 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(F)c3)cc2F)C[C@@H](C)O1 759428790 CMLGYEKUAAXTCG-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD COc1c(F)cc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 761050739 XWZCPHUWMPDAAK-UHFFFAOYSA-N 405.401 2.065 10 20 HECD CCCn1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 762415003 XADDGUYHPDQKAD-GASCZTMLSA-N 417.485 2.301 10 20 HECD CCC1(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CCOCC1 771083828 SXZSNPUIMCTTSM-UHFFFAOYSA-N 414.506 2.428 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O 773745050 ISVNRRUBPYDUCQ-ZSEKCTLFSA-N 403.479 2.036 10 20 HECD O=S(=O)(NC1CCCC1)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 781919566 DKJWJNQXSSNMOE-OAQYLSRUSA-N 407.580 2.350 10 20 HECD O=C(COC(=O)c1cc2ccccn2c1)NCc1ccc(N2CCOCC2)c(F)c1 785995746 ANZBRYLAZVYQOK-UHFFFAOYSA-N 411.433 2.388 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccn(-c4ccccc4)n3)cc2)CC1 786257595 REQMSZAKFTWBNR-UHFFFAOYSA-N 403.486 2.471 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3n[nH]c4c3CCCCC4)CC2)cc1 789173966 YAFYYDLIXYRXBP-UHFFFAOYSA-N 412.490 2.193 10 20 HECD C[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837290 YKPHWZTYTNMRAB-HNNXBMFYSA-N 414.481 2.018 10 20 HECD COC(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 792410419 XLAFFEBVGGQQQY-UHFFFAOYSA-N 412.490 2.328 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)N(C)CC(F)(F)F)cc2F)CC1 793456812 YMUVKDSCVPVXJB-AWEZNQCLSA-N 404.452 2.466 10 20 HECD COc1ccc(CNC(=O)CNC(=O)c2ccc(OC(F)F)c(OC)c2)c(O)c1 794376996 OQPAIPGZMWUCFU-UHFFFAOYSA-N 410.373 2.057 10 20 HECD Cc1cc(C(=O)CN(C)[C@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796203447 OIIGZYDKLOTPFT-KRWDZBQOSA-N 405.520 2.035 10 20 HECD COc1cc(NS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)ccc1O 797820215 LUDQOJMVADSRBM-UHFFFAOYSA-N 409.376 2.066 10 20 HECD C[C@@](O)(CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 801138398 WNDHZVBBDCCLCC-HYBUGGRVSA-N 409.530 2.388 10 20 HECD CN(Cc1ccc2c(c1)OCCO2)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685935 PMJGYAQDLBBCPT-UHFFFAOYSA-N 409.486 2.115 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1 807795805 LFZAGPQGJNYQKG-OAHLLOKOSA-N 418.393 2.246 10 20 HECD O=C(CNc1ccc(-n2cnnn2)cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 916573272 JUJUHISOGBAPMQ-UHFFFAOYSA-N 424.420 2.488 10 20 HECD Cc1csc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 918225009 ZNCFYOGHONBPDW-UHFFFAOYSA-N 419.526 2.459 10 20 HECD COc1ccc(C[C@H](CO)CNCc2ccc(N3CCN(C)CC3)c(F)c2)cc1O 1323761651 QXGVGBUQQRHCRV-IBGZPJMESA-N 417.525 2.233 10 20 HECD CO[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791635222 KXPLQIQWZJFADX-LBPRGKRZSA-N 421.544 2.016 10 20 HECD COc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603584 SWQHPJIUAYKTKU-QDMKHBRRSA-N 415.421 2.206 10 20 HECD COc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251306 RNPWOEAACIOLCZ-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1cc(C(=O)Cn2nc(C(N)=O)ccc2=O)c(C)n1-c1ccc(F)c(Cl)c1 726365469 MPGWAUABYBQBNS-UHFFFAOYSA-N 402.813 2.425 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3CCCN(CC)C3)cc2F)CC1 730126924 VSGPYMBGQFWZHA-LJQANCHMSA-N 405.562 2.499 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 730808978 UVUYSFGWHGZXMH-ZIFCJYIRSA-N 407.530 2.414 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1C(N)=O 732433307 HYPIREIQDQZIOR-MRXNPFEDSA-N 409.490 2.117 10 20 HECD CC(C)C[C@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 733846900 AGFANPCOZHPKJY-QUCCMNQESA-N 402.539 2.345 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1 734074900 XTHQLFNAFYADHA-UHFFFAOYSA-N 411.458 2.200 10 20 HECD COc1cccc(C[C@H](C(=O)NCc2ccc(N(C)C)cc2C)n2nnnc2C)c1 734402709 OYNNEHOJRWVODJ-OAQYLSRUSA-N 408.506 2.465 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCCN(C)C3)CC2)cc1 734655160 KCEUQXWFZZBDCM-HXUWFJFHSA-N 417.598 2.191 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCCN1C(=O)CCC1=O 745806512 IPAPFFOAUMWINK-UHFFFAOYSA-N 412.284 2.225 10 20 HECD CCc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 747463766 RKPLFQMREVZAFU-ZIAGYGMSSA-N 415.469 2.047 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccccc3)[C@H](C)C(=O)OC)nc12 751033080 KZHBRAKXSQTWGC-UGSOOPFHSA-N 412.446 2.252 10 20 HECD CCC(CC)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC 752221794 NIVVFLHCQGCGFR-KRWDZBQOSA-N 418.538 2.167 10 20 HECD COc1cc(N2CCN(C(=O)NCc3cccc(F)n3)CC2)cc(OC)c1OC 759293464 MRTDKFYPIHODHB-UHFFFAOYSA-N 404.442 2.278 10 20 HECD COC(=O)C1CCN(C(=O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C(C)C)CC1 759597857 TULJUFVJWXHQJN-WSSFADSRSA-N 405.447 2.090 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OC)c(Cl)n3)CC2)cc1 766790547 MSGSAARDSVQNIC-UHFFFAOYSA-N 419.865 2.258 10 20 HECD COc1cccc(CN2CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)c1O 769192664 PLUDOPQOEMSAGI-MRXNPFEDSA-N 407.511 2.254 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCN(C)C3CC3)cc2F)C[C@@H](C)O1 770686255 XBCVKRADALMOIU-IAGOWNOFSA-N 406.546 2.082 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771058129 LLHVZGCRRZJOTJ-MRXNPFEDSA-N 404.898 2.359 10 20 HECD CCCc1cc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n(C)n1 772592162 PBYMDIVCMWITFK-UHFFFAOYSA-N 400.527 2.325 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSc1nnc2ccccn12 782772952 GVGPHZJCUIRMEQ-UHFFFAOYSA-N 420.878 2.382 10 20 HECD CCCNC(=O)[C@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413971 RRVLUHSBHMTSTE-NSHDSACASA-N 412.489 2.326 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3cccnc3N(C)C)cc2)CC1 787631004 GLTDTRBBRXHMJM-UHFFFAOYSA-N 409.534 2.317 10 20 HECD COC(=O)CCNC(=O)c1ccc(NC(=O)NCc2ccc(OC)cc2O)cc1 797611769 ZXBCSTGZNRLFDZ-UHFFFAOYSA-N 401.419 2.015 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 803297950 KWJJCNKZBZLESF-HNNXBMFYSA-N 416.909 2.407 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCOC[C@@H]2CCCO2)cc1)C1CCCCC1 803559055 ONJRCFYECQJSGV-NRFANRHFSA-N 417.550 2.384 10 20 HECD CCOCCCN1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 806225564 RHLLSHSFFKXGDR-UEXGIBASSA-N 418.582 2.183 10 20 HECD Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289914 MTYFQDDFLIQVTR-RTWAWAEBSA-N 417.513 2.259 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(N2CCC2=O)cc1 807387231 FCBFSPADGBFWIC-UHFFFAOYSA-N 418.247 2.146 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807674747 QDRCTRMOUSRUQR-ZHALLVOQSA-N 416.566 2.473 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)[C@@H]1CCCN(C(=O)OC)C1 808033163 IEAWDKFPKGVZIM-JKSUJKDBSA-N 405.495 2.114 10 20 HECD Cc1cc(CCNC(=O)N2CCC(S(N)(=O)=O)CC2)c(C)n1-c1ccccc1 811995673 UDUAOFXVEQMVRA-UHFFFAOYSA-N 404.536 2.099 10 20 HECD CCN1CCC(N2CCC(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)CC1 816897988 QKGORXGYBMKONE-UHFFFAOYSA-N 414.594 2.336 10 20 HECD CN1C(=O)c2ccc(S(=O)(=O)Nc3nc(-c4cccnc4)cs3)cc2C1=O 861897505 POJSNFJRLGMTKQ-UHFFFAOYSA-N 400.441 2.232 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)OCCO4)cc2F)C[C@@H](C)O1 918220554 KZFGGVUCFWCPDS-IYBDPMFKSA-N 407.486 2.488 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)C2CC2)cc1 919665011 NTCQLAATSFLVDW-UHFFFAOYSA-N 408.458 2.213 10 20 HECD CCC(C)(C)NC(=O)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 920635097 CKGPYLJXSXUFET-OAHLLOKOSA-N 400.497 2.250 10 20 HECD CC(C)CN1C(=O)/C(=C/NC[C@H](c2ccccc2Cl)N(C)C)C(=O)NC1=S 920980371 KXTGFYJQKWAPEK-SCZPIIQISA-N 408.955 2.316 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(Br)c1O 1116669578 VARHPTWSTXAZAL-ZDUSSCGKSA-N 424.247 2.470 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3N3CCCC3=O)nc12 1337704063 YDJDXZZOSUCSBZ-UHFFFAOYSA-N 424.413 2.095 10 20 HECD CCN1CCC(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1847111879 HUQJZNHGCBJJBS-UHFFFAOYSA-N 421.925 2.300 10 20 HECD CCn1c(=O)[nH]c2cc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)ccc2c1=O 110354719 VQQMOURVDPAZNX-UHFFFAOYSA-N 422.485 2.117 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H](CN1CCOCC1)c1ccccc1 216032730 MXNLKEMMUGLWMM-QHCPKHFHSA-N 410.562 2.374 10 20 HECD COCCO[C@@H]1COCC[C@H]1NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 485543418 JLCYCSLAWHRTPP-TZIWHRDSSA-N 404.507 2.455 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC[C@@H](NC(=O)C(C)(C)C)C2)n(C)c2ccccc12 567266397 AMFMSAVUMYYOTI-MRXNPFEDSA-N 412.534 2.256 10 20 HECD CN1CCCc2cc(CNC(=O)NCc3ccc([C@]4(C)NC(=O)NC4=O)cc3)ccc21 726250598 ZXEBNKKXIMAFRN-QHCPKHFHSA-N 421.501 2.123 10 20 HECD COCCCN1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 727034274 PGAULCMWYGEPOL-UHFFFAOYSA-N 422.545 2.087 10 20 HECD CN1CCN(S(=O)(=O)c2ccc(NNC(=S)Nc3ccccc3F)cc2)CC1 727979134 HSEYDLSROQOLKS-UHFFFAOYSA-N 423.539 2.075 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(N(C)C)nc3)cc2F)CC1 730116291 AWQMQJIESCEJDP-UHFFFAOYSA-N 414.529 2.428 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](N(C)C)C3)cc2F)C[C@@H](C)O1 732205315 OJPIMTWNHMHWSG-SCTDSRPQSA-N 406.546 2.082 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1C(N)=O 732433306 HYPIREIQDQZIOR-INIZCTEOSA-N 409.490 2.117 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCCn3ccccc3=O)cc2F)CC1 735011001 MUGHMFJQXOYXJD-UHFFFAOYSA-N 400.498 2.226 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)o2)cc1 740812794 BJILBZXWZPFIIX-UHFFFAOYSA-N 416.477 2.409 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(N2CCOC2=O)c1 741099889 LEQFMYGKSUYAGD-UHFFFAOYSA-N 406.442 2.274 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1F 741099890 LFGFCHQBEVECTD-UHFFFAOYSA-N 413.449 2.482 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N(CCO)CC1CC1 745610382 WNHZNSIFNQMKPU-UHFFFAOYSA-N 401.429 2.456 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1 747563774 YFNSFLLEHXADIB-UHFFFAOYSA-N 400.527 2.383 10 20 HECD CCNC(=O)NC1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCC1 749407691 WXAOLRXFCXUYHS-UHFFFAOYSA-N 406.502 2.035 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3cc(F)ccc3F)CC2)c1 750252134 ZRKHIYZVYJZKCC-UHFFFAOYSA-N 411.430 2.004 10 20 HECD COc1ccc(N(C)CC(=O)N(CCC(N)=O)c2ccccc2OC)c(OC)c1 752117119 UHHAYFARFCTTRX-UHFFFAOYSA-N 401.463 2.057 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(CC1CCCCC1)c1ccccn1 752863907 OIMWERIGTBCMCY-UHFFFAOYSA-N 400.504 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(C(=O)C4CC4)CC3)CC2)cc1F 753832724 DTLLSKPTICSBED-UHFFFAOYSA-N 404.486 2.067 10 20 HECD CCC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 759421849 NPPLGNXZKPOZKG-GOSISDBHSA-N 419.547 2.425 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763877537 JYWWLNVNAFKINN-MLNJSSBLSA-N 410.495 2.101 10 20 HECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)N(C)Cc1ccc(N(C)C)cc1 768269702 KVGAMXGXJDURHE-IBGZPJMESA-N 420.554 2.377 10 20 HECD Cc1ccncc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769024787 QWNGHQZEYLCTMC-UHFFFAOYSA-N 407.518 2.177 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 772477429 RMLVMHUBMIFGOO-IBGZPJMESA-N 419.485 2.291 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cn3)cc2F)C[C@@H](C)O1 772926268 ABRQLXJHXFCHTA-BETUJISGSA-N 404.417 2.228 10 20 HECD COc1ccc(N2C[C@@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)c(OC)c1 773741769 XRUVKSKUOCVKRO-ZFWWWQNUSA-N 414.458 2.215 10 20 HECD C[C@H](NCC1=Nc2ccccc2S(=O)(=O)N1)c1ccc(N2CCOCC2)cc1 775257979 NSYROAACFPJIPM-HNNXBMFYSA-N 400.504 2.196 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C[S@@](C)=O)c3ccccc3)CC2)cc1 775616456 BRZOBXCWFVHKEA-KCWXNJEJSA-N 415.559 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nc4c(s3)CCC4)CC2)cc1 778227516 LIPWGIWLRXMLHV-KTKRTIGZSA-N 412.515 2.484 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCCCSc1nccs1 781535202 SYVAHWVYHLATPP-UHFFFAOYSA-N 409.489 2.175 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCCn1cnc2ccccc21 785412698 SXQUKFYXTIQJFW-UHFFFAOYSA-N 403.533 2.298 10 20 HECD Cc1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ncn1 786110630 OZHUFECSUWUEHR-UHFFFAOYSA-N 401.378 2.356 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786122555 SWCKBFYQAKSKRL-UHFFFAOYSA-N 415.515 2.036 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3n[nH]c(C)c3Br)cc2)CC1 787321026 CJFAIWVQGUPPFS-UHFFFAOYSA-N 420.311 2.079 10 20 HECD COc1ccc(N2CCN(C(=O)COc3cccc(-c4ncn(C)n4)c3)CC2)cc1 788790676 XIUCLVXRJHQITB-UHFFFAOYSA-N 407.474 2.218 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1 788909976 JHYNVQRSNYLMDX-QGZVFWFLSA-N 413.440 2.473 10 20 HECD Cc1cc(Br)cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)c1O 789557073 FWZUYUYTHUYHON-UHFFFAOYSA-N 417.369 2.158 10 20 HECD C[C@@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797196 ABTKUFJVFWZPCP-CQSZACIVSA-N 417.506 2.486 10 20 HECD CCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccn1 789812934 QFFAPXMJMODOEO-LJQANCHMSA-N 414.481 2.331 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncc(-n2ccnn2)c1 801927849 DNSPPJQLLXXCKT-KRWDZBQOSA-N 412.881 2.416 10 20 HECD CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCO1 802684865 DXBIWHNXRMXORV-FQEVSTJZSA-N 415.538 2.467 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@@H](Cc2ccncc2)C1)c1ccc(N2CCOCC2)cc1 803304247 FNTWVJDGFKZVJP-ICSRJNTNSA-N 422.529 2.187 10 20 HECD COc1cnccc1[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807175892 WNNWRDKUKSGYLW-DOTOQJQBSA-N 413.474 2.181 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1C[C@H](OC)C1(C)C 809124177 XLPPKOFWOGFUQW-GJZGRUSLSA-N 413.312 2.433 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c1 815496496 KJERDHMILCGETK-BFUOFWGJSA-N 411.458 2.417 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](CS(C)(=O)=O)c1ccccc1 816825541 GKLLFKOZVPULKA-NRFANRHFSA-N 416.543 2.310 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccc(Br)cc1O 877845355 HLUYMSZFPSEHLL-QGZVFWFLSA-N 404.264 2.492 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC2CCN(S(=O)(=O)CC)CC2)cc1 916260005 XNKMZHZLICKLEW-UHFFFAOYSA-N 410.584 2.488 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3[S@](=O)CC)nc12 919032595 DCJLQTRCODVCQL-GDLZYMKVSA-N 417.443 2.096 10 20 HECD CCN(CC(=O)N1CCC(C(=O)N2CCCC2)CC1)c1ccc(OC)c(OC)c1 921062461 YSLGUIKJEMCXIJ-UHFFFAOYSA-N 403.523 2.391 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 1325406361 QKELTBZXGPORIF-UHFFFAOYSA-N 401.532 2.394 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(OC)c1ccccc1F 1343688510 RALFAANYOMEYMR-KKSFZXQISA-N 405.422 2.389 10 20 HECD O=C(c1ccc2scnc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250024 BZXUPSLIXQBVNC-UHFFFAOYSA-N 410.455 2.233 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 17114859 IZRNCEHJAUJIPB-UHFFFAOYSA-N 404.536 2.143 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 65715672 GHCVXXFUVWCMBU-CQSZACIVSA-N 401.438 2.487 10 20 HECD Cc1c(CNC(=O)C2CCN(c3ccc4nncn4n3)CC2)n(C)c2ccccc12 471221680 WQLRCGGORWDDJF-UHFFFAOYSA-N 403.490 2.457 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)cc1 730571864 VMACLRLRMUKQMV-SFHVURJKSA-N 418.563 2.090 10 20 HECD CC(C)c1ocnc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 732386509 PGPHYIOGVOWVER-UHFFFAOYSA-N 405.426 2.247 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCCCSc2nccs2)cn1 753588580 NFRBRJGVZNBBED-RMKBEBRYSA-N 413.594 2.357 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1C 754044539 CDVZZVCFGTZMNP-UHFFFAOYSA-N 422.478 2.440 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 754075748 QYHLEOOHRJAUOH-ILBGXUMGSA-N 424.589 2.167 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)CN3CCCCC3)CC2)cc(OC)c1OC 759280284 MIDQLXORCXOKIS-QGZVFWFLSA-N 420.554 2.418 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccc(N(C)C)c1 760870608 VJQDPLSFKOOIAG-UHFFFAOYSA-N 414.525 2.477 10 20 HECD Cc1cc(C(=O)CN2CCN3C(=O)CC[C@@H]3C2)c(C)n1-c1ccc2c(c1)OCCO2 766273392 XOJDVHDBHAKGDV-GOSISDBHSA-N 409.486 2.355 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cn1 769976263 UWKLRKROCWZKIE-UHFFFAOYSA-N 422.470 2.294 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(OCC(F)F)ccn3)cc2)C1 777950096 GHMXVXKHDXGAOI-OAHLLOKOSA-N 418.444 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(F)c(F)c3)CC2)cc1 778237539 PTDLWBGSLUJVES-HJWRWDBZSA-N 415.440 2.495 10 20 HECD COC(=O)[C@H]1[C@H](O)CCCN1Cc1cc(Br)cc(Br)c1O 783704110 JKAFQZYLANWXML-VXGBXAGGSA-N 423.101 2.416 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCCN1C1CC1 787140114 LRZVJRZFBDNBQQ-NRFANRHFSA-N 424.524 2.185 10 20 HECD CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)c3cccc(O)c3O)cn2)CC1 787334672 CELWQBPMLXYASE-UHFFFAOYSA-N 415.450 2.197 10 20 HECD CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312728 LMCCCLZIJZIPMP-ICSRJNTNSA-N 417.550 2.097 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)OC[C@@H]3C)cc2F)C[C@H](C)O1 789820427 QSEVOUJFFBJKMV-JYJNAYRXSA-N 421.513 2.081 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)CCc3cccs3)cc2)CC1 790048505 HYNBNODMCXEDOM-UHFFFAOYSA-N 407.561 2.079 10 20 HECD CN(C)c1ccc(CN2CCN(C(=O)C(=O)N3CCCC3)CC2)c(C(F)(F)F)c1 792788521 NTWMQUANKLESHK-UHFFFAOYSA-N 412.456 2.038 10 20 HECD CC(C)(C)n1ncnc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 800036104 LQLRVFMWUATYQJ-UHFFFAOYSA-N 400.527 2.241 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN(C2CCC2)C1 803686231 DGQPZJJAMSVLSI-FXAWDEMLSA-N 412.578 2.454 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](n3ccnc3)C2)cc1F 804852512 JITOZVXOLQHADA-QGZVFWFLSA-N 401.486 2.348 10 20 HECD CCc1cc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)on1 805745732 FYAMOFCYIHBGTI-AWEZNQCLSA-N 422.432 2.240 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 806279676 WHDANJCZLZXLLJ-JYJNAYRXSA-N 408.593 2.074 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 807095726 FXAIXEYAEWPMFA-INIZCTEOSA-N 418.538 2.145 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)CN1CCCC1 807665062 GGSYFIOXFXTATB-IBGZPJMESA-N 417.550 2.138 10 20 HECD Cc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(N2CCOCC2)c1 807672355 YAZXEMVKXHNJJO-GOSISDBHSA-N 424.545 2.391 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@H]1COC(=O)NC1CC1 810036884 VQIGIDXKKVUJIN-FQEVSTJZSA-N 402.539 2.454 10 20 HECD CCOCc1nc([C@H](C)NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)no1 812567833 KIFGOSSFEKBYSU-ZDUSSCGKSA-N 407.446 2.347 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(CCO)Cc3ccccc3)cc2)C1 918117960 LGYFGEQIVQZETE-HXUWFJFHSA-N 410.518 2.092 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1 918305460 IQKGSBFLSWMUTO-UHFFFAOYSA-N 408.502 2.472 10 20 HECD Cc1nc[nH]c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1797081708 DZPUWZGVGGMBSN-CLLJXQQHSA-N 404.854 2.348 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807764070 SPGKSGDBRSMFEN-HEERMSBFSA-N 410.474 2.254 10 20 HECD Cc1ncoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844092 PPMSQNWIARYXNL-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD COC[C@@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 23559827 SEXXZTKEMRJMQV-GFCCVEGCSA-N 405.426 2.251 10 20 HECD COc1ccc(N(CC(=O)c2c(O)nc(=O)n(CC(C)C)c2N)C(C)C)cc1F 725816590 ZKGGJFFQHOHVGX-UHFFFAOYSA-N 406.458 2.433 10 20 HECD COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 726611771 SRGYEHUMADKKQB-INMHGKMJSA-N 422.501 2.469 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4cccnc4c3N)nc12 731245438 GGYIFTWUADETAQ-UHFFFAOYSA-N 407.386 2.099 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCN(C)CC(F)(F)F)cc2F)CC1 732673511 KRHSNIQDBGAUIE-UHFFFAOYSA-N 419.467 2.261 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)c3cccs3)cc2)C1 741081419 QDSMWZRSUMWXPA-SJLPKXTDSA-N 416.547 2.373 10 20 HECD CCS(=O)(=O)N1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 745433475 KJBBZUPHECOEEK-UHFFFAOYSA-N 410.584 2.487 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cnc(C(C)C)[nH]3)CC2)cc1 747242538 YPGXWLFGNPRMQA-UHFFFAOYSA-N 421.567 2.032 10 20 HECD C[C@@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(Br)cc(F)c1O 756563844 OLSHHNOKALKAAP-LLVKDONJSA-N 402.308 2.497 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3n[nH]c(C(C)(C)C)n3)CC2)cc1 758189537 AWIHTBPIBJKQMX-MRXNPFEDSA-N 405.568 2.386 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@@H](N(C)C)C3)CC2)cc(OC)c1OC 759293352 KHRKTDAMECKNND-DLBZAZTESA-N 420.554 2.417 10 20 HECD COc1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1 761121347 NJUWBUWMZXSHCJ-YLJYHZDGSA-N 422.485 2.190 10 20 HECD O=C1[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCN1CC(F)(F)F 761735715 IERFYDZPTYTAHO-GFCCVEGCSA-N 419.787 2.363 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NCc2cccc(Br)c2O)C1 765746476 GUXUFRFWBGCRBR-CYBMUJFWSA-N 415.284 2.407 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCN1CCCS1(=O)=O 772838643 KDCKQGMKUIOTGV-UHFFFAOYSA-N 409.533 2.469 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1O 773305984 WKIJAXXUGHYDRZ-UHFFFAOYSA-N 416.384 2.334 10 20 HECD COCCCOCCN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 773745222 LVHDDEUOSKCOPT-UHFFFAOYSA-N 410.470 2.385 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 773757756 YZSJIFRMDHIUFX-CYBMUJFWSA-N 401.419 2.204 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1)c1ccc(N(C)C)cc1 773848367 WCOCKKYOBWUDBN-AWEZNQCLSA-N 403.504 2.113 10 20 HECD O=[N+]([O-])c1cc(CN[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)ccc1N1CCCCC1 776498173 IRJLHHIJYJVWKK-FXAWDEMLSA-N 423.535 2.411 10 20 HECD COC(=O)N1CCC([C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 776856555 NGMXNZNIAWXTPW-INIZCTEOSA-N 404.511 2.189 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@]3(C)CCCOC3)cc2F)C[C@@H](C)O1 781290996 RTWBDVCOUUMLDP-DMPWYTOCSA-N 422.497 2.415 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 785440630 AUODVQIYNYZCMO-SFHVURJKSA-N 409.534 2.308 10 20 HECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785445357 WXZZVAKPABZENU-MAUKXSAKSA-N 418.538 2.131 10 20 HECD CC(C)(NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCOCC1 787012822 DZYKHJGWGBNICR-QGZVFWFLSA-N 402.539 2.393 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 787453278 LXMMWNPPTZGJHR-UHFFFAOYSA-N 421.501 2.380 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(C)nc3-c3ccoc3)CC2)cc1 789262772 DYJBOHKEPPWMCG-UHFFFAOYSA-N 424.457 2.194 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCSCC3)cc2F)C[C@@H](C)O1 789811715 GJNYZHJWJVPBBD-GASCZTMLSA-N 409.527 2.021 10 20 HECD Cc1occc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789818701 KEHPYVZIRVILTF-KBPBESRZSA-N 403.454 2.273 10 20 HECD C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)c3cccc(O)c3O)cc2)C1 790544984 AIYUVQGDOKQJQY-AWEZNQCLSA-N 404.488 2.448 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccc4c3OCCCO4)ccc21 793748975 SBEIGEAIJGSSCO-UHFFFAOYSA-N 409.486 2.163 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCC(=O)N2 796765910 ZQHUQWREKORTPR-HNNXBMFYSA-N 415.515 2.103 10 20 HECD Cn1nccc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 802013181 WFBIYWOSWKEYGR-RBUKOAKNSA-N 424.549 2.211 10 20 HECD Cc1ccc(CN(CCO)C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)o1 805025670 SZDOHVMAXDIGKI-UHFFFAOYSA-N 413.518 2.462 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCN(c2ccccc2)CC1 807291799 OHYCHCLTKNPQGP-UHFFFAOYSA-N 404.514 2.418 10 20 HECD COc1ccc(CN2CC[C@@H](NCc3cc([N+](=O)[O-])ccc3O)C2=O)c(OC)c1 808423645 HCTGQPALSPLOKD-QGZVFWFLSA-N 401.419 2.208 10 20 HECD COC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 808789224 LBNYKFCFALNKSH-IBGZPJMESA-N 405.445 2.493 10 20 HECD CCC(CC)(CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)OC 817056440 DTIZUVKUTQHNNN-QXMHVHEDSA-N 403.523 2.221 10 20 HECD O=C(CSc1nccs1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 916153363 JDDRWWZTGKBMLB-UHFFFAOYSA-N 423.585 2.257 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1 916502430 KKCKDUZMEFJHTM-UHFFFAOYSA-N 421.519 2.077 10 20 HECD O=C(CNS(=O)(=O)c1cccc(F)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 917364631 LAZAKYKCWJPDCP-QGZVFWFLSA-N 422.478 2.017 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(OC)c(C(=O)O)c3)CC2)cc1 917759782 YVLUHPKDAJLUNR-UHFFFAOYSA-N 420.487 2.303 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCCc4nc(O)ccc43)cc2)C1 918119010 XNWALHUCUDRVDB-OXJNMPFZSA-N 423.517 2.366 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 1116421880 ZULPCTXOCPXRLB-LJQANCHMSA-N 419.522 2.370 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc2c(c1)CCCN2C 1116722575 MOZMTEQXBQBGEE-UHFFFAOYSA-N 419.459 2.242 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1CC1 1782847141 PEFQSXRXVFXKIF-OXQOHEQNSA-N 408.882 2.289 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(CO)CC1 1848082180 SCGIKPXSFLYGLF-SMELUJQZSA-N 422.909 2.365 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 140126982 PFYXNYQMJZCRQJ-OAHLLOKOSA-N 415.515 2.447 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc(-n4ccnn4)cc3)cc2)C1 727029838 CKSFBKBGIPDJFS-KRWDZBQOSA-N 419.489 2.291 10 20 HECD CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194801 DLTCMGYZJJVVAU-XMMPIXPASA-N 421.541 2.485 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCCN2C(=O)CCC2=O)cc1 750876052 XSMLMKNKJRNQSJ-IBGZPJMESA-N 401.507 2.189 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCc4ccccc43)cc2)C1 752656061 ZRBQIUOONPKFEU-DVECYGJZSA-N 422.529 2.022 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(C[C@H]4CCOC4)CC3)CC2)cc1F 753920285 URUYDANATBKOPY-QGZVFWFLSA-N 420.529 2.167 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cc1 754100526 PBIWHDGYXRCKNC-NJDAHSKKSA-N 414.550 2.074 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)cc1F 754213323 QYGCCSBIPKFIFH-UHFFFAOYSA-N 416.409 2.338 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCCCN2CCN(c3ncccn3)CC2)c1 756534945 NKUZAJNRDVCSTH-KRWDZBQOSA-N 413.522 2.222 10 20 HECD COC(=O)CS(=O)(=O)Cc1ccc(CN[C@H](C)c2cc(OC)ccc2O)cc1 756756668 JUNHUHJATVKOQP-CQSZACIVSA-N 407.488 2.339 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccc(F)cc3)CC2)cc(OC)c1OC 759876624 AUCVHMIHGVXDMD-UHFFFAOYSA-N 417.481 2.290 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)cc1 760656322 MUKAUFQHSOJSPX-KRWDZBQOSA-N 400.483 2.068 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)cc2)C1 760902804 ACAPYGOSINMFNL-VBSBHUPXSA-N 400.523 2.145 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1SCCS1 761147417 YAWZXDOQQRKPIN-UHFFFAOYSA-N 419.551 2.365 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3nc(SC)ns3)CC2)cc1 762952606 INPUCILVLBPWEI-UHFFFAOYSA-N 408.553 2.212 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccnc12 764196863 JXTDNIKYOBOVQN-INIZCTEOSA-N 424.457 2.433 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 768709687 FQAMDLDLMCCQFX-UHFFFAOYSA-N 423.878 2.413 10 20 HECD C[C@@H](Sc1nncn1C)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913278 XSKFYNJXRJNGBN-DOMZBBRYSA-N 409.943 2.436 10 20 HECD Cc1cc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 775467752 RBZACRKYWYIJBI-WMLDXEAASA-N 405.524 2.500 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)O)C3CC3)cc2F)C[C@H](C)O1 778215941 HCFDKSUDSDGAEZ-HOTGVXAUSA-N 407.530 2.291 10 20 HECD CCO[C@@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 780311045 DAXUZUUKQWHHCP-WIYYLYMNSA-N 409.502 2.028 10 20 HECD Cc1csc([C@](O)(CC(=O)OCC(=O)c2ccc(O)c(O)c2)C(F)(F)F)n1 783283664 HCWGWYWXBSINKX-OAHLLOKOSA-N 405.350 2.429 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)ccc1[N+](=O)[O-] 786263471 XRRHJFVDVMZOSZ-UHFFFAOYSA-N 412.446 2.202 10 20 HECD C[C@@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 787953003 LYQGLQWCIZVCFF-HRCADAONSA-N 417.481 2.396 10 20 HECD CC[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789840639 LUCWVBIOQSBUON-JOCHJYFZSA-N 405.514 2.442 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCCC1 793717327 FRLWMJYPQQGSMH-SFHVURJKSA-N 414.550 2.186 10 20 HECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccco1 793848089 SBLVDNFCRTWIEW-SFHVURJKSA-N 404.486 2.300 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](CCO)Cc1ccccc1 799553880 WGZKRKXOBKVQOV-LJQANCHMSA-N 401.482 2.455 10 20 HECD COc1ccc(N2CCN(Cc3noc(CNC(=O)OC(C)(C)C)n3)CC2)cc1 800328630 QQVNKBMUFZCMGQ-UHFFFAOYSA-N 403.483 2.425 10 20 HECD COc1cccc(CNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1O 802783113 ZRLBMJVYBSLIOB-INIZCTEOSA-N 404.467 2.359 10 20 HECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 803882231 PMXOGGZJDDACAU-GOSISDBHSA-N 408.546 2.274 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(F)cc1OC1CCOCC1 806959762 RCODJNWJXRGKRU-UHFFFAOYSA-N 418.421 2.092 10 20 HECD CNS(=O)(=O)N1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 809566772 SMMFNNYTMRRGEP-UHFFFAOYSA-N 416.507 2.122 10 20 HECD C[C@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 916834470 QEUHQCPEXWMWIX-FQEVSTJZSA-N 400.567 2.042 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCSCC1 917216426 LIQCCUKWPGWULY-UHFFFAOYSA-N 423.472 2.290 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309434 ZJAVOFJNXQVTPF-UHFFFAOYSA-N 410.474 2.079 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1 920019235 LURYFSFTMKFYOT-GUSDMMFLSA-N 420.513 2.172 10 20 HECD COc1ccc(CCNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 920254141 LBQIWQIXSWTZCU-VAWYXSNFSA-N 423.513 2.268 10 20 HECD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 920279955 UNZUXIDKNJINQC-UHFFFAOYSA-N 405.432 2.091 10 20 HECD C[C@@H](NC(=O)CNC(=O)c1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 920890306 VHYNLQVUFOVSPF-CQSZACIVSA-N 403.429 2.409 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H]4OCCC[C@@H]4C3)cc2)C1 1319343821 FHYOTGOUGBAQEE-GGPKGHCWSA-N 400.523 2.099 10 20 HECD CN1CCN(c2ccc(CN[C@@H]3CCN(c4ccccc4C(N)=O)C3)cc2F)CC1 1322747843 OLEXSLBCZFEYEE-GOSISDBHSA-N 411.525 2.045 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(NC(=O)C3CC3)cc2)c1 1324072511 VRNUZPXYBBZWMC-UHFFFAOYSA-N 403.460 2.042 10 20 HECD COC(=O)c1c(C)nn(C)c1NC(=O)c1ccc(NC(=O)C2=S=CC=C2)c(C)c1 1623459485 OPJXYCGQNZJSNG-UHFFFAOYSA-N 412.471 2.292 10 20 HECD CC(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786390284 PICIYHLTUWQFNW-JDFRZJQESA-N 410.898 2.391 10 20 HECD Cc1ccncc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598750 DRBLOISXQDKDMI-BCDXTJNWSA-N 410.474 2.081 10 20 HECD C/C=C/C=C\C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1800484963 CVZBEKHLENSPSO-PTSXGIFVSA-N 406.866 2.087 10 20 HECD Cc1[nH]ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818314891 WTOKQMZOUNGKSC-HNNXBMFYSA-N 410.434 2.472 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H]2C[C@H]2C2CC2)=NN1c1ccccc1 1847486019 FKZGQPQFUXBDNJ-ZULIPRJHSA-N 406.486 2.027 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2c(C)c3ccccc3n2C)n1 561628881 VFTXKAGYAXYWMT-AWEZNQCLSA-N 413.478 2.242 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(-c4ncon4)cc3)CC2)cc1 727038704 RPWPSQMOSHRWEH-UHFFFAOYSA-N 421.457 2.423 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cccc(O)c3)CC2)cc1 727056997 IIUUDRBIONLTJG-UHFFFAOYSA-N 412.534 2.455 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)cc1)C(=O)OC(C)(C)C 733952050 VYRVQAMHKOQYPR-UHFFFAOYSA-N 407.511 2.023 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(C(N)=O)(c2ccccc2)CC1 734486077 ADXXRHGZESRUIE-UHFFFAOYSA-N 408.546 2.230 10 20 HECD O=C(Nc1ccc(N2CCN(S(=O)(=O)C(F)F)CC2)cc1)c1cc(O)cs1 743675837 RYIURFIDJLIJBW-UHFFFAOYSA-N 417.459 2.380 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CSCCS3)CC2)cc1 752838640 NYERLROGLCAQTH-LJQANCHMSA-N 424.636 2.355 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 753042178 KXKBTYHHOQITLF-GASCZTMLSA-N 415.531 2.015 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccccc1CN1CCNC1=O 757924734 QBAKFZYKRGLGLD-UHFFFAOYSA-N 409.490 2.370 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(-n4ccnc4)cc3)CC2)cc1 758226049 XANHHNOEXNGFBZ-OAQYLSRUSA-N 408.502 2.443 10 20 HECD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN1Cc1ccccc1 758328938 WWKQAAAAQULADE-RHSMWYFYSA-N 403.504 2.157 10 20 HECD COc1cc(N2CCN(C(=O)Nc3cc(C)c(C)nn3)CC2)cc(OC)c1OC 759984452 WCWYHASOWUCPRN-UHFFFAOYSA-N 401.467 2.473 10 20 HECD O=S1(=O)CCCN1c1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1 763471408 UHLLPLNXHBXKRV-UHFFFAOYSA-N 419.522 2.492 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccn(CC(F)(F)F)n1 765902539 AAXBKCPLTSQOCR-UHFFFAOYSA-N 421.173 2.168 10 20 HECD C[C@@H](OC(=O)C[C@H]1COC(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767603375 UKPDEEFDWBJGDA-OLZOCXBDSA-N 421.405 2.285 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CCN([C@@H]2CCC[C@H]2O)CC1 767938336 WYRCRBNMLMOHGW-NHCUHLMSSA-N 418.607 2.417 10 20 HECD CN(C)c1ccnc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 770446409 ZBTLKNDERBTXSS-UHFFFAOYSA-N 408.485 2.410 10 20 HECD O=C1C[C@H](c2cccc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)c2)CN1 772481787 WBBNGOCOSMBOFP-INIZCTEOSA-N 407.470 2.129 10 20 HECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)c1C 775832803 CCRMKWASEQNPGF-OAHLLOKOSA-N 404.536 2.306 10 20 HECD COc1cc(OC)cc(N2CC[C@H](N(C)C(=O)c3ccc(C)c(O)c3O)C2=O)c1 780965005 ZASOOPKUBPFNGK-KRWDZBQOSA-N 400.431 2.301 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)C2CN(C(=O)C3CCCC3)C2)cc1F 781530781 XCFNVULPPLXISP-UHFFFAOYSA-N 411.543 2.492 10 20 HECD COc1ccc([C@H]2[C@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)CCC(=O)N2C)cc1 783683476 FDLILPWODMNTCN-IERDGZPVSA-N 413.426 2.442 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1Cc1ccccc1F 785294830 NYAIOMZVTGZVDS-CYBMUJFWSA-N 412.421 2.168 10 20 HECD CN(C)C(=O)CCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785823763 GEUGLBWYIVNTMT-UHFFFAOYSA-N 422.437 2.202 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc(Cl)c3)cc2)CC1 786121324 ZAFGMESBIIBELT-UHFFFAOYSA-N 407.923 2.487 10 20 HECD Cc1cccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)c1 788324071 RJJFPRPIALGQBB-NRFANRHFSA-N 407.514 2.464 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 788669220 RSLUUASLKLMQCY-HDICACEKSA-N 421.453 2.348 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](CO)c2ccc(OC)cc2)cc1 788975529 QCFSEHUWNFMBGP-NRFANRHFSA-N 413.518 2.350 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccccc4F)C[C@H]3C)nc12 789492947 BUTYBKNVDXCFGX-CQSZACIVSA-N 413.453 2.461 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NOC3CCCCC3)cc2F)C[C@@H](C)O1 789816622 DSGVJVMGXHTRIR-HUUCEWRRSA-N 407.486 2.436 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ncccn2)C1 790254577 KOSLPKGVHUPYQY-LJQANCHMSA-N 424.549 2.065 10 20 HECD CC(=O)c1cc(F)cc(CN[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 791622862 FOYMWHOWZOZUFW-LJQANCHMSA-N 417.485 2.044 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1 793904212 PZAYAHDLNGFJTN-UHFFFAOYSA-N 409.465 2.352 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CN1Cc1ccccc1 803664724 PQJJMZJSRZCIKC-QFBILLFUSA-N 412.509 2.287 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@H](Cc4ccccc4)C3)ccc21 803685348 DWURJVCYXNXDTE-NRFANRHFSA-N 407.514 2.155 10 20 HECD CC[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@H](C)S1(=O)=O 804990566 XXLXFCVLOMSGTC-TXPKVOOTSA-N 409.552 2.191 10 20 HECD Cc1nn(C)c(C)c1CCCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 807314101 XQHQCXSQXOWINL-UHFFFAOYSA-N 411.550 2.343 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807672312 XNOYBCPIDQBZQD-KSFYIVLOSA-N 403.523 2.368 10 20 HECD CCOC(=O)N[C@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 917461755 XCQSWSBNWZUQPS-FQEVSTJZSA-N 419.522 2.138 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/c3ccc4c(c3)OCO4)cc2)C1 917833930 VUJSXLXOMUKKCY-WGLAMXGCSA-N 407.470 2.447 10 20 HECD Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1NS(C)(=O)=O 918138779 SPBVNYQESBRKIZ-UHFFFAOYSA-N 421.494 2.272 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H]1CCN(CC(F)(F)F)C1 918208618 DDWBVBFNPSQKLE-OAHLLOKOSA-N 418.435 2.346 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(Cc2ccco2)CC1 918219891 QCEDUDUBUNVHCZ-UHFFFAOYSA-N 416.497 2.407 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3COc4ccc(F)cc4C3)cc2)C1 1320297236 NZPZFTKTICYADK-SJLPKXTDSA-N 411.477 2.395 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(Br)n1 1320691975 HJCKFRROGHKPCQ-LBPRGKRZSA-N 409.236 2.160 10 20 HECD O=C(O[C@H]1CCN(C2CC2)C1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1322174286 LGBZVAISPDCYIH-HNNXBMFYSA-N 422.484 2.175 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1cc[n+]([O-])cc1 1789952041 CCXPDXXEFWBVAU-UHFFFAOYSA-N 420.425 2.188 10 20 HECD Cc1cccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)c12 1796604253 VYQXHGPBOGJMSE-MUJYYYPQSA-N 421.457 2.015 10 20 HECD Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805612016 PBBVWGNHJLNDNH-QRWLVFNGSA-N 422.441 2.423 10 20 HECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c[nH]1 1808774851 HFAQZTYGECWNSD-QRWLVFNGSA-N 421.457 2.158 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1 1822569381 RKUFYGKMIXKXPR-JTQLQIEISA-N 415.784 2.353 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)Nc3cccc(C(C)=O)c3)nnc2n1 103535378 OFJPKCKDKAYDJB-UHFFFAOYSA-N 414.495 2.316 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)CCO4)cc2)C1 734011382 GYMRNHUGWGLEAA-HXUWFJFHSA-N 422.529 2.365 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(OCCOC)CC3)cc2F)CC1 735189163 WXSFEFVEXABMLD-UHFFFAOYSA-N 422.545 2.305 10 20 HECD CCn1nc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1C 741649214 PKDALBBGLDWGGT-UHFFFAOYSA-N 406.917 2.346 10 20 HECD O=S(=O)(NCC1CC1)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)nc1 742394594 USTXRJGIQKXKGK-UHFFFAOYSA-N 420.510 2.358 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cccc[n+]2[O-])NC(=O)OC(C)(C)C)cc1 742750416 NHKXHTAZHQTOCP-KRWDZBQOSA-N 400.479 2.382 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C2(C(N)=O)CCC2)NC(=O)OC(C)(C)C)cc1 747905819 BRMUHOJSBDIQTH-INIZCTEOSA-N 404.511 2.090 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)CC2)cc1F 753861627 SXSFKOVEUKMEPE-UHFFFAOYSA-N 414.437 2.454 10 20 HECD C[C@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1cc(F)ccc1O 756587854 DCAFWVAHJHTZGF-HNNXBMFYSA-N 407.511 2.318 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)CC2)cc(OC)c1OC 759286112 BQFRJKYWPDZRFP-MAUKXSAKSA-N 418.538 2.027 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc(C(=O)O)oc2Br)cc1 761242255 QYICMDVYABXEBL-UHFFFAOYSA-N 403.254 2.285 10 20 HECD O=C(NCc1cccc(Br)c1O)N[C@@H]1CCN(CC(F)(F)F)C1=O 764783280 JRFPSYOKUQRYBW-SNVBAGLBSA-N 410.190 2.117 10 20 HECD CC(C)CCNS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765649424 LHYIBZBXZBGNHS-UHFFFAOYSA-N 424.504 2.348 10 20 HECD C[C@@H](C(=O)Nc1c(-c2ccccn2)nc2ccccn12)S(=O)(=O)C1CCOCC1 769697248 CQGWAJUGIMTXBG-AWEZNQCLSA-N 414.487 2.317 10 20 HECD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc2c(c1)CCCN2C 771628683 JMDPGSGWSNSOLW-KRWDZBQOSA-N 405.495 2.142 10 20 HECD O=C(NCCc1ccccc1F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775191487 DPZRHXGCSBSEFA-GOSISDBHSA-N 400.450 2.398 10 20 HECD COCCCOc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785293996 IPTXFDNMHCYBLT-CQSZACIVSA-N 402.447 2.199 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 785294035 JZDNCINPXGRUMU-NQNZVUTLSA-N 424.906 2.316 10 20 HECD COc1ccc(OC(F)F)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785298644 XHGMSOPRGZTITH-JTQLQIEISA-N 410.373 2.394 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4c(nc3O)CCCC4)cc2)CC1 786660152 WVGVGUAMTIXUDQ-UHFFFAOYSA-N 408.502 2.265 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3ccccn3)CC2)cc1 788643993 RCMTXVVEPKSYMF-UHFFFAOYSA-N 409.534 2.329 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)ccc1O 790407804 RKVKNIXSXLCWCV-UHFFFAOYSA-N 410.395 2.120 10 20 HECD CC(C)(C)OC(=O)C1=NO[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 798169670 LJMPQZJNQIIWED-YJBOKZPZSA-N 404.463 2.386 10 20 HECD CCS(=O)(=O)NCCNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799919475 PMZVHUDOLNZPIV-AWEZNQCLSA-N 416.975 2.315 10 20 HECD CO[C@H](C)CS(=O)(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2 800831000 OUMUXTMTUKGZDV-CHWSQXEVSA-N 416.565 2.312 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@@H]1CCCOCC1 803448755 WZTAZFVQNFZUTO-CQSZACIVSA-N 411.449 2.058 10 20 HECD CC[S@](=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 803472054 RSQUOFHVGAMKFA-NDEPHWFRSA-N 405.472 2.360 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 807099928 HNSRNWHRWGRDFZ-PGRDOPGGSA-N 408.546 2.314 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1 807102224 YCHGXONOXGHEOI-UHFFFAOYSA-N 414.472 2.068 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](OCC(F)(F)F)C1 807102981 KEXQYWWJNPKDMK-INIZCTEOSA-N 401.429 2.247 10 20 HECD O=C1NC(=O)C2(CCC(NC(=O)N(Cc3ccco3)Cc3ccccc3O)CC2)N1 807546094 PCTHGGDOJODPAV-UHFFFAOYSA-N 412.446 2.218 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807676427 GKDJCRYIEAOBLR-LSDHHAIUSA-N 406.527 2.301 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOCC(F)(F)C3)cc2F)C[C@@H](C)O1 808785155 WIHKTFWSJGLVJA-HUUCEWRRSA-N 415.456 2.023 10 20 HECD COc1cc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1OC 914563902 WMDMMRPQRGUGAU-UHFFFAOYSA-N 404.441 2.015 10 20 HECD CCN(CC)c1ccc(CNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1 916503433 UACSUPASVCBLSN-FQEVSTJZSA-N 411.481 2.408 10 20 HECD O=C(COc1cccc(Cl)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334988 JMAHQILESBNZPP-UHFFFAOYSA-N 408.907 2.270 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN(C)CCNS(C)(=O)=O)c2C)cc1 1319324649 COXOFUNVSJXHOI-UHFFFAOYSA-N 407.536 2.157 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@](C)(CO)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1319523062 GGTZUBLXXLLDOL-OAQYLSRUSA-N 419.547 2.019 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3sc(N(C)C)nc3C)CC2)cc1 1324904617 FHNLRXAZSZHJBH-UHFFFAOYSA-N 418.519 2.032 10 20 HECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c1 1339378387 UBIKEBKEOORODI-OAHLLOKOSA-N 424.954 2.393 10 20 HECD Cc1nc[nH]c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427062 CORRAFYDPBMELD-INIZCTEOSA-N 413.478 2.071 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cn2ccc3c(F)cccc32)C1 1841321928 UURNMPZARCBBOJ-UHFFFAOYSA-N 424.432 2.104 10 20 HECD Cc1cc(C(=O)COC(=O)CN2C(=O)CN(C)C2=O)c(C)n1-c1ccc2c(c1)CCC2 7095685 JBWDFCSWKABVLC-UHFFFAOYSA-N 423.469 2.203 10 20 HECD COCCN(CCOC)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 14205191 HZULZFOVTBKERE-UHFFFAOYSA-N 408.205 2.373 10 20 HECD CCN(CC)c1ccc(CNC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1 236958600 VRRMOYCXLYWKFL-UHFFFAOYSA-N 405.568 2.209 10 20 HECD CCN(C[C@@H]1CCCO1)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 261460457 PQAKEJIHVAHRFA-NRFANRHFSA-N 404.555 2.418 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2Cl)cc1C(=O)O 728508690 RMLGPMBOILWSSB-UHFFFAOYSA-N 422.843 2.350 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 728981419 ZHGAQEQQEXQQND-KBPBESRZSA-N 412.442 2.402 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1 728983181 VPZCNGHZYVZQAJ-ZDUSSCGKSA-N 407.426 2.215 10 20 HECD CN1CCCc2cc(CNC(=O)NCc3ccc(N(C)S(C)(=O)=O)cc3)ccc21 732257167 ZLGIVJUOAFCFPW-UHFFFAOYSA-N 416.547 2.464 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1 734701858 LSFDBVOOIWNPAY-UHFFFAOYSA-N 419.485 2.280 10 20 HECD O=C(CCCS(=O)(=O)N1CCCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 735518753 KVBYOLIBTGLYOF-GOSISDBHSA-N 410.536 2.106 10 20 HECD CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194772 CZZHDLGODWJTAF-IBGZPJMESA-N 419.591 2.459 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(N)c(Cl)c3)CC2)cc1 738862052 LXJHZEPLMCAPFV-UHFFFAOYSA-N 403.866 2.436 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741097085 BCESVCDFWFEKJT-UHFFFAOYSA-N 408.458 2.174 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1F 743599607 VBIYLMSWTGCBRD-QGZVFWFLSA-N 416.501 2.400 10 20 HECD O=C(COC(=O)c1csc(C2CC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 747506470 GPNGKMGOERXTNM-UHFFFAOYSA-N 419.478 2.469 10 20 HECD C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)NC(=O)NC(C)(C)C 751929616 ALHAGHDABXFAQY-NSHDSACASA-N 404.492 2.486 10 20 HECD CC(C)(CC(N)=O)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 754783905 RPUVGXGUKWLOAM-XFXZXTDPSA-N 411.574 2.500 10 20 HECD C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(C(C)(C)C)no1 755060771 GCNDOFZHCIXLDB-CQSZACIVSA-N 419.501 2.310 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2)CC1 755304416 PFCAMSMHYKBNBH-IBGZPJMESA-N 415.446 2.082 10 20 HECD CCNC(=O)c1cccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758232726 SCNCEOVKTRJUMW-FQEVSTJZSA-N 413.518 2.007 10 20 HECD C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758348284 UACKTDGCHKPZPM-MLGOLLRUSA-N 421.544 2.467 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)cc(OC)c1OC 760097732 VIPYQNMMKRKBIK-UHFFFAOYSA-N 401.463 2.450 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 763283916 MBDFZYPUGOIRKA-NVXWUHKLSA-N 418.515 2.246 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1 765051832 CSESHWFENYWALQ-UHFFFAOYSA-N 421.504 2.138 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1 765116519 TYJXKJSPWYUBPT-LBPRGKRZSA-N 402.472 2.276 10 20 HECD Cn1cnnc1[C@@H]1CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767757077 OLMSFHMFBOOTHR-IBGZPJMESA-N 415.453 2.366 10 20 HECD Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NCCc1ccc(O)c(O)c1 768900689 MKAXPLSXSHYWFL-UHFFFAOYSA-N 423.395 2.463 10 20 HECD CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769781965 DYPGAYQJIYAFAU-QGZVFWFLSA-N 420.487 2.010 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cnc4ccccc4c3)cc2)CC1 770345577 FRLJOTHPPJTGMD-UHFFFAOYSA-N 424.526 2.382 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CC[C@H](S(C)(=O)=O)C3)c2C)cc1 800466490 NSLVQPCOTZEPTI-SFHVURJKSA-N 418.515 2.182 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N3CCC(C)CC3)CC2)cc1 803541176 AHTQFPKIYYJOAR-SFHVURJKSA-N 416.566 2.017 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](C)NC(=O)OC(C)(C)C 804041809 BEKBLQAEALDRII-HNNXBMFYSA-N 406.527 2.131 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC[C@@H](C)C3)cc2F)CC1 805007760 PHQTZHBFRYOIQE-SJORKVTESA-N 404.530 2.136 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C 807095734 FXAIXEYAEWPMFA-MRXNPFEDSA-N 418.538 2.145 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](N3CCCC3)[C@@H]2C)c1 808193795 XNUDVRQTZSUOBT-JTSKRJEESA-N 401.551 2.486 10 20 HECD CON(C)C(=O)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 813046421 HNRCZHJGDSXSDQ-MRXNPFEDSA-N 404.511 2.026 10 20 HECD CN(Cc1nccn1C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 843416430 RYFHJHFVNNCXHH-UHFFFAOYSA-N 404.382 2.376 10 20 HECD CNC(=O)c1ccc(CN(C)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918217513 FMRVGJFREPHOCQ-UHFFFAOYSA-N 414.481 2.364 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnc2ccccc2c1 918284637 LPBLDZMXGYFOGY-UHFFFAOYSA-N 408.433 2.465 10 20 HECD CCc1noc2ncc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc12 918398832 AOWLRAUOQZTUML-OAHLLOKOSA-N 407.474 2.417 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 920923987 ZHCOCJUKAAPNRI-INIZCTEOSA-N 424.501 2.041 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1C1CC1)C1=NN(c2ccccc2)C(=O)C1 1792956110 CARDMWQCOWOPBE-AXDKOMKPSA-N 420.513 2.464 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csnn1)c1cc(O)c(O)c(Cl)c1 1793734872 BFNYDNCMIZSTIB-JGPRNRPPSA-N 408.867 2.168 10 20 HECD C[C@@H](Sc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249135 ZYWKBKBUAWRTRG-CQSZACIVSA-N 413.499 2.491 10 20 HECD CN(C)c1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843250905 BHHQTMRTNUGJRL-UHFFFAOYSA-N 424.501 2.009 10 20 HECD COc1ccnc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1844462525 QEXZSCOOKONNCC-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 108671871 DKOQLWOMTPBARH-UHFFFAOYSA-N 407.467 2.213 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nccn3CC(F)(F)F)nc12 110794415 PROTZSBJVNSULN-UHFFFAOYSA-N 412.372 2.002 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCOc2cc(N(C)C)ccc21 437018875 AHEAOBAHUOTDHE-ZDUSSCGKSA-N 423.922 2.498 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCn1cncn1 726537950 SYXOKMLIEUSULQ-LCYFTJDESA-N 407.546 2.137 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nc(-c3ccc(Cl)cc3)no2)c1 734551264 PGOKESJEAPVZCD-UHFFFAOYSA-N 422.850 2.397 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(CN2CCCC2=O)c1 741097732 XHSQZPLZSLOSNP-UHFFFAOYSA-N 418.497 2.440 10 20 HECD COC(=O)[C@H]1CCC[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 742241670 TVFSPSZNBAMESZ-MOPGFXCFSA-N 417.550 2.303 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CN(C)c3ccc(Cl)cn3)CC2)cc1 742920835 UZMFSTVYRHUWDK-UHFFFAOYSA-N 417.941 2.118 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCO[C@H](C(=O)OC(C)(C)C)C3)CC2)cc1 746761132 IYBIQJICKQPLTF-IBGZPJMESA-N 419.522 2.416 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H]1CCCc2c1cnn2C 749175455 IEZGBDHQSNNEMI-XLIONFOSSA-N 424.549 2.341 10 20 HECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCCCSc1nccs1 749730052 HNWLUKGYGUSJJH-UHFFFAOYSA-N 408.549 2.450 10 20 HECD COc1ccc(N2CCN(c3ccc(S(=O)(=O)NCC4CC4)cn3)CC2)cc1F 754026658 SRJRULJTEPNMHI-UHFFFAOYSA-N 420.510 2.244 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)[C@H](C)C3CCN(C)CC3)CC2)cc1 758414003 KRBRZZVCSWKFQV-LJQANCHMSA-N 417.598 2.189 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3cccs3)CC2)cc(OC)c1OC 759887055 SUIGFZDRFMZYPM-UHFFFAOYSA-N 405.520 2.212 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)n1 760241160 OIUBOSQNMRXTDW-UHFFFAOYSA-N 420.473 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3CCCO[C@H](C)C3)CC2)cc1F 764584395 QTMYOIBREVPXGZ-QGZVFWFLSA-N 408.518 2.167 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2cccc3nonc23)ccc1N1CCSCC1 765069329 XAOQIQLXIKMWIL-UHFFFAOYSA-N 420.472 2.275 10 20 HECD Cc1cc(C)c2c(N)c(C(=O)OCc3nnnn3CC3CCOCC3)sc2n1 768508703 JFHNYPSVSHKMQH-UHFFFAOYSA-N 402.480 2.265 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1)c1ccc(N(C)C)cc1 773844762 GPGVCCBOKZLABG-GOSISDBHSA-N 423.561 2.316 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(OCc2cscn2)c1 774363875 NDZMUOVXHAJURX-UHFFFAOYSA-N 413.455 2.431 10 20 HECD CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc([N+](=O)[O-])c(OC)c1O)CC2 775111769 OLJBWBFAKJDABY-UHFFFAOYSA-N 407.448 2.170 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)NCCCSc2nccs2)CC1 775156413 PJKAZEWXTBZAMF-UHFFFAOYSA-N 422.580 2.234 10 20 HECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 777856685 CVDSDNHOAZSHQT-UHFFFAOYSA-N 408.436 2.318 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(OC)c3O)CC2)cc1 779061236 LEXHDLZSWSYHBC-KHPPLWFESA-N 411.458 2.253 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)CCc3ccccc3)cc2)CC1 786122266 POQAZMMUFNUJBT-UHFFFAOYSA-N 401.532 2.017 10 20 HECD CCN(C)C(=O)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 788731875 GYGJAJDANRDVOT-ZDUSSCGKSA-N 416.444 2.208 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1 792959855 RFCFDCPDPOJZHT-MRXNPFEDSA-N 414.462 2.116 10 20 HECD O=C(NCCc1nccs1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793761510 MHOUSKNCHAZZDX-CYBMUJFWSA-N 424.473 2.188 10 20 HECD CNC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1 797679726 YZPUMZUTPVMVMS-UHFFFAOYSA-N 412.490 2.483 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCc4ccccc4OC3)CC2)cc1 801571423 SMKBMUOHEMWVAO-RBBKRZOGSA-N 411.546 2.162 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CCN(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 803305679 ODEWVYKMFTZYFG-IBGZPJMESA-N 424.545 2.295 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 807094885 DRJUAXBUSQVZNP-MRXNPFEDSA-N 415.925 2.121 10 20 HECD COCCCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289796 JJKSGDCDFLWIDE-UHFFFAOYSA-N 408.502 2.139 10 20 HECD O=C(Nc1ccc2c(c1)C(=O)OC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 808920108 VTXQPWKCLULAIU-KRWDZBQOSA-N 410.426 2.209 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cn(Cc2ccccc2)nn1 815526672 BFLKUSYPSMIIPP-UHFFFAOYSA-N 405.458 2.166 10 20 HECD C[C@@H](C(=O)N1CCN(c2ccccn2)CC1)N(C)Cc1ccc(N2CCOCC2)cc1 857758577 LHFHMJURGVWLMT-FQEVSTJZSA-N 423.561 2.087 10 20 HECD CNC(=O)c1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1319149892 LEOFTUWZIJEHBZ-ZDUSSCGKSA-N 404.417 2.441 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccco1)CC2)c1cc(O)nc(O)c1 1816722312 XBBKNLKXTIGQTG-SNVBAGLBSA-N 400.416 2.082 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N(C)C)cc2)nn1-c1ccccc1[N+](=O)[O-] 7243621 BWMRNJUESSAQBS-UHFFFAOYSA-N 407.430 2.445 10 20 HECD Cn1cc(/C=C2\SC(Nc3cccc(C(F)(F)F)c3)=NC2=O)c(=O)n(C)c1=O 25523673 FDLBPPASEQRTFM-SDQBBNPISA-N 410.377 2.185 10 20 HECD Cc1ccoc1C(=O)NCCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 303835930 RSVLCEZQZYOMNB-UHFFFAOYSA-N 418.469 2.183 10 20 HECD C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1)c1ccc(N2CCOCC2)cc1 725907093 PMRQWAVZRQNYSZ-CYBMUJFWSA-N 423.922 2.315 10 20 HECD C[C@@]1(c2ccc(CNC(=O)NCc3ccc(N4CCCC4)cc3)cc2)NC(=O)NC1=O 726233961 JRLREPGOZGSAOX-QHCPKHFHSA-N 421.501 2.341 10 20 HECD CCOC(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 726979076 TVQNLHNUVMLVFV-UHFFFAOYSA-N 404.511 2.286 10 20 HECD O=S1(=O)CCN(c2ccc(CNC(=S)NCCc3cccs3)cc2)CC1 727698373 NSJUCWPZYAXIQH-UHFFFAOYSA-N 409.602 2.190 10 20 HECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NCc1ccc(N(C)C)cc1C 734468204 QAEJVHMVFZBLFY-UHFFFAOYSA-N 401.419 2.486 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)cc21 737181721 CPOVHKOLPWOKPO-ZDUSSCGKSA-N 412.446 2.213 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](OCC(F)(F)F)C3)nc12 738320704 PJIFWWILWKVWPZ-LBPRGKRZSA-N 402.373 2.155 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(F)c3)cc2F)C[C@@H](C)O1 743175861 VWSVXZCBZPHZMC-OKILXGFUSA-N 419.428 2.447 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)n1C 746419837 NKXZXCTZZUVUIF-UHFFFAOYSA-N 416.485 2.422 10 20 HECD CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 746756322 NFIOSORKTPEFHE-OAQYLSRUSA-N 404.555 2.166 10 20 HECD CCc1ncc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 747475609 GBQRYNDFQYHOPQ-UHFFFAOYSA-N 419.432 2.364 10 20 HECD COc1ccc(N2CCC(NC(=O)COC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 748038623 KODBLZNYTMRFPL-UHFFFAOYSA-N 419.522 2.416 10 20 HECD CCC(CC)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 754907000 VCXKIDBPJHWCKV-IYBDPMFKSA-N 423.529 2.377 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1 756642664 PYUXVNLYRXLLKS-HNNXBMFYSA-N 405.539 2.456 10 20 HECD COC(=O)CS(=O)(=O)Cc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)cc1 756757523 OKZSKLICKUSTFB-CYBMUJFWSA-N 422.459 2.239 10 20 HECD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 758547658 MWKXVVSLUJBMRQ-TWSLPJAOSA-N 402.447 2.438 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/c3ccc(Cl)nc3)nc12 758697787 FUGRLWKIWUUOOH-GQCTYLIASA-N 402.794 2.417 10 20 HECD Cc1cc(C(=O)CN2CCO[C@H](C)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766967941 BDOKVYCEMNQFNG-GOEBONIOSA-N 405.520 2.033 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC(CCO)CC1 770133293 ZGYLHDLLVDWICF-UHFFFAOYSA-N 410.517 2.489 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(OCC(F)F)ccn3)nc12 778182844 HBWYFXYFJWDXBU-UHFFFAOYSA-N 422.344 2.008 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nn3cnc4ccccc43)CC2)cc1 778222903 DJMFZQZXEJOKFY-KHPPLWFESA-N 405.458 2.020 10 20 HECD C[C@H](NC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1)c1ccc(N2CCOCC2)cc1 780339821 SOINAXBQGBHDCU-ROUUACIJSA-N 404.555 2.071 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CC1(O)CCOCC1 781965740 AJCFMMZXGHPALT-OAHLLOKOSA-N 422.481 2.262 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(CCCn3ccnc3)CC2)c1 783645591 VMSAIRQTLPZCPP-UHFFFAOYSA-N 406.508 2.293 10 20 HECD Cc1nc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789377510 LGRQXNWRHNVUED-UHFFFAOYSA-N 420.872 2.399 10 20 HECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N(C)C)cc1 793722515 UBFPZUWJMASGPH-FQEVSTJZSA-N 400.498 2.235 10 20 HECD CCN1CCN(S(=O)(=O)c2cccc(NCc3cc4c(cc3O)OCO4)c2)CC1 796399791 UUXOONFVZVKALA-UHFFFAOYSA-N 419.503 2.059 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cc1ccc([S@](C)=O)cc1 797920859 VBHOMHFJOARYQF-NDEPHWFRSA-N 402.516 2.234 10 20 HECD C[C@H]1CCCN(c2ccc(CNS(=O)(=O)[C@H](C)C(=O)N(C)C)cc2Cl)C1 800148485 MJVPAAGNXUICNB-UONOGXRCSA-N 401.960 2.472 10 20 HECD CC1(C)CNC(=O)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 800322385 BWOMYJIXRWDDNA-UKTHLTGXSA-N 423.585 2.467 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803299302 IZUGOXXGPQAVMM-HNNXBMFYSA-N 414.506 2.130 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 806420771 GRPBUMRKQDFZLE-FQEVSTJZSA-N 408.502 2.023 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2COC(=O)N[C@H]2CCOC2)cc1F 806634291 JMCYPEFYIXVBRL-IRXDYDNUSA-N 422.501 2.471 10 20 HECD Cc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(N2CCCC2)n1 807639600 DOWCTPCNFCFCGD-UHFFFAOYSA-N 409.534 2.331 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 807674525 MKRIMPAUVRNUJS-KBPBESRZSA-N 403.483 2.069 10 20 HECD CC[C@@H]1COCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768469 KKZUUJLOHYAQBB-LSDHHAIUSA-N 411.449 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@H]4CN(C(C)=O)C[C@H]43)CC2)cc1F 808354528 HFYIAYNIRUSYRM-ILZDJORESA-N 418.513 2.313 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(-n2ccnn2)cc1 809614561 NBOQPIKINQMCTB-MRXNPFEDSA-N 406.490 2.169 10 20 HECD Cc1nc(O)nc(O)c1CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 818033896 NOEVHZRUPSEMFX-SFHVURJKSA-N 414.506 2.403 10 20 HECD CN1CCN(C(C)(C)CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 916258726 FNXGUYJZIITNSM-LJQANCHMSA-N 404.555 2.109 10 20 HECD COc1ccc(CCN2C[C@H](C(=O)N(C)Cc3ccccc3O)CC2=O)cc1OC 917307220 GKXAUTDPRLWSIQ-GOSISDBHSA-N 412.486 2.459 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCCC(=O)NCCc2ccc(O)c(O)c2)c(C)c1 917371650 NCIOZSVLGSFULS-UHFFFAOYSA-N 406.504 2.050 10 20 HECD CCO[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 920290472 GEJVVDUEELVDPH-FQEVSTJZSA-N 402.516 2.315 10 20 HECD CN(Cc1ccc(C(N)=O)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1115869415 HAUXJBYNNUVEER-UHFFFAOYSA-N 414.481 2.227 10 20 HECD Cc1c[nH]cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1797024324 IKFRKBDCNWPRGL-VBUUOAMHSA-N 419.485 2.368 10 20 HECD C[C@@H](CN)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814749616 BIADTFSGYWXMDQ-WPRPVWTQSA-N 424.910 2.028 10 20 HECD COc1ccccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038397 PWQWFZRGRRZKLC-CSKARUKUSA-N 424.453 2.342 10 20 HECD COc1ccc(N2CCCN(CN3C(=O)C(=O)c4cc5c(cc43)OCCO5)CC2)cc1 108220319 RHFLBRNNQDNHFY-UHFFFAOYSA-N 423.469 2.166 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 110357542 OOKDHPPAZBRQCN-FQEVSTJZSA-N 423.579 2.375 10 20 HECD COC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 734526662 WAAREIKVQFWXTO-UHFFFAOYSA-N 413.474 2.074 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NCc1ccc2c(c1)CCCN2C 746879773 FKGNXPVIUSOFAK-UHFFFAOYSA-N 403.486 2.382 10 20 HECD O=C1CCc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2N1 749627093 XEDNELWAACMWAF-GOSISDBHSA-N 423.469 2.423 10 20 HECD CCN1C(=O)[C@H]2CN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CCN2C1=O 752510805 ZANRHVXGBMQDSJ-LJQANCHMSA-N 410.474 2.211 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754040287 MRBVWLOREWAXIN-UHFFFAOYSA-N 408.451 2.132 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc2)C1 754127476 JVKXVCMWMTYILE-MDNKFWRPSA-N 412.534 2.145 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](O)CCc3ccccc3)CC2)cc(OC)c1OC 760085724 HOYCHTNOUGWMBU-LJQANCHMSA-N 414.502 2.355 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)c([N+](=O)[O-])cc1F 763424008 NXOQMSIWLPRION-UHFFFAOYSA-N 411.386 2.360 10 20 HECD O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NCCCSc1nccs1 765523985 FGMYYACNCQDRAH-UHFFFAOYSA-N 419.576 2.266 10 20 HECD CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 765697266 OGQJIQSCFVAHRP-QAPCUYQASA-N 424.567 2.025 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C(C)(C)C)cc2F)C[C@H](C)O1 767302293 QTLLZMNYFORCJO-KBPBESRZSA-N 400.516 2.269 10 20 HECD O=C(NCCc1cn2c(n1)SCC2)NCc1ccc(N2CCC(CO)CC2)cc1 767948262 MDFYVIXLLCLDDP-UHFFFAOYSA-N 415.563 2.239 10 20 HECD Cc1nc(-c2ccc(C)c(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2)n[nH]1 769949444 PBQLDHLOIWBEKO-UHFFFAOYSA-N 401.448 2.418 10 20 HECD CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(F)c1 774361541 GRLLJYUOIOMRLE-UHFFFAOYSA-N 418.421 2.490 10 20 HECD O=C(NCCCn1ccc2ccccc21)C(=O)NCc1ccc(N2CCOCC2)cc1 775057058 YLZQFONCBYSZRC-UHFFFAOYSA-N 420.513 2.301 10 20 HECD O=C(CN1CCC[C@@]12CCOC2=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778248791 YEKWIRXVXJKPRC-QHCPKHFHSA-N 404.422 2.182 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC(C)(C)c3nccs3)CC2)cc1 778284160 JWWKWICFKJRCBX-CMDGGOBGSA-N 414.531 2.408 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(CC3CCCCC3)CC2)cc1 785424328 NFXFMIPHNJJFSY-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCCO1 789381738 HUKTVJWFEWNWMR-MOPGFXCFSA-N 408.454 2.184 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(CN(C)C)cc3)CC2)cc1F 790031710 NRXSQMJRAGUJCP-UHFFFAOYSA-N 407.511 2.407 10 20 HECD CC(C)Cc1ncc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 791948622 CEJMQULQAXDLHX-UHFFFAOYSA-N 417.535 2.232 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3ccc(OC)cc3O)C2=O)c1 793076293 ODDRIHITMRTLTA-GOSISDBHSA-N 415.446 2.023 10 20 HECD Cc1cc(=O)c(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)co1 794727479 RZINUPWWULSPSE-GJZGRUSLSA-N 404.438 2.396 10 20 HECD CCOC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c1 795347757 JXMAHKWTTBORRT-UHFFFAOYSA-N 409.416 2.165 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 803310838 KDDJLUFVBRWYMP-XKGZKEIXSA-N 417.550 2.410 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1 803644665 OHNCPJGLZUWAFF-JOCHJYFZSA-N 422.573 2.392 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@H](CC(C)C)C3)CC2)cc1 804314950 CZDQJLOJUUTXEX-GHTZIAJQSA-N 417.550 2.490 10 20 HECD CCCN1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805023051 NBWUBMUDNSDBTP-FQEVSTJZSA-N 400.567 2.387 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(C(=O)OC(C)(C)C)CC1 807097919 QNYXXFUDKFSCIR-UHFFFAOYSA-N 418.538 2.147 10 20 HECD CNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918205722 RWBRSBONTFXQON-UHFFFAOYSA-N 410.518 2.254 10 20 HECD CS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918223151 FTVLWXBRAFKJEK-UHFFFAOYSA-N 422.482 2.356 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 918443450 GQSYMCMZDWDWQN-UHFFFAOYSA-N 419.503 2.020 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H](C)c1ccc(F)cc1 920637683 MXSVKCZRHFHPKX-RYUDHWBXSA-N 424.450 2.326 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)Oc1cccc(C(C)=O)c1 1320153337 MGFLGOPRTPOYBZ-KDOFPFPSSA-N 415.442 2.358 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cnccn3)CCC2)cc1)c1cc(O)nc(O)c1 1788424239 LNPZXXXYVSWNNE-UHFFFAOYSA-N 405.414 2.344 10 20 HECD Nc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cs1 1796113509 KDKNXLLRPZBPSZ-JGPRNRPPSA-N 422.894 2.356 10 20 HECD O=C([C@H]1CCc2ccccc2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250927 CZOKUUADSALOHC-KRWDZBQOSA-N 407.470 2.115 10 20 HECD O=C([C@@H]1[C@H]2C=CS[C@@H]21)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502112 PWVUEXHBMCGTCJ-XFJVYGCCSA-N 406.891 2.443 10 20 HECD CCS(=O)(=O)N(C)CCCNC(=O)N(Cc1ccco1)Cc1ccccc1O 726098366 XZJYODJPFROXAH-UHFFFAOYSA-N 409.508 2.369 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 729049962 FRGCQSHDZDBBHB-HNNXBMFYSA-N 422.526 2.314 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c(OC(F)F)c1 734073677 UTQFLAUFBXXRPZ-UHFFFAOYSA-N 424.356 2.044 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCC[C@H](S(C)(=O)=O)C1 741093168 NUVPGBYZZDMIGU-HKUYNNGSSA-N 409.552 2.020 10 20 HECD COc1ccc(N2CCN(CCNC(=O)/C(=C/c3ccccc3)NC(C)=O)CC2)cc1 742927418 QUAIXXLHXYPENV-NKFKGCMQSA-N 422.529 2.111 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ncc(C)s3)CC2)cc1 743669247 YJFKVRQIXZZTTI-UHFFFAOYSA-N 403.552 2.472 10 20 HECD COCCCN(CCOC)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744390304 VMSJIEDHHJLNMA-UHFFFAOYSA-N 410.470 2.385 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H]1CN1CCOCC1 745591639 CBTKHHSPFAAENN-FQEVSTJZSA-N 404.580 2.246 10 20 HECD CCN(CC)C(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 745654326 BTTLCOXNLUEMCK-UHFFFAOYSA-N 403.571 2.228 10 20 HECD CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407658 WFFLNYGIZLOTBU-SFHVURJKSA-N 423.554 2.351 10 20 HECD CN(C[C@@H](O)CN1CCOCC1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 751790825 UEMIHGGBWQIVMX-JOCHJYFZSA-N 418.582 2.290 10 20 HECD COC(=O)CCC1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 753388702 QARRQJDPKMJUOW-UHFFFAOYSA-N 403.523 2.009 10 20 HECD Cc1cc(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c(C)n1-c1ccccn1 753784921 DHYCQBBCQSSFGX-UHFFFAOYSA-N 402.520 2.176 10 20 HECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1O 754722902 MOHAMQACBCVNJT-UHFFFAOYSA-N 416.503 2.092 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(C)(C)NC(=O)C(F)(F)F)cc2F)CC1 758305043 GKAUHJPSHOAUOB-UHFFFAOYSA-N 418.435 2.041 10 20 HECD CC(C)NC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 760609168 DOUUWARPWVMUTJ-FQEVSTJZSA-N 402.539 2.094 10 20 HECD CCN1C[C@H](C)N(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H]1C 766250373 LCMOJYGIYWONEM-AOIWGVFYSA-N 401.555 2.012 10 20 HECD COc1cc(CN2CCCN(S(=O)(=O)c3c(C)noc3C)CC2)c(O)cc1C 768440613 BBAUCDOSQASNTA-UHFFFAOYSA-N 409.508 2.211 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCc3ccc(O)c(O)c3)C2)s1 768921057 ZYORNXSNBAXQCS-CQSZACIVSA-N 410.517 2.185 10 20 HECD Cc1occc1C(=O)NCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771051909 DAHJEBLSIKPBOC-INIZCTEOSA-N 405.882 2.458 10 20 HECD C[C@@H](N[C@@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(N2CCOCC2)c(F)c1 773024533 IJMOVMRUTAGGLL-CRAIPNDOSA-N 401.486 2.242 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(CC(=O)NC2CCCCC2)c1 773750885 JPDFKVFHHGRABD-AWEZNQCLSA-N 400.479 2.104 10 20 HECD COCCO[C@H]1C[C@H](CO)CN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 775205280 RTIPZMACBMITLH-OALUTQOASA-N 407.511 2.431 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)C(=O)Nc4ccccc43)CC2)cc1 779224901 JNMUYEZVNZROFW-ICSRJNTNSA-N 424.545 2.273 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cc3)cc2)CC1 786428259 QHVBEDPCJVNWLZ-UHFFFAOYSA-N 414.893 2.263 10 20 HECD O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)NCc1ccc(N2CCOCC2)cc1 786751231 BOMRFQLLPMGESM-UHFFFAOYSA-N 424.476 2.119 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ncnn1-c1ccccc1 786999064 MVPVJCHRVWOPPH-UHFFFAOYSA-N 424.480 2.367 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cc1 788928262 CWUZZNUILNTLKD-DLBZAZTESA-N 402.539 2.055 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C(F)(F)F)OC(C)(C)C3)nc12 795059675 DBJMPQVTFVQYMQ-GFCCVEGCSA-N 402.373 2.153 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)c2cnc[nH]2)NC(=O)OC(C)(C)C)cc1 795248936 NCQLGIZZVVSVPQ-HNNXBMFYSA-N 409.512 2.020 10 20 HECD CCOC[C@H](C(=O)O)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 797710489 ZRYWOMCONRNRKW-QWQRMKEZSA-N 411.474 2.070 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCCC34CCOCC4)CC2)cc1 799898277 SNIOVRFIUOOPPJ-OAQYLSRUSA-N 416.566 2.466 10 20 HECD CCOC(=O)[C@H](C)[C@@H](C)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 801541681 UCTGTMIUEZGMLF-YYIAUSFCSA-N 423.529 2.233 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 804366652 UOHTXCAXJRMDGQ-AWEZNQCLSA-N 413.434 2.090 10 20 HECD CC(C)n1cc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 806161038 WGYKFQAYXRXLOU-QGZVFWFLSA-N 413.522 2.136 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCC[C@@H](C(=O)N(C)C)C1 806178567 HRKLYCFBIBGTHM-SJLPKXTDSA-N 403.523 2.284 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 806512843 VMRMKJPGMKZIKW-DOTOQJQBSA-N 401.429 2.226 10 20 HECD CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1nccs1 807257559 PSERMFWBJBVPQF-KRWDZBQOSA-N 402.520 2.206 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)c1 808114101 QHRIJAKMHWOLCA-UHFFFAOYSA-N 402.831 2.362 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COc3ccc(F)cc3F)CC2)cc1 914591704 UFNLWLVTZXHUMM-UHFFFAOYSA-N 420.412 2.244 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCc1nc(-c2ccccn2)no1 915398379 UNYQFLMCTFZNMJ-UHFFFAOYSA-N 423.473 2.332 10 20 HECD CC[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1ccc(OC)cc1 920636555 BXACLQUOINWGQR-KRWDZBQOSA-N 422.459 2.346 10 20 HECD CCN(CC)C(=O)c1ccc(N/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1 920979969 OIZUBHNYCZLKQZ-LFIBNONCSA-N 402.520 2.364 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H]4OCCC[C@@H]4C3)cc2)C1 1319343824 FHYOTGOUGBAQEE-QWFCFKBJSA-N 400.523 2.099 10 20 HECD COC(=O)[C@@H]1CCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1319832912 RRSLEGFEWUDZID-TZMCWYRMSA-N 424.500 2.326 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)[C@H](C)c1ccccc1 1320397049 CEDVLNHDHIKYQI-UVQUFPMPSA-N 401.459 2.243 10 20 HECD CNc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1322069121 JVJIJZBDKGNLNG-UHFFFAOYSA-N 413.478 2.197 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC1CCCCC1)c1cc(O)nc(O)c1 1792888351 AZNAGUOUSVEGLZ-MUJYYYPQSA-N 403.479 2.094 10 20 HECD O=C(CC[C@H]1CCOC1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550894 VRLBFEQRQFOVIK-INIZCTEOSA-N 417.506 2.154 10 20 HECD O=C(c1ccccc1NS(=O)(=O)c1cccc2nsnc12)N1CCC[C@H](O)C1 55628581 VAZDMDQVLLFRRM-LBPRGKRZSA-N 418.500 2.089 10 20 HECD CS(=O)(=O)c1ccc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)nc1 561318436 IEHYAULCASCOIG-UHFFFAOYSA-N 411.483 2.308 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCCN(CC(F)(F)F)CC2)n(C)c2ccccc12 561628507 NMNPLCUXKZRKQD-UHFFFAOYSA-N 410.440 2.200 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)C[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 725823895 GYPWFGCHRNXMDP-HLLBOEOZSA-N 400.516 2.428 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cc1C(=O)O 728015882 YVFCNHXYVBQMQF-UHFFFAOYSA-N 424.500 2.436 10 20 HECD CCOc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2C)cc1 734468316 UTJCRRGIKDQEFA-UHFFFAOYSA-N 419.547 2.445 10 20 HECD CCCCOCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 735632975 KSIKWTNCLBVJGE-UHFFFAOYSA-N 401.486 2.375 10 20 HECD C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 735828229 KWAOBRXEMMXBTA-AWEZNQCLSA-N 416.551 2.014 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1 743639604 WULBXHSOOKZXFL-HOTGVXAUSA-N 413.474 2.441 10 20 HECD O=C(CCn1cccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746156092 XYHFIUVEJIHNMG-UHFFFAOYSA-N 408.481 2.450 10 20 HECD Cc1cc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1C(=O)O 753769578 GMVLAECIAQTGPW-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CC(=O)OC1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 753831788 YQIPYVOTSDCTNJ-UHFFFAOYSA-N 424.500 2.422 10 20 HECD CCC(CC)(NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 754906999 VCXKIDBPJHWCKV-HZPDHXFCSA-N 423.529 2.377 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)nn1 759222421 YLZREUIRNRKZIE-UHFFFAOYSA-N 412.494 2.212 10 20 HECD COC(=O)C1CCN(C(=O)[C@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C(C)C)CC1 759597855 TULJUFVJWXHQJN-SUOMESGTSA-N 405.447 2.090 10 20 HECD CCc1nnc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 759931329 AGIUACUGWKWXQC-UHFFFAOYSA-N 407.496 2.480 10 20 HECD Cc1cc(C(=O)N2CCN(C(=O)CO)CC2)c(C)n1-c1cccc(Br)c1 760207678 QAMFURAFEYKULF-UHFFFAOYSA-N 420.307 2.133 10 20 HECD C[C@@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 764818597 KZDIPBAQFRNIOI-CQSZACIVSA-N 401.960 2.251 10 20 HECD COc1ccc(CN2CCCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2=O)cc1 767931726 SRUIRFAOHMKCDU-UHFFFAOYSA-N 424.545 2.112 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)Nc3ccccc3F)CC2)cc1OC 768465384 KINXWFUKZRBBOJ-UHFFFAOYSA-N 403.454 2.305 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1 768912179 WUTNQXOKMILPTH-ZDUSSCGKSA-N 417.487 2.173 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@@H]3CS(N)(=O)=O)ccc21 769578579 AOFHQXYIJCVOMT-QGZVFWFLSA-N 407.536 2.188 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cccc(NS(C)(=O)=O)c3)c2)CC1 770285406 BPVFLNGXMNMPBQ-UHFFFAOYSA-N 402.520 2.452 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1 773252229 SBZXKSKUXCWIKU-UHFFFAOYSA-N 416.384 2.334 10 20 HECD COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773768420 VERFRWHYRINABJ-UONOGXRCSA-N 407.488 2.264 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 775352775 RKAMKCJBNLVGGP-KRWDZBQOSA-N 422.529 2.214 10 20 HECD C[C@]1(CCCO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 776123830 NGFUHTOEMPXAKN-XMSQKQJNSA-N 402.539 2.225 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ncc(Cl)n3C)CC2)cc1 778637369 RJKFERCMEDUVRF-UHFFFAOYSA-N 420.945 2.046 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296515 FZPIIBNJFWKUMO-SNVBAGLBSA-N 422.384 2.239 10 20 HECD CC(=O)N1CCCc2cc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc21 785297400 OABJJHHKRDMFIT-CYBMUJFWSA-N 411.458 2.083 10 20 HECD CSCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786794522 WMEHJHNQMHGZOY-ZDUSSCGKSA-N 401.479 2.242 10 20 HECD O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ccc(N2CCCC2)cc1 787712722 VKDGNAIEFFULGR-UHFFFAOYSA-N 420.557 2.468 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3nccs3)cc2F)C[C@@H](C)O1 789819960 PJNNWBIJKOALBN-OKILXGFUSA-N 420.510 2.171 10 20 HECD CC(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842182 AQDQUQFZDMCEBL-KRWDZBQOSA-N 405.514 2.298 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 789943820 HHVGBPUTRQWHMG-UHFFFAOYSA-N 401.438 2.196 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 793689888 PQWGDKCKGIGCAG-IAGOWNOFSA-N 407.426 2.306 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCC(=O)NC2CCCCC2)C2CC2)cc1 793761646 PHSXUCMFTFUDSV-UHFFFAOYSA-N 414.550 2.199 10 20 HECD O=S(=O)(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccoc1 795803966 NJKSLDSGNHSONU-UHFFFAOYSA-N 417.466 2.014 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCC[C@@H]1c1ncc[nH]1)c1ccc(N2CCOCC2)cc1 803307177 XUXKIBATVCXZAZ-QFBILLFUSA-N 411.506 2.177 10 20 HECD CN(CCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C(=O)OC(C)(C)C 804180292 FINFOPKYFSAITI-UHFFFAOYSA-N 418.538 2.227 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cc(F)ccc3F)CC2)cc1 804315439 KYVOPKFHENBFBR-UHFFFAOYSA-N 417.456 2.417 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c1 804426488 AKJVYQIYQKOQIP-QYZOEREBSA-N 416.499 2.408 10 20 HECD COc1ccc(CN2CC[C@@H](NC(=O)N(C)Cc3ccccc3O)C2=O)c(OC)c1 807577448 RVWDPBHUQYLZJJ-GOSISDBHSA-N 413.474 2.352 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(c2ccncc2)CC1 807662791 GYHXBHNEJOTCOR-UHFFFAOYSA-N 409.534 2.139 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(CCc2ccccc2)CC1)c1ccc(N(C)C)cc1 807678296 WDAPZMQHIPPFCB-IBGZPJMESA-N 408.546 2.317 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CCC(F)(F)CC1 808855166 UIUIJCBPZSTCPQ-UHFFFAOYSA-N 420.504 2.093 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc3c2OCC(=O)N3)C2CC2)cc1 810353553 MFWJPTIQRQPORN-UHFFFAOYSA-N 408.458 2.213 10 20 HECD Cc1cc(C(=O)COC(=O)COCc2nncn2C)c(C)n1-c1cccc(F)c1 815292061 MMBZIIFFYAGKQU-UHFFFAOYSA-N 400.410 2.304 10 20 HECD CC(C)C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 916590509 IFRKPZGKPVFLLI-OWCLPIDISA-N 415.442 2.190 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c(C)n1-c1ccccn1 916817565 BSZZKVNTRPACCI-UHFFFAOYSA-N 424.482 2.493 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCOCC(F)(F)F)cc2)C1 918123259 SAMKTDYZTUHNHV-OAHLLOKOSA-N 416.444 2.157 10 20 HECD Cn1cnc([N+](=O)[O-])c1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919723442 NGYXTUDKAUPAAM-UHFFFAOYSA-N 412.429 2.196 10 20 HECD O=S(=O)(c1ccc(NCc2c(O)ccc3c2CCCC3)nc1)N1CCOCC1 1261208470 UPTLGTOALXSGNW-UHFFFAOYSA-N 403.504 2.299 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnnc(-c2ccccc2)c1 1324101638 SNHKHELJTMQZJU-SFHVURJKSA-N 407.426 2.459 10 20 HECD COc1cc(/C=C2\N=C(C3=S=C(C)C=C3)OC2=O)c([N+](=O)[O-])cc1OCC(=O)O 1338685748 LRSOHSDYIHOUKX-WZUFQYTHSA-N 418.383 2.031 10 20 HECD O=C(CC1CCC1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1785433905 ANZOJQXLRJURDM-FQEVSTJZSA-N 408.882 2.385 10 20 HECD Cn1ccnc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787491476 DPPVEURZUQUIGR-UHFFFAOYSA-N 407.430 2.288 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2ncncc2c1 1796601048 XAKHXEOLXXOJBO-BJWYYQGGSA-N 419.441 2.002 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1F)c1cc(O)nc(O)c1 1799528096 BDDVHYXFDWZEMT-BTTYYORXSA-N 403.385 2.337 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccccn1 1816364154 JSLLGFDFGYVYCA-HNNXBMFYSA-N 408.418 2.231 10 20 HECD COCc1nc(OC)cc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)n1 480814509 XDVDBJIIKCZDQE-UHFFFAOYSA-N 408.458 2.454 10 20 HECD CCN(C)S(=O)(=O)c1ccccc1C(=O)N1CCOc2cc(N(C)C)ccc21 485760704 XKISFOFJGUAJMQ-UHFFFAOYSA-N 403.504 2.432 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(Cc2ccccc2)C1=O 725866233 PAPJAPRRSKMRMI-NRFANRHFSA-N 408.502 2.124 10 20 HECD O=C(CNC(=O)c1c(F)cccc1Cl)NCc1ccc(N2CCOCC2)cc1 730590157 QCCGQZAIZVVIGF-UHFFFAOYSA-N 405.857 2.362 10 20 HECD COc1ncc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 734048363 FAQDMDZODFGBGY-UHFFFAOYSA-N 417.377 2.056 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC3(O)CCS(=O)(=O)CC3)c2C)c1 749400900 SYGDZWDAOAZZBG-UHFFFAOYSA-N 404.532 2.380 10 20 HECD Cn1ccnc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1=O 754618375 WMPRQYHASUVHGO-BENRWUELSA-N 420.541 2.462 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)o1 754792195 ICBSKCFEJHHYCO-ZDUSSCGKSA-N 408.476 2.251 10 20 HECD COc1cc(N2CCN([C@@H](C)C(=O)Nc3nccs3)CC2)cc(OC)c1OC 759879357 SBTSUVMDVOFDML-ZDUSSCGKSA-N 406.508 2.318 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccccc3O[C@@H]3CCOC3)ccc21 760096636 LKMCGJUPOWKNCJ-GOSISDBHSA-N 409.486 2.492 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCCCSc1nccs1 768184677 HHZPZDIOALWRRF-UHFFFAOYSA-N 410.496 2.221 10 20 HECD CCCc1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n(C)n1 772212837 SDJMHUUGDHFDDA-UHFFFAOYSA-N 401.536 2.181 10 20 HECD CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 773317433 OOABWZKQTGTTBA-LJQANCHMSA-N 416.522 2.498 10 20 HECD C[C@@H]1C(=O)N(C)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 778127425 NRTCFKXDTNQNKR-SLQMCABGSA-N 423.585 2.419 10 20 HECD CN(CC(=O)N1CCN(Cc2ccccc2)CC1)Cc1ccc(N2CCOCC2)cc1 781972866 IFSVRAAEBFJEBQ-UHFFFAOYSA-N 422.573 2.299 10 20 HECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786121534 GQWRHKOJQRJRLR-UHFFFAOYSA-N 417.531 2.232 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)COCCOc3ccccc3)cc2)CC1 786656200 LWAMAJZEGMXUAM-UHFFFAOYSA-N 411.502 2.067 10 20 HECD CN(C)Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 788629960 GPNYQRWCAPRGAR-UHFFFAOYSA-N 417.575 2.435 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 788888725 JUIPADMJFZRQMD-UHFFFAOYSA-N 418.538 2.058 10 20 HECD Cc1cccc(C)c1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837558 ZPXXEPDPZJGZDA-UHFFFAOYSA-N 413.493 2.336 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccsc1 789842612 FDRFYXWEWCZVBN-ZDUSSCGKSA-N 405.495 2.342 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)C 789855496 SLUWYDVFBUCITK-IBGZPJMESA-N 407.580 2.423 10 20 HECD O=C(NCCc1nccs1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793761513 MHOUSKNCHAZZDX-ZDUSSCGKSA-N 424.473 2.188 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 806518736 GYMNGFCZVNCOFY-HNNXBMFYSA-N 406.527 2.131 10 20 HECD COC(=O)c1cn(-c2cccc(NC(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)nn1 812977921 XDDXRIMYWWJQKD-GFCCVEGCSA-N 411.418 2.218 10 20 HECD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1C 815636355 TWGHMTIGTNCULN-GFCCVEGCSA-N 404.902 2.268 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccco4)no3)cc2)C1 917834667 MYNPAEQMEOIPLG-MRXNPFEDSA-N 423.473 2.280 10 20 HECD CC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 918222766 XAIHTZFVKWIVDU-HOTGVXAUSA-N 406.502 2.203 10 20 HECD Cc1ccn(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)n1 918337209 GKKPZWUVDOTWRQ-UHFFFAOYSA-N 424.526 2.346 10 20 HECD COC(=O)CNC(=O)COC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 919448456 UXSAQQDCTVTNGU-UHFFFAOYSA-N 423.263 2.303 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(NS(C)(=O)=O)cc2F)cc1 920260031 PNPAFNLARGHXBB-UHFFFAOYSA-N 415.512 2.084 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)cc1 920482046 DOBZWNGFEXGIIV-UHFFFAOYSA-N 423.516 2.158 10 20 HECD Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637525 IAEDOJGMTUINPZ-KGLIPLIRSA-N 420.487 2.495 10 20 HECD C[C@H](NC(=O)c1cccc(CN2C(=O)CNC2=O)c1)c1ccc(N2CCOCC2)cc1 920880347 GLNPKVADFOWGPH-INIZCTEOSA-N 422.485 2.066 10 20 HECD CC(C)CN1C(=O)/C(=C\NC[C@@H](c2ccccc2)N2CCCC2)C(=O)NC1=S 920980669 VPMVUKDFIBTKTP-FSEPTYSPSA-N 400.548 2.196 10 20 HECD CCCN1CCCC[C@@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1318669552 BJNYRPLRRXLERT-HXUWFJFHSA-N 421.513 2.086 10 20 HECD CCC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510618 UDXOJPFBZHYZJQ-IMAOXBOFSA-N 418.490 2.083 10 20 HECD Cc1c[nH]cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285925 LBZOQVZBEZBWHC-NCSLWMNCSA-N 411.458 2.405 10 20 HECD CC(C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815591724 YCTSQTJPNFOMLC-CQSZACIVSA-N 417.466 2.337 10 20 HECD O=C(Nc1ccc(-c2nc(CC(=O)N3CCSCC3)no2)cc1)C1=S=CC=C1 445544070 ZHCHTLOKSQAHNM-UHFFFAOYSA-N 414.512 2.071 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 726563123 VHYDWBIFRVQGNM-YSSFQJQWSA-N 413.518 2.344 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)CC2)cc1 726632487 XDSMKTQNXWAALC-UHFFFAOYSA-N 423.922 2.395 10 20 HECD Cn1ccnc1COc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 727483255 AHIZDCDWEIFJMC-UHFFFAOYSA-N 416.459 2.329 10 20 HECD CC[C@@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 730191384 VRQQHKQKOLICAW-KECPUOCWSA-N 423.585 2.467 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1 734072518 DVDXGQHXKGCHHQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC[S@](=O)C(C)(C)C)cc2F)CC1 735110869 MKVJLZUOVZIAFY-NDEPHWFRSA-N 412.575 2.314 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c(Br)c1 737285474 CWNHPRQXUUDTBJ-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CS(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739765365 HKPRLUAZBZOAKX-UHFFFAOYSA-N 401.488 2.044 10 20 HECD CN(C)CCN(C[C@H]1CCCO1)C(=O)NCc1ccc(N2CCSCC2)cc1 745593827 YJCSQJSGJGKBAI-HXUWFJFHSA-N 406.596 2.492 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCc2sccc2C1 749298840 PRKIOJPRGDILBG-UHFFFAOYSA-N 405.545 2.251 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCNS(=O)(=O)Cc2ccon2)c1 750082490 ZIZNQJXSQYSTAN-UHFFFAOYSA-N 416.503 2.240 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1 753645802 XTIYIVWVFRBQMP-AWEZNQCLSA-N 424.494 2.385 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCC[C@@H]3OC)CC2)cc(OC)c1OC 759297025 HGOSLHRTZMJXII-WBVHZDCISA-N 407.511 2.359 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)cc1F 760678792 SFVHCCHJZNHLPC-HNNXBMFYSA-N 418.473 2.207 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)CC3(C)C)cc2F)C[C@H](C)O1 766999843 XWSSAELPYLUMMC-IRXDYDNUSA-N 406.546 2.082 10 20 HECD COc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnc1Cl 767671145 ILRSISYGIDPIDE-UHFFFAOYSA-N 411.911 2.401 10 20 HECD COc1cc(O)c(CN2CCCN(S(=O)(=O)c3ccccc3)CC2)cc1OC 768443802 UEGCJXQGGQUAFH-UHFFFAOYSA-N 406.504 2.306 10 20 HECD CCOc1ccc(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c(O)c1 768549439 QEVOJDUJMITHHG-UHFFFAOYSA-N 411.568 2.418 10 20 HECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)C1=O 775837336 RKBIIENWUAXLDN-HJPURHCSSA-N 423.517 2.292 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 777884280 WIFRYFYLCUDDAU-UHFFFAOYSA-N 423.560 2.064 10 20 HECD CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 783150991 HLWBATVVQLXPBX-CQSZACIVSA-N 420.487 2.358 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3-n3cccn3)cc2)CC1 786660100 VJOKEORODODCIB-UHFFFAOYSA-N 403.486 2.471 10 20 HECD Cc1ccc(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(=O)n1C 787002290 VXBBNOBXVWFKGO-HOTGVXAUSA-N 416.497 2.446 10 20 HECD O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1ccc(N2CCCC2)cc1 787626223 LUXXFYWLEDEMMX-UHFFFAOYSA-N 406.530 2.078 10 20 HECD CN(C)c1ccc(CNC(=O)CN[C@@H](CO)c2ccc(Br)cc2)cc1 794827813 NOCUKNZIRFRFRR-SFHVURJKSA-N 406.324 2.455 10 20 HECD CCOC1CC2(CCN(C[C@@H](O)CN3CCN(c4ccc(OC)cc4)CC3)C2)C1 796527226 WVTPZACAZDTIDU-RBKXMNCYSA-N 403.567 2.069 10 20 HECD CCOC1CC2(CCN(C[C@H](O)CN3CCN(c4ccc(OC)cc4)CC3)C2)C1 796527228 WVTPZACAZDTIDU-RDABAPPSSA-N 403.567 2.069 10 20 HECD Cn1nncc1C(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 803225924 WPEAAXLHYPQSGM-UHFFFAOYSA-N 409.785 2.284 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(Cl)nc3C)CC2)cc1 804999928 MNZXQJZYMIEKRG-UHFFFAOYSA-N 424.954 2.153 10 20 HECD CC[C@@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007353 JBMFKJUDELFEHZ-KRWDZBQOSA-N 424.586 2.184 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCC[C@H]3C)cc2F)CC1 805007957 WGFMASUNEYLZRS-AEFFLSMTSA-N 404.530 2.136 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)sn1 806841974 CKLXBPAFPLLZRL-BETUJISGSA-N 406.483 2.459 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 809457847 KIOPWUFDQQVFPW-QGZVFWFLSA-N 405.564 2.272 10 20 HECD C[C@H]1[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1Cc1ccccc1 813824630 QDRQWTKUVSTQOL-KSSFIOAISA-N 403.504 2.157 10 20 HECD O=C(Cn1nnc2c1CCCC2)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 816889596 FASIXEPCOLCMSQ-UHFFFAOYSA-N 423.439 2.329 10 20 HECD CCN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1cccc(Br)c1 914515573 WOLRVVKQLZFNOR-UHFFFAOYSA-N 410.293 2.300 10 20 HECD CCOC(=O)C1CCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 917926937 VIPYJNLEIYYXBP-UHFFFAOYSA-N 409.552 2.237 10 20 HECD COCCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918224213 NJTIVRBOLSGYMY-UHFFFAOYSA-N 402.470 2.416 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(C(F)(F)F)cn2)c1 1124079938 VCIMBQNNFOUXFE-UHFFFAOYSA-N 403.382 2.150 10 20 HECD CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 1317920952 KGACXDNYVQAPHR-PXNSSMCTSA-N 420.513 2.155 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(-c2ccncc2)noc1C 1320399095 QHKJCLRNGHFICD-HNNXBMFYSA-N 411.414 2.360 10 20 HECD CCOC(=O)C1=S=c2nc(NC(=O)c3cc(C4CC4)nn3CC)sc2=C1C 1437303453 NDOVVJVBNZWVCA-UHFFFAOYSA-N 404.517 2.393 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)CC2)c1cc(O)nc(O)c1 1816720269 ILNGZCAHICMKEB-FRRDWIJNSA-N 414.487 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 26118080 ULYAOGRDKYLURT-UHFFFAOYSA-N 413.430 2.417 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2)cc1 57548365 VWYIVDIWVUHRIC-UHFFFAOYSA-N 424.545 2.175 10 20 HECD CC(=O)N1c2ccccc2C[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 726660187 SDTBFEWTWAKEBN-NRFANRHFSA-N 409.486 2.232 10 20 HECD Cc1n[nH]cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732215398 BUKRQVQVYFWXNU-UHFFFAOYSA-N 404.414 2.052 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3nc4c(s3)COCC4)cc2)C1 735576135 DGUGGPGKSDHXGX-CQSZACIVSA-N 415.519 2.239 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc([S@](C)=O)c3)CC2)cc1 737175336 YAALSFOKPAIRLW-LJAQVGFWSA-N 415.515 2.156 10 20 HECD Cn1cc([C@H](O)CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 745801182 WWEYKBNXUKKWAY-QGZVFWFLSA-N 409.437 2.023 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745819511 AATBVFARMADEJX-KBPBESRZSA-N 419.494 2.379 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccccc3C)CC2)cc1 747239769 COODLOYWHWQWJM-UHFFFAOYSA-N 403.548 2.494 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2c(c1)CCO2 751227260 GIJFANGTHXFKMY-UHFFFAOYSA-N 406.479 2.200 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)CC2)cc1F 753876134 JVMIIAYSCZHACF-UHFFFAOYSA-N 402.426 2.053 10 20 HECD COCC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 756374778 YOZJZHLJUYGEND-HUUCEWRRSA-N 410.486 2.271 10 20 HECD Cc1ccc([C@@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c(O)c1 756587557 BDKRXDRZQTVFFE-QGZVFWFLSA-N 403.548 2.488 10 20 HECD O=C(N[C@H]1CCc2c[nH]nc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 759098961 NFQYMMHEJYZWCR-LBPRGKRZSA-N 418.500 2.265 10 20 HECD COc1cc(N2CCN(C(=O)NCC3(N(C)C)CCCC3)CC2)cc(OC)c1OC 759280215 LYKQRHDKTILDEE-UHFFFAOYSA-N 420.554 2.418 10 20 HECD COc1cc(O)c(CN2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1OC 768443040 XTFQCJXOJMOUIM-UHFFFAOYSA-N 424.494 2.445 10 20 HECD O=S(=O)(c1ccccc1)N1CCCN(Cc2ccc(N3CCOCC3)cc2)CC1 769061922 ZHERVSQDXPYEGK-UHFFFAOYSA-N 415.559 2.420 10 20 HECD COC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 769137680 APXIWYXWPHNKBK-MRXNPFEDSA-N 412.490 2.050 10 20 HECD CS[C@@H](CO)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769340491 KYAPEHMKDRCJLO-YGRLFVJLSA-N 416.546 2.097 10 20 HECD CN(CCN(C)C1CC1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771573805 DPVVTNBUCIHTOJ-UHFFFAOYSA-N 409.533 2.421 10 20 HECD CCc1cnccc1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 779004578 WTONOGFNZYBPQL-CMDGGOBGSA-N 408.502 2.174 10 20 HECD COC(=O)[C@H]1CCN(Cc2cc(Br)cc(C)c2O)[C@@H](C(=O)OC)C1 780784032 NUUCVCXIZMOQJZ-SMDDNHRTSA-N 400.269 2.390 10 20 HECD CN(C[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 785444233 PSTWYIMMAPLXKN-SFHVURJKSA-N 418.538 2.227 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](c1ccccc1F)c1nccn1C 785608304 ZZRAXASKHRWAOZ-HXUWFJFHSA-N 423.492 2.489 10 20 HECD COC(=O)CCc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 786312004 NVEBTMLABIJSBH-CYBMUJFWSA-N 400.431 2.322 10 20 HECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787318483 FLLNDXLEAFXYDO-IBGZPJMESA-N 418.538 2.275 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1 787913398 QZAUKPUBZQIIHT-UHFFFAOYSA-N 406.490 2.443 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc2cccnc12 788318592 FHLIROGIPYYTEH-UHFFFAOYSA-N 404.470 2.004 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CCN(C2CC2)C1 788805433 LIZJROFDBFEFMQ-ZDUSSCGKSA-N 424.339 2.104 10 20 HECD CO[C@@]1(C)CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 791556088 KGAKFLDXYZFTBQ-NRFANRHFSA-N 419.547 2.425 10 20 HECD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 801907513 YWJQWERDUMWZIP-UHFFFAOYSA-N 402.426 2.455 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCOC3CCCC3)CC2)cc1 804018816 BFYULNKURYIGTK-UHFFFAOYSA-N 403.523 2.199 10 20 HECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NCc2ccc(N(C)C)cc2)CC1 806324133 ALDFOYZYFHNIHG-MRXNPFEDSA-N 410.584 2.344 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1csc(N2CCCC2)n1 806332425 COWRIXJPEXYENN-UHFFFAOYSA-N 415.563 2.093 10 20 HECD O=C(NCCCn1cc(Br)cn1)NCc1ccc(N2CCOCC2)cc1 806511166 FJIOBWVCVQTXEV-UHFFFAOYSA-N 422.327 2.372 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1 806821505 NOBAQWPMVGZCFP-MRXNPFEDSA-N 408.568 2.064 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCO[C@@H](C)C1 807925917 CABYFCJXGBISPE-IBGZPJMESA-N 418.582 2.107 10 20 HECD O=C(Nc1cccc2c1COC2=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 808919956 PGFHWOIWENVRGK-HNNXBMFYSA-N 410.426 2.209 10 20 HECD O=C(CCNC(=O)c1cccs1)NCc1ccc(N2CCC(CO)CC2)cc1 919968632 LLYYMBLPLJRCIA-UHFFFAOYSA-N 401.532 2.393 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccccc1NS(C)(=O)=O 1322681434 WJRCLZXBXSYRQN-UHFFFAOYSA-N 417.531 2.096 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC=CO1 1798411197 HVYQAYMTTXIYLS-MXJZGFGZSA-N 414.458 2.148 10 20 HECD C[C@@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1800199683 FTSCKERLERSCIP-MXASKKJJSA-N 411.458 2.212 10 20 HECD COCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291226 VRMSECUABKMJKV-ZDUSSCGKSA-N 408.842 2.427 10 20 HECD O=C1/C(=C/c2ccc3c(c2)OCCO3)SC(=S)N1CCCN1CCOCC1 28836198 PQEPWWMQRCNQDC-LGMDPLHJSA-N 406.529 2.381 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 36624906 ZHZWWLRKAFRANJ-UHFFFAOYSA-N 419.547 2.258 10 20 HECD CN(CC(=O)NCC(=O)Nc1ccccc1Br)Cc1ccccc1O 303362711 JKXICJREPUTBCB-UHFFFAOYSA-N 406.280 2.341 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 726726571 UIRGNHJDEMFBOJ-UHFFFAOYSA-N 411.458 2.190 10 20 HECD CC(=O)NCCCc1ccc(-c2csc(NS(=O)(=O)c3ccn(C)n3)n2)cc1 727246909 ZTJCWCAEJWQKBJ-UHFFFAOYSA-N 419.532 2.413 10 20 HECD CCc1cc(N2CCC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2)ncn1 732913986 FBRBUMHWKOWVQV-HXUWFJFHSA-N 424.549 2.344 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1 734072857 QUYGKQYOMWWPOT-UHFFFAOYSA-N 411.458 2.282 10 20 HECD CC(C)(C)c1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 737106732 AIDTVRIDGGEMAE-UHFFFAOYSA-N 415.469 2.005 10 20 HECD CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NCc3cccc(OC)c3O)c2)n1 737286306 UUSPFQPXPBGHPF-UHFFFAOYSA-N 422.441 2.381 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(N4C(=O)CCC4=O)cc3)c2)CC1 739768369 QSYMBAXTIMVABU-UHFFFAOYSA-N 420.469 2.294 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cs1 743253510 NZLBIUNUUUQITE-UHFFFAOYSA-N 424.909 2.360 10 20 HECD C[C@@H]1C[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C(=O)N1c1cnn(C)c1 745919907 XHZDDXOPXFZDFT-FOIQADDNSA-N 410.522 2.354 10 20 HECD COC(=O)[C@](C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 746474208 FGFBCHCOFIKNLC-HSZRJFAPSA-N 406.438 2.332 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccccc2O)ccc1NC(=O)c1cccnc1 748482640 WMUWALPSLYAKHP-UHFFFAOYSA-N 420.425 2.303 10 20 HECD C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 749296179 GICFZPRCSYUFQW-AWEZNQCLSA-N 418.519 2.114 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(C(F)(F)F)CC3)CC2)cc1 754049743 KPLVPEFDTYLXDM-SFHVURJKSA-N 401.473 2.452 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc(F)c1F 756172567 HEADJDYSUKUYAX-UHFFFAOYSA-N 402.394 2.435 10 20 HECD O=C(CN1CC(=O)N[C@@H]2CCCC[C@H]21)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 758780905 UWNVQMSRHRCNEM-WOJBJXKFSA-N 417.465 2.144 10 20 HECD CCc1nn(C)c(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1[N+](=O)[O-] 758941009 OHQXURKNWCLWIP-UHFFFAOYSA-N 405.455 2.243 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnc1Cl 760091775 FYPFLLHLOLHHCG-UHFFFAOYSA-N 402.882 2.477 10 20 HECD COC(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761523645 MWRVTZFVMQLVOK-RYUDHWBXSA-N 424.409 2.077 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1CC(F)(F)F 762561388 VDWAUOHVWNPCKK-HNNXBMFYSA-N 400.445 2.301 10 20 HECD C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cnn(C)c1 764351436 PZRSJBROOUHLIN-LLVKDONJSA-N 406.489 2.479 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 772448740 XKTLIGFHXJYXSH-QZTJIDSGSA-N 412.577 2.391 10 20 HECD C[C@@H](NC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(N(C)C)cc1 773135007 HBPZGULXDMMOFK-OAHLLOKOSA-N 401.511 2.368 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCc2ccncc2)cc1 774361798 IYADRDXQPOEXEW-UHFFFAOYSA-N 407.426 2.369 10 20 HECD O=C1NC[C@H]2CN(Cc3cc(Br)cc(Br)c3O)CCN12 775736478 GNNXJFHVWMIYAD-JTQLQIEISA-N 405.090 2.127 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc4c(c3)CCO4)CC2)cc1 778255891 ZKNSHEMHKTVSFB-CMDGGOBGSA-N 421.497 2.151 10 20 HECD CC(C)N1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1=O 779982520 ZSEZCCIXSBPPDD-HOTGVXAUSA-N 406.502 2.202 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc4c(c3)NC(=O)[C@H](C)N4C)c2)CC1 781045596 LSOHSVLPCOCUIF-HNNXBMFYSA-N 421.501 2.384 10 20 HECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 783191392 QQSFLBDLEGSJQU-UHFFFAOYSA-N 406.504 2.376 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 785295595 WYTUVSXZIXBQMZ-RDTXWAMCSA-N 414.458 2.342 10 20 HECD Cc1cccc(Cn2nccc2NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785305324 XGRCQSOABICDQL-HNNXBMFYSA-N 408.458 2.337 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c(F)ccc(OC)c3OC)CC2)cc1 788173463 MFEHQXILGOUWIA-UHFFFAOYSA-N 417.481 2.404 10 20 HECD CN(Cc1cccc(Cl)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310169 JCQIDSZKTNOCAY-UHFFFAOYSA-N 401.894 2.451 10 20 HECD CCOC(=O)C1(CC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCC1 789210305 WGGDLYVHYLAGIW-UHFFFAOYSA-N 420.506 2.485 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)c1cccnc1 789813813 VXPRAZRBQLOUDR-INIZCTEOSA-N 414.481 2.283 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(O)c1 794369938 KJVZDBUIFLFXLF-SFHVURJKSA-N 404.488 2.260 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnc(OCc2ccccc2)c1 800621557 XZHBCMGLFSJKSE-UHFFFAOYSA-N 407.426 2.369 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1COc2c(cccc2OC)C1 804673431 BZWDZIYUMXBPFI-GOSISDBHSA-N 411.502 2.230 10 20 HECD CCc1cc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n[nH]1 805846120 BABQXRKQFYIGCX-UHFFFAOYSA-N 409.490 2.476 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674604 NPRXODYCACAOPM-OAHLLOKOSA-N 406.527 2.255 10 20 HECD CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCSC1 807771867 YHQKRYCSNBHUIM-UKRRQHHQSA-N 413.490 2.337 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)cc1F 810362440 PMTWEOZFXSPVST-UHFFFAOYSA-N 414.437 2.258 10 20 HECD Cc1cccc2c1N(C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 918437822 BNIGVFCTSIUMMB-UHFFFAOYSA-N 411.477 2.301 10 20 HECD COc1cc(N2CCN(Cc3c(Cl)nc(OC)n3C)CC2)cc(OC)c1OC 1116583930 YTBKQVFBXSRZIX-UHFFFAOYSA-N 410.902 2.430 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 1319624714 VTRLBNBPQBSFLY-WOJBJXKFSA-N 413.518 2.299 10 20 HECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)s1 1794981745 LWEIBAHLEVMVJR-CLLJXQQHSA-N 423.585 2.169 10 20 HECD Cc1nocc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285310 KSLWKXUPBKUMKL-PLCSWTFUSA-N 413.430 2.065 10 20 HECD CC(=O)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822338709 CYWGMYWZNIKNRZ-ABAIWWIYSA-N 415.450 2.137 10 20 HECD CC1CCN(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)CC1 1845500586 RBHJDQHMLQGWFQ-UHFFFAOYSA-N 421.925 2.300 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2C[C@H]2C2CC2)=NN1c1ccccc1 1847485994 FKZGQPQFUXBDNJ-HNJRGHQBSA-N 406.486 2.027 10 20 HECD COC(=O)CCn1c(SCC(=O)c2ccc(O)c(O)c2)nc2ccccc2c1=O 5349525 XWRZDEPJFCBVAA-UHFFFAOYSA-N 414.439 2.346 10 20 HECD Cc1cc(C(=O)N2CCO[C@@H](C(N)=O)C2)c(C)n1-c1cccc(Br)c1 50844742 JZDIYNBCPKFFDD-MRXNPFEDSA-N 406.280 2.183 10 20 HECD O=C1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CN1CC(F)(F)F 97576261 GGTFXZSNELGVNL-HUUCEWRRSA-N 400.397 2.311 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3Oc4ccccc4O[C@H]3C)CC2)cc1 106213103 JWNCZEZKMCZATK-HTAPYJJXSA-N 411.502 2.162 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(-c4nnco4)c3)CC2)cc1 726725796 IIXNBUBXCPKCEO-UHFFFAOYSA-N 421.457 2.469 10 20 HECD COC(=O)Nc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 728470036 AVJQUEVPDPTSHB-UHFFFAOYSA-N 403.460 2.352 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741077361 QESSNSOLEUSBKX-JOCHJYFZSA-N 419.529 2.117 10 20 HECD Cn1nnnc1-c1cccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c1 742284563 ZZOKQCUYSVAMJX-UHFFFAOYSA-N 412.519 2.346 10 20 HECD O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1c(O)ccc2c1CCCC2 745522928 VQGPIJFJGOSIBG-UHFFFAOYSA-N 417.531 2.190 10 20 HECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 747011716 ISVGFFBIYVUILQ-UHFFFAOYSA-N 402.470 2.087 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 758224166 OLIAPRYZSOGGOC-SFHVURJKSA-N 401.463 2.474 10 20 HECD COc1cc(N2CCN(Cc3nnc4n3CCCCC4)CC2)cc(OC)c1OC 759872756 OOKJICFTUBTJLV-UHFFFAOYSA-N 401.511 2.353 10 20 HECD CC(=O)c1cn(CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)c(=O)n(C)c1=O 760422701 UCSLPCNTTINVKZ-UHFFFAOYSA-N 411.433 2.488 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)[C@H]4Cc5ccccc5CN4C3=O)cc2)C1 761117169 DMYXLYHUIJKBEE-TZIWHRDSSA-N 418.497 2.277 10 20 HECD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)n1 772773761 DRJSYEGMMBXIAD-FNORWQNLSA-N 423.429 2.194 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773750747 WLLIDTXRSRPYJO-QAPCUYQASA-N 418.515 2.307 10 20 HECD CC[C@H]1CN([C@H](CC)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 774015060 WRWIWNYLUXQFER-AZUAARDMSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nnc(C4CC4)s3)CC2)cc1 778241954 IXIJPPORGUNSRW-CMDGGOBGSA-N 413.503 2.268 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H](c4cc[nH]n4)C3)CC2)cc1 778244076 OPOLFLPWQANWRA-GFOMBABLSA-N 423.517 2.029 10 20 HECD CNC(=O)CCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781234456 OYSMPOQVQKZZIE-CYBMUJFWSA-N 422.437 2.249 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 785295592 WYTUVSXZIXBQMZ-KBXCAEBGSA-N 414.458 2.342 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785298025 UHFHVMYJHJHTSP-ZDUSSCGKSA-N 414.458 2.234 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(C(F)(F)F)n1 786294954 YNPIDWCUKUPNLB-UHFFFAOYSA-N 408.380 2.192 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cccc1N1CCNC1=O 787561044 ZFWNARBNDMPVSS-HNNXBMFYSA-N 409.490 2.407 10 20 HECD Cc1csc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)n1 788913254 WIEGIWSMZBHRHH-UHFFFAOYSA-N 413.547 2.017 10 20 HECD C[C@H]1CCC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832629 BLRRQDZBMLMJKC-DOTOQJQBSA-N 405.514 2.440 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2cccc(OC)c2O)c1OC 790213541 OSRJSIWPCZULAC-UHFFFAOYSA-N 415.851 2.328 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nnnn1C1CC1 790220133 UAPMLWHDKXQOSR-MCIONIFRSA-N 417.489 2.321 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@@H]3C[C@H](C)O)CC2)cc1 790687998 WMZIVARLLOWSTI-AZUAARDMSA-N 404.555 2.152 10 20 HECD C[C@H](O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 793642539 KLIHPYSFLZBXKM-OXJNMPFZSA-N 412.486 2.270 10 20 HECD COc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 793861588 ICCYVOOGCXHZKF-UHFFFAOYSA-N 409.486 2.273 10 20 HECD COc1ccc(CNC(=O)[C@@H](CCSC)N2C(=O)c3ccccc3C2=O)c(O)c1 794388257 SSMGADWLHYSINI-QGZVFWFLSA-N 414.483 2.435 10 20 HECD Cn1nnc2c(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccnc21 800903332 VVCLOMDLEAKMNV-LBPRGKRZSA-N 402.405 2.364 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@H](O)c3ccccc3)CC2)cc1F 803661608 HKHRDNIOGPDUSQ-OAQYLSRUSA-N 413.493 2.480 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)o1 803685822 MLPGXGLIUJVLFS-UHFFFAOYSA-N 412.534 2.177 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCSC[C@@H]3c3nccs3)ccc21 803686108 WFPPRIPIPRHJPJ-QGZVFWFLSA-N 416.572 2.458 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCc4ccc(O)cc4C3)CC2)cc1 804315883 UHKVDYSBANBVSM-UHFFFAOYSA-N 409.486 2.071 10 20 HECD O=C(NCCS(=O)(=O)NCC1CCC1)NCc1cc(Cl)cc(Cl)c1O 805097590 SVPJMRGTLXEYFN-UHFFFAOYSA-N 410.323 2.218 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCOC[C@H]3C)CC2)cc1 805820943 AOMZPZSUGTVIIT-MOPGFXCFSA-N 404.555 2.179 10 20 HECD CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)NCc1ccc(N4CCC(O)CC4)c(F)c1)C[C@@H]3C2 806457860 SMDKQICCJHNSNM-BRYJNJBFSA-N 403.498 2.352 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12 807286991 GANJMMKSAQUNMT-KZNAEPCWSA-N 403.573 2.175 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H](c4ccccc4)OC3=O)CC2)cc1 809679956 JFAKRPVVKHMGRD-VXKWHMMOSA-N 423.513 2.238 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)c1 810112450 VFMFOOUKSXGUSW-UHFFFAOYSA-N 401.532 2.498 10 20 HECD NS(=O)(=O)c1cc(F)c(NCCc2ccc(O)c(O)c2)c(Br)c1 811811108 LOOGVXDHQAOPMJ-UHFFFAOYSA-N 405.245 2.301 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](n4cccn4)C3)cc2F)C[C@@H](C)O1 812874736 FOVSVTKQUUWEQD-ZHALLVOQSA-N 415.513 2.199 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCO[C@H](C(C)C)C3)CC2)cc1 819406825 WQGOXWASIWAQHN-YUQDSPFASA-N 415.534 2.174 10 20 HECD CCNC(=O)CN(CC)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 917173823 ICSZPRFLEBZJBO-AWEZNQCLSA-N 407.470 2.247 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442474 LXDVYORCEYLXHN-UHFFFAOYSA-N 424.501 2.109 10 20 HECD O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969752 YHIWTHHDEVJMAD-HXUWFJFHSA-N 413.449 2.193 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ncoc3[C@@H]3CCCO3)CC2)cc1 1328473535 UHAFOVXOTBJJMM-KRWDZBQOSA-N 415.446 2.040 10 20 HECD O=C(NC[C@H]1CCN(C(=O)/C=C/C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993734 MZUBUXGAETXXDG-KYNLDRKZSA-N 408.458 2.174 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc(F)c2Cl)C1 1845369385 NOVOYWOMNIECOP-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CC(=O)NCC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1845991335 AASHTLIUQZLSQK-UHFFFAOYSA-N 408.502 2.047 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)n1cccc1 1846540774 QRFJRZDJLCGHBT-QGZVFWFLSA-N 419.485 2.045 10 20 HECD CCN(CC)S(=O)(=O)N1CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 14305022 OPLITYRSRBUDFP-UHFFFAOYSA-N 407.536 2.258 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN([C@H]4CCS(=O)(=O)C4)CC3)c2C)c1 109108085 UAFRLKOSIDWBKS-FQEVSTJZSA-N 415.559 2.347 10 20 HECD CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NCc1ccccc1O 109678071 JEXOWNFNGSUELF-OAHLLOKOSA-N 412.508 2.248 10 20 HECD O=C(COc1ccccc1CNCc1cc([N+](=O)[O-])ccc1O)NC[C@H]1CCCO1 725848181 LAEPKAJDXOGJQQ-GOSISDBHSA-N 415.446 2.264 10 20 HECD NC(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1-c1ccccc1 735520107 WAQWTICYVJCXKD-SFHVURJKSA-N 420.469 2.498 10 20 HECD CN(C)CCN1C[C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 735877591 ICDGNJXHHOZRCX-IBGZPJMESA-N 400.567 2.482 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)[C@@H](C)c3ccc(C)cc3)nc12 745755546 ZTFHRDWDUORIRJ-SCLBCKFNSA-N 413.430 2.128 10 20 HECD CN1CCCc2cc(CNC(=O)NCC3(NS(C)(=O)=O)CCCCC3)ccc21 746980916 BMEKHAMFLPHVJW-UHFFFAOYSA-N 408.568 2.120 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCOCC3)cc2)C1 747124321 RZQKMSMIVMCHAZ-LJQANCHMSA-N 422.529 2.155 10 20 HECD CC(C)COC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 749180076 ZKDSYYOGJJNCLV-UHFFFAOYSA-N 404.511 2.143 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c1 749564518 CWBJQKZSJFQXBE-UHFFFAOYSA-N 410.518 2.212 10 20 HECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1Nc2ccccc2S(=O)(=O)N1 749931747 VYPDCNRQTNHJKK-LJQANCHMSA-N 400.504 2.023 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NCc2cccc(Br)c2O)C1 765516918 RKTMRSCIIBGULZ-RYUDHWBXSA-N 405.314 2.310 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)Cc1ccc(F)cc1 766763891 LOJMXFBSPXRASG-SFHVURJKSA-N 419.472 2.329 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](O)c3cccc(C)c3)CC2)cc1 767939710 NZFATIKUDZZTPU-QFIPXVFZSA-N 412.534 2.158 10 20 HECD C[C@H](O)C[C@H]1COCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 768328590 VZBJYHDXMUQETH-YOEHRIQHSA-N 413.465 2.438 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4cc[nH]c34)CC2)cc1 773269264 OELUOHOGZMNYEP-UHFFFAOYSA-N 421.501 2.053 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cnc(C2OCCO2)s1 773980461 VKCJCHPYMCUCQG-UHFFFAOYSA-N 403.504 2.327 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 774363358 JDYBOODPSXFZTE-UHFFFAOYSA-N 418.453 2.310 10 20 HECD O=C(NCCc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774460851 QMKANDVOXIXTRQ-UHFFFAOYSA-N 420.557 2.194 10 20 HECD C[C@@H](NC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 776127040 KLTLBSPULYCGNZ-GOSISDBHSA-N 424.549 2.247 10 20 HECD C[C@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 777720576 HVEQOMGYUZDAQU-JTSKRJEESA-N 418.559 2.485 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC(=O)NCC1CC1 778209303 KQFINBQGILYUTJ-ZROIWOOFSA-N 423.585 2.372 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc4c(c3)COCC4)CC2)cc1 778423937 YZJWJZQTPIMIOT-VOTSOKGWSA-N 422.485 2.006 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(Cc3cccc(F)c3)no2)c1 783153295 UYZUCGPRHBBPPU-UHFFFAOYSA-N 421.406 2.234 10 20 HECD C[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@H]1CO 785865074 VPKPDGDEVXIINN-GUYCJALGSA-N 401.429 2.454 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)nc4c3c(C)nn4C)cc2)CC1 786261372 CEKVKWSZSJCTMX-UHFFFAOYSA-N 420.517 2.184 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCSC(F)(F)F)CC2)cc1 788539912 PFUVDXOSHCJJSA-UHFFFAOYSA-N 405.442 2.103 10 20 HECD CCOc1ccc(O)c(CNc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1 796393271 YAEGSLPFGLMPLQ-UHFFFAOYSA-N 422.503 2.433 10 20 HECD CC[C@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(F)cc1O 796693801 JHVNPQCBDZGVCJ-SFHVURJKSA-N 422.526 2.119 10 20 HECD COC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 803448552 UCUIFQCCPDHDDN-UHFFFAOYSA-N 411.449 2.058 10 20 HECD C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662868 IMENHFBYIGRTPC-MMEWPQADSA-N 419.522 2.465 10 20 HECD CN(C[C@@H](O)C(F)(F)F)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677553 QNTSXGLNARVJKY-QGZVFWFLSA-N 415.456 2.453 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H]1OC 804315067 DOOMDYZQDGYTAF-WOJBJXKFSA-N 417.550 2.490 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NCc2cc(OC)ccc2O)s1 806809948 FAOYEPKFZRPHGG-WDEREUQCSA-N 407.496 2.277 10 20 HECD CN(CCCNC(=S)Nc1cccc(CN2CCNC(=O)C2)c1)c1ccccc1 812264628 ARHSENUHGBMACJ-UHFFFAOYSA-N 411.575 2.431 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 915922995 RXJCWNNOVXKPLG-WOJBJXKFSA-N 405.539 2.440 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4)CC3)cc2)C1 918116860 BPZUKXAVNTWWGQ-HXUWFJFHSA-N 421.545 2.420 10 20 HECD CCC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1800478168 VSNNMOADMRRWPK-HATOLVCRSA-N 423.513 2.276 10 20 HECD NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 16218266 IUBSXYBIOIGFAI-UHFFFAOYSA-N 419.847 2.348 10 20 HECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 726277607 OQQRSXRZYAASFJ-NRFANRHFSA-N 415.582 2.369 10 20 HECD CN(C)CCc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 728140076 OXRJKKIKHOMJFP-UHFFFAOYSA-N 424.545 2.224 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c1O 737285126 ZPHJXCZCFPEDAU-HUUCEWRRSA-N 413.474 2.269 10 20 HECD CCCCN(C)C[C@@H](C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 753017395 HKGIFWJLUHETRG-YAINUAMHSA-N 416.566 2.137 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccnc(C(=O)N(C)C)c2)cc1F 754935862 AFZFXRABJBRLIN-UHFFFAOYSA-N 415.469 2.024 10 20 HECD COc1cc(N2CCN(C(=O)CCn3nc(C)cc3C)CC2)cc(OC)c1OC 759222751 WQKJYCSREWBETH-UHFFFAOYSA-N 402.495 2.265 10 20 HECD CN(C)c1ccc(CNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1 760798484 GNVJITIZRUOCMZ-SFHVURJKSA-N 418.538 2.275 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@H]([C@@H]4CCCOC4)C3=O)cc2F)C[C@@H](C)O1 761097486 IYTGGXSRDMZVAO-QHHYFVSCSA-N 405.470 2.286 10 20 HECD CC(C)C(=O)NCCN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767773369 DGGRYGCFGFYJPR-UHFFFAOYSA-N 407.470 2.105 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(C)ccc3S(N)(=O)=O)c2)CC1 771636999 MJTBANRGQYANRL-UHFFFAOYSA-N 402.520 2.037 10 20 HECD Fc1cc(CNc2cnn(Cc3nnc4n3CCCC4)c2)ccc1N1CCOCC1 775032665 IUWAMCAVLSMLON-UHFFFAOYSA-N 411.485 2.447 10 20 HECD C[C@H](NC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N(C)C)cc1 775404816 PDCRSIQAYCARHC-INIZCTEOSA-N 417.531 2.265 10 20 HECD COC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 777899393 XHTJDGLWFXCOLA-UHFFFAOYSA-N 423.466 2.319 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 778869649 DGSBMFSOLGQQEY-UHFFFAOYSA-N 422.533 2.442 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 779062623 YLGTXUZERUVLQI-SFHVURJKSA-N 423.579 2.411 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3CN3CCOCC3)c2)CC1 781271734 OXVFDDHXGNYGJE-UHFFFAOYSA-N 422.529 2.440 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 782371289 DMZBJZBYZTYBDN-UHFFFAOYSA-N 421.471 2.476 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cc(Cl)cc3c2OCC3)SC1=S 782887367 MKWVIUKTZADQLS-XYOKQWHBSA-N 418.949 2.025 10 20 HECD COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296553 GHIQYTBPQHYFME-JTQLQIEISA-N 406.822 2.224 10 20 HECD Cc1cccc(C(=O)N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)c1 785432319 AIYBRQGNZNVVTR-UHFFFAOYSA-N 422.529 2.052 10 20 HECD O=C(COC(=O)c1cc(O)ccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 785869647 IQYBSIRQGJWDTM-UHFFFAOYSA-N 422.840 2.495 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(N2CCCCC2)nc1 787204545 ZBSIZCFOXBCBIW-UHFFFAOYSA-N 419.529 2.381 10 20 HECD COc1ccc(/C=C/C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1O 787319148 KVMMDJNCDFDAKK-UXBLZVDNSA-N 409.486 2.399 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccc(F)cc2)N(C)C)cc1F 787642980 XGMZYSSVUQXBHI-IBGZPJMESA-N 404.461 2.066 10 20 HECD C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788311221 RXKAVFXPYHIKBA-UTKZUKDTSA-N 408.502 2.144 10 20 HECD CCCc1csc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 789371381 WBKMWYKNHLDKAX-UHFFFAOYSA-N 406.483 2.326 10 20 HECD Cc1ccc(F)c(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789801025 YTDZTCJFNFHXER-UHFFFAOYSA-N 417.456 2.385 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1 796322909 LQBQLSIBBQBYAD-SFHVURJKSA-N 406.548 2.406 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3c(F)cncc3F)CC2)cc1 796626707 PMSNIEWKCDXDGM-WBVHZDCISA-N 406.477 2.202 10 20 HECD CCC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803679797 VYYHDBKJTHQHBC-GOSISDBHSA-N 414.550 2.199 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1csc(N(C)C)n1 806664769 ZDXLAPBPKDCMKH-UHFFFAOYSA-N 415.563 2.474 10 20 HECD COC1CCC(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 806944478 WMJJIGSYWKMPFB-KVZIAJEVSA-N 404.507 2.221 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1 807097105 KBBHEPSUGXCFOH-PKOBYXMFSA-N 400.567 2.446 10 20 HECD CN(C)CCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 807289488 WPSWYYONFSPWGH-UHFFFAOYSA-N 406.530 2.100 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nc(-c2cccc(F)c2)no1 808734700 DXPIKYLEOLMGFC-UHFFFAOYSA-N 411.437 2.217 10 20 HECD CC(C)NC(=O)C(=O)N1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809540754 HJKGQWJWXNKUKT-UHFFFAOYSA-N 420.557 2.418 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1 810304995 AIPBSJXSBKQMKH-UHFFFAOYSA-N 422.503 2.127 10 20 HECD CCOCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 812007569 YCMIEUVOSXJDDW-ZDUSSCGKSA-N 407.446 2.142 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3ccn(-c4ccccc4)n3)nc12 917160685 NWZDITAJIQVBPE-UHFFFAOYSA-N 406.446 2.429 10 20 HECD CCOC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 919969220 QNMMENGKQFFRFP-LJQANCHMSA-N 403.523 2.380 10 20 HECD CCCCC[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790892359 CEEJWDMGUHMZLP-FZCLSBEQSA-N 419.522 2.303 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1 1795013150 DHNXHGOJDIFRIK-BJKLQHCMSA-N 409.442 2.164 10 20 HECD Cn1cncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715590 HEQULTBQGGZNFG-CLLJXQQHSA-N 404.854 2.050 10 20 HECD C/C=C/C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814165398 FLTKNDZJGCDBRT-WZXFWBCVSA-N 423.469 2.494 10 20 HECD O=C(CCc1ccc[nH]1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817530691 YAANDGXUFRHSFK-MRXNPFEDSA-N 424.461 2.483 10 20 HECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccn1 1847038265 HRUZDXHKYOXNFP-GQCTYLIASA-N 409.442 2.037 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)c1 728979788 MXFGLYWDTAGXNC-SNVBAGLBSA-N 408.838 2.418 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)cc([N+](=O)[O-])c3)nc12 731529319 WRVORODTCQEQOZ-UHFFFAOYSA-N 404.310 2.016 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(NC(=O)COC(=O)c2cc(O)cs2)c1 731910743 BLURGALSYFWORQ-UHFFFAOYSA-N 412.489 2.280 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@H]3CCCC[C@@H]3C)CC2)cc1 733571765 PGROVPPAIUCEKM-PXNSSMCTSA-N 404.507 2.482 10 20 HECD C[C@@H](c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1)N1CCOCC1 737080052 WTMFPODVYYKHBQ-KRWDZBQOSA-N 410.518 2.401 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1 741704543 VDVMDXRBUHGXSA-UHFFFAOYSA-N 413.503 2.463 10 20 HECD COCCN(CC(=O)NC(=O)NCc1ccccc1)c1ccc(OC)c(OC)c1 746474841 MQKMPTZDKFAYAW-UHFFFAOYSA-N 401.463 2.183 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)cc1 749254543 UNBSGANUMLTLEH-FXAWDEMLSA-N 411.506 2.036 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cc(OC)ccc2O)c(Br)o1 751418668 PVAMWHIUXYQEEK-UHFFFAOYSA-N 420.237 2.021 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3sc(N)nc3C3CC3)CC2)cc1 758531883 DHLDLRHBDUNSRL-UHFFFAOYSA-N 416.503 2.117 10 20 HECD COC(=O)C1=C(COC(=O)c2cccc(O)c2O)N(C)C(=O)N[C@@H]1c1ccccc1 758560653 IKCQKSDMBBYBGQ-QGZVFWFLSA-N 412.398 2.078 10 20 HECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1C 759512423 NMGKZZKGPCDTIW-UHFFFAOYSA-N 404.442 2.234 10 20 HECD COC(=O)[C@@]1(C)CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 759782572 BFXTVBUBRGOCLD-QHCPKHFHSA-N 406.438 2.286 10 20 HECD CC(C)Oc1ccc(N(C)CC(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 759915968 SZZGVDXWKINONC-AZUAARDMSA-N 424.563 2.105 10 20 HECD COc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1CC(=O)O 761296512 JBMNNBNVOGSCOS-UHFFFAOYSA-N 402.519 2.240 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN4C(=O)OC[C@@H]4C3)c2C)cc1 763715123 PQMWJGLPRUNDDZ-SFHVURJKSA-N 411.458 2.200 10 20 HECD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCCCCC2)cc1 765758885 MQNCJHONGRGADW-IBGZPJMESA-N 408.612 2.295 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CNS(=O)(=O)CC)c2C)cc1 767395073 ONYKZDGCEVYAKQ-UHFFFAOYSA-N 422.503 2.158 10 20 HECD O=C(COC(=O)c1ccnc(O)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 769054084 BHJKFHQACIFIRK-UHFFFAOYSA-N 402.362 2.358 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(c3cccc(F)c3)CCOCC2)c1 769922701 ABVFRDNSFSJGJU-UHFFFAOYSA-N 408.451 2.339 10 20 HECD COc1cccc(OC)c1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 772711276 PMRCUGRACCNXOD-UHFFFAOYSA-N 424.494 2.283 10 20 HECD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773741524 JPEKJMLXDCWECH-CQSZACIVSA-N 422.503 2.374 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)ccc1Cl 774357672 XCJORKANRWAJTA-UHFFFAOYSA-N 406.822 2.225 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1Cc2ccccc2C(=O)O1 777825956 BXNWKHLWFUOAKM-KRWDZBQOSA-N 403.818 2.329 10 20 HECD Cc1cnn(-c2c(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)c(C)nn2C)c1 778546492 NOHHEAQMCIXWTA-UHFFFAOYSA-N 424.505 2.104 10 20 HECD CCC[C@H]1C[C@@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 780157002 AVEBAIZTOOGYET-PXNSSMCTSA-N 404.507 2.482 10 20 HECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1N1CCOCC1 783629691 BLWNFZDFTOSYIZ-UHFFFAOYSA-N 405.476 2.161 10 20 HECD Cc1cc(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)no1 785964010 XJUKUEDKFUFVBQ-UHFFFAOYSA-N 404.378 2.483 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C)CC3)cc2F)C[C@@H](C)O1 789822961 XJVSDYVYBPWOJL-OWCLPIDISA-N 423.554 2.410 10 20 HECD CCCCCN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(C)C 793735890 ZIEUPLYKZZEMLQ-IBGZPJMESA-N 416.566 2.432 10 20 HECD Cn1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc2ccccc2c1=O 795396417 ILUGYAONBHBTAQ-SFHVURJKSA-N 418.497 2.170 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COC3CCC(C)CC3)CC2)cc1 795949385 HBNSNXPMTXGZLP-UHFFFAOYSA-N 404.507 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@](O)(C(F)(F)F)CC3)CC2)cc1 796450983 ZORDQPMISIZIER-LJQANCHMSA-N 415.456 2.123 10 20 HECD C[C@@]1(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803451692 SORIORHHPLDGOY-FQEVSTJZSA-N 411.449 2.058 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCOC3CCCC3)CC2)cc1 804018823 BKYOSGKNACOGMM-UHFFFAOYSA-N 403.523 2.246 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCC[C@H]3c3ncc[nH]3)CC2)cc1 804317318 ZRHRIZBXZDNPLF-IBGZPJMESA-N 411.506 2.257 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N(CCO)[C@@H]1CCc2ccccc21 806282823 VIXKJULJDSHXIG-MRXNPFEDSA-N 405.545 2.250 10 20 HECD O=C(COC(=O)Cn1cc(Cl)cn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808551154 QEVJWWHIDSDZIM-UHFFFAOYSA-N 423.812 2.494 10 20 HECD Cc1cnc([C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 808822764 DTJNNJJAJOMEBX-OAHLLOKOSA-N 416.547 2.166 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(OCC4CC4)nc3)cc2)CC1 1321090488 ZQWGTHRYYAJIEO-UHFFFAOYSA-N 408.502 2.469 10 20 HECD CCOC(=O)c1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 1344769226 AWKBXZPUQPJPAY-UHFFFAOYSA-N 407.467 2.350 10 20 HECD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c[nH]1 1816724718 CPUUFMSHXQZSCN-GFCCVEGCSA-N 413.459 2.125 10 20 HECD CCSc1cccnc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250405 UWZXFTQIQWBQSJ-UHFFFAOYSA-N 414.487 2.131 10 20 HECD Cc1nc(C)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)o1 1844481834 LCWKCSVVQCNCAK-UHFFFAOYSA-N 405.838 2.487 10 20 HECD COc1cc(C(=O)NCC(=O)NCc2ccc(N(C)C)cc2)ccc1OC(F)F 8171328 VZPJEARLNFLZOF-UHFFFAOYSA-N 407.417 2.409 10 20 HECD CCNC(=O)COc1cccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 472763207 AEZZCLWVYZEUMY-UHFFFAOYSA-N 422.485 2.257 10 20 HECD Cc1nc(C)n(C[C@H]2CCCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2)n1 579753082 XULXYEBWNDINIV-SFHVURJKSA-N 422.533 2.250 10 20 HECD Cc1cc(C(=O)CN2CCC(CCO)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730260168 BTYSMOCABZCOLN-UHFFFAOYSA-N 419.547 2.019 10 20 HECD COC(=O)CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 733613529 AKXLJFRFKHXYQM-IAGOWNOFSA-N 423.529 2.329 10 20 HECD COc1ccc(O)c(CNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1 734066128 PMTKCDUTXRXKGG-UHFFFAOYSA-N 413.474 2.100 10 20 HECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cc2)CC1 734701498 BAQINJNXDIXWKI-UHFFFAOYSA-N 423.561 2.458 10 20 HECD COC(=O)C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc21 743501987 UXHPEWVEKXBGDS-LBPRGKRZSA-N 404.444 2.071 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)CC3CCCCC3)cc2)C1 748714641 OKJWVYRCUOEJNN-LJQANCHMSA-N 414.550 2.091 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 749630165 YMNNQANRSTZRTG-UHFFFAOYSA-N 407.478 2.023 10 20 HECD COc1ccc(N2CCN(C(=O)CCn3cnc4sccc4c3=O)CC2)cc1F 753737771 DIVODQLBCMWXIH-UHFFFAOYSA-N 416.478 2.345 10 20 HECD COc1ccc(N2CCN(CC(=O)NC(=O)N[C@@H]3CCCC[C@@H]3C)CC2)cc1F 753856646 DNSPFEOXAKNXKP-MAUKXSAKSA-N 406.502 2.361 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(OC)cc3C(C)=O)CC2)cc1 758220960 ARCXMHWEIZNXNH-LJQANCHMSA-N 414.502 2.468 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@H](c4cccc(O)c4)C3=O)cc2F)CC1 761283582 SLGGGOTYESZTLX-HXUWFJFHSA-N 412.465 2.466 10 20 HECD COC[C@H](O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 765902293 BXSZODRKIBUITB-HLVNSREUSA-N 414.574 2.243 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)[C@H]1CN(C)CCO1 770436489 VWQSOPYBRLIXCY-MLGOLLRUSA-N 400.317 2.405 10 20 HECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 771008886 MWDNMMGFINGKQU-GOEBONIOSA-N 424.544 2.328 10 20 HECD COC(=O)c1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c(F)c1 772511761 RVJBYQCIMPKZDN-UHFFFAOYSA-N 415.465 2.173 10 20 HECD CCOC(Cn1ncc(C(=O)NCc2ccc(N3CCCC3)cc2)c1N)OCC 773794376 XQJKEYFAPZLLFJ-UHFFFAOYSA-N 401.511 2.395 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)c1 775035228 XVNAGHMSQCGEKG-MRXNPFEDSA-N 417.418 2.221 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H]3CCCC[C@@H]3S(C)(=O)=O)CC2)cc1 775365055 OLFXTXAEPYNGSX-RTWAWAEBSA-N 409.596 2.153 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](O)COc1ccccc1Br 779533271 HZTWRADNRLIZKS-CFNZNRNTSA-N 408.248 2.430 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1 785421274 BKKOGPUESFSALD-LJQANCHMSA-N 422.529 2.037 10 20 HECD Cn1ccnc1[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccccc1 785596806 BDPJQCADUCZRKI-HNNXBMFYSA-N 415.544 2.381 10 20 HECD C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 787914953 RCXKAIKFNYBMCJ-IAGOWNOFSA-N 406.546 2.382 10 20 HECD O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 789946242 BLEWOCBXRZMTJD-UHFFFAOYSA-N 402.378 2.457 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCS(=O)(=O)c2ccccc21 793457289 HPNNCOARMYMRBR-HXUWFJFHSA-N 414.527 2.443 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cn1 797647419 GDUXERPLIBTOBF-GFCCVEGCSA-N 422.507 2.322 10 20 HECD C[C@H](NC(=O)C(=O)NCCN1[C@H](C)CCC[C@H]1C)c1ccc(N2CCOCC2)cc1 803297604 BFDZISBSYSGXPS-QRVBRYPASA-N 416.566 2.080 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@H](Cc2ccncc2)C1)c1ccc(N2CCOCC2)cc1 803304251 FNTWVJDGFKZVJP-UYAOXDASSA-N 422.529 2.187 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@@H]1C 808851723 IXMGQTWQVJUYJV-OALUTQOASA-N 412.578 2.339 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(C(F)F)cc3=O)cc2F)C[C@@H](C)O1 813579340 ABFYAOPGBSOZOA-BETUJISGSA-N 424.423 2.250 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@](C)(O)c3ccc(Cl)cc3)CC2)cc1 815135252 SGVSGXOHZCBGDS-QFIPXVFZSA-N 417.937 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCO[C@@H](C(C)C)C3)CC2)cc1 819406823 WQGOXWASIWAQHN-LCCNJJIFSA-N 415.534 2.174 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1cccnc1-n1cccn1 918206405 COKKCFGKZOMVSU-UHFFFAOYSA-N 410.453 2.242 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(-n2cnnn2)cc1 918308821 QZEXDIMQNFJEIV-UHFFFAOYSA-N 419.489 2.250 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](O)COc1ccc(F)cc1 919907161 BFUKPLJEHKEVGC-QGZVFWFLSA-N 421.444 2.041 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCc3c(C)ncnc3O)cc2F)CC1 1116002520 OLYMZXKIKFKEAU-UHFFFAOYSA-N 401.486 2.021 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1789783903 HOQQGICHKPAJMT-VPBCXWTOSA-N 422.909 2.391 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1 1822569382 RKUFYGKMIXKXPR-SNVBAGLBSA-N 415.784 2.353 10 20 HECD Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)co1 1825953702 JBLADFAZTZVTSQ-KRWDZBQOSA-N 414.462 2.336 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2nccs2)CC1 1826110984 UFRYPDWFZQIXQB-HNNXBMFYSA-N 416.503 2.496 10 20 HECD O=C(/C=C/c1ccco1)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848232608 FZOGVSYYUXQVTD-MYQZKEJQSA-N 410.426 2.325 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](NC(C)=O)C3CCCC3)cc2F)CC1 303340494 VYKUNPLPSVZUFX-OAQYLSRUSA-N 404.530 2.279 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)[C@@H]2CCCN(c3cccnn3)C2)n(C)c2ccccc12 515324587 SFBUHKGYAIBQRM-QGZVFWFLSA-N 420.517 2.020 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H](C)c2nnc3n2CCCCC3)n(C)c2ccccc12 555896482 OSRPENILGGFTMX-OAHLLOKOSA-N 408.506 2.298 10 20 HECD O=C(COC(=O)COC[C@@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733592789 IGPQPDCHPITMHN-HNNXBMFYSA-N 423.421 2.139 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](OCCO)C1 734485688 PYGBMWRSPFDWTQ-DOTOQJQBSA-N 422.481 2.262 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H](O)C3CCOCC3)cc2F)C[C@@H](C)O1 736653247 LUZZDAQKSJYWRS-STXHMFSFSA-N 409.502 2.026 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC3(O)CCCC3)cc2F)C[C@H](C)O1 740984935 MJRHEJRUMOXZML-HOTGVXAUSA-N 422.497 2.294 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C 751716087 GVZYVKMJOLTYOC-MRXNPFEDSA-N 417.531 2.278 10 20 HECD C[C@@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)cc(F)c1O 756633695 KNRXPDAMPKOAQH-SECBINFHSA-N 422.276 2.052 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NCC3CCN(C)CC3)CC2)cc1 760468660 XNXVXUSNNCIQIP-UHFFFAOYSA-N 419.639 2.013 10 20 HECD CS(=O)(=O)c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 760999002 SQGAIRSGVRYYBO-UHFFFAOYSA-N 408.863 2.414 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCN3C(=O)CC[C@H]3C2)c([N+](=O)[O-])c1Br 765658490 VDCNUDITEUOWLR-QMMMGPOBSA-N 415.200 2.085 10 20 HECD Cc1ccc(S(N)(=O)=O)c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 767854532 ZWVKIEXAXGCBNY-MRXNPFEDSA-N 404.488 2.169 10 20 HECD CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCN(c2ccccc2)C1=O 769806389 TWBFQCGXIJHINH-QGZVFWFLSA-N 417.487 2.031 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CNS(=O)(=O)c2c(C)noc2C)cc1 770756983 YYRUWSXLLNGFJN-UHFFFAOYSA-N 408.524 2.075 10 20 HECD C[C@H](NC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21)c1ccc(N(C)C)cc1 773027510 WRXKTIUDLOJPKY-AWEZNQCLSA-N 400.504 2.011 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)c1O 774915118 RABICMWCKPVHBN-UHFFFAOYSA-N 418.425 2.204 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](CO)C3CCOCC3)cc2F)C[C@@H](C)O1 782502073 UCIUFCGKSDFLHF-ZRGWGRIASA-N 409.502 2.026 10 20 HECD C[C@H](NC(=O)COCCNC(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 783932882 GUFNQFUDSGAHCK-SFHVURJKSA-N 411.502 2.147 10 20 HECD COc1ccc(N2CCN(CCCNCc3cn(Cc4cccnc4)nn3)CC2)cc1 784496411 SZQLJGNMYXIKQA-UHFFFAOYSA-N 421.549 2.032 10 20 HECD O=C(COCCNC(=O)c1ccccc1)NCc1ccc(N2CCSCC2)cc1 784621988 JJBGCJHAMPKJOS-UHFFFAOYSA-N 413.543 2.303 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(O[C@@H]2CCOC2)c1 785432840 JCTOVCKTZZYYLE-HXUWFJFHSA-N 411.502 2.161 10 20 HECD COc1cccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)c1 785444240 QAUHIDZUQKQGAT-GOSISDBHSA-N 410.518 2.163 10 20 HECD O=C(NCCCOc1ccccc1)C(=O)NCc1ccc(N2CCSCC2)cc1 785588159 OLKGUMLFWGBAGR-UHFFFAOYSA-N 413.543 2.441 10 20 HECD Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 786225513 VSDYKDDMQFSYCF-IBGZPJMESA-N 415.509 2.498 10 20 HECD Cc1cnc(Cl)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 787875222 NCMBGYMYZLGTLJ-UHFFFAOYSA-N 420.872 2.399 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(O[C@H]4CCOC4)cc3)cc2)C1 788741448 GYBTYFZHNMAVDS-UGKGYDQZSA-N 423.513 2.486 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C)[C@@H](Cc4ccccc4)C3)CC2)cc1 792944860 YPGAGVKZDPTHAA-QHCPKHFHSA-N 422.573 2.203 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)n3)cc2F)CC1 792978903 JUSRBOOZFMTSSD-UHFFFAOYSA-N 419.888 2.271 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CC(C)(C)OC1=O 795654110 SQIXABSVAZGBGR-QGZVFWFLSA-N 406.438 2.426 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c(O)c1 797388318 XVGHUVCWBAFLTF-GOSISDBHSA-N 400.431 2.214 10 20 HECD CCN(CCc1nccs1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803299830 OBCRNGVZBWOZHD-INIZCTEOSA-N 416.547 2.248 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CC1 807481073 GTAPGYNAVPLUQL-SFHVURJKSA-N 418.538 2.131 10 20 HECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807677201 MRDCRDLMANLWAY-CVEARBPZSA-N 418.538 2.303 10 20 HECD CC(C)[C@@H](NCc1cc(Cl)c(F)cc1O)C(=O)N(C)Cc1nnc2n1CCC2 816594401 BXSSCRJBOWFUAB-GOSISDBHSA-N 409.893 2.495 10 20 HECD CCc1noc(C)c1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 817998749 MCURLVJKRWXWMU-MDZDMXLPSA-N 412.490 2.075 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccc(-n2cnnn2)cc1 916670337 HTWAEHKMQZRJTJ-UHFFFAOYSA-N 411.441 2.084 10 20 HECD CCOc1ccccc1C(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 917141615 JVKJDFQFGJRYAX-UHFFFAOYSA-N 424.545 2.226 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cnccn1 1800715902 WOOQRJIAYHHKGK-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C34CC(F)(C3)C4)CC2)C1 1810547345 LJKSJRXLDSKUSR-UHFFFAOYSA-N 403.454 2.230 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2ccc(=O)[nH]c2=O)c(C)n1-c1ccc(C(C)C)cc1 7190894 YGFVOBAMNNRUAU-UHFFFAOYSA-N 423.469 2.494 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)COc1ccc([N+](=O)[O-])cc1 8562759 IFBSAZNTEFHCOV-UHFFFAOYSA-N 401.419 2.241 10 20 HECD CC[C@@H](Nc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 729860938 JYMRNLAIKLUFKV-HXUWFJFHSA-N 401.532 2.428 10 20 HECD CCN1CCN(c2ccc(CNC(=S)NC[C@@H]3CCCN3CC)cc2F)CC1 730157663 VQXUBESGBGBBJS-SFHVURJKSA-N 407.603 2.416 10 20 HECD CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCC3)c2)cc1 741906432 LIDCDDZENODANQ-UHFFFAOYSA-N 415.515 2.401 10 20 HECD COc1ccc(N(C)CC(=O)NCC(=O)Nc2cc(C)ccc2OC)c(OC)c1 752109007 DVZHGDMCEZRWTF-UHFFFAOYSA-N 401.463 2.212 10 20 HECD COc1cc(N2CCN([C@H](C)C(=O)Nc3nccs3)CC2)cc(OC)c1OC 759879356 SBTSUVMDVOFDML-CYBMUJFWSA-N 406.508 2.318 10 20 HECD CCCn1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 762415007 XADDGUYHPDQKAD-HUUCEWRRSA-N 417.485 2.301 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cccc4nonc34)cc2F)C[C@@H](C)O1 765166688 KMEPYLJBQBPKQI-BETUJISGSA-N 420.466 2.454 10 20 HECD CC(=O)NCc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765928245 XDADLRMVTQILIN-UHFFFAOYSA-N 420.263 2.046 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1C1CCOCC1 766364529 LZKMKDKZCRVSPZ-UHFFFAOYSA-N 402.470 2.449 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)c([N+](=O)[O-])cc1OC 766924510 FYXZPLVVJVZLPZ-HOTGVXAUSA-N 420.510 2.239 10 20 HECD CCOc1ccc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c(O)c1 769023571 OIIAIQBJKRJMEB-UHFFFAOYSA-N 416.503 2.174 10 20 HECD Cc1cc(N(C)C)ccc1CNCc1ccc(S(=O)(=O)N2CCOCC2)cc1 769926782 BKCDSGAPGFRTJK-UHFFFAOYSA-N 403.548 2.372 10 20 HECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)c1ccc(NS(C)(=O)=O)cc1 772774099 GSYCHYLYSIURTB-LHJMJDNXSA-N 405.428 2.297 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccnc3Br)ccc21 774191608 ZQYCMJXHELXLQW-UHFFFAOYSA-N 403.280 2.481 10 20 HECD C[C@H](Cc1ncc[nH]1)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 782914090 ZCQNNQWGFBAQPJ-BZUAXINKSA-N 404.486 2.426 10 20 HECD C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785428311 KDTGFKSVIJOOMB-DOTOQJQBSA-N 418.538 2.131 10 20 HECD CC[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785526988 HPHNRYPGOXHMAA-NQIIRXRSSA-N 416.566 2.018 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(N4CCCC4=O)c3)cc2)CC1 786256588 GIJOICDCDQAFCI-UHFFFAOYSA-N 420.513 2.412 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(O)cc3)cc2F)C[C@H](C)O1 786626763 MVPQQYDZIAHVDH-GJZGRUSLSA-N 415.465 2.078 10 20 HECD CC[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842641 FJVZXFKJAMEOON-RDJZCZTQSA-N 405.514 2.488 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(-c4ncnn4C)cc3)CC2)cc1 790517100 ASMDICBOTKUIKP-UHFFFAOYSA-N 407.474 2.218 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1c1ccccn1)c1ccc(N2CCOCC2)cc1 803309995 FGMAQZZJGSIBLY-UWJYYQICSA-N 408.502 2.459 10 20 HECD CC(C)[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1nnc2ccccn12 804100983 KLJVCDFEFOKUJJ-AWEZNQCLSA-N 418.548 2.298 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(C)cc3OC)CC2)cc1 807695675 WZDKNJKGZJRGOM-UHFFFAOYSA-N 411.502 2.367 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)CC34CCC(CC3)C4)cc2)CC1 812508378 YCPGJPUSGYUNQT-UHFFFAOYSA-N 405.564 2.355 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 814269145 QYHCKRBWHPOTHE-UHFFFAOYSA-N 414.574 2.078 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(CO)(c4ccccc4)CC3)CC2)cc1 814647104 MWVBDBJLKBBAGC-UHFFFAOYSA-N 423.557 2.370 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(C(=O)N2CCCC2)CC1 916626104 VBSIHCVVULDMAL-UHFFFAOYSA-N 417.579 2.283 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3COc4ccc(F)cc4C3)nc12 1116401380 VBFQZAAOYALCJN-GFCCVEGCSA-N 415.377 2.045 10 20 HECD COC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787682956 HCRQFWDGPIKUKS-UHFFFAOYSA-N 413.430 2.194 10 20 HECD Cn1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)cn1 1788424252 MZTLKSOGAHUTBD-UHFFFAOYSA-N 407.430 2.288 10 20 HECD CC(=O)N/C(C)=C/C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791024775 SCSALEBZYIMZPE-JLHYYAGUSA-N 424.457 2.280 10 20 HECD Cn1cccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843997 MPXRALQWFRDLJW-AWEZNQCLSA-N 410.434 2.174 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1)c1cc(O)nc(O)c1 1817848725 ZHQASMSTJGGWRU-ZDUSSCGKSA-N 403.414 2.414 10 20 HECD CC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708591 JEZKEYDTQIESLN-SECBINFHSA-N 409.851 2.023 10 20 HECD COc1ccc(N2CCC(Nc3cc([N+](=O)[O-])cc(S(N)(=O)=O)c3)CC2)cc1 726594072 GRAVOCMXNOTZPG-UHFFFAOYSA-N 406.464 2.332 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN4CCC[C@H]4C3)cc2F)CC1 730117445 YJZBKZQNGQKWMG-MOPGFXCFSA-N 403.546 2.394 10 20 HECD CCn1c(COC(=O)c2cc(O)cs2)nc2cc(S(=O)(=O)N(C)C)ccc21 732353884 CJAYCWJEGDZGCB-UHFFFAOYSA-N 409.489 2.431 10 20 HECD Cc1ccc2c(=O)c(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)cn(C)c2n1 734035936 WNZWRAWTZGDETB-UHFFFAOYSA-N 422.485 2.123 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)c2cccc(OC(F)F)c2)c1 738631070 UORIOTKKILWUEI-UHFFFAOYSA-N 415.370 2.405 10 20 HECD Cc1nn(C)c(=O)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 744373181 UGRIJZXPOKRUSO-AWEZNQCLSA-N 406.433 2.397 10 20 HECD CCOC(=O)N1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 748460187 MAMCLVUBYRUEIX-UHFFFAOYSA-N 422.501 2.161 10 20 HECD CCOc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 748672169 DHIYENAJBSEAHH-UHFFFAOYSA-N 410.517 2.121 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)Cc2cc(Cl)cc(C(C)=O)c2O)C1 750044500 YIHRAAZNWPUSIW-AWEZNQCLSA-N 410.898 2.482 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751237131 NUNLQZWJHWEEKS-UHFFFAOYSA-N 417.531 2.332 10 20 HECD Cc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1S(N)(=O)=O 751293358 AQXZXVLDYJBRCJ-QGZVFWFLSA-N 404.488 2.169 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)N[C@H](C)c3cc(OC)ccc3O)C2)nc1 753281658 ZBXVKUKXCCVYIY-CYBMUJFWSA-N 414.462 2.222 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 753446233 JMFOZAWGFVAUGV-JMQGSBJISA-N 407.515 2.123 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)C3=CCN(C)CC3)CC2)cc(OC)c1OC 759298986 PKOBDOWXTQWXPU-MRXNPFEDSA-N 418.538 2.194 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 759577541 AVSXEJHUMVIOJB-HICRUJFJSA-N 410.470 2.433 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 770316517 QIVDVRTYHBUQLJ-UHFFFAOYSA-N 410.434 2.307 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 772929308 QYDYNKHXZHYMHG-GASCZTMLSA-N 400.454 2.398 10 20 HECD CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cc1 775286752 NEHWSEJGCBIJJT-UHFFFAOYSA-N 406.460 2.462 10 20 HECD O=C(COC(=O)c1cccc(Cl)c1O)NCc1ccc(N2CCOCC2)c(F)c1 775931700 AFCZSHPABYQMFN-UHFFFAOYSA-N 422.840 2.495 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCCN1C(=O)C(F)(F)F 776656999 DTTLDXVBFUKFPD-QGZVFWFLSA-N 413.440 2.065 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@](C)(O)c1ccc(S(C)(=O)=O)cc1 777543579 FLRJVXCSZFZPLH-QFIPXVFZSA-N 418.559 2.266 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4ccc(OC)cc43)CC2)cc1 779222528 PXMSJDGZFKZYNX-LJQANCHMSA-N 413.518 2.086 10 20 HECD CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785294843 OGHLVAMDGPCMFE-CQSZACIVSA-N 413.474 2.266 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c(O)c1 797640355 YDTUVJLPAXOONL-UHFFFAOYSA-N 409.439 2.302 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1 801242038 NOPXCIALZUHEHC-AWEZNQCLSA-N 418.471 2.083 10 20 HECD COc1ccc(OC)c(CCCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803662538 CTMVKDJIELHMIO-UHFFFAOYSA-N 417.481 2.274 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](CCc3ccccc3)C2)cc1F 803665032 RZYASRFAGAQXNM-IBGZPJMESA-N 413.493 2.368 10 20 HECD CC(C)[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1nnc2ccccn12 804101076 KXBZAZFLQPEKPK-BEFAXECRSA-N 408.506 2.486 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C)[C@@H](C)C3)cc2F)CC1 805006827 HLZNCDYMODHJCV-SJORKVTESA-N 404.530 2.088 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)[C@@H]1c1ccccc1 806276332 NBBIYRSXKDJTST-CVEARBPZSA-N 404.561 2.303 10 20 HECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F 806565992 WCKDGFQWUXMVCJ-AWEZNQCLSA-N 411.446 2.136 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc2nccnc2c1Br 806879339 BSQWIINLFGZFSU-UHFFFAOYSA-N 401.220 2.353 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387796 XQRZRQWZMXHXOQ-UHFFFAOYSA-N 407.220 2.196 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCSCC1 807768380 IMJZHJNKYUHOSQ-CQSZACIVSA-N 413.490 2.339 10 20 HECD COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NCc1cccc(OC)c1O 808295209 QQFFSDGNXVIQQH-UHFFFAOYSA-N 414.867 2.500 10 20 HECD Cc1cccc2c1OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 812009522 IHHYUKKYMHLALX-UXHICEINSA-N 422.529 2.500 10 20 HECD COC[C@@H](C)[C@H](C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 812479467 CJJUHEVHZDQCFZ-SJORKVTESA-N 415.513 2.477 10 20 HECD Cn1nc(C2CC2)nc1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472006 DMCMKSBNCLNCIQ-MRXNPFEDSA-N 403.914 2.375 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3O)cc2)C1 918672850 MBBSDPRGZPGKSW-CYBMUJFWSA-N 422.407 2.438 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnc(C2CC2)[nH]1 1323796971 IIUIMIMNHXRBOI-UHFFFAOYSA-N 421.480 2.473 10 20 HECD CC(C)CCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510541 OPWYGQJSJXOPOG-QNBZTBGESA-N 418.490 2.083 10 20 HECD Cc1nnsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800714959 PUCDUJWACXHURS-ZSBIGDGJSA-N 422.894 2.477 10 20 HECD CC1=C(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CCO1 1810543876 PQTOULOSPONQLT-UHFFFAOYSA-N 401.463 2.032 10 20 HECD Cc1ocnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819943941 ORPPCCUBEZJEQI-CYBMUJFWSA-N 412.406 2.132 10 20 HECD CN1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1841367432 ZODKVWPURBOOKR-HNNXBMFYSA-N 407.898 2.053 10 20 HECD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501852 KRVHWMZEHUMBGT-UHFFFAOYSA-N 420.809 2.118 10 20 HECD COc1ccccc1-n1nnnc1SCC(=O)N(C)Cc1ccc(N(C)C)cc1 15411065 BYZPEIFCLUIYBT-UHFFFAOYSA-N 412.519 2.488 10 20 HECD NS(=O)(=O)c1cnc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 301140491 HRZBBQJIKQRPIX-UHFFFAOYSA-N 422.454 2.258 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@H](C)C1 554111713 GYVDVQLDDXQQCN-OAHLLOKOSA-N 421.563 2.401 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)C2CC2)cc1 727038266 MUKJBDVLCNVCPI-UHFFFAOYSA-N 404.474 2.463 10 20 HECD COC(=O)c1nn(CN(Cc2ccc(N(C)C)cc2)C(C)C)c(=O)c2noc(C)c12 727165416 WXXAEUJOTUWULT-UHFFFAOYSA-N 413.478 2.414 10 20 HECD CCCOc1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 727176954 UMLQVAAUABBRJH-KAMYIIQDSA-N 400.547 2.226 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccnc3)cc2)C1 730422792 DCLKAQHOBCOWMM-QGZVFWFLSA-N 404.474 2.103 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ncn(C)c2Cl)cc1 740812812 CNKKQLCYXGVXSQ-UHFFFAOYSA-N 406.917 2.416 10 20 HECD CCOC(=O)CCS(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742334740 SNIFQAGVKVPRCO-CYBMUJFWSA-N 406.451 2.129 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3ccc(OC)c(F)c3)CC2)cc1 742927108 INTWOJRJGLCIQS-UHFFFAOYSA-N 401.482 2.324 10 20 HECD CNS(=O)(=O)c1ccc(CCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743719608 KWIWKWFTCPTTOM-UHFFFAOYSA-N 402.516 2.428 10 20 HECD C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743869480 QHHZUUSFUUFQEP-CQSZACIVSA-N 424.469 2.283 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)cc([N+](=O)[O-])c2C)cc1 746134816 SOJROUXUESQSPL-UHFFFAOYSA-N 420.491 2.327 10 20 HECD CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCc1ccccc1O 748349623 INCLJZNEMBLYQB-QGZVFWFLSA-N 408.545 2.417 10 20 HECD C[C@@H]1C(=O)Nc2cc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)ccc2N1C 750026079 BJUFFUICAWFZEL-CQSZACIVSA-N 421.501 2.417 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3c(OC)cccc3OC)CC2)cc1F 753856533 CLTRRDWJWDGKHW-KRWDZBQOSA-N 420.481 2.413 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 754020809 AZQMECSLMQFAFF-UHFFFAOYSA-N 420.579 2.232 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(N(C)C)nc3)CC2)cc(OC)c1OC 759220381 JVQIPOYFQJGLPT-UHFFFAOYSA-N 400.479 2.136 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc4c3OCO4)CC2)cc(OC)c1OC 759226563 ZIUISAWCLAFPGB-UHFFFAOYSA-N 400.431 2.404 10 20 HECD COc1cc(N2CCN(C[C@@H](O)COc3ccc(F)cc3)CC2)cc(OC)c1OC 759876813 CGLIAHHIKCDNLG-GOSISDBHSA-N 420.481 2.413 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCNC(=O)C3)c2C)cc1 761207707 OXFZDLMHLLZKLY-MRXNPFEDSA-N 412.442 2.133 10 20 HECD COc1ccc(N2CCN(CCN[C@H](C)c3ccc(-n4cnnn4)cc3)CC2)cc1 765401461 LGCHLPNBDLXSPS-GOSISDBHSA-N 407.522 2.144 10 20 HECD C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 765902738 FRWHTETWPTVHBL-OAHLLOKOSA-N 409.446 2.092 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)oc1C 766199606 GOHWXWXVFIJBHM-UHFFFAOYSA-N 404.238 2.321 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)COC(C)(C)C)cc2F)C[C@@H](C)O1 768933898 XGCKYMKXPLJJAE-GASCZTMLSA-N 424.517 2.369 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1F 770435690 STAVJDZSXFFWRL-UHFFFAOYSA-N 412.473 2.386 10 20 HECD COc1cccc(OC)c1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772875827 BBFRHLVUPGXJBJ-UHFFFAOYSA-N 404.438 2.375 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 772997766 HTKAXEQCXIXATM-MRXNPFEDSA-N 419.547 2.477 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1CN1CCOCC1)c1ccc(N(C)C)cc1 773846590 MSZWZQCBDWXANV-QGZVFWFLSA-N 410.518 2.401 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCc1cnccn1)c2[N+](=O)[O-] 775504866 CDNFPUCMTSUVFH-UHFFFAOYSA-N 402.366 2.133 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 777765188 IQWMESPPBBKINA-UHFFFAOYSA-N 410.584 2.344 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(CNC(N)=O)cc1 777828643 NOBDXLNRMOOEFH-UHFFFAOYSA-N 405.838 2.029 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 783311141 ZVUPKPZNULSZFC-UHFFFAOYSA-N 418.837 2.340 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(-c2nnnn2CC)c1 784024866 WYFVEGIQSUEYSS-UHFFFAOYSA-N 408.462 2.443 10 20 HECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 787709574 XWOBXCJRHPJUIY-RTBURBONSA-N 400.567 2.387 10 20 HECD O=C(NN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)c1cccc(O)c1O 790485005 XOIAYWJXBSVQIA-UHFFFAOYSA-N 403.394 2.238 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1F 803663303 MPEOQGNBLHFVJI-KRWDZBQOSA-N 403.454 2.309 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCSC[C@@H]1c1nccs1 807289119 JKLUGNVMFNFHGS-QGZVFWFLSA-N 414.556 2.452 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3sc(C)nc3C)CC2)cc1 807354609 MDYAUTHLNNWMIJ-UHFFFAOYSA-N 402.520 2.124 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CN(Cc3ccccc3)CC[C@H]2CO)c1O 809765253 LRLULFVJEIYSPG-ZWKOTPCHSA-N 401.463 2.282 10 20 HECD CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2ccc(N3CCN(C)CC3)cc2)CC1 809785776 BPOYBZXGRJIASH-IBGZPJMESA-N 422.639 2.320 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(C(F)F)cc3=O)cc2F)C[C@H](C)O1 813579342 ABFYAOPGBSOZOA-STQMWFEESA-N 424.423 2.250 10 20 HECD COc1cc(C)cc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1O 915798807 MSTRKNBPFYRDEC-UHFFFAOYSA-N 421.475 2.124 10 20 HECD O=C(NCc1ccc(-n2ccnc2)nc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918199526 FWESBMIUXHSPFL-UHFFFAOYSA-N 424.480 2.367 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(N2CCOCC2)c1 918265908 KXMCDNHBYNVDFB-UHFFFAOYSA-N 408.502 2.378 10 20 HECD COc1cccc([C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 919749951 JTIBIWTUHBOJRF-MRXNPFEDSA-N 402.516 2.350 10 20 HECD C[C@H](c1ccccc1)N(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 1319814777 XHPXCUBXSBUNGQ-VQIMIIECSA-N 402.516 2.259 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)[C@@H](C)c1ccc(C)cc1 1324120577 FYAZZDOETWYCLQ-VHFSOBRXSA-N 401.459 2.161 10 20 HECD CC1(C)CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)C1 1799770349 OWOZAASJJJXIBX-XOIINTDNSA-N 422.909 2.391 10 20 HECD COCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1800712327 GXMLVLGUKODVPD-BTTYYORXSA-N 408.882 2.430 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nc1 1847039071 KDYGDPUGNRXSGH-VMPITWQZSA-N 409.442 2.037 10 20 HECD CC(C)NC(=O)CN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 17306473 SBHLNDZTCHRUND-AWEZNQCLSA-N 407.470 2.245 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(NC4CC4)nc3)CC2)cc1 108801401 NNGFEERZIULZEY-UHFFFAOYSA-N 410.474 2.170 10 20 HECD O=C(CCCN1C(=O)CCC1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726567396 KFSMOHUDURCTQL-UHFFFAOYSA-N 409.433 2.302 10 20 HECD COCCOc1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)ccc1OC 729064666 URKLGCXKAFZCFN-CYBMUJFWSA-N 418.446 2.251 10 20 HECD CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCCN(S(C)(=O)=O)C3)cc2)CC1 731120218 QZUKGPULMFIVSM-GOSISDBHSA-N 408.568 2.146 10 20 HECD CCN(C1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1)S(C)(=O)=O 731360286 ZSTSDGTWSWNHGM-UHFFFAOYSA-N 408.568 2.242 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 732207228 SFVWKEXKJZBJSO-KRWDZBQOSA-N 420.554 2.189 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1 734074893 XPBMICYZGQFNTI-GOSISDBHSA-N 400.431 2.214 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CCO)c3ccccc3)cc2)C1 741080535 CHORHKQCNWYYFN-RTWAWAEBSA-N 424.545 2.354 10 20 HECD CCc1nncn1CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 743554680 KEDYOYJDTVIYMO-GASCZTMLSA-N 404.490 2.093 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 748706031 YYGNASKHFPITTH-UHFFFAOYSA-N 405.539 2.049 10 20 HECD O=C1NCCc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc21 751137690 UVKLFEZKGVCNIV-QGZVFWFLSA-N 416.499 2.048 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nccn2CCc2ccccc2)c1 751418784 QOLAFDQBHSDTDO-UHFFFAOYSA-N 414.487 2.133 10 20 HECD CN(C)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(F)c1 751642937 HYJDWGYLEDYBNR-UHFFFAOYSA-N 405.495 2.057 10 20 HECD CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)Nc2ccc(O)cc2F)c1 758169818 CZZIGRPAHKWIGP-UHFFFAOYSA-N 424.269 2.498 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCCS(=O)(=O)C1 758659279 RHURALXMTAYFMR-ZDUSSCGKSA-N 405.314 2.263 10 20 HECD CCNC(=O)c1ccc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1 758936349 PFZGPCMYUWESAU-UHFFFAOYSA-N 400.479 2.184 10 20 HECD COc1cc(N2CCN(C(=O)Nc3cccc(C(N)=O)c3)CC2)cc(OC)c1OC 759199040 KFGMLBGHPSCWJK-UHFFFAOYSA-N 414.462 2.165 10 20 HECD C[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@]1=O 759867107 INWAYJYUZADQTE-MMEWPQADSA-N 410.495 2.243 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3ccccc3)C(=O)C2)c1 764948995 HJAKDWYCMXDHBA-UHFFFAOYSA-N 423.513 2.276 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1OC 768451069 LSKLURBSGHVIIN-AEFFLSMTSA-N 405.539 2.222 10 20 HECD COc1cc(Br)cc(CN2CCC(N(C)S(C)(=O)=O)CC2)c1O 769125258 LRPHDJSYYQDQPE-UHFFFAOYSA-N 407.330 2.019 10 20 HECD O=C(Nc1cnoc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769740138 DKBUSKADUDIFGV-UHFFFAOYSA-N 404.360 2.342 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOCC4(CCCC4)C3)CC2)cc1 775847577 AOIJPCALJDLQPA-NRFANRHFSA-N 403.567 2.071 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccnc(C(=O)N(C)C)c1 783313512 BMCCOLDXOIKLMS-UHFFFAOYSA-N 411.506 2.225 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1(c2ccccc2)CC1 785864531 MDBAPDFTTGXGSA-UHFFFAOYSA-N 407.514 2.330 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)[C@@H](C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 788289440 VIDJQHJDFCLHDV-LXTVHRRPSA-N 400.516 2.125 10 20 HECD CCN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309227 DFOFXZKTJKTZGM-UHFFFAOYSA-N 401.532 2.292 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cscn3)cc2F)C[C@@H](C)O1 789822980 BZPBPNZRIMYBJI-ZIAGYGMSSA-N 420.510 2.171 10 20 HECD O=C(NCCOCc1ccccc1)C(=O)NCc1ccc(N2CCSCC2)cc1 789856308 RVZOGLCJZXMDTK-UHFFFAOYSA-N 413.543 2.189 10 20 HECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793715748 ABCFVHQAJOPYNV-NZSAHSFTSA-N 414.550 2.090 10 20 HECD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1ccc(N2CCOCC2)c(F)c1 794239862 WBZDULPYMSBYMT-MNZLEMJZSA-N 419.497 2.391 10 20 HECD CN(Cc1nccs1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451079 DGJUMXNJVBPGPS-UHFFFAOYSA-N 424.473 2.488 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677308 MEBBYVWEDDSWHO-UXHICEINSA-N 414.550 2.103 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 804845062 ZVHASXDXDSDTNR-KRWDZBQOSA-N 416.472 2.351 10 20 HECD CS(=O)(=O)C1(CNC(=O)NCc2cccc(Br)c2O)CCCC1 805839806 HTFQXLFXCGIVBS-UHFFFAOYSA-N 405.314 2.311 10 20 HECD CNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806457374 LAFFESYMKFFVEX-MRXNPFEDSA-N 408.474 2.082 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 806855747 XLORVQCGFUAGHM-UHFFFAOYSA-N 400.410 2.048 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807310066 YHYLEGWYIMTZIY-KDOFPFPSSA-N 415.490 2.252 10 20 HECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NCc1c(O)ccc3c1CCCC3)C2 807514671 MRLKMBMMEZJUAH-ROUUACIJSA-N 414.550 2.154 10 20 HECD COC1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 807768881 QCYHWXWAXSKIEC-CQSZACIVSA-N 411.449 2.058 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)cc1 808079150 QKHDQJNOAYWGSZ-XLIONFOSSA-N 417.550 2.444 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1 914849559 PDLVULGZNGECGC-UHFFFAOYSA-N 422.460 2.480 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc2c(c1)C(=O)OC2 917864018 DRNDGUIZXQTAHE-UHFFFAOYSA-N 402.472 2.014 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc4cnccc34)cc2)C1 917930262 OOKZLOBBLZNCDH-SFHVURJKSA-N 424.526 2.415 10 20 HECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccco1 918177027 DZSJJMCVEWJYKQ-LJQANCHMSA-N 404.486 2.482 10 20 HECD CN(CCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(F)(F)F 918208836 GOVJOKGASVNGNY-UHFFFAOYSA-N 406.424 2.346 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(c2ccccn2)CC1 918220373 XGKQKJGRVDLPRG-UHFFFAOYSA-N 413.497 2.214 10 20 HECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 919730560 FLIWHOCRSUPEMQ-UHFFFAOYSA-N 410.879 2.353 10 20 HECD CC(C)(C)n1cc(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 919971232 MOYJLCDBMBKRDM-UHFFFAOYSA-N 402.470 2.237 10 20 HECD CN(C)C(=O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 920476426 XKZPMGSPCYOWJY-ACCUITESSA-N 411.574 2.324 10 20 HECD COCCN1C(=O)/C(=C/N[C@@H](C)c2cccc(C(F)(F)F)c2)C(=O)NC1=S 920980624 RXGQVUSTKNPDKI-YWEFTTLKSA-N 401.410 2.130 10 20 HECD CN1CCN(c2ccc(CNc3cc(-c4cccnc4)nn3CCO)cc2F)CC1 1116825694 RVRHDMLKXAXZIO-UHFFFAOYSA-N 410.497 2.440 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1c(CC)nc2ccccc21 1320513613 MYVRZKPLJNUWNT-INIZCTEOSA-N 411.458 2.301 10 20 HECD Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)co1 1817843979 LNURMZNXHVFWMC-AWEZNQCLSA-N 412.406 2.132 10 20 HECD O=C([C@@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428202 LLXWCEIVIUBWNB-ROUUACIJSA-N 415.490 2.419 10 20 HECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)N1CCOc3cc(N(C)C)ccc31)C2=O 536043880 OQISIJOVKBWOJJ-HUUCEWRRSA-N 414.506 2.225 10 20 HECD CC(C)c1cc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n2ncnc2n1 726968538 YAMUQHRPHJLUEO-UHFFFAOYSA-N 400.508 2.095 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 727159951 UBCWYJATMWOHAS-WSTZPKSXSA-N 418.557 2.226 10 20 HECD CC1CCC(NS(=O)(=O)CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 728071746 XJKASDNEGNUQHO-HFCFLWKCSA-N 423.579 2.199 10 20 HECD CN1CCC(N(C)CCN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 729594303 NYGUFIZTUMCCOE-UHFFFAOYSA-N 419.639 2.407 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 739699774 VAPYUFLUCXYMPR-HNNXBMFYSA-N 424.954 2.393 10 20 HECD CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741278621 FQCYEKZFIMAYEH-AITUJVMLSA-N 400.523 2.001 10 20 HECD NC(=O)[C@H]1CC(C(=O)NCc2c(O)ccc3c2CCCC3)=NN1c1ccc(F)cc1 743719158 QZDIHMVVRVATGD-LJQANCHMSA-N 410.449 2.147 10 20 HECD COCCOC[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 744416921 JVLQLBKXUXQLIL-MRXNPFEDSA-N 422.481 2.385 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3c(S)nc4ccccc4c3=O)CC2)cc1 746689735 WPJLPRXLRQZJGS-UHFFFAOYSA-N 424.526 2.479 10 20 HECD CC(C)(CO)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 747615986 FXJXCSWWKKUKSD-QGZVFWFLSA-N 406.504 2.296 10 20 HECD CCS(=O)(=O)NCCCNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 747979925 MYEOJDXUCSQSRR-UHFFFAOYSA-N 406.552 2.265 10 20 HECD O=C1OCc2c1cccc2S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751120160 CJMFHDSNMWQXRR-OAHLLOKOSA-N 403.456 2.433 10 20 HECD C[C@@H](NC1CCN(CCC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)c(F)c1 765885115 LQBYNLZUDBPKPI-QGZVFWFLSA-N 406.546 2.256 10 20 HECD Cc1cc(CC(=O)N2CCN(C(=O)[C@H](C)O)CC2)c(C)n1-c1ccc(Cl)cc1 766022501 FEFPZALOCRKAQX-INIZCTEOSA-N 403.910 2.342 10 20 HECD CN1CCC[C@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC[C@H]21 766878936 KRHXVYCQKGQYMJ-FXAWDEMLSA-N 404.530 2.413 10 20 HECD C[C@H](Sc1nncn1C)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913281 XSKFYNJXRJNGBN-WFASDCNBSA-N 409.943 2.436 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCn2ncnc2C1 771626221 HZXMXTPAECQAHM-UKTHLTGXSA-N 419.557 2.363 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 773749159 PJPDBXXULANVCU-AAEUAGOBSA-N 419.459 2.420 10 20 HECD CCOC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 775002237 QSRHYBLERICUSO-UHFFFAOYSA-N 422.501 2.025 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)CN2CCN(c3ccccn3)CC2)c1O 775028487 RKFYKJXBRQZSEA-OAHLLOKOSA-N 401.467 2.004 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nc(C)ccc3OC)CC2)cc1 778300460 AZGSKPKXCQYDFV-ZHACJKMWSA-N 410.474 2.251 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3Cn3cncn3)c2)CC1 781046979 KZJUMAFQOUPSFC-UHFFFAOYSA-N 404.474 2.247 10 20 HECD CNC(=O)[C@H]1CN(CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)CCO1 782098718 QHZGAQOVYDEZFS-HXUWFJFHSA-N 401.532 2.446 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785296482 FTGCUCPEHVVQML-CYBMUJFWSA-N 409.446 2.062 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)cc1 785425833 RVXUULHTBQNJSV-INIZCTEOSA-N 416.472 2.290 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3N3CCOCC3)cc2)CC1 786660534 ZHUHXNSTSQARQF-UHFFFAOYSA-N 422.529 2.122 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 789669124 SEGBJNMQWNGGFV-QFIPXVFZSA-N 418.541 2.460 10 20 HECD Cc1cncc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 789820991 RKTSWXKAUUEPDS-HOTGVXAUSA-N 414.481 2.075 10 20 HECD Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 793532005 XIQYKJOUBYNEEX-UHFFFAOYSA-N 422.533 2.361 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cnn(C)c3)cc2Cl)C1 793940091 VKYCOOPTMRDZIS-CQSZACIVSA-N 403.914 2.242 10 20 HECD CC[C@@H]1C[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007081 MQTMMEHCZWZCEL-FUHWJXTLSA-N 404.530 2.231 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 811186522 QBIDHWDGCKLKKL-CQSZACIVSA-N 403.504 2.111 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1[C@H]1CCCO1 812010082 MXZAKRYJYJRGDO-DFQSSKMNSA-N 414.550 2.487 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(-c4ncc[nH]4)c3)cc2)C1 814338741 WJSYMBHOVHOJBA-QGZVFWFLSA-N 404.474 2.103 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 918441189 XWVQSNORZYLWJT-UHFFFAOYSA-N 403.429 2.489 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)nc3)cc2F)CC1 730269225 RKHVIFSFDDZZHG-UHFFFAOYSA-N 412.918 2.495 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3nnc4ccccc4c3O)CC2)cc1 731893290 JEEQECHPXCIHFO-UHFFFAOYSA-N 421.501 2.286 10 20 HECD CN1CCN(c2cc(CNC(=O)NCc3c(O)ccc4c3CCCC4)ccn2)CC1 743536715 KECGRHRCOKLVIG-UHFFFAOYSA-N 409.534 2.417 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@@H](O)c3ccccc3)cc2)C1 745692594 XSBHMENTJWFLQW-PZJWPPBQSA-N 410.518 2.311 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@](C)(O)c3ccco3)cc2F)CC1 745807552 DPLJGUPTCDSFRO-OAQYLSRUSA-N 404.486 2.268 10 20 HECD Cc1nc(C(=O)NCCCSc2nccs2)nn1-c1n[nH]c(C(F)(F)F)n1 747392995 BDRPWSVDDWVCKM-UHFFFAOYSA-N 418.430 2.081 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H]1CCCc2c1cnn2C 749175450 IEZGBDHQSNNEMI-FXAWDEMLSA-N 424.549 2.341 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H](CO)C(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749467283 XJWRQMPGWMIQRI-FQEVSTJZSA-N 421.563 2.263 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H](C)CS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 749840225 LUTRMTKHHGPDMC-HNNXBMFYSA-N 420.531 2.413 10 20 HECD COc1ccc(N2CCN(C(=O)NCCc3cn4c(n3)CCCC4)CC2)cc1F 753832865 PPNYLPAZVPRDCL-UHFFFAOYSA-N 401.486 2.441 10 20 HECD C[C@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)c(F)cc1O 756583475 ODNXFBHVWIUZAR-KBPBESRZSA-N 416.335 2.351 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccccc3C[S@@](C)=O)CC2)cc1 762529512 XCHVLLXRHQFNAS-MUUNZHRXSA-N 401.532 2.334 10 20 HECD CCc1ncc(S(=O)(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)s1 763580545 RAZAYEUUQMFDMH-UHFFFAOYSA-N 412.556 2.465 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F 765304386 QMCGEIRXEJHOLZ-UHFFFAOYSA-N 420.510 2.431 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCOC4(CCC4)C3)CC2)cc1 768522356 MHKNIEGKPYKJCG-SFHVURJKSA-N 402.539 2.218 10 20 HECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)c1c(F)cccc1F 770043601 YCRTXQRRGVNKGA-PBHICJAKSA-N 414.430 2.284 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)c2)CC1 770285287 AWOGRAHHUKGYPN-UHFFFAOYSA-N 402.520 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCC(=O)[C@@H](C)C4)n3)CC2)cc1 771055671 IVGIBPCYKWJWQH-JKSUJKDBSA-N 412.490 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C4(C)CCOCC4)n3)CC2)cc1 771083271 QUUISLUUYJTVTO-UHFFFAOYSA-N 400.479 2.038 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)CC2)cc(OC)c1OC 771472539 XGRCAVQOAUPOQK-UHFFFAOYSA-N 423.473 2.460 10 20 HECD CN1CCN(c2ccc(CN[C@@H]3CN(Cc4ccccc4)CC[C@H]3CO)cc2)CC1 771841817 LPSAJVTYXNGCHD-UKILVPOCSA-N 408.590 2.411 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCCC2)cc1)S(=O)(=O)c1cccs1 771963388 OWBNCLPUOXHHGO-UHFFFAOYSA-N 422.576 2.468 10 20 HECD COc1cc(Br)cc(CN2CCc3cc(S(N)(=O)=O)ccc32)c1O 772602178 WQPOGNXTEBEZAF-UHFFFAOYSA-N 413.293 2.373 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1nc2ccccc2s1 774981978 PBHKYMARVJADHN-UHFFFAOYSA-N 424.526 2.408 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCN2CCCCCC2=O)cc1F 775093239 CGLRSJLYIWBWHT-UHFFFAOYSA-N 420.529 2.197 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CCO)c3ccccc3)CC2)cc1 778377924 JIPVOXNAVXOYOC-SSSWZJSRSA-N 423.513 2.140 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2COC)cc1OC 778560127 LZFJYHBNKNVTSM-UHFFFAOYSA-N 414.505 2.404 10 20 HECD CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782409589 VBRSFBRNZWLVAT-LBPRGKRZSA-N 407.444 2.214 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)OC)[C@H]3C)cc2F)CC1 786754434 UJOURMDNNXTUGB-WBVHZDCISA-N 406.502 2.061 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cnccc3C)CC2)cc1 788954853 MJHMMNFGGSIVTM-UHFFFAOYSA-N 409.534 2.201 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC2(CCCC2)C1 789844417 RZGUSDVBGPWHMZ-UHFFFAOYSA-N 403.498 2.196 10 20 HECD COCC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccco1 789860898 NQXHRXTYWSHHGH-GOSISDBHSA-N 417.531 2.343 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOCC2(CCCC2)C1 789863179 DXBMWOJHLKYLRL-UHFFFAOYSA-N 417.575 2.275 10 20 HECD CCOC(=O)c1n[nH]c(-c2cccc(CNC(=O)/C=C\c3ccc(O)c(O)c3)c2)n1 790157007 DDIZGESTEPMDDL-CLFYSBASSA-N 408.414 2.389 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)ccc1C 795290051 MJXBKOFEDCJPGN-UHFFFAOYSA-N 412.489 2.344 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2OC(C)C)c1 795353636 OWDZCHNFTJGHNZ-UHFFFAOYSA-N 408.476 2.356 10 20 HECD CC(C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCCC1 796579829 IWBRHBJVCQFMPP-UHFFFAOYSA-N 419.481 2.391 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 797432597 KGAJUVMEMVHKPO-LRAJWGHMSA-N 406.502 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCC(F)(F)C3)CC2)cc1 797768128 KTZGLZGLPNIGCN-FYCOFBDGSA-N 407.461 2.452 10 20 HECD CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCOC1 802760561 FCGRDWIQWMVRSN-IBGZPJMESA-N 415.538 2.324 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686338 HVKCWPKFFXOHKQ-XEHJXZTKSA-N 413.562 2.473 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)cc1F 804851930 SVAWMZNUJLDOQN-MRXNPFEDSA-N 407.486 2.090 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)C(C3CC3)C3CC3)cc2F)CC1 805008017 XSZSBMNWNQADSV-UHFFFAOYSA-N 416.541 2.231 10 20 HECD C[C@@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807013603 AQXPRCHRMNEKGP-NQIIRXRSSA-N 412.578 2.387 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1 807291723 MIWLBNLVCJSJGS-QGZVFWFLSA-N 411.424 2.249 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H]1CCSC1 808130097 XEPRQRHCJYENGQ-LLVKDONJSA-N 401.326 2.373 10 20 HECD COC(=O)Cc1occ(C)c1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 810167978 RUAIYRAVPKPANQ-UHFFFAOYSA-N 404.438 2.334 10 20 HECD Cc1cc(C(=O)CSc2nccnc2N)c(C)n1-c1ccc(S(N)(=O)=O)cc1 812251628 AXROUCNMGKKKBX-UHFFFAOYSA-N 417.516 2.089 10 20 HECD CC(=O)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811799782 YYZQLRMVMAZTBL-CXAGYDPISA-N 417.849 2.055 10 20 HECD CC(C)(C)c1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)ccn1 1843249184 GUDMVOKGXJRVBF-UHFFFAOYSA-N 410.474 2.316 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@@H](NC(N)=O)c1cccs1 9975468 RKQFAOHCZBBQBZ-QGZVFWFLSA-N 402.520 2.343 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N(CCN(C)C)[C@H]2CCS(=O)(=O)C2)cc1 733367950 ODGCVWIESDAZEQ-FQEVSTJZSA-N 403.548 2.285 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl 734702341 XTOXRROZJGZBQB-UHFFFAOYSA-N 423.922 2.373 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 744380765 DQYRMXNULORRII-OKZBNKHCSA-N 403.548 2.276 10 20 HECD CC(C)(C)C(=O)Cn1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nn1 746279734 HEBVPTVFPVXQFW-UHFFFAOYSA-N 413.522 2.032 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 748296180 MCROFFIKCRYARH-NRFANRHFSA-N 407.486 2.489 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@]3(C)CCCC[C@@H]3O)CC2)cc1 748617264 XVVOHGSIWQQOLS-JTHBVZDNSA-N 418.582 2.448 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3sc([C@H](C)OC)nc3C)nc12 750436940 CNKXOTFYXXLVDJ-JTQLQIEISA-N 420.447 2.441 10 20 HECD CN(C)[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 751063091 KKEYYYLEOPTRON-HNNXBMFYSA-N 409.533 2.325 10 20 HECD C[C@H](O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 752147598 PPQBAYDDKOSSPQ-FAJBIJEISA-N 407.530 2.291 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O 753640461 QOUPHKOGSLCUJZ-ZDUSSCGKSA-N 404.488 2.171 10 20 HECD CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@@H]1CCNC1=O 760116780 NKIVQOVQWHPFDP-YGYTWAPGSA-N 409.558 2.076 10 20 HECD Cc1noc(C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2)n1 760762324 QUSDWQBWYJXGDM-MRXNPFEDSA-N 416.459 2.169 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCC(=O)OC(C)C)cc2F)CC1 765881922 NJCDOJJXBOWYFI-UHFFFAOYSA-N 408.518 2.499 10 20 HECD CCN1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 769788381 RQPFLDZZJVXORB-UHFFFAOYSA-N 409.533 2.422 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc3c(c2)NC(=O)CO3)cc1 770724446 LAUKZKYNOKDCKM-SFHVURJKSA-N 410.474 2.300 10 20 HECD O=C(CNc1ccc(F)c([N+](=O)[O-])c1)NCc1ccc(N2CCOCC2)c(F)c1 772901135 CCIKJVXJKBQKDG-UHFFFAOYSA-N 406.389 2.438 10 20 HECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 772993946 JMQWYPVFRJPJMI-WNSKOXEYSA-N 424.501 2.406 10 20 HECD CN(C)c1ccc(CNC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)cc1 773321508 JUWWSDXUZIMOMD-UHFFFAOYSA-N 406.508 2.002 10 20 HECD COC1(CO)CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 773934417 JBGLPWAKHWQMPB-OAHLLOKOSA-N 422.481 2.262 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)ccc2O)cc1 775671794 CODYQSFKZGNAGJ-UHFFFAOYSA-N 400.478 2.353 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@@H](C(C)C)C3)CC2)cc1 778297063 FXQKWZYCFRCYLP-ZTBDEIDFSA-N 417.575 2.500 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)Cc3ccncc3)CC2)cc1 778305517 ARHFRZQGBLURSO-ZEVQVBBLSA-N 408.502 2.042 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc4ccccn34)CC2)cc1F 782727488 FXOGSXZIOJUPMH-UHFFFAOYSA-N 401.467 2.318 10 20 HECD COCCn1ccc2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc21 785296872 JYLLWOMYCLPPDO-AWEZNQCLSA-N 411.458 2.385 10 20 HECD CS(=O)(=O)c1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1F 786212009 LHWYSGVCPQJDMU-UHFFFAOYSA-N 419.478 2.183 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(N2CCCCC2)c1 786467590 LGNYULWDZJXQOQ-UHFFFAOYSA-N 409.534 2.413 10 20 HECD C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789836763 WENADCOQZZHHBR-WBVHZDCISA-N 405.514 2.346 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793723448 WWRYVCBJXFGHRP-BHIYHBOVSA-N 414.550 2.090 10 20 HECD Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 797532236 HCHMCGPEXADMTJ-UHFFFAOYSA-N 422.529 2.469 10 20 HECD COCCN1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 798213685 MPLHPOVQSIBADV-INIZCTEOSA-N 421.497 2.053 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN(C2CCC2)C1 803686233 DGQPZJJAMSVLSI-XLIONFOSSA-N 412.578 2.454 10 20 HECD COCc1cnc(NC(=O)C(=O)NCc2cc(Br)ccc2O)s1 807386873 NVZQKIZGMQRESM-UHFFFAOYSA-N 400.254 2.013 10 20 HECD Cc1cc(CN(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 917051634 CRANZMMKBTZZQR-HOTGVXAUSA-N 404.486 2.484 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)n1cnc2ccccc21 918337013 AZGRPOLCMDDVFS-MRXNPFEDSA-N 412.515 2.149 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc(OC)c3)CC2)cc1 920253756 GXKWHWJNMNIATF-KHPPLWFESA-N 409.486 2.225 10 20 HECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccnc1 1793324014 OIJRKEBRVFSTCD-REBRKWNGSA-N 418.881 2.461 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncn1)c1cc(O)c(O)c(Cl)c1 1796985627 PCYLUYYVKDPWMP-CLLJXQQHSA-N 402.838 2.107 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n(C)n1 1800715896 VZZREFKDCFVVQM-BTTYYORXSA-N 418.881 2.359 10 20 HECD COCCN1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1=O 728836680 BNUGKVLHKBTTSG-HNNXBMFYSA-N 401.429 2.138 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3F)cc2F)CC1 730391111 HOXJPXSQVVWACT-UHFFFAOYSA-N 402.445 2.362 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 734066048 NEUPGNXZLAFFFX-JPYJTQIMSA-N 410.518 2.095 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2CCC(=O)NC2=O)cc1 735273249 SBCOXROXUDZBPA-UHFFFAOYSA-N 410.474 2.236 10 20 HECD CN(C)c1ccccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738888784 GLMIGPMUJDCILK-UHFFFAOYSA-N 402.520 2.309 10 20 HECD O=C(CCCN1C(=O)CCC1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798480 OKPOMUNUDYFWQM-CQSZACIVSA-N 409.433 2.302 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc2n(c1=O)CCS2 742799886 DWMYFVVLBKTUNJ-GFCCVEGCSA-N 422.457 2.349 10 20 HECD COc1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1Cl 743281597 CWAWAOMXEJKOCC-XYOKQWHBSA-N 406.938 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@]3(C)CCCO)CC2)cc1 755732138 XFPMTZNVMQPTRB-AXKWSIDASA-N 415.534 2.054 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc(OC)c1OC 759240475 YAQYWVPVUHCDJJ-UHFFFAOYSA-N 400.431 2.404 10 20 HECD COCC1(O)CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 759316292 VTOITIXJTRGIAD-HNNXBMFYSA-N 422.481 2.262 10 20 HECD COc1ccc(CCNC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 759588098 IDWNUKVBESUCJE-YVMONPNESA-N 401.415 2.030 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CC[C@H]3CCCO3)cc2F)C[C@@H](C)O1 760535729 CSGWSNJVDPSREY-BFYDXBDKSA-N 400.516 2.428 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)C1 765040824 KCDTVEMIWAHCGW-IBGZPJMESA-N 419.522 2.165 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)c1c[nH]c2ncccc12 767607843 CAZOGIBRAZCBMC-SNVBAGLBSA-N 403.416 2.068 10 20 HECD Cn1ccnc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769638050 YMRZSQYZYAGGKW-KRWDZBQOSA-N 400.460 2.017 10 20 HECD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 773747704 FJIMYXWSKHURJM-GFCCVEGCSA-N 410.467 2.285 10 20 HECD C[C@H](NS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 780849691 QOXRNGLGTHPELV-AWEZNQCLSA-N 411.549 2.042 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccc(OCC(F)(F)F)nc2)c1 783153292 UUHJKJFUYLYIHI-UHFFFAOYSA-N 420.365 2.457 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CO[C@H](C)C3)cc2F)C[C@H](C)O1 784281299 FLWYIJIESBMZNQ-AESZEHBQSA-N 408.470 2.024 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1nnc2n1CCC2 786445714 XMZALCHFDZGDBL-INIZCTEOSA-N 410.522 2.050 10 20 HECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3ccccc3C)c2C)nn1 786556717 QKMRMKLQUKHRPI-UHFFFAOYSA-N 410.430 2.207 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccsc3)cc2F)C[C@@H](C)O1 787329360 SCFWCHGXILZNKK-OKILXGFUSA-N 405.495 2.433 10 20 HECD Cc1nc2c(s1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788310123 IUZAFNXZVZGYLN-SFHVURJKSA-N 414.531 2.098 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCCC[C@H]12 789836747 VXOINFAJYWBKBM-XFQXTVEOSA-N 417.525 2.440 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)ccc2[nH]1 792335495 NULNYDFJRRGUME-UHFFFAOYSA-N 407.474 2.191 10 20 HECD C[S@@](=O)C1(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 799402929 DYJZHRGMUWEKJY-HHHXNRCGSA-N 401.479 2.467 10 20 HECD COCCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC1=O 800762217 FXHIMIXRRYXNQK-UHFFFAOYSA-N 408.506 2.185 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803448293 NUYUKWSCCAGNNL-INIZCTEOSA-N 411.449 2.010 10 20 HECD O=C(NCc1ccc(F)cn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450501 JFECPFHYWTWLFW-UHFFFAOYSA-N 422.407 2.224 10 20 HECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2ccccc2C1 803882232 PMXOGGZJDDACAU-SFHVURJKSA-N 408.546 2.274 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2C2OCCO2)cc1F 804852114 ZTAAEJIWDKKMDI-SFHVURJKSA-N 407.486 2.042 10 20 HECD Cc1nc(S(=O)(=O)NCCCSc2nccs2)c(Br)n1C 805002282 WVSJUISTSPIOHC-UHFFFAOYSA-N 411.372 2.408 10 20 HECD CNC(=O)CN1CCC(NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 916517191 XFUCANFTYNBZTI-UHFFFAOYSA-N 401.555 2.029 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccc(-n2cnnn2)cc1 916669706 LUNLRSKBDFFEAW-UHFFFAOYSA-N 407.478 2.193 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1nncn1-c1ccccc1 918208257 CSGNEDWQRCXHIH-UHFFFAOYSA-N 410.453 2.242 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3(O)CCCCC3)cc2F)C[C@@H](C)O1 919047329 XPWSDJDPDBAYDD-IYBDPMFKSA-N 422.497 2.294 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 920867505 UATIWEWJKLMATR-QZTJIDSGSA-N 417.550 2.364 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccncc1O 1800718143 MBWDYLWCRNGPRJ-CLLJXQQHSA-N 417.849 2.417 10 20 HECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCc1c(C)c2ccccc2n1C 471236461 KFKVAJHEMJSAHE-UHFFFAOYSA-N 423.517 2.376 10 20 HECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CCCC3)cc2)C1 726097112 DVRXCESZSILIPU-HKUYNNGSSA-N 402.539 2.360 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cccc4c3OCCO4)CC2)cc1 726601199 JEWCECBLEGSDGZ-UHFFFAOYSA-N 404.488 2.414 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(C(F)(F)F)cc2)SC1=S 727177083 BNOQLLGQKXULAE-FLIBITNWSA-N 410.464 2.456 10 20 HECD CC(C)N(C)CC1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 728572067 QLBHWNOTSIOOJM-UHFFFAOYSA-N 420.573 2.331 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1 734072958 WZDZPJYZNSXKDV-UHFFFAOYSA-N 416.434 2.398 10 20 HECD O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1c(O)ccc2c1CCCC2 745629058 CJQBJEUSRIUQQI-UHFFFAOYSA-N 417.531 2.190 10 20 HECD O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1c(O)ccc2c1CCCC2 745792290 JYBRAYYUCLZOGY-UHFFFAOYSA-N 422.529 2.419 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)nc3)cc2)C1 746513818 WCNHTKKQMNJVRM-OAHLLOKOSA-N 417.307 2.476 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)N(C)CCO4)CC2)cc1 746794270 SUWOZUMVYJIXIS-UHFFFAOYSA-N 424.501 2.248 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3c3ncccn3)cc2F)CC1 747384601 YHBJNGYNMJIBOR-FQEVSTJZSA-N 412.513 2.043 10 20 HECD Cc1c(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 747810578 XYYAEFKQEHIRSW-GOSISDBHSA-N 410.474 2.464 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@]1(O)CCc2ccccc21 752650316 PIXGBFHYXOYFNK-QHCPKHFHSA-N 413.493 2.420 10 20 HECD COC[C@H](CCO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 755994851 YIABLIJAUZBVCV-GVIGZQTCSA-N 414.574 2.243 10 20 HECD CC1(C2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)OCCO1 756680580 IJWUQFQEXKRSAB-UHFFFAOYSA-N 421.513 2.471 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 759577543 AVSXEJHUMVIOJB-MXFAVLBMSA-N 410.470 2.433 10 20 HECD COC(=O)[C@@]1(C)CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 759784580 NNCUSXLXHCFGGA-QHCPKHFHSA-N 406.438 2.286 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)nn1 762568689 NCIRNGSYWQEBRX-GOSISDBHSA-N 412.494 2.212 10 20 HECD Cc1cc(C(=O)CN2CCO[C@@H](C)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766967942 BDOKVYCEMNQFNG-HOCLYGCPSA-N 405.520 2.033 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc4c(cc3OC)CCC(=O)N4)CC2)cc1 767623751 VNLQSQFCKHLNNF-UHFFFAOYSA-N 424.501 2.349 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1 768912178 WUTNQXOKMILPTH-CYBMUJFWSA-N 417.487 2.173 10 20 HECD COc1cccc(O)c1CN1CCN(c2ncc(Br)c(OC)n2)CC1 769331058 BRPVUCUNANIRJX-UHFFFAOYSA-N 409.284 2.284 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(OC)cn3)CC2)cc1 770102100 HYMAPFHATXWXDQ-UHFFFAOYSA-N 413.522 2.110 10 20 HECD CC(=O)Nc1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 772907879 WVLXDRLIDYGXOG-UHFFFAOYSA-N 418.444 2.488 10 20 HECD COc1cc(OC)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785295994 AFBQRXLDZSESCD-SNVBAGLBSA-N 408.838 2.454 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C 787638485 MXCVALJMIIZVPG-FQEVSTJZSA-N 400.498 2.269 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)c(OC)cc2C)ccc1O 788489679 MYGOYDVZCIRRDG-UHFFFAOYSA-N 420.896 2.072 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C2CCN(C(=O)OC)CC2)cc1 788951056 GMZQGOFMSKQPQM-MRXNPFEDSA-N 418.538 2.132 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1cccc2cccnc12 789799581 JVRPJKDKBXGPKU-UHFFFAOYSA-N 422.460 2.143 10 20 HECD CC1(C)CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840891 QDUKQOCYUSPEET-LJQANCHMSA-N 405.514 2.488 10 20 HECD CC1(C)[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]2CCCO[C@H]21 789864154 MMTMCUNBTCMRHR-GUDVDZBRSA-N 417.575 2.176 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](C)[C@H](C)C(=O)NCc2cc(OC)ccc2O)c1 790788370 VHDPFUMTPFZACT-KBPBESRZSA-N 416.474 2.320 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cn(C)c2c(cnn2C)c1=O 791386531 PDKDGUABVLYCBW-UHFFFAOYSA-N 419.279 2.402 10 20 HECD CC1(C)CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793733638 NOIDASIRSCYGIO-HKUYNNGSSA-N 414.550 2.090 10 20 HECD CC1=C(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@H](C)n2ncnc2N1C 798968073 AIONNMZZQBHRJO-INIZCTEOSA-N 410.522 2.088 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 804118710 YHFFHOVNBQCJGO-SFHVURJKSA-N 410.518 2.115 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ncnn2-c2ccccc2)cc1F 804853119 KFRBMQJUZGFLSH-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 806178001 AYGWOFPKCYBVPU-MSOLQXFVSA-N 414.550 2.007 10 20 HECD Cc1ccc(N2CCC[C@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2=O)cc1 807658072 PEZDTQNXPZBXEH-NRFANRHFSA-N 422.529 2.331 10 20 HECD CN(C)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1 808027350 JZTXVKBVLHTJOH-UHFFFAOYSA-N 402.516 2.392 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 809136751 MUOGYOFXSIPGHY-FQEVSTJZSA-N 405.539 2.301 10 20 HECD O=C1CCCCC[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 811382776 PZXGNNAWCCTUGC-QGZVFWFLSA-N 420.481 2.361 10 20 HECD CC[C@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)OC 811868106 WMWJJDKXZYAYIK-QGZVFWFLSA-N 416.501 2.167 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(Cc3ccccc3)CCOCC2)c1 857531124 BMSXIZMWFIMRPL-UHFFFAOYSA-N 404.488 2.285 10 20 HECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cn1C 914790800 YDEPZPMYLDQBTO-UHFFFAOYSA-N 420.472 2.038 10 20 HECD Cc1cc(CCNC(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1-c1ccccc1 916220817 CIRLLLVLRKFXNZ-UHFFFAOYSA-N 411.550 2.100 10 20 HECD NC(=O)CCN(Cc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918201347 GUZDTKPINHWYOL-UHFFFAOYSA-N 414.481 2.250 10 20 HECD COc1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 918286560 IZLJRPMQJYOYRN-UHFFFAOYSA-N 423.391 2.204 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-n2nnnc2C)c1 918304691 TWYQPMSLZFTMCC-UHFFFAOYSA-N 407.478 2.024 10 20 HECD O=C(NCCN1C(=O)c2ccccc2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 919787935 ACELWMOBMVSNIB-KRWDZBQOSA-N 423.469 2.379 10 20 HECD CC(C)CCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510540 OPWYGQJSJXOPOG-PABBZOGXSA-N 418.490 2.083 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(F)cc1F 1796604966 ZLNLIHCCJFFQLI-BTTYYORXSA-N 403.385 2.337 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F)c1cc(O)nc(O)c1 1799532083 PYULYGSVZNNNND-CLLJXQQHSA-N 403.385 2.337 10 20 HECD O=C(Cc1cscn1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543677 MZWBFFGJQTZNPL-UHFFFAOYSA-N 416.503 2.037 10 20 HECD CC(C)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819505327 VVKOVZMPCARZNY-WFASDCNBSA-N 417.466 2.335 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)C(=O)N(C)C4=O)cc2F)CC1 303314197 PUDIAVLCUUUXIZ-UHFFFAOYSA-N 424.476 2.123 10 20 HECD COc1ccc(CNC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)cc1[N+](=O)[O-] 604016656 MIFVSJRVPMWWND-UHFFFAOYSA-N 415.427 2.238 10 20 HECD CC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOCC1 726753618 ABPYCDGQQJZGDK-UHFFFAOYSA-N 413.497 2.375 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ncccc3C(N)=O)CC2)cc1 734273762 LIMNCOIMCCNZRA-UHFFFAOYSA-N 410.522 2.059 10 20 HECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)cc1S(=O)(=O)N(C)C 734405906 NAHCYIPDRQRXFX-UHFFFAOYSA-N 405.520 2.250 10 20 HECD C[C@@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1C(=O)NC2(CCCC2)C1=O 735517072 HCPRARXNCIZKPX-RDJZCZTQSA-N 415.490 2.153 10 20 HECD O=C(NC[C@@]1(O)CCSC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747584944 DKCYMQCUJNUSKR-UGSOOPFHSA-N 401.479 2.424 10 20 HECD COC(=O)Nc1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758232351 QEVVXSOQXKPLBW-LJQANCHMSA-N 415.490 2.435 10 20 HECD CCCS(=O)(=O)Nc1cccc(NS(=O)(=O)c2cccc3nonc23)c1C 765060124 IHBVAMNGMUPPNA-UHFFFAOYSA-N 410.477 2.484 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC(=O)N2CCC(O)CC2)cc1 765479474 IQCUUKYDVIFPBC-NRFANRHFSA-N 417.550 2.024 10 20 HECD CCOC1CC(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)(N2CCOCC2)C1 768078607 JDGKCLLTNHDXRM-UHFFFAOYSA-N 412.534 2.489 10 20 HECD CN1CCCc2cc(CNC(=O)NCCN(C)S(=O)(=O)c3cccs3)ccc21 772017788 XSQXMKHJJQWWIC-UHFFFAOYSA-N 422.576 2.250 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1O 774840446 MNLNQFLIXDVRPY-UHFFFAOYSA-N 422.419 2.237 10 20 HECD COCc1noc(CN2CCN(Cc3cc(Br)cc(C)c3O)CC2)n1 783705346 KIDDSKFCCFLJMB-UHFFFAOYSA-N 411.300 2.310 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1 784025387 BRHHTUNHABVOKD-UHFFFAOYSA-N 424.457 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)(C)OC(C)(C)C3)CC2)cc1 785798467 ZEEJILXZDWKPOJ-KHPPLWFESA-N 415.534 2.316 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCN1CCc2ccccc2C1 787713545 ZYRSBXMAVIUXRO-UHFFFAOYSA-N 408.546 2.242 10 20 HECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788941100 ZOKIWFWCZSKJPE-UHFFFAOYSA-N 414.550 2.010 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 790409401 QHIADIGJYFTZOH-UHFFFAOYSA-N 412.489 2.032 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cccc(F)c4)C[C@H]3C)nc12 795194667 XZQZUZBLGGWSTB-CQSZACIVSA-N 413.453 2.461 10 20 HECD O=C(COC(=O)C1CCC(O)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 795644536 LGZAAEARNKMWKH-UHFFFAOYSA-N 407.422 2.495 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC(C)(C)c3c(C)noc3C)CC2)cc1 796664479 XKCBVVIXMYSSSY-LJQANCHMSA-N 402.539 2.308 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)Nc1cccn(CCS(C)(=O)=O)c1=O 801641319 CWAMYHFUQSLRLO-UHFFFAOYSA-N 421.519 2.433 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(OC(F)F)nc1)c1ccc(N2CCOCC2)cc1 802552737 LGIQXLOFUXBZFX-ZDUSSCGKSA-N 420.416 2.336 10 20 HECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N1CCc2ccccc2C1 803885337 LNRYIZXCNFITGU-ZWKOTPCHSA-N 408.546 2.493 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(Cc2cccs2)CC1 806276800 WCDFHLZMXCQGOF-UHFFFAOYSA-N 410.590 2.147 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(CCc2ccccc2)CC1 807100095 JMNSJVFFAXEYNP-UHFFFAOYSA-N 408.546 2.064 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC12CCCCC2 807678022 FAOSIUHZYXWVEB-KRWDZBQOSA-N 414.550 2.323 10 20 HECD COc1cc(C)ccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807692999 FPOZNUWHBHDPND-UHFFFAOYSA-N 411.502 2.115 10 20 HECD CS[C@H](C)CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769423 FUCGWPDXSMRADM-CHWSQXEVSA-N 401.479 2.241 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1OCC(F)F 809633487 OVULMXHXSKRJMP-UHFFFAOYSA-N 420.460 2.456 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H](c4ccccc4)OC3=O)CC2)cc1 809679957 JFAKRPVVKHMGRD-YADHBBJMSA-N 423.513 2.238 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)CC2)cc1 810092432 ALBBBCCODIKFKV-PMVMPFDFSA-N 415.578 2.212 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C[C@@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 815063042 UVNLOAVHHIPHBU-INMHGKMJSA-N 412.527 2.270 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1 918309184 HBWOKIIFGSMHJZ-UHFFFAOYSA-N 400.454 2.368 10 20 HECD CS(=O)(=O)Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919970462 DNSTUYODVORLOX-UHFFFAOYSA-N 420.506 2.261 10 20 HECD O=C(CNC(=O)c1ccc(F)cc1F)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970543 KMSFMMRZCJQSRG-UHFFFAOYSA-N 421.419 2.111 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3CNc3cccc(C)n3)nc12 1116349914 QBJHYTMNWPIHOM-INIZCTEOSA-N 410.478 2.392 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccco1 1805371041 JAPQGIVHRUPJCE-IFXJQAMLSA-N 408.414 2.114 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2ccco2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992356 XBLMQRRXQBTUJV-AUUYWEPGSA-N 408.414 2.114 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCCS1 1823013796 MOEXAPMAQHPHFL-KBPBESRZSA-N 417.491 2.417 10 20 HECD CC(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1823864907 HCCDCOWHQGTIIS-QGZVFWFLSA-N 405.495 2.151 10 20 HECD COC[C@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 23564734 BTHRUEKKDIEPHD-AWEZNQCLSA-N 401.463 2.420 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4c(c3)OCCO4)CC2)cc1 32765922 UURVRFYKZFCVHP-UHFFFAOYSA-N 411.502 2.409 10 20 HECD COc1ccc(N(C)CC(=O)N(CCC(N)=O)c2ccccc2OC)cc1OC 64517285 PHWFFEOPDHJFFX-UHFFFAOYSA-N 401.463 2.057 10 20 HECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 517591254 OPMBAKGSUANMGH-UHFFFAOYSA-N 415.427 2.108 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 527462951 JENXYVKYLRPLNU-UHFFFAOYSA-N 413.499 2.454 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@@H](C(C)C)N3CCN(C)CC3)CC2)cc1 726704636 WNFZATKMGPHQEX-QFIPXVFZSA-N 417.598 2.235 10 20 HECD C[C@@H]1COCCN1CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729612305 VHZZXMIWMCJMNI-OAHLLOKOSA-N 412.481 2.277 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](N4CCCCC4)C3)CC2)cc1 730826096 YRMJJGVQNSJUGN-OAQYLSRUSA-N 415.582 2.087 10 20 HECD CCOC(=O)CCCS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 734841995 DAIRRARLTDCBTO-GASCZTMLSA-N 416.515 2.202 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(Cn4cncn4)cc3)c2)CC1 739766608 SFJUJSJXLHODCM-UHFFFAOYSA-N 404.474 2.280 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCCN(C)C3)cc2F)C[C@@H](C)O1 741249158 CPQQKQPAPGORCA-WSTZPKSXSA-N 420.573 2.329 10 20 HECD COc1ccc(N2CCN(CCNc3cc(C(F)(F)F)nc4ncnn34)CC2)cc1 742926690 NIGFVXLXPFIBPK-UHFFFAOYSA-N 421.427 2.386 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCC(=O)N1CCCCCC1 748343729 MZOKYGDGSTYAIH-UHFFFAOYSA-N 402.539 2.457 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 749513356 DHKOEVCDJBKDFP-AUSIDOKSSA-N 412.578 2.293 10 20 HECD COc1cccc2c1OCC(C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)=C2 751097543 LICBJXXDDXLVDP-GOSISDBHSA-N 421.497 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1F 753738770 UPXRJDFYBLRFIK-USXIJHARSA-N 417.481 2.047 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4ccc(OC)cc4C3)CC2)cc1 754019247 RORHPGNZJGNAFD-QFIPXVFZSA-N 411.546 2.245 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cncc2ccccc12 758964197 HGYBFSMTWWOLEZ-UHFFFAOYSA-N 408.433 2.465 10 20 HECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1 761121334 NJUWBUWMZXSHCJ-PXNSSMCTSA-N 422.485 2.190 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1Cc1ccc2c(c1)CCS2(=O)=O 762125710 JIXNFVJWWJXBMC-UHFFFAOYSA-N 420.874 2.340 10 20 HECD CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 762261504 NVJJLFCAARKUDU-KRWDZBQOSA-N 402.516 2.237 10 20 HECD CCC(=O)N1CC[C@@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 762411671 CWWKNVHWSRDEEN-GFCCVEGCSA-N 421.409 2.111 10 20 HECD C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NCc1ccccc1O 771003303 CSUVYRRPYYEDEB-NSHDSACASA-N 402.394 2.394 10 20 HECD Cc1nc(C)c(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)n1 771054588 AHAVPYKXTNSMKV-INIZCTEOSA-N 404.898 2.481 10 20 HECD CNC(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 771059414 QVXQNXSBCFSEMO-MRXNPFEDSA-N 402.882 2.195 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCCS1(=O)=O 773408101 QESUGKLQBBIDCB-DOTOQJQBSA-N 400.928 2.094 10 20 HECD C[C@H](O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 774244003 MODQEDUDAJUINA-VYDXJSESSA-N 407.942 2.422 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](CN2CCN(C)CC2)c2ccccc2)c1O 774942280 OZTKDZMBNHVRJS-SFHVURJKSA-N 400.479 2.387 10 20 HECD COc1cc(O)c(CNCCNS(=O)(=O)c2cc(C)sc2C)cc1OC 776252002 IBLAUEGXMMQIMS-UHFFFAOYSA-N 400.522 2.156 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3CN3CCCCC3)CC2)cc1 779223679 POBMTDPJMICXMF-DHIUTWEWSA-N 416.610 2.128 10 20 HECD CC(C)(O)C1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 780306949 WDEARROVMKFYBZ-UHFFFAOYSA-N 401.429 2.454 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(CCCO)CC3)cc2)C1 782713825 YYUIPFMZJXKWAN-IBGZPJMESA-N 402.539 2.082 10 20 HECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 783316961 RFCJZPAWKGQYLH-UHFFFAOYSA-N 415.494 2.039 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1N1CCOCC1 783318775 IYUQBXNYXIDBJI-UHFFFAOYSA-N 414.481 2.292 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3ccsc3)N(C)C)ccc21 787653975 NITCCBSNMPBTMW-LJQANCHMSA-N 400.548 2.166 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H](C)C1 789861727 RMBLBRWSBFWZBO-PXNSSMCTSA-N 418.607 2.045 10 20 HECD CN1Cc2ccccc2[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864580 QJMCEJRYXZJDQZ-NRFANRHFSA-N 424.570 2.159 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c(O)c1 797389361 CYJGWGVKNDJDGY-OAHLLOKOSA-N 413.474 2.049 10 20 HECD NS(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)ccc1Cl 798341295 FXZRWLWZMAZSGJ-UHFFFAOYSA-N 419.684 2.386 10 20 HECD O=C(Nc1cncc(F)c1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 799262509 WYILHTNTVHVJBT-HNNXBMFYSA-N 406.845 2.299 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCC(=O)N3CCOCC3)cc2Cl)C1 799966642 LTLWDHDAWGVFMM-OAHLLOKOSA-N 408.930 2.234 10 20 HECD C[C@@H]1c2nncn2CCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676859 SZIQDMNQYMVCRL-MRXNPFEDSA-N 410.522 2.267 10 20 HECD COc1ccc(COCCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 804040348 WBWWLLHPOFPREG-UHFFFAOYSA-N 409.486 2.021 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c1 804426483 AKJVYQIYQKOQIP-CEXWTWQISA-N 416.499 2.408 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1COCCN1CC(F)F 807107829 LZJYNBWWQPNDQR-HOTGVXAUSA-N 417.884 2.092 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287709 MJZDHDMZNOSYKH-CIQXWFTPSA-N 411.546 2.467 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1nc(O)c2ccccc2n1)c1ccc(N(C)C)cc1 807672575 DLGQJYKMSMTCPL-AWEZNQCLSA-N 407.474 2.237 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 808084614 BNOOMIVNKZEPOE-YLJYHZDGSA-N 403.523 2.054 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1COC2(CCCCCC2)O1 809677511 QBLNIQFERNHHNZ-IBGZPJMESA-N 403.523 2.293 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(-c2nc(=O)o[nH]2)c1 857458670 ZXJPEEUDOXZGSZ-UHFFFAOYSA-N 412.421 2.060 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)c4ccc(O)cc4)CC3)nc12 917094459 ARRQFMZAYJXNTR-UHFFFAOYSA-N 424.457 2.412 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1 918461778 LNPZOLBSJFJXMH-UHFFFAOYSA-N 424.501 2.074 10 20 HECD Cc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918462493 BINWESACHVRILE-GOSISDBHSA-N 408.502 2.260 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2cnn(CC)c2nc1C 1116911897 XCKBWYMJMFBRSR-INIZCTEOSA-N 412.446 2.075 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cnn(C)c3C)n2)cc1 1326113164 VIEXWNDBUZYMOM-UHFFFAOYSA-N 405.505 2.289 10 20 HECD O=C(CN1CCCC1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425222 HQJXIXNHPSFYKY-UHFFFAOYSA-N 410.474 2.336 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H]3C[C@H]3F)cc2)CCC1 1790434492 QHVMXMNDHTZQDB-UONOGXRCSA-N 421.519 2.339 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ncccn1 1800715495 ANMWPEGQZNOVOE-CLLJXQQHSA-N 402.838 2.107 10 20 HECD Cc1cnn(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c1 1800715619 WQSYPCWFIQOSBC-QDMKHBRRSA-N 418.881 2.208 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817842556 FWRLQEPJYINYIG-HUUCEWRRSA-N 415.450 2.091 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1 24088787 ZJHZLFNZGHDGBF-UHFFFAOYSA-N 412.490 2.474 10 20 HECD C[C@@H](NC(=O)CCNC(=O)OCC(F)(F)F)c1ccc(N2CCOCC2)cc1 65561677 QCQCMHCPZUMBJB-CYBMUJFWSA-N 403.401 2.379 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc(C(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 140122159 DUFLZFPNSRFGNC-MRXNPFEDSA-N 417.531 2.265 10 20 HECD COCCn1cc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1=O 141999413 JPRFZHRUNWLUPC-INIZCTEOSA-N 400.479 2.214 10 20 HECD COc1ccc(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)CC2)cc1 726563625 PIHOIGWHGVJGDE-INIZCTEOSA-N 421.501 2.119 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)C3CC(=O)NC(=O)C3)c2C)cc1 726820665 GHCOYEKJPQODHE-UHFFFAOYSA-N 412.442 2.272 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(CN(C)C)ccc2OC)c1 729065799 FRZJWROJXOXDOJ-ZDUSSCGKSA-N 401.463 2.287 10 20 HECD CCc1nc(C[S@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 729871315 GTQQUFUMXBDXRI-MHZLTWQESA-N 407.561 2.312 10 20 HECD CC(C)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 732449647 MICXJQHDIOBLPZ-RBUKOAKNSA-N 401.555 2.060 10 20 HECD CON(C)S(=O)(=O)c1cccc(C(=O)NCCCSc2nccs2)c1 733973340 FOHKQIZYGPKDAJ-UHFFFAOYSA-N 401.535 2.237 10 20 HECD CN1CCC[C@H](N2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)C1 734662137 VBYIPZRZNPKUSV-NRFANRHFSA-N 417.623 2.161 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)N(C)Cc3ccc(N(C)C)cc3)ccc21 735649318 BYNPSCVXUWQHEU-UHFFFAOYSA-N 408.502 2.050 10 20 HECD Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NCc2ccc(N(C)C)cc2)CCCC1 742241969 YQPUDLCNQFTSLX-UHFFFAOYSA-N 420.535 2.265 10 20 HECD COc1ccc(N(C)CC(=O)NCC(=O)N[C@H](C)c2ccc(F)cc2)cc1OC 744390146 CYBOPDMBFQOWHW-CQSZACIVSA-N 403.454 2.273 10 20 HECD O=C(NC[C@H](O)C1CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904077 LCCSHVZQDMYQDB-YJBOKZPZSA-N 413.465 2.344 10 20 HECD CNC(=O)[C@@H](C)CN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747967470 NKQBHIQKOKVUQG-UONOGXRCSA-N 407.470 2.103 10 20 HECD CCOCCO[C@H]1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 749805090 BAIAUMSKLRQXNJ-NRFANRHFSA-N 406.523 2.054 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3cnc(N(C)C)n3C)cc2F)C[C@@H](C)O1 751784459 YVZMWYOBPOLYQI-GASCZTMLSA-N 418.517 2.238 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2cnc3nc(O)nc(O)c3c2)cc1 752233036 JADPMWVEIIQQSG-UHFFFAOYSA-N 417.491 2.103 10 20 HECD COc1ncnc(OC)c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761982550 NFMXSEHZUZWIFJ-AWEZNQCLSA-N 406.870 2.247 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2cccc(Br)c2O)C1 765516921 RKTMRSCIIBGULZ-VXGBXAGGSA-N 405.314 2.310 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(S(C)(=O)=O)c3)c2)CC1 769848942 SQCDAJLGLMSOIJ-UHFFFAOYSA-N 423.560 2.033 10 20 HECD Cc1ccc(N2CCOC2=O)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769932345 MDNXTJVOEVDUHS-UHFFFAOYSA-N 405.432 2.281 10 20 HECD CCCCn1cc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c(C)n1 770492922 LYYBVYIMUPLQSX-UHFFFAOYSA-N 401.423 2.274 10 20 HECD CCN1CCN(c2cccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)c2)CC1 770749667 XVZFKXCNDQJLJN-UHFFFAOYSA-N 423.561 2.458 10 20 HECD CS(=O)(=O)N1CCN(c2ccc(NCc3cc(Cl)cc(F)c3O)cn2)CC1 777502766 ROWUSNSKWNRCPO-UHFFFAOYSA-N 414.890 2.273 10 20 HECD CC(C)n1nnnc1-c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1F 782918548 IZMCWSBOUOZFFU-UHFFFAOYSA-N 403.399 2.397 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 784646169 JAASSDTUEGLPHI-UHFFFAOYSA-N 413.474 2.292 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1Cc1ccccc1F 785294831 NYAIOMZVTGZVDS-ZDUSSCGKSA-N 412.421 2.168 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1 785440357 YXOJSZXGINQHDR-UHFFFAOYSA-N 416.522 2.052 10 20 HECD O=C(COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc(O)c(O)c1 785766221 LWIPSYCPBDJQIG-GOSISDBHSA-N 420.421 2.260 10 20 HECD CCC(CC)N1C[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786657501 YSLFMARRONQZFB-IBGZPJMESA-N 414.550 2.008 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)c1 787484131 ARBVRGPIHSQYDW-ZDUSSCGKSA-N 412.446 2.055 10 20 HECD COc1ccc([C@@H](CO)N(C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788932281 MQURIYZXLKFWOI-OAQYLSRUSA-N 411.502 2.104 10 20 HECD CN1C(=O)Cc2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 789378195 NXMKVWOCSNKJDC-UHFFFAOYSA-N 424.526 2.014 10 20 HECD CCC[C@@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814144 ZCYQTOMNWWWOKQ-QFIPXVFZSA-N 421.513 2.086 10 20 HECD CC(C)OC(=O)CC[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 792043438 FHKUMHVOGYUKIL-AEFFLSMTSA-N 418.538 2.308 10 20 HECD C[C@H](COc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793685789 KBAJVXIWCDNXEB-XLIONFOSSA-N 412.486 2.484 10 20 HECD Cc1cnc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803299743 NEYRGVZXNPUUMH-LSDHHAIUSA-N 402.520 2.343 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CC(C)(C)OC1(C)C)c1ccc(N2CCOCC2)cc1 803307896 PATHHGIYPZFVIT-MAUKXSAKSA-N 403.523 2.163 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](CCN(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 803309916 CEKZICUQROCNDW-PXNSSMCTSA-N 418.582 2.183 10 20 HECD CCC(=O)c1ccc(N(C)Cc2ccc(N3CCOCC3)cc2)c(S(N)(=O)=O)c1 804333514 KYIMXNCSLYWAPS-UHFFFAOYSA-N 417.531 2.400 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc2c(c1)CC(=O)N2C 804574666 XJEUFNVSZMDFJM-INIZCTEOSA-N 418.497 2.075 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@](C)(CC)C3)cc2F)CC1 805007001 CHKJGAHOGJVBFP-QFIPXVFZSA-N 404.530 2.232 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3cnn(C(C)C)c3)CC2)cc1 806158606 MYMUEGUROIREEF-KRWDZBQOSA-N 413.522 2.389 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC1CCC(O)(c2cccnc2)CC1 806281823 LULIVZCGFPWQPM-UHFFFAOYSA-N 420.560 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H]2C[C@]2(C)NC(=O)NC2=O)cc1 806464957 PBPLJLSONGTBJW-UTKZUKDTSA-N 401.511 2.195 10 20 HECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)CC2 807289649 CYQKPXLZUPUSHW-IBGZPJMESA-N 407.518 2.130 10 20 HECD COC1(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCC(C)CC1 807848186 RGJILEAMTQWOHF-UHFFFAOYSA-N 417.550 2.193 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NCc2ccc([N+](=O)[O-])c(OC)c2O)s1 809721035 LODDHLNLJNUJAR-VHSXEESVSA-N 409.468 2.476 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(C)(=O)=O)ncc1Cl 816825422 CUVQLCUZZBOSNB-UHFFFAOYSA-N 423.922 2.247 10 20 HECD Cn1cc(/C=C\C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 919698181 VKNOXOXKTSHBEV-XQRVVYSFSA-N 421.480 2.005 10 20 HECD COC(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)n(-c2ccccc2)n1 1115983673 VJHBXQVETLIVMY-UHFFFAOYSA-N 420.469 2.426 10 20 HECD Cc1nc2ccc(S(=O)(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc2o1 1116730790 DMBLIMYJMRJTJB-UHFFFAOYSA-N 421.500 2.172 10 20 HECD CN1CCN(c2ccc(CN[C@H]3CCN(c4ccccc4C(N)=O)C3)cc2F)CC1 1322747844 OLEXSLBCZFEYEE-SFHVURJKSA-N 411.525 2.045 10 20 HECD CNC(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1800512268 SGHXMMDWOXXACY-NUZGMZIFSA-N 422.529 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3oc4ccccc4c3CO)CC2)cc1 726015872 PNSMNGSWXXISDP-UHFFFAOYSA-N 424.453 2.439 10 20 HECD CCN(CC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 731916597 QDJFVVJBGMMHCT-UHFFFAOYSA-N 411.502 2.414 10 20 HECD CC(C)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 734167662 YWQVLAXTAJRNLH-RKVPGOIHSA-N 406.502 2.248 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(N)(=O)=O)cc([N+](=O)[O-])c1C 735877358 BOIJJRUSYNOTQO-UHFFFAOYSA-N 420.491 2.279 10 20 HECD CCCCn1c(N)c(N(CC)C(=O)CN(CC)c2ccc(OC)cc2)c(O)nc1=O 746108825 FCZFNWJAWCTAEH-UHFFFAOYSA-N 417.510 2.219 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2F)C[C@H](C)O1 748482727 YBDVTMSWKYFICU-KBPBESRZSA-N 401.438 2.400 10 20 HECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730881 YOBFGGFXHHCYES-UHFFFAOYSA-N 408.505 2.014 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C(C)(C)C)C3)cc2F)CC1 750640135 CECZMEPCNMFPLY-QGZVFWFLSA-N 419.545 2.166 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCCc3c(F)cccc3F)CC2)cc1 758208446 FVUBKMHKQYUZDZ-GOSISDBHSA-N 405.489 2.289 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@@H](C4CCOCC4)C3=O)cc2F)C[C@@H](C)O1 761090011 HQIUNFYCMPVDOY-LPMFXHHGSA-N 405.470 2.286 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2cc([C@H](C)O)nn2)c(C)n1-c1cccc(F)c1 762958140 MRNGPMOJADCEAT-AWEZNQCLSA-N 400.410 2.304 10 20 HECD Cc1cccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 763381311 LYHHGCUGTHLRIM-INIZCTEOSA-N 412.465 2.091 10 20 HECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1C 767237836 UCJRBLIASPFVNS-ZIAGYGMSSA-N 410.515 2.443 10 20 HECD Cc1cc(C(=O)COC(=O)Cc2ccco2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767512904 FCCGBFAACZVYLA-UHFFFAOYSA-N 416.455 2.303 10 20 HECD C[C@@H](OC(=O)C[C@@H]1COC(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767602518 RDBDLVIOOGVSGI-CHWSQXEVSA-N 421.405 2.285 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)CC2)cc1F 769157513 WHXJCECJFDWBOW-UXHICEINSA-N 420.529 2.044 10 20 HECD Cc1csc2ncc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c(=O)n12 776465328 GTNDNIGBHDRWHD-UHFFFAOYSA-N 416.478 2.095 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)C1=O 779527883 GPFAPWVDMVAACC-MRXNPFEDSA-N 420.529 2.185 10 20 HECD CC(C)C[C@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788745369 GFFAWMKSWREJHB-CVDCTZTESA-N 416.566 2.471 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccccn3)cc2F)C[C@H](C)O1 789823774 GBXJSECHPJFYMW-JYJNAYRXSA-N 414.481 2.328 10 20 HECD C[C@H](O)C[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855663 VOWVWXHKIXDYGY-QFBILLFUSA-N 405.564 2.008 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(F)cc1C 793050234 DBMYEMZMWSDZJK-GFCCVEGCSA-N 418.421 2.408 10 20 HECD COc1cc(Cl)cc(CN[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 793247713 RJPUCORQTOEPGF-GOSISDBHSA-N 421.929 2.365 10 20 HECD CCn1nc(C)c(CC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1C 794413490 HVEMQHZFCBFEED-UHFFFAOYSA-N 416.522 2.437 10 20 HECD Oc1cc2c(cc1CN1CCN([C@H]3CCN(Cc4ccccc4)C3)CC1)[C@H](O)CO2 795696792 DIMAELKYSIWROH-NZQKXSOJSA-N 409.530 2.210 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1F 803663988 CYZLWOJETXFKBP-IBGZPJMESA-N 412.509 2.289 10 20 HECD CCc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 804034852 CKTZOYRFUCCSKF-KRWDZBQOSA-N 417.531 2.278 10 20 HECD CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)NCC(C)C)c(Cl)cc1Cl 808483263 JAPPWKNHBSOBDX-UHFFFAOYSA-N 410.275 2.243 10 20 HECD C[C@@H]1CN(c2ccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])cc2F)C[C@@H](C)O1 811738521 ARLCQPDXQNPDDJ-VXGBXAGGSA-N 403.414 2.454 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)[C@@H](O)c3ccccc3)CC2)cc1 812016892 STVFDKPQHHMBPF-XMSQKQJNSA-N 412.534 2.239 10 20 HECD COCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCOC1 812396660 XJRJHRDFBFKLFE-KRWDZBQOSA-N 401.511 2.186 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@@H]3CC(C)(C)OC3=O)cc2F)CC1 813633097 RVYLOSWZLBVRCS-GOSISDBHSA-N 406.502 2.203 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cnc1C 813652968 QYPGDHCQRQRTRR-UHFFFAOYSA-N 421.544 2.208 10 20 HECD COc1cc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c([N+](=O)[O-])cc1OC 814949964 YUTLELOEBCPUIP-UHFFFAOYSA-N 416.390 2.483 10 20 HECD O=C(Cc1cnn(-c2ccccc2)n1)NCc1ccc(N2CCC(CO)CC2)cc1 919970144 QTSVCFMVXBNJPS-UHFFFAOYSA-N 405.502 2.335 10 20 HECD C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1=O 919970345 WPFIWSPCWYRYLE-KRWDZBQOSA-N 423.513 2.326 10 20 HECD CCOc1ccc(N2CCN(CCCN3C(=O)CS/C3=C/C(=O)OC)CC2)cc1 1336435250 KEXKBNSUYGHCPN-HMMYKYKNSA-N 419.547 2.187 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)cc1F 1521776929 BPYWEEAWQKLYEI-UHFFFAOYSA-N 407.490 2.192 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1)c1cc(O)nc(O)c1 1792409407 ZOJVBYZLSQPIRB-BTTYYORXSA-N 402.838 2.107 10 20 HECD CC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CCCC1 1792672274 RWQJXCLNRAXYGJ-BTTYYORXSA-N 409.577 2.065 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)cco1)c1cc(O)c(O)c(Cl)c1 1795382403 CKYSKUQRUPUACN-CLLJXQQHSA-N 418.833 2.270 10 20 HECD CC(C)(C)n1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cn1 1796598729 BLLVIVVMNQMXOA-MUJYYYPQSA-N 413.478 2.010 10 20 HECD Cc1c(CNC(=O)N2CCN(c3ccc(C(N)=O)cn3)CC2)n(C)c2ccccc12 471615497 UICMBACLWGSIIN-UHFFFAOYSA-N 406.490 2.012 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1F 729061348 BKOKZCZYVCMQTH-GFCCVEGCSA-N 406.410 2.381 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C3CCN(C(=O)C(C)C)CC3)cc2F)CC1 730193063 CNWHBNABGMOEEO-UHFFFAOYSA-N 418.557 2.478 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730591064 GZEATXBJMHVBPE-CZUORRHYSA-N 412.442 2.402 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1 734016009 FGCCOHMYPXXXNX-UHFFFAOYSA-N 416.455 2.402 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F 734525674 OKGNOFAMIXGGFN-SFHVURJKSA-N 413.444 2.434 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)nn(CC)c2C)cc1 741651868 AQBUDAIVJGBYDD-UHFFFAOYSA-N 400.526 2.472 10 20 HECD CCN(C)C[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 744424076 SHNKCZNCPVHHAU-BJLQDIEVSA-N 420.573 2.329 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)ccc1OC 752001175 QKFDNCXIVOBINJ-CYBMUJFWSA-N 422.503 2.475 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@](C)(CO)C3CCCCC3)CC2)cc1 754043553 SHZDYEPMRLMMPF-GGAORHGYSA-N 405.583 2.099 10 20 HECD COc1cc(C[C@H](NCc2ccc(N3CCOCC3)c(F)c2)C(=O)O)cc(OC)c1 756367610 UYYDHSWTKSOXLL-FQEVSTJZSA-N 418.465 2.465 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H](CO)CC(F)F 758381990 NTJJGVZIEMUONX-LBPRGKRZSA-N 411.371 2.357 10 20 HECD CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 759206204 APWDQVCSYPOWNT-IRXDYDNUSA-N 424.409 2.294 10 20 HECD CN1CCN(c2ccc(CNC(=O)NCCCSc3nccs3)cn2)CC1 759547828 NMBVQLNUWCGIQG-UHFFFAOYSA-N 406.581 2.272 10 20 HECD COc1ccccc1C(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760647568 CHVZQVZOPYOKPB-UHFFFAOYSA-N 414.458 2.253 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)[C@@H]4Cc5ccccc5CN4C3=O)cc2)C1 761117161 DMYXLYHUIJKBEE-CTNGQTDRSA-N 418.497 2.277 10 20 HECD Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1 768425967 XLWDQBBPDPYXFM-QFIPXVFZSA-N 405.458 2.478 10 20 HECD COc1cc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)c(O)cc1C 768447256 NSZFKIGAZJDZPV-UHFFFAOYSA-N 410.458 2.498 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)c2)CC1 770148963 UDDBVDDDUFZZAX-LJQANCHMSA-N 420.513 2.286 10 20 HECD CN(C)C(=O)CN1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 774359872 JGWGNCDOYQIWFL-UHFFFAOYSA-N 422.489 2.273 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1O 775004379 NAPBKPHZTWXXHN-GFCCVEGCSA-N 409.464 2.410 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)c(C)c1 778924522 WYTXQYCBKGHBMW-UHFFFAOYSA-N 418.515 2.432 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@H](C)N1C(=O)OC(C)(C)C 785440336 YKCRFATZNXRMST-HOTGVXAUSA-N 418.538 2.225 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCc2nn[nH]c2C1 787080795 YFVKCLZIWIZKJA-NTEUORMPSA-N 419.557 2.433 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@]1(N(C)C)CCSC1 788240575 CVLRYWHTGAKREU-OAQYLSRUSA-N 406.596 2.043 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC(C)(C)O1 789811749 HANVGHAYADWBLA-OAGGEKHMSA-N 421.513 2.081 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccoc3)cc2F)C[C@@H](C)O1 789815793 ACTCHORNGDRIBS-HUUCEWRRSA-N 403.454 2.307 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOc2ccccc2C1 789856420 UORRIZJINGKKEN-UHFFFAOYSA-N 411.527 2.277 10 20 HECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 789984460 RGQJHNPPHUHFEE-QWFCFKBJSA-N 414.550 2.090 10 20 HECD O=C(NCc1nnc2n1CCCC2)C(=O)N(Cc1ccccc1O)C1CCCCC1 793585784 ARYOKUZEORBBOV-UHFFFAOYSA-N 411.506 2.298 10 20 HECD CCCc1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 796546735 DITSPMKCYPMRQV-UHFFFAOYSA-N 401.463 2.450 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCCCN3C(=O)CNC3=O)cc2Cl)C1 799923484 MLQSPXHBGKRDLW-CQSZACIVSA-N 421.929 2.317 10 20 HECD C[C@@](O)(CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 801138397 WNDHZVBBDCCLCC-GBXCKJPGSA-N 409.530 2.388 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccccc3OC)CC2)cc1 804315952 WCFXKTKUNCKVHG-UHFFFAOYSA-N 411.502 2.447 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@H](c2ccccc2F)C1 806280985 KBPXAUWAYZNFBK-HNNXBMFYSA-N 409.508 2.481 10 20 HECD O=C(NCc1ccc2c(n1)CCCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807573365 MCGWBFPZTOISFK-HXUWFJFHSA-N 423.513 2.490 10 20 HECD COc1ccc(CN2CC[C@H](NC(=O)N(C)Cc3ccccc3O)C2=O)c(OC)c1 807577449 RVWDPBHUQYLZJJ-SFHVURJKSA-N 413.474 2.352 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4O[C@@H](C)C[C@@H]4C)n3)CC2)cc1 809464652 JTRTXWHGLIVSCQ-AUSJPIAWSA-N 400.479 2.456 10 20 HECD C[C@H](OC(=O)c1cn(C)cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 811228415 HVSKVIGCRMAYKM-LBPRGKRZSA-N 403.394 2.380 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN3c4ccccc4C[C@H]3C2)c1 811613815 CICBDXLDRKGAPP-INIZCTEOSA-N 401.488 2.041 10 20 HECD CCOC1(C)CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 816787983 OFUFCBFHVBXVKK-MDZDMXLPSA-N 415.534 2.318 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnn(C4CCOCC4)c3)CC2)cc1 1116413919 ITARNEWWJXXDDP-UHFFFAOYSA-N 420.535 2.144 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)NC)ccc3C)CC2)cc1 1320393692 IHYUBGGXUJBYSB-UHFFFAOYSA-N 417.531 2.264 10 20 HECD O=C(COC1CCCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601152 YZLRIMVHMYZVRV-MUJYYYPQSA-N 403.479 2.094 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccccc3)cc2F)C[C@H](C)O1 57373893 UTJMZNJGJRTUSK-IRXDYDNUSA-N 413.493 2.414 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c1 115731643 JNSKALYZXUKMAQ-UHFFFAOYSA-N 421.494 2.251 10 20 HECD CCn1nnnc1-c1cccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 303743194 JAZPCAFQZIJUEQ-UHFFFAOYSA-N 421.505 2.129 10 20 HECD O=C(O)c1ccc2c(=O)n3c(nc2c1)/C(=C\c1cn(Cc2cccnc2)nn1)CC3 543116088 ADZGZCDEJXZCEL-ZSOIEALJSA-N 400.398 2.074 10 20 HECD CC(C)C(=O)N1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 727842047 OGBIHOMBGHGEJM-UHFFFAOYSA-N 406.502 2.062 10 20 HECD Cc1nn(C)c(=O)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 728164755 KBLLUHOQPUSJOG-BETUJISGSA-N 402.470 2.080 10 20 HECD Cn1c(=O)oc2cc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 728393814 QBYVZXIBGDDDST-OAHLLOKOSA-N 423.473 2.155 10 20 HECD C[C@H]1Oc2c(cccc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)NC1=O 729523920 YOXMOXPPJIOPPA-CYBMUJFWSA-N 413.449 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)CN(CCO)[C@H]3CCc4ccccc43)CC2)cc1 733895065 NKQDJNFOZUJRRY-QHCPKHFHSA-N 409.530 2.326 10 20 HECD O=C(NCc1nnc2n1CCC2)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742712662 YIRWXZRYWCGTGB-ZDUSSCGKSA-N 406.437 2.294 10 20 HECD CCN(CC(=O)N1CCC[C@@H](NC(C)=O)C1)Cc1cc(Br)ccc1O 744425716 KXLPDALEKKSJMH-MRXNPFEDSA-N 412.328 2.104 10 20 HECD Cc1cc(C(=O)COC(=O)c2cn(CC(N)=O)nn2)c(C)n1-c1ccc(C(C)C)cc1 745469916 ZDLLUWIZAJFPKY-UHFFFAOYSA-N 423.473 2.334 10 20 HECD CC[C@@H](NC(=O)NCc1cccc(OC)c1O)c1ccccc1OCC(=O)NC 745648909 IMRDGEHDLIVYMX-MRXNPFEDSA-N 401.463 2.476 10 20 HECD C[C@@H](NC(=O)Cn1c(S)nc2ccccc2c1=O)c1ccc(N2CCOCC2)cc1 746687920 NBHJPSRBULSUIU-OAHLLOKOSA-N 424.526 2.399 10 20 HECD Cc1nccn1-c1ccccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 747213149 TWFUCEQCWUTVAF-UHFFFAOYSA-N 400.460 2.188 10 20 HECD C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccccc3O)c2)C[C@@H](C)O1 748354266 XQRZPAJTLKNYCY-HUUCEWRRSA-N 404.488 2.120 10 20 HECD CNC(=O)Cc1noc(CN(Cc2cccs2)c2ccc3c(c2)OCCO3)n1 749842002 GJZHUSWICHWFQR-UHFFFAOYSA-N 400.460 2.398 10 20 HECD Cc1cc(C(=O)COC(=O)c2cc(C(N)=O)c[nH]2)c(C)n1-c1ccc2c(c1)OCCO2 750420491 LZSGVOFUTACSBQ-UHFFFAOYSA-N 423.425 2.332 10 20 HECD CC(C)N1C[C@@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1=O 750639741 WURUWOBLLHSTFY-UXLLHSPISA-N 406.502 2.248 10 20 HECD Cc1nnc2n1C[C@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 750795388 OTENBCTUVCVPGL-RHSMWYFYSA-N 403.914 2.289 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 751136626 JLAJAOTXSFLDJJ-MRXNPFEDSA-N 424.544 2.460 10 20 HECD COc1cc(OC)cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227449 IUYMMGSTBLIGNQ-UHFFFAOYSA-N 424.494 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCCCS3)CC2)cc1 752797110 LSTYUOAKUCEBPW-ZBTAVZRMSA-N 403.548 2.302 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](c4nccn4C)C3)cc2F)CC1 756695925 ZGANLZZOBIFUCK-GOSISDBHSA-N 414.529 2.400 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c[nH]c4ncccc34)CC2)cc1 757152274 VYXWDADLGDOMAV-UHFFFAOYSA-N 408.458 2.006 10 20 HECD COc1cc(N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)cc(OC)c1OC 758934447 DXFBECPIEAYZOL-UHFFFAOYSA-N 410.478 2.323 10 20 HECD COc1cc(N2CCN(c3ncc(C(N)=O)cc3Cl)CC2)cc(OC)c1OC 758935247 JYFAUCPHTIYZKW-UHFFFAOYSA-N 406.870 2.186 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3[C@H]4CCO[C@H]4C3(C)C)CC2)cc(OC)c1OC 759268414 WJHIZKFYAFCCHL-CDHQVMDDSA-N 419.522 2.358 10 20 HECD COc1ccc2nc(CN3CCN(c4cc(OC)c(OC)c(OC)c4)CC3)[nH]c2n1 760879589 WEIVQLGRINKCPA-UHFFFAOYSA-N 413.478 2.315 10 20 HECD COC(=O)CCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 764581249 BFPSJDJVBQJFNH-UHFFFAOYSA-N 409.394 2.287 10 20 HECD O=S(=O)(c1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768151914 KIJMMOHZCNVFNN-UHFFFAOYSA-N 419.522 2.169 10 20 HECD CCC[C@](C)(O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 770215576 YZQNBEHJKVSFSZ-FQEVSTJZSA-N 422.503 2.019 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCOc1ccc(S(C)(=O)=O)cc1 773739330 FFFAWULBQKPAAR-AWEZNQCLSA-N 407.488 2.408 10 20 HECD CCCCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774652766 LFXCZHCFCCSOPZ-SJLPKXTDSA-N 402.539 2.090 10 20 HECD COCc1noc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 777047290 VRCRLCPGVQJLNP-UHFFFAOYSA-N 423.337 2.257 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H]3CCn4ccnc4C3)cc2F)C[C@@H](C)O1 777460542 YJJDKKPWHNVQFS-INMHGKMJSA-N 401.486 2.450 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](C)C(=O)Nc4ccccc43)CC2)cc1 779225013 JNMUYEZVNZROFW-UYAOXDASSA-N 424.545 2.273 10 20 HECD C[C@H]1CN(C)C(=O)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 782881344 RZKMZXJMRXEOFL-CJAAZZPWSA-N 423.585 2.419 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)C2 786675385 UCXLSODJHOWZIU-SFHVURJKSA-N 420.469 2.286 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 787827758 CUXNJSPRIVUTBY-INIZCTEOSA-N 410.518 2.386 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN(c4cnc(O)nc4N)CC3)c2C)c1 787913513 RZPWATHXLFXPLF-UHFFFAOYSA-N 406.490 2.443 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCO[C@@]2(CCSC2)C1 788931109 FLKFENRNRPMPIS-UWJYYQICSA-N 403.548 2.074 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)OC(C)(C)C 788939563 UZYMMDQRHFTVES-UHFFFAOYSA-N 418.538 2.276 10 20 HECD C[C@@H]1CCC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832640 BLRRQDZBMLMJKC-WBVHZDCISA-N 405.514 2.440 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3cccc(C)n3)CC2)cc(OC)c1OC 792236379 KFCQFBOCKSJHFX-UHFFFAOYSA-N 414.506 2.490 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(Cl)n1 792964731 AVAYACNQSNNENN-UHFFFAOYSA-N 402.882 2.199 10 20 HECD CCCc1c(NC(=O)C(=O)NCc2ccc(OC)cc2O)cnn1-c1cc(C)ccn1 797390382 FDFOXGPYXREREN-UHFFFAOYSA-N 423.473 2.497 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1 797675309 MVUXMBJOWIYMFZ-ZDUSSCGKSA-N 420.491 2.030 10 20 HECD COCCn1c(-c2ccccn2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802535643 CCVBLXSYJUUJNS-UHFFFAOYSA-N 412.469 2.461 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](n3ccnc3)C2)cc1F 804852510 JITOZVXOLQHADA-KRWDZBQOSA-N 401.486 2.348 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1 805243269 VOBZQBPYTHEMRW-UHFFFAOYSA-N 411.823 2.000 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 806178002 AYGWOFPKCYBVPU-QZTJIDSGSA-N 414.550 2.007 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1COC2(CCC(C)CC2)O1 806703747 MPVFZFYMDYIBGN-JOXBDYEASA-N 403.523 2.115 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676012 BYKRNNYXCOZJGZ-CRAIPNDOSA-N 418.538 2.398 10 20 HECD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)[C@@H]1C 808851781 KLBSRWSQLAYUOX-RBUKOAKNSA-N 412.578 2.482 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c(O)c1 815631615 KLTJOMYWXPTVJO-BFUOFWGJSA-N 411.458 2.417 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCCCCS(N)(=O)=O 816940391 BHEHUACSYSCJFA-UHFFFAOYSA-N 407.330 2.352 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1S(=O)(=O)N(C)C 918374581 NTXORFQZMZKNDP-UHFFFAOYSA-N 419.503 2.034 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2nccnc2c1 918442165 AGYQPNMUWGHOPP-UHFFFAOYSA-N 419.485 2.093 10 20 HECD CCOc1ccc(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920637545 IYJSGLSDDQZVJP-LBPRGKRZSA-N 422.459 2.346 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CC(=O)N(c2ccccc2)C1 921076025 ANJUSUUBYDZHQZ-KRWDZBQOSA-N 412.465 2.267 10 20 HECD Cc1ccc(CCS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1327055551 JWCADOPTDFZZIC-FQEVSTJZSA-N 415.559 2.359 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCN3CCN(c4ccccn4)CC3)CC2)cc1 1341407645 XZKHGKYFVNJHEQ-UHFFFAOYSA-N 423.561 2.341 10 20 HECD C/C=C(\C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499536 LOWIMTQVSOMPQM-LXRBDXNZSA-N 421.548 2.228 10 20 HECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N(Cc1ccco1)Cc1ccccc1O 104725612 DYVHORRVGHLXSG-LATRNWQMSA-N 406.438 2.321 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(OCC(F)F)c2)c1 726625691 UISFSYUPJYEMLM-UHFFFAOYSA-N 400.403 2.338 10 20 HECD CO[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 728056398 SXBWWZMBLIWFAH-KRWDZBQOSA-N 405.520 2.035 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c1 728980977 RILDIXUDAJQZQM-JLCFBVMHSA-N 411.458 2.354 10 20 HECD CC(=O)c1ccc(N2CCN(C(=O)COC(=O)c3cc(O)cs3)CC2)c(F)c1 731910662 VIYSJWWKKVFRRM-UHFFFAOYSA-N 406.435 2.301 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)c1 734016761 DDDQBHHDFOIBEJ-UHFFFAOYSA-N 420.487 2.124 10 20 HECD CCOC(=O)C1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCC1 741079813 PWXJOHIISUDPJU-UHFFFAOYSA-N 407.486 2.319 10 20 HECD COc1cc(N(C)Cc2nnc3n(C)c(=O)c4sccc4n23)cc(OC)c1OC 741795806 RXNQKIAUAISGPQ-UHFFFAOYSA-N 415.475 2.305 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNC(=O)c1cc2ccccc2[nH]1 745643193 LNQLAGNJUSCQAY-UHFFFAOYSA-N 422.485 2.166 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)CN1CCN(C)CC1 745810181 YMNFTYXHMIFKSY-CQSZACIVSA-N 413.360 2.322 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1 746396474 RTRBTQGQSLUOGL-GFCCVEGCSA-N 409.446 2.321 10 20 HECD C[C@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 750558030 JLCJGWFSFBXVOB-ZDUSSCGKSA-N 417.421 2.481 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1S(N)(=O)=O 752151477 IMCYPRZETQMADL-KRWDZBQOSA-N 404.488 2.169 10 20 HECD CC[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)N1CCOCC1 753056537 HUNYEJQTOHWVJN-GOSISDBHSA-N 401.463 2.334 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)CCC3CCOCC3)CC2)cc1 757667603 SBDXTISZPVGSHR-UHFFFAOYSA-N 404.555 2.275 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCC3(N(C)C)CCCCCC3)CC2)cc1 758186104 PCQYZHPMYNYAHZ-JOCHJYFZSA-N 418.626 2.422 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 765658974 MMMBLPOOATWKLR-SZXPJGKVSA-N 406.502 2.153 10 20 HECD NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769958450 QMUQIKCHRYOLEU-OCCSQVGLSA-N 423.516 2.028 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3(OC)CCCCC3)CC2)cc1 774783265 QDYMPGFNAOQIOR-ZHACJKMWSA-N 415.534 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 778221968 ZDWJFAPGWOBVRC-MDZDMXLPSA-N 410.430 2.447 10 20 HECD Cc1nnc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)s1 780812824 CHJILHBCQRGBLZ-UHFFFAOYSA-N 410.502 2.344 10 20 HECD Cn1c(SCC(=O)OCC(=O)c2ccc(O)c(O)c2)nnc1-c1cccs1 783390214 SJIFZWQHORBZCQ-UHFFFAOYSA-N 405.457 2.473 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)cc1 785434524 UQVUDIDMOWPZAO-UHFFFAOYSA-N 422.529 2.132 10 20 HECD CN(CCN(Cc1ccccc1)S(C)(=O)=O)Cc1ccc(N2CCOCC2)cc1 792199530 TYIMAKQUHLRZGI-UHFFFAOYSA-N 417.575 2.417 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cc[nH]c(=O)c3=O)cc2Cl)C1 800571565 KGQCAZLUMCZHSQ-CQSZACIVSA-N 404.898 2.133 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCc3c[nH]nc3C2)cc1 806303494 XAIYEJLCGLHQRU-GOSISDBHSA-N 421.501 2.271 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ncnn1C(C)(C)C 809929907 XXWMIZSDSOYYHX-UHFFFAOYSA-N 400.527 2.153 10 20 HECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 918308219 GZPCJKXRTWWWDX-UHFFFAOYSA-N 412.446 2.337 10 20 HECD CC(C)OCCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 919089526 LDGSEOAOWBBZNO-IYBDPMFKSA-N 410.486 2.414 10 20 HECD CC[C@@H](C)[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793623752 NNUWBIYAXBNUOM-HFVZKWEFSA-N 410.898 2.410 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2c(c1)C(=O)CC2 1796604026 BWSCOKPPKAZFIB-BJWYYQGGSA-N 421.453 2.187 10 20 HECD COC(=O)c1csc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726601210 JSVNSMMCYSPLLE-UHFFFAOYSA-N 410.517 2.491 10 20 HECD O=C(NC[C@@H]1CCCO1)c1c(NS(=O)(=O)c2cnc[nH]2)sc2c1CCCC2 736540192 VPQAQTOHGGLUQB-NSHDSACASA-N 410.521 2.060 10 20 HECD Cc1cc(N2CC[C@H](NC(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)n(C)n1 745906472 QHTRDZYFJRVYAM-IBGZPJMESA-N 410.522 2.274 10 20 HECD CC(C)OCCS(=O)(=O)N1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1 747469432 LQPSFBWLVOBSQE-UHFFFAOYSA-N 414.568 2.268 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3cnn(C(C)C)c3)CC2)cc1 754803784 WBAVWSJZQWHONR-GHTZIAJQSA-N 401.555 2.306 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NCCc1ccc(O)c(O)c1 755022119 RVQIDZYZFSLQGW-UHFFFAOYSA-N 423.491 2.111 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](c3ccccc3)N(C)C)CC2)cc1 758184620 FEJVIYFSJLYUFW-VWNXMTODSA-N 412.578 2.071 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)cc1 758971202 ZNWJPVLEUQKDEX-UHFFFAOYSA-N 417.531 2.500 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)C[C@H](O)c3ccco3)CC2)cc1 759575872 QJVLNWROOSIWMQ-PXNSSMCTSA-N 416.522 2.222 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3[C@@H](C)C3CC3)CC2)cc1F 760257520 VNRLEXWUQMHZOA-AWEZNQCLSA-N 415.469 2.289 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc(Cl)nc3)cc2)C1 760819016 ZVSWHSMGLLFJES-KRWDZBQOSA-N 415.925 2.479 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](O)CCc3ccccc3)CC2)cc1 764640073 MMUSDKLQOJCBCQ-QHCPKHFHSA-N 411.546 2.317 10 20 HECD CC(=O)Nc1ccccc1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 766936823 HBVNBWAGHAUYKN-UHFFFAOYSA-N 408.502 2.172 10 20 HECD COc1cccc(S(C)(=O)=O)c1NNC(=S)Nc1ccc(NC(C)=O)cc1 767421778 ASFCJYOHXSUWLZ-UHFFFAOYSA-N 408.505 2.371 10 20 HECD CC(C)(C)OC(=O)NCCN(CCO)C(=O)NCc1ccc(N2CC=CC2)cc1 768367489 HRVKVSAIFOZHDL-UHFFFAOYSA-N 404.511 2.091 10 20 HECD CCOc1cccc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1O 769450880 JEQUJCKEQHWTPG-UHFFFAOYSA-N 418.515 2.152 10 20 HECD CNC(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 771059413 QVXQNXSBCFSEMO-INIZCTEOSA-N 402.882 2.195 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1OC 773764026 ZRUBEWULLFANLA-LBPRGKRZSA-N 420.418 2.401 10 20 HECD CCC[C@@]1(COC)CCCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 773956862 BNQUNGHLQHIBJB-GGAORHGYSA-N 405.583 2.459 10 20 HECD C[C@H](NCc1nnc2n(C)c(=O)c3sccc3n12)c1ccc(N2CCOCC2)cc1 775259198 HAAQYHYTLYWOIZ-AWEZNQCLSA-N 424.530 2.330 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3N(C)C)CC2)cc1 778252538 SJICRXKWOUPHJY-OUKQBFOZSA-N 422.529 2.282 10 20 HECD CCOc1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 778301452 IKVWQVVJPHPYON-VAWYXSNFSA-N 410.474 2.332 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2ncn(C)c2=O)c(C)n1-c1ccc(F)c(Cl)c1 779130120 TYJRPPUCBFBMMF-UHFFFAOYSA-N 420.828 2.208 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](N(C)C(=O)/C=C/c3ccc(O)c(O)c3)C2=O)c1 779529563 DZECAWPOVXVJCB-SUQGKYDKSA-N 412.442 2.392 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 785394547 BUZYDJYMFBJHIR-MRXNPFEDSA-N 406.490 2.135 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(OCC(F)F)ccn3)cc2)CC1 786260596 ZBKLJABRZAVODN-UHFFFAOYSA-N 418.444 2.324 10 20 HECD CO[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 786652795 AZKKRCAODZIHRM-LAUBAEHRSA-N 411.502 2.204 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1F 788420458 PPRBSMZSAXNTBC-UHFFFAOYSA-N 422.501 2.024 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 793409003 MNOVFDHOLIPLPR-UHFFFAOYSA-N 410.404 2.424 10 20 HECD CCOc1ccc(CNc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c(O)c1 796403555 UNGYHNLBXVOHCM-UHFFFAOYSA-N 422.503 2.433 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCN(c4ccccc4)C3)ccc21 803686098 VXIVZVKUHDCKLA-HXUWFJFHSA-N 406.530 2.470 10 20 HECD C[C@@H](NC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807665482 CNAWEWBKIDPBLH-CQSZACIVSA-N 406.527 2.349 10 20 HECD C[C@H]1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC[S@@]1=O 821568967 RNQYUBVSJJLABH-YNKAJNBZSA-N 411.543 2.492 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 915553621 DPQHGVACJBKXCN-UHFFFAOYSA-N 421.515 2.498 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1nnc2ccccn12 918200801 DOTFKTYUCLBNAI-MRXNPFEDSA-N 408.506 2.498 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284664 MWZIOQSEFRWKRL-UHFFFAOYSA-N 405.401 2.065 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(-n2cccn2)c1 918310643 NHNDCFUUBZZUOA-UHFFFAOYSA-N 419.485 2.306 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccc(-n4cccn4)cc3)nc12 919178528 OIMBEGRJSBIVLE-UHFFFAOYSA-N 421.413 2.083 10 20 HECD CN(C)C(=O)CN(C)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 920432135 LDYKCAZQHGBVJW-JLHYYAGUSA-N 411.574 2.276 10 20 HECD COC(=O)[C@H]1CCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1319832906 RRSLEGFEWUDZID-GXTWGEPZSA-N 424.500 2.326 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(n4cc(Cl)cn4)CC3)nc12 1319938591 OBJCFXSKTIZARF-UHFFFAOYSA-N 404.858 2.299 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1c[nH]c2ccc(OC)cc12 1323859769 LOELYWSGYYXCQQ-SFHVURJKSA-N 412.442 2.421 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)c1ccco1)c1cc(O)nc(O)c1 1801304846 XHTDQZFZSGUQEM-CLLJXQQHSA-N 407.373 2.130 10 20 HECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1803780558 IPZJDQVHAQPMSB-MGPUTAFESA-N 422.441 2.423 10 20 HECD Cc1cc[nH]c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816170280 BQIVKGXJEWBDKZ-AWEZNQCLSA-N 410.434 2.472 10 20 HECD C[C@H]1CN(c2ccc(CNc3ncc(S(N)(=O)=O)s3)cc2F)C[C@@H](C)O1 725787312 DZXVLJNACOLAFQ-PHIMTYICSA-N 400.501 2.155 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1cccc(NS(C)(=O)=O)c1 730207053 GVPHZQQBRTWNGZ-UHFFFAOYSA-N 417.531 2.096 10 20 HECD Cc1ncsc1CN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 731281859 CMWSVZRZBBJZDI-INIZCTEOSA-N 401.536 2.495 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCS(=O)(=O)NC(C)(C)C)cc1F 731364277 JQENASXYNGUZNK-UHFFFAOYSA-N 402.536 2.189 10 20 HECD CCCc1[nH]nc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1[N+](=O)[O-] 731808173 JBIWVNWXGXIIEN-UHFFFAOYSA-N 401.467 2.409 10 20 HECD O=C(COC(=O)COC[C@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 733593962 FEWLXWBWDLCXHW-CQSZACIVSA-N 423.421 2.139 10 20 HECD COC(=O)[C@H]1CC12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 733848321 MFTYHHRUHFQPNM-MRXNPFEDSA-N 405.470 2.147 10 20 HECD CS(=O)(=O)N[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 735200571 LPAFRRKJOIVMHK-QGZVFWFLSA-N 415.475 2.191 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccn(C(C)C)n3)CC2)cc1 738969166 KAZXVDWKPPSKOL-UHFFFAOYSA-N 414.554 2.484 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCC[C@@H]2C2OCCO2)c1 742149580 KEBIXDPNYVTFLJ-HXUWFJFHSA-N 404.507 2.154 10 20 HECD CCN(CC(=O)N1CCN(C(=O)C2CC2)CC1)Cc1cc(Br)ccc1O 743871177 UYFGXQMXNUNDRA-UHFFFAOYSA-N 424.339 2.057 10 20 HECD CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NCc2ccccc2O)c2ccc(Cl)cc21 743901161 ABZVSBFUWNOZMW-AWEZNQCLSA-N 415.877 2.271 10 20 HECD CC(C)NC(=O)NC(=O)[C@@H](C)OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 744473413 DWTHWFHNSKYDKN-GFCCVEGCSA-N 408.410 2.242 10 20 HECD COc1cccc(CNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1O 745289911 BRAWYSRYDLTTMF-GOSISDBHSA-N 403.454 2.413 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(CN4CCN(C)CC4)c3)CC2)cc1 746094502 YGZBTALLXWCSDS-UHFFFAOYSA-N 408.546 2.405 10 20 HECD O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748039809 AJBCJQLMZXAHAC-OAHLLOKOSA-N 421.544 2.469 10 20 HECD COC(=O)[C@H]1CCCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 752333323 XYGIBQDNMPWWAP-LJQANCHMSA-N 406.438 2.428 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@]3(C)CCO[C@H]3C3CC3)CC2)cc1 753092336 BJAABBVUWDDHJQ-JTHBVZDNSA-N 416.566 2.464 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1F 753738766 UPXRJDFYBLRFIK-OIISXLGYSA-N 417.481 2.047 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(F)ccc(F)c3OC)nc12 756677314 RADSUPXBUWEQRF-UHFFFAOYSA-N 407.329 2.255 10 20 HECD COC(=O)C1(NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CCS(=O)(=O)CC1 757033212 MMJFOHURQVCUGM-UHFFFAOYSA-N 418.515 2.253 10 20 HECD CCn1cc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccc1=O 759199371 LVOPZVXVUKNYMF-UHFFFAOYSA-N 416.478 2.248 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc2)C1 760902797 ACAPYGOSINMFNL-AFYVEPGGSA-N 400.523 2.145 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2cccc(Br)c2O)CCCO1 765567117 YNXRTZOZAWATER-ZDUSSCGKSA-N 400.317 2.455 10 20 HECD CNC(=O)COc1cccc(CC(=O)NCc2cccc(Br)c2O)c1 765766480 XXYODUDBHNCSDH-UHFFFAOYSA-N 407.264 2.138 10 20 HECD CCOC(=O)[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 767025954 AZQDJMLUWQXHGV-JXXFODFXSA-N 421.513 2.083 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1 768074299 KSCWRILDQUIVPQ-UHFFFAOYSA-N 406.442 2.330 10 20 HECD C[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CN(C)CCO1 770107074 GRMLXPKJZVTTAZ-RDTXWAMCSA-N 412.481 2.275 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC3CCN(Cc4ccccc4)CC3)ccc21 774545718 VFUQEDJDRNHDLQ-UHFFFAOYSA-N 420.557 2.466 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F 775537337 CPBVUXODAWHVNM-UHFFFAOYSA-N 413.858 2.232 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccccc3[N+](=O)[O-])CC2)cc1 778236673 ZLQUHZNLYUXRJC-KHPPLWFESA-N 424.457 2.125 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(N4C(=O)CCC4=O)c3)c2)CC1 781045591 LLBGSEDJVKNGKD-UHFFFAOYSA-N 420.469 2.261 10 20 HECD COCc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 787506432 UXPLSHFIBPCVHR-KRWDZBQOSA-N 411.502 2.163 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1 787738992 SUMTUHROWMXLTR-OAQYLSRUSA-N 422.529 2.157 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 788270591 MGAFBWLCHSFLAK-DOTOQJQBSA-N 418.538 2.446 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)[C@@H](C)S(C)(=O)=O 788289439 VIDJQHJDFCLHDV-KBUPBQIOSA-N 400.516 2.125 10 20 HECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788932304 JURSHYYNZOKIRD-FQEVSTJZSA-N 400.567 2.387 10 20 HECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 789797516 AEFQBGKOESVTRD-UHFFFAOYSA-N 413.493 2.254 10 20 HECD CC(C)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789847428 QXXUETGBRJBXAG-LJQANCHMSA-N 405.564 2.130 10 20 HECD CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NCc3ccc(OC)cc3O)c2)n1 797390027 KHHXVLAHOLSGAJ-UHFFFAOYSA-N 422.441 2.381 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN[C@@H](c3ccccc3Cl)C2)c1 801406419 FNZBQUKZYQCQLV-MRXNPFEDSA-N 409.895 2.204 10 20 HECD COc1ccccc1CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298270 SFCMODUTGOLNBB-QGZVFWFLSA-N 411.502 2.368 10 20 HECD CC(=O)Nc1ccc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803558377 STBHSDCGDVAEJJ-UHFFFAOYSA-N 408.502 2.003 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cn(C)nc3-c3ccccc3)ccc21 803686561 DSKSNQKQKSMSMO-UHFFFAOYSA-N 417.513 2.402 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(c3cnc[nH]3)CC2)cc1F 804852941 IUQVVSVBCXJKAL-UHFFFAOYSA-N 401.486 2.417 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2nc([C@@H](C)OC)no2)cc1F 804853384 XDYZOZHTLIXAHG-CYBMUJFWSA-N 421.473 2.037 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]4CCC[C@H]43)cc2F)CC1 805007585 MOWRKCRHCGMPRB-AZUAARDMSA-N 416.541 2.375 10 20 HECD C[C@H](OC(=O)[C@@](C)(O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805581062 UAJLYZNMJQOVCI-MYODQAERSA-N 407.422 2.493 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccnc(Br)c2)c1 815196585 KOBKXBBSXBROKJ-UHFFFAOYSA-N 401.238 2.278 10 20 HECD Cn1ncc(C(=O)NCCCSc2nccs2)c1I 815590662 DULLXCUUMKWRDF-UHFFFAOYSA-N 408.290 2.393 10 20 HECD CC(=O)c1cc(CN(C)Cc2ccc(C(N)=O)cc2)c(O)c(CN2CCOCC2)c1 1322025322 TVKZHRHVQLUQGL-UHFFFAOYSA-N 411.502 2.158 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OCC2CC2)nc1 1334826059 SSOWAADBRRPFAN-UHFFFAOYSA-N 415.515 2.035 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1=CCCC1 1795044790 CFCMAZRIKWYBLA-XOIINTDNSA-N 406.866 2.065 10 20 HECD CN(C)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796601438 IWIGKMHWOMBRLD-VBUUOAMHSA-N 410.474 2.124 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@]1(F)Cl 1802496529 FWGRTCNHBDEEQJ-YKHWISPQSA-N 424.856 2.379 10 20 HECD Cc1ccc(CC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)o1 1847036779 DEHCKTHLEGQDCB-VMPITWQZSA-N 412.442 2.164 10 20 HECD Cc1cnn(-c2ccc(C(N)=O)cc2NS(=O)(=O)c2cccc3nsnc23)c1 538705766 ZPCWEVWRTQEQBX-UHFFFAOYSA-N 414.472 2.085 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1nc(CN2CCOCC2)cs1 577316159 DLGSLCZUDJZTDJ-UHFFFAOYSA-N 403.508 2.472 10 20 HECD O=S1(=O)CCN(c2ccc(CNC(=S)Nc3ccc(Cl)nc3)cc2)CC1 727086381 ZHGYZKYJALSLIB-UHFFFAOYSA-N 410.952 2.456 10 20 HECD CCCN1CCC(N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 727225853 PINCBECNMMOASA-IBGZPJMESA-N 415.582 2.404 10 20 HECD CCNC(=O)COc1cccc(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 728947336 SSCTUIHMQJSCPW-AWEZNQCLSA-N 401.463 2.476 10 20 HECD CCN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)CS(=O)(=O)CC 733341838 FOOAPKWDWCSZSN-HNNXBMFYSA-N 415.531 2.017 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1cc(OC)ccc1O)O[C@H](C)C2 734072530 FPVLPLWUYLTJMA-GFCCVEGCSA-N 400.431 2.378 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3cccc(F)c3F)CC2)c1 734548826 GEZCGPBXLDAZMN-UHFFFAOYSA-N 411.430 2.004 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc4cccnc34)cc2)C1 734743501 VBVMJDBOGDUXJP-SFHVURJKSA-N 424.526 2.415 10 20 HECD Cn1cc(C(=O)NCC2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cn1 741092177 YZJKESRQUGNZLK-UHFFFAOYSA-N 422.533 2.148 10 20 HECD COc1ccc(N(CCNS(=O)(=O)c2cnn(C)c2)Cc2ccco2)cc1F 744404618 UNYYKWMXLQPCGA-UHFFFAOYSA-N 408.455 2.146 10 20 HECD CSC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCOCC1 745692620 YEBXXZPWXYKPBF-KRWDZBQOSA-N 420.579 2.100 10 20 HECD O=C(NCCNc1cnccn1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745772076 MCXPSUJJZVPJKG-AWEZNQCLSA-N 406.437 2.458 10 20 HECD COc1cc(C[C@@H](CO)CNC(=O)NCc2ccc(N(C)C)cc2)cc(OC)c1 747446275 JQGCENNAHMUWHI-GOSISDBHSA-N 401.507 2.420 10 20 HECD COC(=O)[C@@H](O)C1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 747516708 GKXBMTVPPWMFLT-FQEVSTJZSA-N 400.475 2.489 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3cc(Cl)cn3C)CC2)cc1 754060762 ILFQNIPSQXUCPG-FQEVSTJZSA-N 406.958 2.302 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(O)n1 755190865 CIWNKRMUIPRMBO-KBPBESRZSA-N 416.453 2.103 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 756092969 FTOYGBBWZAZWOE-ZULIPRJHSA-N 410.518 2.091 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCCC4(C3)OCCO4)cc2F)CC1 768067769 HZEHRDRGOJGJLO-UHFFFAOYSA-N 406.502 2.016 10 20 HECD Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768447796 PTQYVRKNVCHVMJ-OXJNMPFZSA-N 412.486 2.238 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1 778926705 FKHCPKYLUHZNSR-CQSZACIVSA-N 404.850 2.295 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cn4c(n3)CCCC4)cc2F)C[C@@H](C)O1 779877086 BPRSAUNPVKTGLA-HUUCEWRRSA-N 422.526 2.451 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc2c1OCCC2=O)c1ccc(N2CCOCC2)cc1 780046683 MKWZPCLXMHMYHT-HNNXBMFYSA-N 423.469 2.304 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccccc1-n1ccnc1 788913821 ZNOFYQIGIMSVRI-UHFFFAOYSA-N 403.486 2.405 10 20 HECD C[C@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(N2CCOCC2)c(F)c1 790755556 AOCNRFLAIRWBEG-INIZCTEOSA-N 422.522 2.279 10 20 HECD COC(=O)c1cnc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c([N+](=O)[O-])c1 790775321 AUIARYXVMIZWMF-UHFFFAOYSA-N 413.434 2.057 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3OC)CC2)cc1 795061148 UOELQNKZGTTWQO-UHFFFAOYSA-N 407.448 2.123 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795249363 RUGZIBKNXSYBLJ-DLBZAZTESA-N 413.540 2.027 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1 796829239 MKJYBXZVNVBJHX-UHFFFAOYSA-N 414.437 2.412 10 20 HECD C[C@H](NC(=O)C(=O)NCC(C)(C)[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803305346 LLGJTGOOCRJPSE-FXAWDEMLSA-N 417.550 2.412 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](OCC(F)(F)F)C3)ccc21 803686809 QSTPXTJDMXSHMI-INIZCTEOSA-N 413.440 2.255 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 807288707 ZRNURKBTPHBFOW-DENIHFKCSA-N 408.546 2.154 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@H](C(C)C)C3)CC2)cc1 808084612 BNOOMIVNKZEPOE-PXNSSMCTSA-N 403.523 2.054 10 20 HECD O=C(CNC(=O)c1ccc(Br)cc1)OCC(=O)c1ccc(O)c(O)c1 916590307 MPBIYSRSGCSYAV-UHFFFAOYSA-N 408.204 2.016 10 20 HECD Cc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1[N+](=O)[O-] 916676319 GWXNBQRIDREHFN-UHFFFAOYSA-N 403.460 2.068 10 20 HECD CN(C)c1ccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918339781 HCHWYVKWHWMXNM-UHFFFAOYSA-N 415.559 2.236 10 20 HECD Cc1cc(Br)ccc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 919872114 ZHJFSRBPBAGPFA-UHFFFAOYSA-N 410.293 2.218 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)c2ccccc2oc1=O 1116570789 JVOVXBZEMUBUOB-HNNXBMFYSA-N 411.410 2.417 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)NC=O)cc1 1800094368 GYPJCRIBSXEIJI-BZNRXQDOSA-N 422.529 2.480 10 20 HECD CCn1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845500987 MRPGWLMEGICYFL-UHFFFAOYSA-N 404.854 2.098 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2)c1O 727761385 ZMZORYTZGYFXOE-INIZCTEOSA-N 424.544 2.117 10 20 HECD O=C(Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1)c1cc(O)cs1 738511326 YBCNCNYPXIJGRI-UHFFFAOYSA-N 423.498 2.387 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 742916491 JVDPDXIURXTIDR-UHFFFAOYSA-N 414.462 2.164 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N1CCN(C(C)=O)CC1 743870930 IAJCJIJLXQOWIY-CYBMUJFWSA-N 412.328 2.056 10 20 HECD CNS(=O)(=O)c1csc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 748699179 XMYAAHHNGDTXDI-UHFFFAOYSA-N 411.574 2.139 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@](C)(CO)C3CCCCC3)CC2)cc1 755967698 QMNWPXYDWHTPEI-QHCPKHFHSA-N 418.582 2.448 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 756570632 AZFDQVILMCKTPE-HNNXBMFYSA-N 418.515 2.264 10 20 HECD CCn1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757272449 OTMFBPMROOPHFK-CYBMUJFWSA-N 407.421 2.228 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc4c(c3)OCCO4)CC2)cc1 758221352 BSVGSPAVIDNZMI-GOSISDBHSA-N 400.475 2.028 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc([S@](C)=O)cc3)CC2)cc(OC)c1OC 759406944 YYVDZUKDTYTHPV-LJAQVGFWSA-N 418.515 2.412 10 20 HECD C[C@H](C1CC1)n1nccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 760200456 LPVUTIISWBIRHI-MRXNPFEDSA-N 411.506 2.288 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 761967763 OXRVCFDOBUVJHU-LLVKDONJSA-N 408.451 2.472 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 762411675 CWWKNVHWSRDEEN-LBPRGKRZSA-N 421.409 2.111 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccnc(-n2cncn2)c1 768913178 VXUJRQBGOJHTLT-KRWDZBQOSA-N 412.881 2.416 10 20 HECD COc1cccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)c1O 769507404 KHFLZKCLZVHQPF-UHFFFAOYSA-N 424.544 2.496 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](Cn2cccn2)c2ccccc2)c1 769908209 MJAZBFAGRWRYDU-KRWDZBQOSA-N 400.460 2.132 10 20 HECD Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774357668 WZCOCENHBWZXRQ-UHFFFAOYSA-N 415.515 2.257 10 20 HECD COc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)N2CCCC2)cc1 774810615 LHABCJFLLMUMKI-QFIPXVFZSA-N 424.545 2.331 10 20 HECD C[C@@H](CCc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 775217986 FKTMNUWONVJLHM-HNNXBMFYSA-N 417.481 2.134 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCc4nnc(O)cc4C3)cc2F)C[C@@H](C)O1 776119036 ZNKBKJMCUZURRN-OKILXGFUSA-N 415.469 2.203 10 20 HECD COc1cc(C)ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 781343737 RAQNKIJSAHIXSV-UHFFFAOYSA-N 416.449 2.453 10 20 HECD COCCO[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 781963254 IOXAYXQYNLIJGM-INIZCTEOSA-N 408.454 2.138 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc4c(c3)NC(=O)C4)CC2)cc1 783790954 IQFFIKHMVQNWLO-UHFFFAOYSA-N 422.529 2.061 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)O[C@H](C)C2 786625505 IXAQKCGZRWLOCQ-OAHLLOKOSA-N 423.513 2.334 10 20 HECD C[C@@H](Sc1n[nH]c(CO)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787485396 BFVWKCVSLHKJIR-SNVBAGLBSA-N 408.439 2.192 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccco3)cc2F)C[C@@H](C)O1 787953006 LYQGLQWCIZVCFF-OAGGEKHMSA-N 417.481 2.396 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCc2ccccc2C1 788320850 PZBWRBSLPWWNEX-LJQANCHMSA-N 407.514 2.061 10 20 HECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 788931878 IOPMLJIKMDVAPE-KRWDZBQOSA-N 411.502 2.495 10 20 HECD O=C(NCCc1ccc(Cl)nc1)C(=O)NCc1ccc(N2CCSCC2)cc1 789863333 FLOGANATCHBCTA-UHFFFAOYSA-N 418.950 2.263 10 20 HECD CC[C@@H](C)NC(=O)CCNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 793666142 MWLUAPRKGMQQES-QGZVFWFLSA-N 402.539 2.056 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCCCC1 793717753 HWEXJRUJHCDEBS-SFHVURJKSA-N 414.550 2.186 10 20 HECD Cc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCC(CO)CC3)cc1)OCO2 795113619 PCTWAWDNALTJDI-UHFFFAOYSA-N 418.515 2.411 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1Cl 797389939 GBQSFRAVCPWTEW-UHFFFAOYSA-N 419.865 2.449 10 20 HECD C[C@@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663292 MDBIZNNEPPPHAS-HNNXBMFYSA-N 418.538 2.475 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC3(CN(C)C)CCCC3)CC2)cc1 804319080 XWFWIBQKSSHOQL-UHFFFAOYSA-N 416.566 2.018 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](c3nccn3C)C2)cc1F 804853077 SPIDPNAOJMWCES-MRXNPFEDSA-N 401.486 2.038 10 20 HECD CC[C@H](C)CN(CC)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007181 GJURRSIECOTKEZ-KRWDZBQOSA-N 406.546 2.478 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)C[C@H](O)C3CC3)cc2Cl)C1 807957022 VRKFJBNIZCMKFC-KUHUBIRLSA-N 407.942 2.422 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)cc3)cc2)C1 813419939 GXXHFMRVHBYMII-APWZRJJASA-N 401.894 2.392 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)CCCC2=O 815066276 ZDNIQJNSTIXJFE-UHFFFAOYSA-N 412.511 2.370 10 20 HECD O=C(NC1CC1)c1cccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 917760130 BMQGBEXRMHYPNA-UHFFFAOYSA-N 401.488 2.216 10 20 HECD C[C@H](CN1CCCCC1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117081 GKIPCXUFECYABX-MJGOQNOKSA-N 401.555 2.062 10 20 HECD Cc1ccc(-c2cc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)n[nH]2)o1 918645409 TVGMAALOHBKQBH-UHFFFAOYSA-N 414.487 2.143 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(-n2ccnc2)c1 918762782 AALWVDLVDNPYKM-UHFFFAOYSA-N 419.485 2.306 10 20 HECD Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1S(C)(=O)=O 919971813 YJAVSSCLVLQAOO-UHFFFAOYSA-N 420.506 2.429 10 20 HECD COC(=O)c1ccc(F)c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920865637 IILZVROPHZHJFS-AWEZNQCLSA-N 422.478 2.488 10 20 HECD Cc1occc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004618 IKNWVGJMSVHHDR-FQEVSTJZSA-N 420.849 2.410 10 20 HECD Cn1cc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)cn1 1788429373 LEYZVRBUKLRTKF-UHFFFAOYSA-N 421.457 2.217 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2nccnc2c1 1796601307 SBTSNVFPRXTYAQ-MUJYYYPQSA-N 419.441 2.002 10 20 HECD O=C(Cc1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426197 OGVWQTCJQFTOLM-IBGZPJMESA-N 424.501 2.364 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 12069000 VRFGAKFDWUFAQO-UHFFFAOYSA-N 419.547 2.194 10 20 HECD O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1ccc(N2CCOCC2)c(F)c1 53109442 LIFSCUCAXMAZPZ-UHFFFAOYSA-N 413.371 2.159 10 20 HECD C[C@@H](NC(=O)Cn1cc(Br)ccc1=O)c1ccc(N2CCOCC2)cc1 109180352 SLHJCBZTEACEIJ-CQSZACIVSA-N 420.307 2.325 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 472802611 KUATYWSXZPWBIZ-UHFFFAOYSA-N 422.485 2.452 10 20 HECD CCNC(=O)CN(CC)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 728950007 XDYRSCPFPDGIHO-UHFFFAOYSA-N 416.444 2.210 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3cnnc3[S@@](C)=O)c2C)cc1 729242160 QSKFNTWTSYDARL-MUUNZHRXSA-N 400.460 2.093 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(OC)nc3)cc2F)CC1 730115103 GSZXGRWPAHFSNF-UHFFFAOYSA-N 401.486 2.371 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)cc1F 731405803 OJYGVFUPLUVQAY-HXUWFJFHSA-N 421.561 2.414 10 20 HECD CC(C)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 732449649 MICXJQHDIOBLPZ-RTBURBONSA-N 401.555 2.060 10 20 HECD CC(C)Oc1ccc([C@@H](O)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 734872158 LXHVCMYGWYCWQG-SFHVURJKSA-N 408.476 2.014 10 20 HECD CN(C)C(=O)c1cc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccn1 741070304 ZPHGCIOIDTWRAN-UHFFFAOYSA-N 415.469 2.205 10 20 HECD Cn1cnc2cc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc21 751238116 XPGOGHGITIUUQH-UHFFFAOYSA-N 414.531 2.261 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCc4ccccc43)cc2)C1 752656062 ZRBQIUOONPKFEU-NTKDMRAZSA-N 422.529 2.022 10 20 HECD Cc1noc(C)c1[C@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753962179 BIBWVUJZIOZEPV-CQSZACIVSA-N 405.520 2.336 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCC[C@@H]1CCOC1=O)c2[N+](=O)[O-] 754055679 VXDXLVDHOYAMOZ-NSHDSACASA-N 409.350 2.480 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCNS(=O)(=O)c2cccc(Cl)c2)c1 756480593 SOHIPIJHFUTPAO-LBPRGKRZSA-N 412.895 2.461 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(N(C)C(C)=O)cc3)CC2)cc1 758232898 ULLSLQFSYOCPFE-NRFANRHFSA-N 413.518 2.240 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4c3cccc4[N+](=O)[O-])CC2)cc1 759851998 XZTREQXCYRLJJY-GOSISDBHSA-N 412.490 2.149 10 20 HECD COc1cc(N2CCN(CC(=O)NC(C3CC3)C3CC3)CC2)cc(OC)c1OC 759878249 JZXAZCIGQVBOKT-UHFFFAOYSA-N 403.523 2.139 10 20 HECD COc1cc(N2CCN(Cc3cnc(N4CCCC4)nc3)CC2)cc(OC)c1OC 761218846 KWQVMKOFCKLLLG-UHFFFAOYSA-N 413.522 2.425 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCc4ccc(OC)cc43)nc12 763452663 PUMHNUUFXCHADA-HNNXBMFYSA-N 411.414 2.393 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCc4n[nH]cc4C3)cc2F)CC1 765850628 YGKXZXUVPCIQEJ-QGZVFWFLSA-N 400.502 2.047 10 20 HECD CCc1ccc(CS(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 768836557 DIUJPHWCSQUQKQ-UHFFFAOYSA-N 422.572 2.103 10 20 HECD O=S(=O)(Cc1ccon1)N1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 769502339 LAJMINUBSRUHFI-UHFFFAOYSA-N 406.291 2.335 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 770086071 ANRGKQQHHUGRDA-INIZCTEOSA-N 420.487 2.291 10 20 HECD COC(=O)CC[C@@H](Cc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 770151512 VPDKODGZLFMHEV-HNNXBMFYSA-N 420.487 2.058 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 770203569 AGBFTCVQULUIBP-UHFFFAOYSA-N 422.478 2.270 10 20 HECD Cc1cc(F)cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 770607177 OMUOHGBFININRW-UHFFFAOYSA-N 403.429 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnc(C5CC5)n4)n3)CC2)cc1 771056010 KDKJDILNFRCFEV-UHFFFAOYSA-N 420.473 2.304 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CO)C3)cc2Cl)C1 774241114 CXVGQIMSYNLZCJ-RDJZCZTQSA-N 407.942 2.423 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)CC2)cc1 775156951 BBGRMNRSJLUPPP-LBPRGKRZSA-N 400.306 2.090 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3Cc4ccccc4O3)CC2)cc1 778237428 PCPWWOXVZFQEKH-XPTLAUCJSA-N 421.497 2.020 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc(OC)c(O)c3)CC2)cc1 779222532 QDIQSPMTHBZUME-HXUWFJFHSA-N 415.534 2.024 10 20 HECD Cc1cc(C)cc(OCC(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1 779534160 FHXAPULUWRFFQY-XQRVVYSFSA-N 410.470 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)COc3nc(C)cc(C)c3[N+](=O)[O-])CC2)cc1 782054943 BFLSYMBRCIDXIR-UHFFFAOYSA-N 400.435 2.343 10 20 HECD O=C(NCCCOc1ccccc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785587354 JYNDQICWDUCDEO-HXUWFJFHSA-N 412.486 2.485 10 20 HECD Cn1nccc1COCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 785883609 WCZLDMZHEQLIDC-UHFFFAOYSA-N 412.412 2.109 10 20 HECD C[C@@H](OC(=O)CCn1ccnn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787626656 CFHUEIKTSHYHJL-CYBMUJFWSA-N 418.409 2.014 10 20 HECD COc1ccc2c(c1)nc(CNC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)n2C 788930860 BBEJUEUXXLKAKI-UHFFFAOYSA-N 421.501 2.115 10 20 HECD Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)cc1 789967470 QFOJIIGKDURUBH-CQSZACIVSA-N 422.478 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(C(C)=O)s3)CC2)cc1 792165964 VOOMWZLDDGWNLT-UHFFFAOYSA-N 402.472 2.465 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)c2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 795249380 SDCGPPJSVZQIJX-QGZVFWFLSA-N 423.539 2.030 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 795544521 RTJDODKTLFUSOO-QGZVFWFLSA-N 417.462 2.174 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1OC 796869727 RVMNZKGCGJHVIZ-UHFFFAOYSA-N 412.442 2.321 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c(O)c1 797389731 WCXUNQJFBCSASN-UHFFFAOYSA-N 415.515 2.205 10 20 HECD CN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F 799666026 UNKHWMPYAMLFFP-UHFFFAOYSA-N 415.874 2.305 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1cc(F)cc(F)c1)c1ccc(N2CCOCC2)cc1 803303110 IAALXJZHLZNSQW-HNNXBMFYSA-N 417.456 2.338 10 20 HECD Cc1nc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)sc1C 803311730 YLURHGDOTINAAI-OAHLLOKOSA-N 416.547 2.133 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)c3ncc(C)s3)CC2)cc1 804316779 IZQMNNANGRYIJB-AWEZNQCLSA-N 416.547 2.465 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)cc1F 804851929 SVAWMZNUJLDOQN-INIZCTEOSA-N 407.486 2.090 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc2c1OCCC2=O 807387047 WOLCXXSFZHEJOV-UHFFFAOYSA-N 419.231 2.375 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3C[C@H](OC(C)C)C3(C)C)CC2)cc1 809438419 RIELFRAYBXBHOF-UXHICEINSA-N 417.550 2.442 10 20 HECD CCC[C@]1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 812010541 QWOZXYSWLLDDFN-AVRDEDQJSA-N 402.539 2.082 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)c3cc(F)c(C)cc3F)CC2)cc1 814800429 XICKTWBXSIUYND-UHFFFAOYSA-N 424.469 2.404 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 917365215 ZODOWSFINMFRAS-SFHVURJKSA-N 418.515 2.464 10 20 HECD CC(C)(C)c1nnc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 918286186 DSZPCSWZYCODME-UHFFFAOYSA-N 421.498 2.066 10 20 HECD O=C1OCc2c1cccc2S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 918744339 GENPIDJCSMUMAY-UHFFFAOYSA-N 404.513 2.389 10 20 HECD CN(C)c1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1325453551 QTXCZCOOKSXRJP-HXUWFJFHSA-N 423.561 2.496 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(Cl)nc1F 1796598747 DHSUKZFCQUFPGO-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cccc(F)n3)CC2)C1 1810547458 YHTHLFLMVQGRRV-UHFFFAOYSA-N 414.437 2.186 10 20 HECD CC(C)(C)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826861347 WYGCHKQHFNNYMC-QGZVFWFLSA-N 418.538 2.114 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCc1nc2ccccc2c(=O)[nH]1 18546582 URFLCCXPFDVWAH-UHFFFAOYSA-N 422.485 2.124 10 20 HECD CCNC(=O)c1ccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 550477465 MBKIIDTWEQRQOZ-UHFFFAOYSA-N 406.486 2.169 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(F)c(-n4nnnc4C)c3)CC2)cc1 727938919 RAIRAYKLILDNLL-UHFFFAOYSA-N 411.441 2.473 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(CCO)CC(C)(C)C)CC2)cc1 730112644 GUPAEOZATYVMBQ-UHFFFAOYSA-N 406.571 2.257 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(CC(C)C)C3)cc2F)CC1 730194963 SXOTWTQVQZFXRJ-GOSISDBHSA-N 404.530 2.088 10 20 HECD CC(=O)N1CCN(C(=O)CCNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 730783766 USXMJZHEUFTTTH-UHFFFAOYSA-N 410.518 2.213 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1 734072442 AABRBHPNCKACGF-UHFFFAOYSA-N 415.515 2.205 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)c2ccc(C)c(O)c2O)cc1 734191575 YKBLVWFQZXSRFL-UHFFFAOYSA-N 407.444 2.385 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc(NC(C)=O)c1OC 742573396 LMBLNTCCPQALEQ-UHFFFAOYSA-N 413.474 2.429 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1 743905765 HPHUIWRXJSKNJY-CYBMUJFWSA-N 412.446 2.136 10 20 HECD CC(C)(C)N1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 746952146 MLJTVUXOXDPHMX-LJQANCHMSA-N 415.582 2.404 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H](O)Cc1ccccc1 747387161 FTYBIETYCACHFR-UCNVEGJOSA-N 424.545 2.180 10 20 HECD COc1cccc(NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 747762847 ZHCFQDDLSADKGA-UHFFFAOYSA-N 422.532 2.030 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCCC[C@H]3N3CCOCC3)CC2)cc1F 763660126 QASQZOUWGVSKQC-VQTJNVASSA-N 420.529 2.309 10 20 HECD Cc1ccc([C@@H](C)[C@@H](O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 764861971 JHYRAHSBFPJHRK-DYESRHJHSA-N 416.543 2.011 10 20 HECD COc1ccc2c(c1)CCCN2Cn1c(=O)oc2cc(S(=O)(=O)N(C)C)ccc21 766338689 CYSICBZPZOSZPD-UHFFFAOYSA-N 417.487 2.264 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3-c3ccccc3)CC2)cc1F 768107451 YDFODJDJHDSKTQ-UHFFFAOYSA-N 423.448 2.307 10 20 HECD COc1ccc(N2CCN(CCNc3ccc4nnc(C(F)F)n4n3)CC2)cc1 768527332 XCLHVQLDOLGVOG-UHFFFAOYSA-N 403.437 2.305 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C(C)C)nn4C)n3)CC2)cc1 771055555 GCRIICLOQCFIGB-UHFFFAOYSA-N 424.505 2.493 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)C3CCC(O)CC3)nc12 773488298 BXXJOQLAEHCWTQ-UHFFFAOYSA-N 405.451 2.232 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(C(F)(F)F)nc3)cc2)C1 777577804 TZBCPSVNVBUTAO-ZDUSSCGKSA-N 407.396 2.127 10 20 HECD Cc1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(F)F 777875036 JQMRNKHDWQCWFO-DHZHZOJOSA-N 422.500 2.347 10 20 HECD CC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 778306368 XMNIFOIACUAGKD-MHNQQFQPSA-N 415.534 2.221 10 20 HECD CON(C)S(=O)(=O)c1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 782549836 LDVIIWGHTRPMPO-UHFFFAOYSA-N 420.491 2.365 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)cc1 785425834 RVXUULHTBQNJSV-MRXNPFEDSA-N 416.472 2.290 10 20 HECD CCN(CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 785527701 DATLAQTYLAEBJP-UHFFFAOYSA-N 424.545 2.172 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cc(Cl)c2c(c1)OCCO2 787874751 ITIUTSKOVAYOEA-UHFFFAOYSA-N 417.893 2.452 10 20 HECD CSc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323717 OIAVRECMIPYRTK-UHFFFAOYSA-N 413.543 2.486 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC(=O)N(CC2CC2)C1 789377288 HIAOUWTXJKAOHN-CQSZACIVSA-N 417.465 2.301 10 20 HECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859720 FWZVJBQPALHNST-QFIPXVFZSA-N 419.591 2.256 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864057 LPPPTLMQJAJUCA-IBGZPJMESA-N 418.607 2.093 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)c(O)c1 793129075 OFQXPXGAFGPZNR-UHFFFAOYSA-N 421.519 2.335 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1CC(C)(C)OC1=O 795675984 JUGOVGXKGGEWIQ-SFHVURJKSA-N 406.438 2.426 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2)CC1 799541770 FNTUHUGBACXTMZ-UHFFFAOYSA-N 404.448 2.064 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](CCN(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 803309923 CEKZICUQROCNDW-YLJYHZDGSA-N 418.582 2.183 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 805736725 CYWVQJRXQZJFBZ-GJZGRUSLSA-N 406.527 2.207 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1 807097102 KBBHEPSUGXCFOH-MJGOQNOKSA-N 400.567 2.446 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCO[C@@]2(CCOC2)C1 808115040 MGABDYJPRDVSPD-XXBNENTESA-N 415.534 2.090 10 20 HECD CO[C@@H](C)c1nsc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 809924660 RORGIBVBJVIBOL-GXTWGEPZSA-N 418.523 2.269 10 20 HECD O=C(CSc1nnc(N2CCOCC2)n1Cc1ccco1)c1ccc(O)c(O)c1 832833757 DADPDCANAKJKRQ-UHFFFAOYSA-N 416.459 2.142 10 20 HECD O=C(Nc1ccc(-n2cccn2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918296448 KFYUQAMXXOFTAR-GOSISDBHSA-N 421.457 2.119 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(-n2ccnc2)c1 918763355 IYXVHVDKOYNOQF-UHFFFAOYSA-N 423.448 2.103 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cn2ccnc2)cc1 1116669788 ZFRBVVTYMJRKED-SFHVURJKSA-N 409.442 2.247 10 20 HECD CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1317928953 UTZQZPFTZNOFTD-UHFFFAOYSA-N 421.494 2.354 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)[C@H](C)CO)CC2)cc1 1320090033 PZXUCPRIVUMIQC-OFNKIYASSA-N 413.562 2.061 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnc4c(cnn4C)c3)n2)c[nH]1 1320429391 ROEHRZSAFKLDTA-UHFFFAOYSA-N 418.460 2.007 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2Cc2ccc(N3CCN(C)CC3)c(F)c2)cn1 1343627827 VOQKNXFFBZNFOG-ONOMSOESSA-N 419.570 2.100 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243741 HBWZKCHZJGMAAD-JOQLLSBZSA-N 422.909 2.391 10 20 HECD O=C(/C=C/C1CC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1803183268 KIHILQPESBBBFT-IKSNEBHTSA-N 408.458 2.174 10 20 HECD O=C(Cn1ccc2c(F)cccc21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248947 WHQACBKRRGQLLJ-UHFFFAOYSA-N 424.432 2.104 10 20 HECD Cc1nn(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(=O)c(C#N)c1C 31756418 IHVIFCMANFPARR-UHFFFAOYSA-N 412.405 2.146 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](CNC(C)=O)C3)cc2F)CC1 730133592 ZMWNDCUMXMVHAT-IBGZPJMESA-N 419.545 2.025 10 20 HECD COc1ccc([C@@H](CO)N(C)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 733195259 ILKMBUSGWCBDEH-JOCHJYFZSA-N 413.518 2.018 10 20 HECD COc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)c1 734017359 FTOQIVBJPMHDKB-UHFFFAOYSA-N 417.443 2.428 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 741092982 MDFWIWLDROHSSN-APWZRJJASA-N 409.552 2.273 10 20 HECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc21 746038075 LWKSBBBYKMDOJZ-UHFFFAOYSA-N 423.517 2.442 10 20 HECD CCCN(CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O)Cc1ccccc1O 750871763 BTDVCRUTTGTOOC-UHFFFAOYSA-N 402.495 2.136 10 20 HECD CCC(CC)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC 752221795 NIVVFLHCQGCGFR-QGZVFWFLSA-N 418.538 2.167 10 20 HECD CCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)COC1 756567093 IZFIMWVOYDUOLN-HUUCEWRRSA-N 408.470 2.025 10 20 HECD CCn1nc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C1CC1 759022097 FRWOLELOZZDYMR-UHFFFAOYSA-N 415.469 2.011 10 20 HECD COc1cc(N2CCN(C(=O)NCCN3CCC[C@H](C)C3)CC2)cc(OC)c1OC 759219413 AVKVNOSTOFOARX-KRWDZBQOSA-N 420.554 2.276 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)c1 763223199 LAYZPNZUFSQHCC-HNNXBMFYSA-N 402.831 2.020 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1 764157392 NJTHYXOPRIDITL-QMMMGPOBSA-N 402.831 2.332 10 20 HECD O=C(COC(=O)[C@H]1C[C@@]12CCOC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 764634622 GJXNFVKRCUCGQX-WAIKUNEKSA-N 405.406 2.370 10 20 HECD CS(=O)(=O)Nc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 771837779 ZQHAKLRNODULCL-UHFFFAOYSA-N 409.851 2.386 10 20 HECD CC(=O)Nc1ccccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772877625 HWFGMMWSQQLQPZ-UHFFFAOYSA-N 401.438 2.316 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1)c1ccc(N(C)C)cc1 773848369 WCOCKKYOBWUDBN-CQSZACIVSA-N 403.504 2.113 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F 785297542 PMFACHRAVLXXMD-GFCCVEGCSA-N 415.421 2.050 10 20 HECD COC(=O)CC[C@@H](NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)C(=O)OC 791753721 IUDGAIIWJIROIK-GOSISDBHSA-N 402.447 2.327 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Br)cn1 794174292 VGLVITRPTNHSHB-VIFPVBQESA-N 414.281 2.412 10 20 HECD Cn1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc2ccccc2c1=O 795396416 ILUGYAONBHBTAQ-GOSISDBHSA-N 418.497 2.170 10 20 HECD COc1ccccc1CCNC(=O)CNC(=O)NCc1ccc2c(c1)CCCN2C 798108463 XGSRZWYKEHUZHZ-UHFFFAOYSA-N 410.518 2.236 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)Cn3ncn4nccc4c3=O)cc2Cl)C1 800049041 LEAKNGYVZXITHM-CQSZACIVSA-N 414.897 2.097 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)cc2Cl)C1 800719779 NOTQJFALPGAVQU-CXAGYDPISA-N 419.913 2.022 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(Cc3ccco3)C[C@@H]3CCCO3)ccc21 803685478 BFXTVCVDGHESQK-FQEVSTJZSA-N 411.502 2.486 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(CC2CCCCC2)CC1 806275524 JUDJCMAHMKLEDH-UHFFFAOYSA-N 410.609 2.466 10 20 HECD COc1ccc(OC)c(CCCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 807289715 FWJIVHLZICZYCI-UHFFFAOYSA-N 423.513 2.445 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(C)cc(OC)c3)CC2)cc1 807540572 YNXRLZOPRDXSAM-UHFFFAOYSA-N 411.502 2.367 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671672 RXBVOSINVRVUII-JKSUJKDBSA-N 418.538 2.303 10 20 HECD COC(=O)[C@@H]1[C@H]2CN(c3cc([N+](=O)[O-])c(OC)c(Br)c3[N+](=O)[O-])C[C@H]21 813625663 VLIDASKLIPVPEK-MTBHXBHISA-N 416.184 2.129 10 20 HECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 915778295 IHOAGPMSIUBQAC-UHFFFAOYSA-N 410.518 2.482 10 20 HECD O=C(COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(O)c(O)c1 916595523 OCTQZDNFEILTOU-MRXNPFEDSA-N 419.455 2.067 10 20 HECD O=C(NCCCN1CCCCCC1=O)NCc1ccc(N2CCOCC2)c(F)c1 918186418 HSXNYMQLHRWQLF-UHFFFAOYSA-N 406.502 2.254 10 20 HECD CS(=O)(=O)N1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 918314154 SKOXHFSQJOKWQF-UHFFFAOYSA-N 415.475 2.144 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cncc(OCC(F)F)c3)cc2)CC1 1329164562 KYTBWLKQJKNINU-UHFFFAOYSA-N 418.444 2.324 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1ccco1)CCO2 1782004923 QCKUOLXBHUXFOZ-LJQANCHMSA-N 406.822 2.102 10 20 HECD O=C(CC1CCC1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728148 LCDHNHVUIGYVNL-LBPRGKRZSA-N 402.476 2.365 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccnc1 1841467793 QUKNBUYJMCMGTF-GFCCVEGCSA-N 404.854 2.026 10 20 HECD O=C(CN1CCCCC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500936 HCMFLQVMDCWVLW-UHFFFAOYSA-N 407.898 2.054 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 1847454088 OINKVANDIZEEGS-BDXSIMOUSA-N 411.433 2.251 10 20 HECD COc1ccc(-c2nnn(CN(C)Cc3ccc(N4CCOCC4)cc3)n2)cc1OC 16878819 WLVZYGMPKOTYIX-UHFFFAOYSA-N 424.505 2.283 10 20 HECD CCN(C(=O)CN(Cc1ccco1)c1ccc(OC)c(F)c1)[C@@H]1CCS(=O)(=O)C1 303867654 UQEPMJJRFUSUOH-MRXNPFEDSA-N 424.494 2.470 10 20 HECD CO[C@H](C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726612328 BJKDKEHCQUPRRD-MRXNPFEDSA-N 416.501 2.167 10 20 HECD CSc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 727227130 GPKQXVUPCRWXFX-CQSZACIVSA-N 400.504 2.456 10 20 HECD COC(=O)CCc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 729787853 PBICHTQTNNEKFL-UHFFFAOYSA-N 401.438 2.252 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C1(S(=O)(=O)c2ccccc2)CC1 731339627 BSAFMXIEQURNFJ-UHFFFAOYSA-N 400.500 2.146 10 20 HECD C[C@H](c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1)N1CCOCC1 732288342 QEHLPEMFFYPCMD-CQSZACIVSA-N 419.503 2.409 10 20 HECD CN(C)S(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 740907507 NRCCOJLYKFPKKK-UHFFFAOYSA-N 414.531 2.313 10 20 HECD Cc1c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nnn1C 742750018 LHASHKGTXYXFSZ-MRXNPFEDSA-N 402.499 2.185 10 20 HECD O=C(C[C@H]1CCS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799612 LUMHVISYKLQIQZ-KGLIPLIRSA-N 402.463 2.198 10 20 HECD Cc1cc(NC(=O)NCc2ccc3c(c2)CCCN3C)n([C@H]2CCS(=O)(=O)C2)n1 746759247 DKFZRLZEBSSFOX-KRWDZBQOSA-N 417.535 2.255 10 20 HECD NC(=O)c1cccc(OCCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751386140 VRLOLRONINAJQH-UHFFFAOYSA-N 411.502 2.080 10 20 HECD COc1ccc(N2CCN(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)CC2)cc1F 754010659 BMWVLXBQVBHSKT-UHFFFAOYSA-N 414.393 2.118 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](C)N3CCCC[C@@H]3C)CC2)cc1 758207580 ATYOKSMJPCLPTQ-TUNNFDKTSA-N 404.599 2.031 10 20 HECD CCCS(=O)(=O)N1CCC(NC(=O)NCCCSc2nccs2)CC1 759549830 KJGPZFZPOBKJGR-UHFFFAOYSA-N 406.599 2.129 10 20 HECD COCCOc1ncccc1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761059646 DHLNIPWDHDJZFZ-UHFFFAOYSA-N 405.838 2.430 10 20 HECD CC(C)Cn1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 762416868 ZIGCLVMCHLBPOJ-GOSISDBHSA-N 400.479 2.391 10 20 HECD COc1cccc(-c2nnc(SCC(=O)NCc3ccc(N(C)C)cc3)n2N)c1 768434637 FZARRRPPRJFNGN-UHFFFAOYSA-N 412.519 2.142 10 20 HECD CC(C)NC(=O)Cc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 771059558 VWURGBYLHJDTBZ-UHFFFAOYSA-N 422.488 2.372 10 20 HECD COc1cc2nc(C)sc2cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774363134 HVUQCYYMSGSLAC-UHFFFAOYSA-N 401.444 2.322 10 20 HECD COCC1=CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 775827398 QYUZVIHGSHXKNE-IAGOWNOFSA-N 405.514 2.334 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCOC3CCCC3)CC2)cc1 778252468 KVXZRKLKDPXVND-QXMHVHEDSA-N 415.534 2.366 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O 778916736 PPRPSXAKYJOSPP-UHFFFAOYSA-N 409.419 2.405 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4cc(C)ccn4)CC3)nc12 782514829 XPDUADLINMIXBT-UHFFFAOYSA-N 411.462 2.358 10 20 HECD CC1(C)OC[C@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)O1 783180727 YJOUEIGJUZINOI-HNNXBMFYSA-N 417.428 2.493 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](Oc4ncccc4F)C3)nc12 785837108 FJJYQWALMMXWBD-AWEZNQCLSA-N 415.425 2.189 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3NC(=O)O[C@H]3C)c2C)cc1 786072596 QFXGXJCMHQOTMH-UGSOOPFHSA-N 414.414 2.104 10 20 HECD CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 787085287 RWLXDRYMORBMHD-ZDUSSCGKSA-N 400.454 2.344 10 20 HECD Cc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788319207 BHCKJJNIJSBTQO-SFHVURJKSA-N 411.502 2.032 10 20 HECD CC(C)CSCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801400 SVBDNVNCDZQZGP-UHFFFAOYSA-N 411.543 2.174 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)ccc1-n1cccn1 793177545 UMTJVMIESNRLJJ-UHFFFAOYSA-N 414.462 2.499 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H](OCC2CC2)C1)c1ccc(N2CCOCC2)cc1 803299601 MBMLCNWNSGXYCF-UWJYYQICSA-N 415.534 2.118 10 20 HECD CN(Cc1nccn1Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665110 WUCKDNQASDKTNH-UHFFFAOYSA-N 423.492 2.411 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1F 804852140 AJLSZKBNINAYLR-INIZCTEOSA-N 406.546 2.477 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccc(OC)cn1 806720776 CXBJNMMXZGYIEM-UHFFFAOYSA-N 422.279 2.223 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCNC(=O)C[C@@H]1c1ccccc1)c1ccc(N(C)C)cc1 807678782 JPLXBIULLYAZRV-OXQOHEQNSA-N 408.502 2.020 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 808095162 UEPCEERSJBQKNN-DOTOQJQBSA-N 423.506 2.476 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc2[nH]ccc12 808924323 KCXHUYDTFRPRMS-LLVKDONJSA-N 411.414 2.485 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1COc2ccccc21 809536221 JAZYQJDNJXZUOH-UWJYYQICSA-N 423.513 2.163 10 20 HECD COc1cccc2c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)n[nH]c12 809619312 RTTURLKBZRZMNN-HNNXBMFYSA-N 407.474 2.203 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C(=O)N(C)C)cc1 813861718 XLYMTGVDVCGDPU-KRWDZBQOSA-N 415.559 2.474 10 20 HECD COc1cc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc2c1OCO2 814285173 FLOYYGIUOXETMS-LFIBNONCSA-N 422.528 2.347 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](O)C34CCCC4)cc2F)C[C@@H](C)O1 814665832 SOMFWUQZVPFCNW-FVJLSDCUSA-N 419.541 2.435 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c1O 815510331 RYNKDFUFIQAUBG-UGSOOPFHSA-N 411.458 2.417 10 20 HECD CCc1nocc1CN(C)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 818555852 WUYLIGUPMZPARD-MDZDMXLPSA-N 412.490 2.109 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)CCOc3ccccc3F)CC2)cc1 912940391 VZFCXWSULVJPJE-GDLZYMKVSA-N 420.506 2.311 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1(C(=O)O)Cc2ccccc2C1 1354026787 GKYZPFGYADDOJD-UHFFFAOYSA-N 413.449 2.084 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCS1 1803331925 SMVLDQLLQNKPJP-ZTIJGCPXSA-N 418.515 2.350 10 20 HECD Cc1cnn([C@@H](C)C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1846590217 LTGQVLGGTAMPBB-ZDUSSCGKSA-N 418.881 2.334 10 20 HECD O=C(COc1ccccc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039129 OKRJTEWAJPRFPM-CSKARUKUSA-N 424.453 2.099 10 20 HECD CCOC(=O)C(C)(C)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1847046315 TWIUIFQZQTWSCI-UHFFFAOYSA-N 424.881 2.158 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CSc2nnnn2C2CC2)cc1 8545195 HCDYBERTNQQXPQ-SFHVURJKSA-N 416.551 2.374 10 20 HECD CS(=O)(=O)NC[C@@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1 728196319 OXUUUMYOMHNZLL-HNNXBMFYSA-N 418.515 2.090 10 20 HECD C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc(N(C)C)c(F)c1 735519646 VDBPOSBGVJKAGC-QGZVFWFLSA-N 414.529 2.297 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cccc(N4C(=O)CCC4=O)c3)c2)CC1 739768187 NCJVGTYJMBLYGL-UHFFFAOYSA-N 420.469 2.294 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cc(C(F)(F)F)cnc1O 741096757 FXKYUJJIFPRLFE-UHFFFAOYSA-N 406.364 2.437 10 20 HECD COC[C@H]1CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 741795185 OQNQINNKHIWZSC-LSDHHAIUSA-N 408.454 2.136 10 20 HECD Cn1c(CO)cnc1SCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 746138101 CXSPSRZRDYSFDE-UHFFFAOYSA-N 407.451 2.419 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NCc3ccccc3O)CC2)cc1 748462653 GGAJNMTXRQAPEG-UHFFFAOYSA-N 403.504 2.353 10 20 HECD CC(=O)c1cc(F)cc(CN2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)c1O 749447779 GAWAWTPIZUVAKE-MRXNPFEDSA-N 412.417 2.231 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(F)c2C)cc1 751271353 UXTJDOBESTVDOU-UHFFFAOYSA-N 416.452 2.395 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCN(c2ccccn2)C1 753126642 JJWIXHVNPFDTNQ-FQEVSTJZSA-N 409.534 2.368 10 20 HECD NC(=O)NC1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 757235249 OWAUYCGXDTXMJI-AWEZNQCLSA-N 411.453 2.099 10 20 HECD COc1cc(N2CCN(C(=O)NCc3cccnc3OC)CC2)cc(OC)c1OC 759216655 OXQMOWIXBWAOFI-UHFFFAOYSA-N 416.478 2.148 10 20 HECD COc1cc(N2CCN([C@H](C)C(=O)N3CCC(C)CC3)CC2)cc(OC)c1OC 759886683 OVLMVPQMWNPPIF-QGZVFWFLSA-N 405.539 2.481 10 20 HECD CC(C)Oc1ccc(N(C)CC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 759915971 SZZGVDXWKINONC-ICSRJNTNSA-N 424.563 2.105 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)CN(Cc4ccc(F)cc4)C3=O)cc2)C1 761123838 PJPNNDAVZHNFGP-SFHVURJKSA-N 424.476 2.492 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(C)(C)C(=O)NCC3CCCC3)CC2)cc1 767660607 YMAUTHIMENVVGF-UHFFFAOYSA-N 416.566 2.018 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769024573 NQESZBPPKSHATK-UHFFFAOYSA-N 422.529 2.482 10 20 HECD O=C(CCCN1C(=O)CCC1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771055593 ZPOXINQRYHXRHF-MRXNPFEDSA-N 407.898 2.055 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F 774918240 MJPNTUWDMXODAQ-ZDUSSCGKSA-N 421.419 2.434 10 20 HECD CCN(Cc1ccncc1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778257209 TVMJXFPIIMCLLL-CMDGGOBGSA-N 408.502 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC4(CCCC4)C3)CC2)cc1 778382455 QNBLDCCTQOXMJA-HJWRWDBZSA-N 413.518 2.072 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cn1 778570329 LTJSWRJKVBFXJI-UHFFFAOYSA-N 424.505 2.185 10 20 HECD C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2)C1 778915726 UVFGXZDEPGHNBM-AWEZNQCLSA-N 404.488 2.448 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCOC[C@@H]3CCCO3)cc2)CC1 785563480 RXDWYZIOOSSAIJ-NRFANRHFSA-N 417.550 2.241 10 20 HECD Cc1nc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 785671464 UZBQNBIOXPQBND-UHFFFAOYSA-N 424.473 2.454 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCn3cnc4ccccc43)cc2)CC1 787321670 IARGMUBKXGVLOG-UHFFFAOYSA-N 405.502 2.411 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]c4c(C)cccc4c3=O)cc2)CC1 788004439 VVCRAKMCYKNXCR-UHFFFAOYSA-N 418.497 2.435 10 20 HECD COc1ccc(N2CCN(CCCN[C@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 788505815 KSFWBPKSHRABJI-GHTZIAJQSA-N 409.596 2.153 10 20 HECD C[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(N(C)C)cc1 790503572 VUOSSVBXXUOSTE-OAHLLOKOSA-N 405.520 2.079 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664038 FLJDCSAXRUOZHF-OXJNMPFZSA-N 412.509 2.145 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3COC4(CCCCCC4)O3)ccc21 803689096 JUJAARWFYXHHCR-LJQANCHMSA-N 415.534 2.267 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1 804310328 LLZGMKKFGYNGOI-UHFFFAOYSA-N 418.538 2.227 10 20 HECD CC(C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807272384 ZVUZRFSZWPPIOW-GOSISDBHSA-N 400.567 2.243 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC([C@](C)(O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673553 VORGMLUZWXKMLR-YJYMSZOUSA-N 415.456 2.482 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1 807795804 LFZAGPQGJNYQKG-HNNXBMFYSA-N 418.393 2.246 10 20 HECD CN(C)c1ccc(CN(C(=O)CNS(=O)(=O)c2ccccc2F)C2CC2)cc1 810064664 PIOWLWILKKKOAZ-UHFFFAOYSA-N 405.495 2.361 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cn(C4CCOCC4)nn3)cc2F)C[C@@H](C)O1 810167844 QOVVVSVGPWFERM-HUUCEWRRSA-N 417.485 2.312 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C3(c4ccccc4)CC(=O)C3)CC2)cc1 811272010 UJAVDUMBQIYADD-UHFFFAOYSA-N 422.481 2.188 10 20 HECD C[C@@H](NC(=O)N(C)CCCN(C)CCN(C)C)c1ccc(N2CCOCC2)cc1 812014052 FVBRQIQOCRUFHH-LJQANCHMSA-N 405.587 2.109 10 20 HECD CCC[C@@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 814431383 LLCYANGZNSFZFN-OAHLLOKOSA-N 408.518 2.138 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)cc1 916197215 XONIQEFWTNVPSO-CTNGQTDRSA-N 415.582 2.133 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCC2(CC1)OCCO2 918206508 FSMZLIXQGVGTTL-UHFFFAOYSA-N 403.523 2.380 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCCO3)cc2F)C[C@@H](C)O1 919155386 UNAQUTNDIWHWMZ-BFYDXBDKSA-N 408.470 2.168 10 20 HECD NC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 919970889 HXZBTTITBGNCHM-LJQANCHMSA-N 414.481 2.203 10 20 HECD O=C(Cc1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604915 XHUDXBWZLTYJDG-BJWYYQGGSA-N 420.469 2.469 10 20 HECD Cc1nscc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543016 JJXXNTZRQBSBLQ-UHFFFAOYSA-N 416.503 2.416 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1nccs1 1816568988 WHFMAUMANJUNDK-GFCCVEGCSA-N 414.447 2.292 10 20 HECD C[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831647307 PTZDDOYYNOBZJS-BLLLJJGKSA-N 410.898 2.365 10 20 HECD CCN(CC)S(=O)(=O)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 54720781 OVJCMQGXPBXUDU-UHFFFAOYSA-N 418.563 2.439 10 20 HECD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N(C)C)c(F)c1 302993316 MUTLVNGQSMZVMC-LJQANCHMSA-N 400.433 2.426 10 20 HECD CCOC(=O)CNC(=O)C1CCN(C(=O)NCc2c(C)c3ccccc3n2C)CC1 472284721 VCBVQPDJZLXHMU-UHFFFAOYSA-N 414.506 2.088 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccccc2OCCN(C)C)n(C)c2ccccc12 557014324 FICYSZFVCOHQMH-UHFFFAOYSA-N 422.529 2.360 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(NCc3cccc(OC)c3O)CC2)cc1 725849533 PORIADNINLFZEQ-UHFFFAOYSA-N 406.504 2.352 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OC2CCCC2)nc1 727039888 XSXHKCDQUISFHR-UHFFFAOYSA-N 424.501 2.495 10 20 HECD CC(C)NC(=O)CNC(=S)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 727279180 ZGCJVXYJHSMLTL-UHFFFAOYSA-N 418.485 2.031 10 20 HECD Cc1cc(C(=O)CN2CCCO[C@@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 727437983 VITCBMCVDLWTBZ-HNNXBMFYSA-N 405.520 2.035 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@]3(C(=O)OCC)CCc4ccccc43)nc12 735875142 ZHEAGUKSAFDXFX-QFIPXVFZSA-N 424.457 2.106 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1 742927284 MIQSWNGJJAAVNV-UHFFFAOYSA-N 405.502 2.433 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NCc1cc(Cl)cc([N+](=O)[O-])c1O 752106205 JVXVAKPETISTAF-INIZCTEOSA-N 407.854 2.417 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc([N+](=O)[O-])cc3O)CC2)cc1 753782496 RDYBKROBWBDLRP-UHFFFAOYSA-N 414.462 2.251 10 20 HECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccc(F)cc4)C3=O)CC2)cc1F 753976873 DDDCEZXBHYMGHK-GOSISDBHSA-N 401.413 2.428 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(F)cc3[N+](=O)[O-])nc12 758114241 BWIJXUNWZXFGSU-UHFFFAOYSA-N 404.310 2.016 10 20 HECD CCS(=O)(=O)N1CCC(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 758744329 PFEJHLHLALNLLH-UHFFFAOYSA-N 422.595 2.488 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)c3cnn(C)c3)CC2)cc(OC)c1OC 759265590 AASOKZJNNIHKEP-AWEZNQCLSA-N 403.483 2.039 10 20 HECD N=C(Cc1cccs1)NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772897001 OTUZJMLOIYWWGC-UHFFFAOYSA-N 406.483 2.081 10 20 HECD O=C(Cn1c2c(sc1=O)CCCC2)NCc1ccc(N2CCOCC2)c(F)c1 772898775 XGRDBYNJCVAXGZ-UHFFFAOYSA-N 405.495 2.081 10 20 HECD COc1ccccc1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775052035 JNJUGGVAJWJRDF-IBGZPJMESA-N 412.486 2.267 10 20 HECD O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775157907 BNXHYBWIOSAQEN-KGLIPLIRSA-N 401.290 2.210 10 20 HECD CC(=O)N1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C(C)(C)C1 775561300 CNIOMTJJNMOBKG-UHFFFAOYSA-N 419.481 2.343 10 20 HECD C[C@H](NS(=O)(=O)c1cnn(CC(F)F)c1)c1ccc(N2CCOCC2)cc1 777908062 CQCCESSWTCYSEV-ZDUSSCGKSA-N 400.451 2.024 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 784024050 JUBDPVXUJQWJRB-UHFFFAOYSA-N 413.474 2.237 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1 784708136 VJBUFUWTOSZVPB-UHFFFAOYSA-N 424.461 2.063 10 20 HECD COc1ccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1OC 786260054 VRFRLOXMDLITOW-UHFFFAOYSA-N 411.502 2.231 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12 788933336 UPHDIEDTACWNTO-KZNAEPCWSA-N 405.589 2.399 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCC(=O)c4ccccc43)nc12 792647182 RORHAYWHKHKCHO-HNNXBMFYSA-N 409.398 2.415 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793685786 KBAJVXIWCDNXEB-PXNSSMCTSA-N 412.486 2.484 10 20 HECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N(C)C)cc1 793720350 ODWPLXVCZOOFJF-QFIPXVFZSA-N 406.530 2.407 10 20 HECD C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793822865 FGORDYTXKZYVFM-UZLBHIALSA-N 412.486 2.353 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)[C@H](COC(C)C)N(C)C3=O)cc2F)CC1 794771650 AYFYGDLKCQOETP-IBGZPJMESA-N 406.502 2.155 10 20 HECD CC[C@@](C)(OC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 796397309 IWTPWZFSGASBAQ-LRAJWGHMSA-N 410.486 2.414 10 20 HECD Cc1nn(CCS(C)(=O)=O)c(C)c1CN(Cc1ccccc1O)C[C@@H]1CCCO1 797972051 KIUAKQZIROFAEH-IBGZPJMESA-N 421.563 2.431 10 20 HECD CCN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@@H]1CCNC1=O 799445581 PPKPGXHDFXOAAI-KECPUOCWSA-N 423.585 2.467 10 20 HECD CO[C@@H](C)CS(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 799820512 NTRMGMOQNLHBEL-YOEHRIQHSA-N 415.556 2.273 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OCO3)cc1Cl 800833178 WYOPHOUNKNUMLI-UHFFFAOYSA-N 404.853 2.241 10 20 HECD Cc1ncc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803300050 DZQRDNBAKMCVAP-CQSZACIVSA-N 402.520 2.124 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1C[C@@H]2CC[C@H](C1)N2C 806495374 FYDFNEYOVNQDOT-OKCRPCIYSA-N 413.566 2.155 10 20 HECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1ccc(OC)cc1O 806737693 VZJQSRBEIICPCS-UHFFFAOYSA-N 424.475 2.151 10 20 HECD O=C(O)COc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917912757 UYXCHBXJLJHZDU-UHFFFAOYSA-N 422.528 2.182 10 20 HECD NC(=O)c1ccc(F)c(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 918294372 GVGYURMXAGPZQE-UHFFFAOYSA-N 411.389 2.391 10 20 HECD Cc1cccc(NC[C@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 1320511094 LHSQFBMVISMJDC-OAHLLOKOSA-N 404.492 2.184 10 20 HECD O=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)c(F)c1 1320733364 RKLUHOHJWDHEBL-SFHVURJKSA-N 403.410 2.356 10 20 HECD O=C(Nc1ccc(NC(=O)c2ccn(CCn3cccn3)n2)cc1)C1=S=CC=C1 1358200301 WVIBJZDYVUISQA-UHFFFAOYSA-N 406.471 2.248 10 20 HECD O=C(CC1CC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786630369 MWYQRPKLLLSRKQ-JDFRZJQESA-N 408.882 2.145 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(Cl)ccc1F)c1cc(O)nc(O)c1 1794524038 AFWYSSRDZYJVDM-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD Cc1nocc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816522504 WJXYKAGHAITHIS-CQSZACIVSA-N 412.406 2.132 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1C 1817845179 DYHPNZGOJVVPFV-MRXNPFEDSA-N 424.461 2.483 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)Cn3nccn3)C2)cc1 1845266337 ZVEUVIWUPFXXDU-UHFFFAOYSA-N 418.501 2.203 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc(F)c3)CC2)cc1 12069011 LXCLLQAEWVYPTG-UHFFFAOYSA-N 407.511 2.325 10 20 HECD COCCN(C(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C)[C@H]1CCS(=O)(=O)C1 303351150 FDVDMEUQLBWSLJ-IBGZPJMESA-N 415.515 2.242 10 20 HECD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)COC(=O)c2ccc(C)c(O)c2O)n1 727004094 NQKQBCWIQMLVSQ-UHFFFAOYSA-N 411.418 2.103 10 20 HECD CN(C)c1ccc(CN(CN2C(=O)NC3(CCOCC3)C2=O)CC(F)(F)F)cc1 728904928 YNDBNIWHDZNFMY-UHFFFAOYSA-N 414.428 2.175 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c(C)c1 729061330 ATDUTGPGXGMCPZ-CYBMUJFWSA-N 416.430 2.077 10 20 HECD COc1cccc(OC)c1OC[C@H](O)CN(C)Cc1ccc(N2CCOCC2)cc1 730080766 JQLFFYRYMNHPSF-HXUWFJFHSA-N 416.518 2.412 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1 731042085 CUNRAZCNLNPQPW-OAQYLSRUSA-N 423.561 2.449 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(OC)nc2OC)cc1F 731409384 RRKJMWMYYAMXEX-UHFFFAOYSA-N 404.442 2.339 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(CC(C)C)nn3C)CC2)cc1 737173188 DLPWUAKBUIBUHR-UHFFFAOYSA-N 413.522 2.351 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCC[C@@H](O)C3)CC2)cc1 745348029 AQMWYKINHATLHG-AZUAARDMSA-N 404.555 2.058 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 753640943 VDYIWNNKUHUACL-NEPJUHHUSA-N 412.895 2.165 10 20 HECD COc1ccc(N2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)cc1F 753940150 MSHFVYGSQHSPPB-UHFFFAOYSA-N 413.453 2.421 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C(C)C)N3CCCC3=O)CC2)cc(OC)c1OC 759239538 MVQRHCXBQAPZGR-HXUWFJFHSA-N 419.522 2.008 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4c3cccc4[N+](=O)[O-])CC2)cc1 759851999 XZTREQXCYRLJJY-SFHVURJKSA-N 412.490 2.149 10 20 HECD CC(C)(C)NS(=O)(=O)Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765059321 BRSVBYUILRHOCA-UHFFFAOYSA-N 424.504 2.242 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765931801 RSSUZERFVJFECG-UHFFFAOYSA-N 407.220 2.196 10 20 HECD COc1cccc(O)c1CN1CCN(C(=O)c2ccc(OC)c(OC)c2OC)CC1 769539745 MPIDVENVGFMKTQ-UHFFFAOYSA-N 416.474 2.385 10 20 HECD C[C@@H](NC(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1)c1ccccc1 770959982 NBUVDEJUJXPVLU-GFCCVEGCSA-N 416.459 2.234 10 20 HECD N=C(CCc1ccccc1)NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772881643 DMWAUPWBMMDJAN-UHFFFAOYSA-N 414.481 2.410 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)C3CCOCC3)cc2F)C[C@@H](C)O1 775456182 YNAHYSPEEYRHJY-BBWFWOEESA-N 407.530 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](O)C(C)(C)C3)cc2F)C[C@@H](C)O1 782583858 OJUNMDYCYQGCDY-YRNRMSPPSA-N 407.530 2.148 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 785298065 VGMDNDILOGZJBF-ZDUSSCGKSA-N 413.474 2.312 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 785433951 QBTAESVBNOZIHN-FQEVSTJZSA-N 409.465 2.147 10 20 HECD COc1ccc(C[C@@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785439852 XGRSNLSIMOPQJA-MRXNPFEDSA-N 413.518 2.381 10 20 HECD C[C@@H](OC(=O)c1ccn(C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785683388 SAZHEKLQXQASTP-GFCCVEGCSA-N 403.394 2.380 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(-c4ccc(C)cc4)nn3)cc2)CC1 786258297 BPCCFXDLXMYGCX-UHFFFAOYSA-N 418.501 2.174 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](OC)c3ccccc3)CC2)cc1 786658264 UASOCAFLUAJHSO-NRFANRHFSA-N 411.502 2.238 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 787833776 QTSMXSXHUOGTNR-UHFFFAOYSA-N 420.513 2.135 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1)c1ccc(N(C)C)cc1 787979742 PMRYUTPUMTWDKA-XMSQKQJNSA-N 424.545 2.120 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(c2ccccn2)CC1 788652643 SYTLNOOIGOZYBN-UHFFFAOYSA-N 409.534 2.281 10 20 HECD CC(C)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789847425 QXXUETGBRJBXAG-IBGZPJMESA-N 405.564 2.130 10 20 HECD COc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(-n2cccn2)c1 792630557 PIZDYSGDFNLMRN-UHFFFAOYSA-N 402.432 2.210 10 20 HECD COc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 793131548 IKQRMDOMJAYCDS-HNNXBMFYSA-N 412.446 2.235 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1 794581153 FMTFJBVJIVNKBJ-UHFFFAOYSA-N 416.452 2.175 10 20 HECD Cc1nc(C)c(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803301375 ZWZGDVGEOXJZDB-ZDUSSCGKSA-N 402.520 2.090 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](CCN(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 803309912 CEKZICUQROCNDW-FXAWDEMLSA-N 418.582 2.183 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1 804278258 RXVRVQJZPYQJJU-QGZVFWFLSA-N 418.588 2.380 10 20 HECD CCN(CCc1nccs1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315295 JQTLDFCYTHMJOM-UHFFFAOYSA-N 416.547 2.328 10 20 HECD Cc1ccc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)cc1 804975157 HBTCXDATAMLLER-UHFFFAOYSA-N 408.502 2.390 10 20 HECD Cc1cc(C(=O)O[C@@H](C)C(=O)NCCN2CCOCC2)c(C)n1-c1ccc(F)cc1 805970896 COKSHBDYIZTEEH-KRWDZBQOSA-N 417.481 2.227 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 807100606 LHDCURUNOPNEAT-GHTZIAJQSA-N 408.546 2.456 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]1C 807770536 MAPHBMIOERPSBN-ILXRZTDVSA-N 411.449 2.009 10 20 HECD CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 808537435 OWKBABMUASJVDU-UHFFFAOYSA-N 405.505 2.436 10 20 HECD CC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918222768 XAIHTZFVKWIVDU-HZPDHXFCSA-N 406.502 2.203 10 20 HECD O=S1(=O)CCN(c2ccc(CNC(=S)NCCc3ccccc3)cc2)CC1 920994815 IGXTXCXMKXTRBU-UHFFFAOYSA-N 403.573 2.128 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nc(C2CCCC2)no1 1320270995 BXZKQRHDFMQVGD-HNNXBMFYSA-N 417.462 2.362 10 20 HECD CCc1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1S(N)(=O)=O 1324115050 HMHWHWYUDIKBIL-UHFFFAOYSA-N 406.527 2.399 10 20 HECD Cc1nocc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795215609 KOZQOKJWLVUVHI-PLCSWTFUSA-N 413.430 2.065 10 20 HECD CNc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1842901524 HQEJOLQNAPKEGS-UXBLZVDNSA-N 423.469 2.376 10 20 HECD O=C(c1ccccc1Cl)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056196 VLQTWFRGLXDAOB-UHFFFAOYSA-N 423.947 2.017 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 42985633 UALHXQLUZABRFU-UHFFFAOYSA-N 407.448 2.123 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCN(CC(F)(F)F)C1 142371952 LEWDACPONLOWLB-KRWDZBQOSA-N 414.472 2.331 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c1 728979702 KLRYDISTHSHDKM-ZDUSSCGKSA-N 410.467 2.476 10 20 HECD Cc1ccc(-c2nnn(CC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)n2)cc1 736195336 FLAIXVQYPVRXDQ-UHFFFAOYSA-N 420.517 2.174 10 20 HECD CCOc1ccc(CN2CCN(CCNC(=O)c3ccc(OC)cc3)CC2)c(O)c1 736647073 DOHUMEDYJBCXCN-UHFFFAOYSA-N 413.518 2.347 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)cn1 743045709 URNNBZCMNVMFCZ-UHFFFAOYSA-N 422.488 2.297 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 743887498 CUOPMNALMVQZQH-KRWDZBQOSA-N 408.458 2.425 10 20 HECD Cc1ccc(NC(=O)[C@@H]2CCCN(CC(=O)NCc3ccc(N(C)C)cc3)C2)nc1 746457030 ICIQBVOFIQPQOY-LJQANCHMSA-N 409.534 2.423 10 20 HECD CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 749555630 RNLAJHUCAPRTHF-CMKODMSKSA-N 401.555 2.060 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]([C@H]4CCOC4)C3)CC2)cc1 750241258 DMLHKVROYRMATC-UXHICEINSA-N 416.566 2.275 10 20 HECD CCNC(=O)c1cccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758232727 SCNCEOVKTRJUMW-HXUWFJFHSA-N 413.518 2.007 10 20 HECD CCCc1cc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n2ncnc2n1 758931401 NYWVDSXUHNLMPM-UHFFFAOYSA-N 412.494 2.429 10 20 HECD CN(C)CCOc1ccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 761637972 KPAUWRDZXQXLDR-UHFFFAOYSA-N 418.475 2.421 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCCN3C3CC3)cc2)C1 764848913 FOIIZGADHSFQNK-RXVVDRJESA-N 413.566 2.204 10 20 HECD C[S@@](=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765926673 OYPHVDYJOWICGU-XMMPIXPASA-N 411.277 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3cccc(O)c3)CC2)cc1 768723142 WFZUOADCLBDQDA-DVQDXYAYSA-N 409.486 2.483 10 20 HECD CC(C)OC[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 771300607 BFQUITJEXGRMKR-SFHVURJKSA-N 409.502 2.122 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3CC(=O)OC)cc2F)CC1 772601784 OXWPYCXYZHUBSH-QGZVFWFLSA-N 406.502 2.205 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCCn3ccnc3)cc2F)C[C@@H](C)O1 774738248 OATBZRDEHAXFSI-QZTJIDSGSA-N 417.529 2.274 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnc(C(F)(F)F)nc3)CC2)cc1 777443511 QGVYFVSUNOASDK-UHFFFAOYSA-N 423.439 2.446 10 20 HECD COc1ccc(OC)c(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786259528 QPBQRXPXJOHABC-UHFFFAOYSA-N 411.502 2.231 10 20 HECD C[C@@H](Cc1ccccc1F)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787974387 LSANNJNXVABYLN-HNNXBMFYSA-N 417.456 2.165 10 20 HECD CN(Cc1ccc(F)c(F)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788333941 SQBRNRULTQECAK-UHFFFAOYSA-N 403.429 2.076 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788911626 PWAVWKKNZIRWLQ-QHCPKHFHSA-N 415.534 2.341 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)ccc1F 788936300 JTLNKBVTLZLGBD-UHFFFAOYSA-N 412.509 2.420 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@H]1c1ccccn1 789799689 KKFWXAZUWBAZMC-FQEVSTJZSA-N 412.465 2.037 10 20 HECD COc1ccc(CNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c(O)c1 792790705 CDRYJALXHVFALK-UHFFFAOYSA-N 412.490 2.303 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 793822483 JVPXNWFCOBNFLB-OAHLLOKOSA-N 417.456 2.338 10 20 HECD Cc1cc(=O)c(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)co1 794727476 RZINUPWWULSPSE-GASCZTMLSA-N 404.438 2.396 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c(Cl)c2)cc1 797431697 WHEYPDZISNGLJI-UHFFFAOYSA-N 405.885 2.026 10 20 HECD COc1cc(N2CCN(C(=O)C(F)(F)C3(O)CCCC3)CC2)cc(OC)c1OC 803105152 IXNWPBWRERSGHD-UHFFFAOYSA-N 414.449 2.301 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC([C@@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 803308495 GFNAXBCIZOGLCP-UTKZUKDTSA-N 415.534 2.118 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](Oc3cccc(F)c3)C2)cc1F 803663420 OVQWEWIHHLYXRR-KRWDZBQOSA-N 403.429 2.327 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 804317329 ZVGARVJRYXGUCM-PGRDOPGGSA-N 403.523 2.100 10 20 HECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)NCCCSc1nccs1 806279946 FRTKBPSUBQUSAQ-AWEZNQCLSA-N 407.517 2.390 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccccc1 807289375 RSHUFJJFPYRHRH-FGZHOGPDSA-N 404.514 2.241 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N(C)C)cc1 807677551 QEXKYEBALNVTCF-HOTGVXAUSA-N 406.490 2.388 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N(C)C)cc1 807677553 QEXKYEBALNVTCF-HZPDHXFCSA-N 406.490 2.388 10 20 HECD CC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C1CCOCC1 807982578 GBDCIUINTSNZFQ-MOPGFXCFSA-N 404.507 2.221 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NCc2ccc([N+](=O)[O-])c(OC)c2O)s1 809721033 LODDHLNLJNUJAR-NXEZZACHSA-N 409.468 2.476 10 20 HECD CC(C)OCc1cc(NS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)ccc1O 811704834 KYPIJVRMTLCZGJ-UHFFFAOYSA-N 404.444 2.344 10 20 HECD COC(=O)c1cn(-c2cccc(NC(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2)nn1 812977922 XDDXRIMYWWJQKD-LBPRGKRZSA-N 411.418 2.218 10 20 HECD CS(=O)(=O)c1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)ccc1Cl 821197611 FPCBQCGNCJDYFE-UHFFFAOYSA-N 406.825 2.158 10 20 HECD COc1ccc(N2CCN(Cn3nnc(-c4ccc(OC)c(OC)c4)n3)CC2)cc1 916568104 YTFIDAPFEQPKFF-UHFFFAOYSA-N 410.478 2.146 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)c1ccc(S(C)(=O)=O)cc1 917020842 WGUYAUHYVDPXFL-NRFANRHFSA-N 404.532 2.092 10 20 HECD CCNC(=O)CN(CC)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 917173826 ICSZPRFLEBZJBO-CQSZACIVSA-N 407.470 2.247 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCCC3)cc1 917732695 WSZVHCSMEOZAHG-UHFFFAOYSA-N 424.500 2.436 10 20 HECD CCCNC(=O)CN1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 918069057 LKWMAIWWHOELDP-UHFFFAOYSA-N 415.582 2.417 10 20 HECD NC(=O)C1CCN(C(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)CC1 1320012404 RPJURSQOPDUJOD-UHFFFAOYSA-N 415.515 2.250 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CC34CCS(=O)(=O)CC4)cc2F)C[C@@H](C)O1 1325807621 HZMMPCVVPZDTRP-UXLLHSPISA-N 424.538 2.270 10 20 HECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)s1 1794637996 RFAQDGAZKVTYGS-CLLJXQQHSA-N 403.460 2.129 10 20 HECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(O)cc1 1796604455 IRJCZFCZKDGPDZ-VDNDLQMASA-N 411.458 2.254 10 20 HECD COc1ccc(F)cc1CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 22770561 FXBCOGSDKAMKHR-UHFFFAOYSA-N 414.525 2.334 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 148449417 WKSFLBOEGUQDDY-INIZCTEOSA-N 417.531 2.312 10 20 HECD CCNS(=O)(=O)c1ccc(CC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 544743467 SKWBPTUHVXEULF-UHFFFAOYSA-N 403.504 2.019 10 20 HECD COCCN(C)CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 727033739 CVZAIABJQPXPSK-UHFFFAOYSA-N 400.470 2.134 10 20 HECD CCCN1CCC(N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 727225854 PINCBECNMMOASA-LJQANCHMSA-N 415.582 2.404 10 20 HECD Cc1nnnn1/C(=C\c1ccccc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 728302245 VDWZPIYSAPKXLI-JWGURIENSA-N 418.501 2.475 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc4c(cc3O)OCO4)cc2F)CC1 730287163 GVYCSOFSMHICRL-UHFFFAOYSA-N 401.438 2.332 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccn(-c3ccncc3)n2)C2CC2)cc1 733856140 SEYXODGJNSSMFW-UHFFFAOYSA-N 404.474 2.463 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ncn(Cc2ccccc2)n1 737100793 VFAUOUZFHRTPFS-UHFFFAOYSA-N 404.474 2.182 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H]3CCCN(C)C3)cc2F)C[C@@H](C)O1 741248822 CPQQKQPAPGORCA-GGPKGHCWSA-N 420.573 2.329 10 20 HECD Cc1cc(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)cc3)CC2)nc(C)n1 749563778 MBDRTQMQMQYJLO-UHFFFAOYSA-N 424.549 2.398 10 20 HECD O=C(CCN(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)NCC(F)(F)F 751477242 AMBQSHKMDYQZCA-AWEZNQCLSA-N 403.401 2.151 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@H]1CCN(S(C)(=O)=O)C1 753662578 VLHBLODTDWWQDN-GOSISDBHSA-N 408.568 2.100 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)c1 754490281 XZVRCHIBKWMKSW-UHFFFAOYSA-N 421.453 2.174 10 20 HECD COc1cc(N2CCN(C(=O)Cc3csc4nccn34)CC2)cc(OC)c1OC 759238826 QUNHMKWVEYBLDJ-UHFFFAOYSA-N 416.503 2.313 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CS[C@H]1CCS(=O)(=O)C1 761752229 FSAYQGDFYHOIAJ-ZDUSSCGKSA-N 422.366 2.424 10 20 HECD CO[C@]1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOC1 763640787 NJFMWGOENGXSMZ-SFHVURJKSA-N 417.428 2.147 10 20 HECD C[C@H]1NC(C(=O)NCc2cccc(Br)c2O)=NN(c2ccccc2)C1=O 765763414 BCZVJIZWZFSRBQ-LLVKDONJSA-N 417.263 2.109 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccco3)cc2F)C[C@@H](C)O1 767515697 OYIRGLMXOFKEFB-HUUCEWRRSA-N 404.438 2.434 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(OC)c(Cl)n3)CC2)cc1 767883183 IIXFVVKIYMMDDH-UHFFFAOYSA-N 404.898 2.304 10 20 HECD O=C1CCc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)c(F)cc2N1 767894824 ZFCYYUOIXFOHEB-UHFFFAOYSA-N 417.462 2.198 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)CC2)cc1 769153505 HWBNZYYHFRPYAC-YADHBBJMSA-N 416.566 2.341 10 20 HECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 769331015 YUFBEEPBDJJCRX-HXUWFJFHSA-N 402.583 2.336 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](C(C)(C)C(=O)OC)C3)nc12 772369377 FTWROJMIZGHAJG-CYBMUJFWSA-N 404.467 2.023 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C 773760258 FTHBGCQVYXYWCU-PSLXWICFSA-N 423.469 2.144 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 775370390 GAEBXKDSIDNQTF-CABCVRRESA-N 401.463 2.018 10 20 HECD CCN1C(=O)c2ccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2S1(=O)=O 775404715 NIDDUTCDKMNUBO-CYBMUJFWSA-N 401.488 2.408 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cnn(-c2ccccc2)c1 785969469 ICGROGCKKWQRKJ-UHFFFAOYSA-N 401.470 2.181 10 20 HECD C[C@H]1CN(CCN(C)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 788910313 WGTYPYCETGNQIY-OTWHNJEPSA-N 404.555 2.335 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F 789838738 IBMCORBVTNWGJC-LLVKDONJSA-N 411.455 2.240 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NCc1ccc(S(=O)(=O)CCO)cc1 790188338 XKNZOSVAUXUOBL-UHFFFAOYSA-N 417.531 2.052 10 20 HECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)CN1CCCC1 790189095 OYFBIXCRQJYMLZ-LJQANCHMSA-N 400.567 2.483 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)c1 790227196 CXRHHMYZRCSGSW-HNNXBMFYSA-N 403.504 2.410 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1 790411736 PUFOMTKETWLVKD-UHFFFAOYSA-N 423.403 2.457 10 20 HECD CN(C)CCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 792200912 DIIVGIBISGQCBP-UHFFFAOYSA-N 423.447 2.210 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c(O)c1 797387763 OSGCLGRQRIYEDE-UHFFFAOYSA-N 420.425 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](c4ccccn4)C3)CC2)cc1 799065045 AMIQNDWIXZLZCL-VJIACCKLSA-N 420.513 2.311 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc2ccccn12 804099817 BDRKVIXXSYGLFC-HXUWFJFHSA-N 418.501 2.235 10 20 HECD CCCN(CC(C)C)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805009897 PVACPCITAQZHQT-UHFFFAOYSA-N 406.546 2.478 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3(C)OCCO3)cc2Cl)C1 806377382 JXQAPJHOTGOUHD-HNNXBMFYSA-N 423.941 2.462 10 20 HECD C[C@H]1CN(c2ccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])cc2F)C[C@@H](C)O1 811738520 ARLCQPDXQNPDDJ-TXEJJXNPSA-N 403.414 2.454 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 816816745 GXCRAXCXBGIFQA-KRWDZBQOSA-N 405.520 2.209 10 20 HECD CCc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 919729788 IIAXTYFPYWZHPX-UHFFFAOYSA-N 404.488 2.262 10 20 HECD COc1ccc(CN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OCC(N)=O 1319683689 MQRUEATXJKEZRQ-SFHVURJKSA-N 400.475 2.446 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)no3)CCC2)cc1)c1cc(O)nc(O)c1 1788427413 XFSOBZQYFUQQNJ-UHFFFAOYSA-N 410.386 2.248 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1c(F)ccc(O)c1F 1796604292 ZVVJIPMJNUXTFQ-ZSBIGDGJSA-N 419.384 2.042 10 20 HECD O=C(CC(F)(F)F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931952 VJDMYFPTXOCOHL-YOWGUQMCSA-N 422.407 2.370 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccnc3ccccc23)C1 1843618152 WEBFMEXNOVGZQX-UHFFFAOYSA-N 404.426 2.172 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1C 147126252 DUXOZWDGKLJWJE-UHFFFAOYSA-N 410.474 2.045 10 20 HECD O=S(=O)(N1CCC(CNCc2ccc(N3CCOCC3)cc2)CC1)C(F)(F)F 237759212 ZPKAVAPHSWXWQS-UHFFFAOYSA-N 421.485 2.174 10 20 HECD Cc1noc(C)c1/C=C1/SC(=S)N(Cc2ccc(S(N)(=O)=O)cc2)C1=O 726626916 MRWWRBFJQJKBMG-VGOFMYFVSA-N 409.514 2.340 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)c3cn(C)nc3C)CC2)cc1 727845817 AFBYKFNZGILXHI-KRWDZBQOSA-N 414.554 2.310 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](C)CN3CCCC3)cc2F)CC1 730119296 IVHXWACNHTXCSL-GOSISDBHSA-N 405.562 2.499 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730591063 GZEATXBJMHVBPE-CJNGLKHVSA-N 412.442 2.402 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCCCN1CCCCCC1=O 732202087 HDNRIJXODFYEQJ-HXUWFJFHSA-N 417.550 2.282 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1 734064347 FKSLGQZWAPKPLK-LJQANCHMSA-N 403.454 2.413 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(NC(C)=O)c3)CC2)cc1 736626075 WCIVTLVPLCDTDD-UHFFFAOYSA-N 407.467 2.304 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1O 737285488 DHLJQEVRUDAFCH-UHFFFAOYSA-N 419.865 2.146 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(C(=O)NC2CC2)c1 743958064 JPGCAXFMPHZIGP-UHFFFAOYSA-N 407.470 2.418 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745903258 FCOBWXLWPZDMMK-CABCVRRESA-N 410.465 2.424 10 20 HECD Cc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)o1 746378980 HMBFWECCJUXJHM-UHFFFAOYSA-N 407.474 2.470 10 20 HECD CC[C@H]1CO[C@H](C)CN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 747297098 GECGTDMUKXQEAT-WBVHZDCISA-N 419.547 2.424 10 20 HECD COCc1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751237120 NGKVMVWGUKPSIE-UHFFFAOYSA-N 408.495 2.412 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)o1 754789494 KVGMINPHKULLGJ-UHFFFAOYSA-N 408.476 2.032 10 20 HECD COc1ccccc1Nc1nc(N)nc(COC(=O)/C=C\c2ccc(O)c(O)c2)n1 759597345 RELXFNWZBKIVEK-CLFYSBASSA-N 409.402 2.374 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccnc3c(C(N)=O)cnn23)cc1 763630425 JGWCLZDECRQFCN-UHFFFAOYSA-N 418.457 2.330 10 20 HECD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 766806868 QMRJKOBTJFLCGW-UHFFFAOYSA-N 413.356 2.114 10 20 HECD NC(=O)[C@@H]1CCC[C@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 768130128 OBIQQYNXYHZUSR-NEPJUHHUSA-N 421.409 2.144 10 20 HECD CN(C)C(=O)c1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1Cl 769690223 VDSADLIMRLJOGQ-UHFFFAOYSA-N 411.867 2.371 10 20 HECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H](C)CN1C 770161574 GPWPVRMGWHVLGG-STQMWFEESA-N 409.533 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc(C)nc4)n3)CC2)cc1 771083319 RMAGAPXHLLYWOW-UHFFFAOYSA-N 407.474 2.264 10 20 HECD Cc1cc2ncc([C@H](C)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c(C)n2n1 772456012 PTJXPALYOBOPRN-INIZCTEOSA-N 413.547 2.432 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N(C)c2ccccc2C(=O)OC)cc1 784555178 MGXZRKINRYDMRQ-UHFFFAOYSA-N 400.431 2.124 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(N2CCOC2=O)cc1 785423634 DQSUFWHMNOGORY-OAHLLOKOSA-N 410.474 2.203 10 20 HECD O=C(NCCCOC1CCCCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785536419 AKRUDEOBGXDDSR-UHFFFAOYSA-N 421.513 2.134 10 20 HECD Cc1nccn1-c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cn1 787482548 SOGAHYUKCHATOV-HNNXBMFYSA-N 406.490 2.135 10 20 HECD C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788928692 BOOICBJIDGVUDY-QRVBRYPASA-N 400.567 2.386 10 20 HECD CCCCN(CCCO)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789833173 DTZCTIRWJPZIBO-CALCHBBNSA-N 423.529 2.067 10 20 HECD COC(=O)CCNC(=O)c1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 789834184 DIONBLSYVLFRBO-CYBMUJFWSA-N 415.446 2.143 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)ccc1O 790406863 IMPGFEUAVYNVIL-UHFFFAOYSA-N 411.288 2.408 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(=O)OC(C)(C)C 792037409 ASWJHGQJTJPJQA-CQSZACIVSA-N 424.517 2.499 10 20 HECD CCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)s1 792052541 UGLCMGBXDSVUGA-UHFFFAOYSA-N 423.560 2.378 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccccc1Br 793901533 ISRMJYNVOBNOOA-LBPRGKRZSA-N 419.279 2.217 10 20 HECD CN1C(=O)C(=CNNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)C(=O)N(C)C1=O 794698271 IIEWCPKAIGISQI-UHFFFAOYSA-N 420.351 2.013 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H]1c1ccncc1)c1ccc(N2CCOCC2)cc1 803300620 VBGZRNATNQPNGX-DYESRHJHSA-N 408.502 2.459 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)cc1 803306960 VPKMZINNLGMETL-HKUYNNGSSA-N 423.513 2.383 10 20 HECD CCN(C[C@H](O)c1ccc(C)cc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661707 KNVTVKNGVVPDIH-FQEVSTJZSA-N 401.482 2.398 10 20 HECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685358 DXUDVPZPVKNMEQ-INIZCTEOSA-N 411.502 2.278 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3cc[nH]n3)C2)cc1F 804852015 WWAAUDJIVBTMAT-MRXNPFEDSA-N 401.486 2.417 10 20 HECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCN(c2ccccc2)C1=O 806276879 MUTWWASWIGHUMF-OAHLLOKOSA-N 418.544 2.005 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807679705 UUFCCQYZULVRCZ-KRWDZBQOSA-N 410.518 2.287 10 20 HECD COc1cc(N2CCN(C(=O)c3snnc3C3CC3)CC2)cc(OC)c1OC 811045354 OTVKIOCSNXOLMS-UHFFFAOYSA-N 404.492 2.404 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H](C4CCC4)C3)cc2)C1 813593837 DDIMOGMUVPRINY-UXHICEINSA-N 414.550 2.346 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)N(C)[C@H](C)C3)cc2F)C[C@@H](C)O1 815179470 RMGMGJRHGICJGA-USTZCAOPSA-N 406.546 2.080 10 20 HECD Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)sc2nc3n(c(=O)c12)CCC3 916595645 WGRJCWRBJOXSBK-UHFFFAOYSA-N 400.412 2.164 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCC4)C3)cc2)C1 918122414 KRHMKKZSPLLHNA-FPOVZHCZSA-N 413.566 2.158 10 20 HECD CCCC(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918169046 BWGNDMOSXVFPMY-QUCCMNQESA-N 414.550 2.186 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 918463197 IMGKJJLCPSTIIP-SFHVURJKSA-N 408.502 2.260 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(C)nc3C(C)C)CC2)cc1 919401538 GEUSVMIREUPYJR-UHFFFAOYSA-N 400.479 2.058 10 20 HECD CN1CCC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)C1 1800718502 WXRVHJUMKUKBGW-HNKHHVNMSA-N 421.925 2.345 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1cc(O)nc(O)c1 1817844100 PXIXFUWUDXUMLL-LBPRGKRZSA-N 414.447 2.292 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2=COCCC2)CC1 1831915879 VBFGESAGBWDNCJ-SFHVURJKSA-N 415.490 2.420 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@]2(F)CCCCC2(F)F)C1 1843891958 MCBMUKJAKBYNOH-GOSISDBHSA-N 413.396 2.227 10 20 HECD CCN1C[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)Oc2ccccc21 115731088 GTDIKQKQIMSPLZ-HNNXBMFYSA-N 419.503 2.123 10 20 HECD Cn1cc(-c2ncc(/C=C3/CCn4c3nc3ccc([N+](=O)[O-])cc3c4=O)cn2)cn1 480042790 TUSBMNSWZUZCLF-MLPAPPSSSA-N 401.386 2.440 10 20 HECD Cc1c(CNC(=O)C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)n(C)c2ccccc12 550202715 SXZQZQBCRHSYQI-HZPDHXFCSA-N 414.550 2.107 10 20 HECD Cc1nn(CCC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c1[N+](=O)[O-] 726646398 ZBHXMBAJOXYMSY-UHFFFAOYSA-N 417.466 2.066 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)c1 728979958 RTGHZZPWEZVRFO-ZDUSSCGKSA-N 420.487 2.149 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(CC(=O)N3CCCC3)CC2)cc1F 731363661 KOEQLBSDWMDGCR-UHFFFAOYSA-N 419.545 2.122 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H](N2CCCC2=O)C1 732447370 CFZYBQMHCZGHNM-QGZVFWFLSA-N 418.513 2.083 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1 734402573 NCEKRYDNUDVXSS-UHFFFAOYSA-N 417.531 2.012 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1 734686424 MWNKEOFSMNVXDL-UHFFFAOYSA-N 423.561 2.205 10 20 HECD CCOc1ccc(N(CC)CC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 744391944 QMKWILRTXBXOIW-QUCCMNQESA-N 424.563 2.106 10 20 HECD CC(=O)NC(C)(C)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 744934277 JFDWOZUAPLKTAP-GFCCVEGCSA-N 422.437 2.247 10 20 HECD CCCN(C)C[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 745784705 YVAPRFOXQOQAFA-FQEVSTJZSA-N 417.598 2.191 10 20 HECD O=C(NC[C@H](O)COCC1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903007 AUEJYSGGPGAUJN-WBVHZDCISA-N 413.465 2.344 10 20 HECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccccc3O)c2)C[C@@H](C)O1 748354262 XQRZPAJTLKNYCY-GASCZTMLSA-N 404.488 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cc1 748983496 RUJAQFYHMOLZOD-UHFFFAOYSA-N 412.881 2.301 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H]([C@H]4CCOC4)C3)cc2F)C[C@@H](C)O1 750263083 RFQIZQHXMURZIZ-JYBIWHBTSA-N 419.541 2.414 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)ccc1OC 751981167 RTFDCWRMHMISST-UHFFFAOYSA-N 423.510 2.405 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CSCCS3)CC2)cc1 752838635 NYERLROGLCAQTH-IBGZPJMESA-N 424.636 2.355 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](C4CCOCC4)C3)CC2)cc1 754842103 OWURKSIPYKMUFO-FQEVSTJZSA-N 416.566 2.275 10 20 HECD Cc1cc(C(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c(C)n1-c1ccccn1 755587576 CFBBUBGNOQCLKR-IBGZPJMESA-N 409.534 2.258 10 20 HECD Cc1ccc([C@@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c(O)c1C 756441664 MQVOVVNIPKISDP-GOSISDBHSA-N 418.563 2.207 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)c1 756617370 OIDFAYWIFBXCKP-KRWDZBQOSA-N 404.488 2.238 10 20 HECD Cc1cc(C(=O)OCC2(CS(C)(=O)=O)CCOCC2)c(C)n1-c1ccccn1 756632141 WRXRMIAOXCOVDH-UHFFFAOYSA-N 406.504 2.487 10 20 HECD C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Br)ccc1O 756707319 UZKYGXBJPDVLCF-OCCSQVGLSA-N 421.357 2.294 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3Cc4cccc(O)c4C3)cc2)C1 758434543 BQPIAWZZXXMKBZ-ROUUACIJSA-N 408.502 2.061 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)COC(C)(C)C)cc2F)C[C@H](C)O1 768933901 XGCKYMKXPLJJAE-GJZGRUSLSA-N 424.517 2.369 10 20 HECD Cn1c(=O)nc(O)c2c(C(=O)NCc3c(O)ccc4c3CCCC4)cc(C3CC3)nc21 769564335 VRAASGSWGYTLNS-UHFFFAOYSA-N 420.469 2.426 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769957268 KQUOZXBBOKUYKR-DNVCBOLYSA-N 417.531 2.404 10 20 HECD C[C@H](NC(=O)C(=O)NCC1(N2CCOCC2)CCCCC1)c1ccc(N(C)C)cc1 774839919 CFUNUGAYUDPFQD-SFHVURJKSA-N 416.566 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(CC(F)F)c3)CC2)cc1 778284740 REFBXICZFHLHNK-SREVYHEPSA-N 419.432 2.000 10 20 HECD O=C(NCCN1CCCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 782958211 AMTAZLDXVWWTJR-UHFFFAOYSA-N 412.481 2.278 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)[C@@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1Br 784384380 BSTJTGIWSQLDKL-SYDQRWKJSA-N 410.246 2.477 10 20 HECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc2C1 784689654 KALCAXBIKDZRJR-KSFYIVLOSA-N 423.513 2.453 10 20 HECD O=C(COC(=O)c1cc2occc2[nH]1)NCc1ccc(N2CCOCC2)c(F)c1 786032049 XSNFEGRCDRONSK-UHFFFAOYSA-N 401.394 2.210 10 20 HECD CCC(CC)[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N1CCOCC1 786601182 YPHTZLZZNKZGSV-DYESRHJHSA-N 418.582 2.183 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3sccc3CN(C)C)cc2)CC1 787322437 QMNLDYFDEXXRGC-UHFFFAOYSA-N 400.548 2.408 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3C(F)(F)F)nc12 788133517 NKEMSBKPUIWQKN-UHFFFAOYSA-N 410.308 2.382 10 20 HECD Cn1cccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788335238 LCZFTBPCNJFSLI-AWEZNQCLSA-N 406.433 2.028 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc(CC(C)C)nc3)CC2)cc1F 792341322 VQSAZXNJDNKHHC-UHFFFAOYSA-N 415.469 2.110 10 20 HECD CC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793733251 LVQCQOJLISUFSK-MJGOQNOKSA-N 414.550 2.043 10 20 HECD CC1(C)CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793733641 NOIDASIRSCYGIO-PKOBYXMFSA-N 414.550 2.090 10 20 HECD CCn1c([C@H]2CCOC2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 801896341 UWOMQAAOBOOYGZ-HNNXBMFYSA-N 417.510 2.154 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803299338 JJFWANKDMRFCPX-PKOBYXMFSA-N 415.534 2.308 10 20 HECD CN(CCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 803687092 UJZYCCLTMIUPTG-UHFFFAOYSA-N 418.538 2.011 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2nc([C@H](C)OC)no2)cc1F 804853386 XDYZOZHTLIXAHG-ZDUSSCGKSA-N 421.473 2.037 10 20 HECD CCOC(=O)CC1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 914574595 VGOOLSBHVDJJRC-UHFFFAOYSA-N 403.523 2.009 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(C(=O)N2CCCC2)CC1 918218377 YMMSFSKPYBFIJV-UHFFFAOYSA-N 418.513 2.206 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)on1 919037808 JVUCROOAVWODIJ-OKILXGFUSA-N 405.426 2.209 10 20 HECD COCCN1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 920814323 VHLCWBGCAXZQIQ-IRXDYDNUSA-N 422.545 2.349 10 20 HECD C[C@@H](OC(=O)CO[C@H]1CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1318911081 RGAFPVMXGNYSHL-HIFRSBDPSA-N 423.421 2.138 10 20 HECD C[C@@H](OC(=O)CO[C@@H]1CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1318976414 XFZKIVMQKFEWII-ZIAGYGMSSA-N 423.421 2.138 10 20 HECD CCOc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5ccccc5n34)CC2)cc1 1324468428 OGPJNOZQZOQSEL-UHFFFAOYSA-N 418.501 2.302 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCn1c(=O)n(C)c2ccccc21 29028466 VHTGAIKSJVGJGS-UHFFFAOYSA-N 408.502 2.225 10 20 HECD Cn1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(-c2ccc([N+](=O)[O-])cc2)n1 63454117 OJUKHXNAMBKLRC-SDQBBNPISA-N 404.429 2.281 10 20 HECD CC(=O)N1CCN(CCOc2ccc(CCNCc3ccc4c(c3)CCO4)cc2)CC1 728063314 IFKWBMUSLJDIGE-UHFFFAOYSA-N 423.557 2.497 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 734214747 AVXYCDNPTIFYRW-UXHICEINSA-N 416.566 2.342 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC3CCOCC3)cc2F)C[C@H](C)O1 742278207 KQZJVBMGDLPWOX-GJZGRUSLSA-N 400.516 2.285 10 20 HECD Cc1cc2c(cc1C)O[C@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)C2 742560761 KPBVEKDAMGPKFM-NRFANRHFSA-N 414.527 2.158 10 20 HECD O=C(CN1CCN(c2ccccn2)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 743339020 MVPDYQPBVCRIGQ-FQEVSTJZSA-N 410.518 2.117 10 20 HECD CN(C)C(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 743559882 PDRNNIRAIRJLKO-UHFFFAOYSA-N 410.518 2.267 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1 743905085 ASJWDEYZYWBJMG-CYBMUJFWSA-N 413.430 2.482 10 20 HECD COc1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1NC(C)=O 743954588 CAQVTNOUNCJJDV-UHFFFAOYSA-N 411.458 2.493 10 20 HECD O=C(NCc1ccccc1O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 748347340 ZYIXERICLZWBJJ-QGZVFWFLSA-N 419.459 2.160 10 20 HECD NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(N3CCCCC3)cc2)cc1 749941699 LQMLOBHIMZVFMG-UHFFFAOYSA-N 403.504 2.020 10 20 HECD CN(C)c1ccc(CNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1F 751386545 IESIGWOMNFPYFQ-UHFFFAOYSA-N 419.522 2.052 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 752352359 TYKLMRHULAXOSU-UHFFFAOYSA-N 419.507 2.144 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1cccc(Br)c1 753637388 UWQQOBOCNXXQJG-NSHDSACASA-N 407.264 2.338 10 20 HECD C[C@@H](NC1CCN(S(=O)(=O)C2CCOCC2)CC1)c1cc(F)cc(F)c1O 756734583 XUZPJRHATOMAQQ-GFCCVEGCSA-N 404.479 2.294 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C[C@H](O)c3ccco3)nc12 758828373 RWXLODKJIVSUFA-ZBFHGGJFSA-N 400.435 2.293 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(-c3cccnc3)c2)SC1=S 768478972 DOWYZDKLAXTWSU-LFIBNONCSA-N 419.553 2.499 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3cccc4c3OCO4)nc12 770440573 SRKFAEACHQSBJT-UHFFFAOYSA-N 413.386 2.016 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 772404367 STVRZRPSGPTYLJ-UHFFFAOYSA-N 418.519 2.266 10 20 HECD CNC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1 783314498 NRTPPKSISOARJK-UHFFFAOYSA-N 410.518 2.417 10 20 HECD C[C@H]1C[C@H](C)CN(CCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 787709571 XWOBXCJRHPJUIY-OALUTQOASA-N 400.567 2.387 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 787742000 YRLFTAZHUSSLMD-UWJYYQICSA-N 422.529 2.410 10 20 HECD C[C@H]1CN(C(=O)c2ccc(CNC(=O)c3c(F)ccc(O)c3O)cc2)C[C@H](C)O1 790068856 FVIRYXXUSVDJGJ-STQMWFEESA-N 402.422 2.416 10 20 HECD COc1ccc(CNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c(O)c1 794389029 HFXSRXFVLVGEQE-UHFFFAOYSA-N 414.487 2.473 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)cc1C 795607464 PDPZNKAEQAQMBX-UHFFFAOYSA-N 413.502 2.420 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCN(CC(F)(F)F)C1 795731053 BYRVOOJDAXMRBF-HNNXBMFYSA-N 401.429 2.138 10 20 HECD COc1cccc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CCO2)c1 803664869 QKOKYRDQGHBHOV-FQEVSTJZSA-N 415.465 2.117 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc2c(c1)CC(=O)N2C 804569024 BBBRFIAYNBAJMD-GFCCVEGCSA-N 418.544 2.138 10 20 HECD C[S@](=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 804975804 SXLAWBQGSBXKEY-NDEPHWFRSA-N 401.532 2.401 10 20 HECD CN(C)CCN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290215 FDQJDHSTJCGQJT-UHFFFAOYSA-N 424.520 2.409 10 20 HECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H](C)CO1 807769842 IYFYEKNHTLILLK-RBSFLKMASA-N 411.449 2.009 10 20 HECD CN(Cc1ccccn1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770331 KLSUIIGZDKBGAO-INIZCTEOSA-N 418.444 2.427 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 808366851 BNFNGNHMXNNRJK-AWEZNQCLSA-N 419.494 2.379 10 20 HECD C[C@@H]1CN(S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3O)CC2)C[C@@H](C)O1 816491312 HXVLBNSRZIOWJL-IAGOWNOFSA-N 419.547 2.017 10 20 HECD O=C(COC(=O)[C@H]1CC1(Cl)Cl)NCc1ccc(N2CCOCC2)c(F)c1 918953693 RLWKAAKEAKOJPJ-GFCCVEGCSA-N 405.253 2.016 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C(F)(F)F 919971208 LFDNAYZLHUBOOK-UHFFFAOYSA-N 400.376 2.469 10 20 HECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC1CCCCC1 920635580 IKLUAZKHBUKNOS-KRWDZBQOSA-N 412.508 2.394 10 20 HECD Cn1nc2cc(Br)ccc2c1C(=O)Nc1nc(C2=S=CC=C2)n[nH]1 1641156852 VVCMHAPVMCBCLL-UHFFFAOYSA-N 403.265 2.332 10 20 HECD COc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796603481 PBUCDUHVQIHXFV-BTTYYORXSA-N 415.421 2.206 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 730281225 RGPPQTIKIGDZLH-OAHLLOKOSA-N 423.517 2.135 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730591065 GZEATXBJMHVBPE-XJKSGUPXSA-N 412.442 2.402 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)cc1F 731363900 PMIRXTLKCMJUAO-KRWDZBQOSA-N 407.534 2.059 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@H]3C3OCCO3)cc2F)CC1 732463090 PCJJKTINUQFSMM-FQEVSTJZSA-N 420.529 2.405 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CSc2ccccc21 735651612 PDMDBGYLKLHDCC-SFHVURJKSA-N 402.541 2.427 10 20 HECD COc1cc(N(C)CC(=O)N[C@H](Cc2ccccc2)C(C)=O)cc(OC)c1OC 741795974 XNNPIBNNFVPVTA-GOSISDBHSA-N 400.475 2.465 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](NC3CCOCC3)C(C)C)cc2F)CC1 743338806 GMNUOKIDDXIFQX-JOCHJYFZSA-N 420.573 2.377 10 20 HECD CCC1(O)CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 743855726 XSCCPVYLNJWNKV-IRXDYDNUSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 745333523 NZAFCTORJBEJRD-UHFFFAOYSA-N 413.430 2.038 10 20 HECD CNC(=O)CC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 746414901 IEAUNXSVWCQJLQ-HOTGVXAUSA-N 420.529 2.497 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(=O)Nc4cc(F)ccc43)CC2)cc1 746494866 LZNIQLWIRGJTDY-UHFFFAOYSA-N 412.465 2.332 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ccc(-n4ccnc4)nc3)CC2)cc1F 753833986 OFQTZQCMYXHHHW-UHFFFAOYSA-N 410.453 2.447 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)co2)cc1 753950534 RRKWFRQJLPXXSN-UHFFFAOYSA-N 416.477 2.409 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3cccc(N(C)C)c3)CC2)cc1 754068602 BYQUDIPFRUVVRP-HSZRJFAPSA-N 412.578 2.376 10 20 HECD CN1C(=O)c2ccc(NC(=O)CN(Cc3ccccc3O)C[C@@H]3CCCO3)cc2C1=O 756336598 OMWUFABQYNUYQV-KRWDZBQOSA-N 423.469 2.238 10 20 HECD O=C(CN1CCO[C@@H]([C@H]2CCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756898423 LVDBQBBUJAWOLU-NHCUHLMSSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(OC)ccc3C(C)=O)CC2)cc1 758220987 BAQCSQAMIWJNFB-LJQANCHMSA-N 414.502 2.468 10 20 HECD COc1ccc(O)c(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759240318 KPWYGUISJVJYLL-UHFFFAOYSA-N 402.447 2.389 10 20 HECD C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(-n2cnnn2)cc1 765257125 WONIATYDOADGGI-QFBILLFUSA-N 405.506 2.215 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)N1CCCCCC1 768212533 LCIWYGKWVZFIBE-UHFFFAOYSA-N 418.557 2.183 10 20 HECD CC(C)n1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 769024715 PSSWQKCIQSQBBS-UHFFFAOYSA-N 424.549 2.251 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1 769153432 IFRBNRBFBVXDAZ-VXKWHMMOSA-N 416.566 2.042 10 20 HECD CN(C)c1ccc(CN(CC(=O)Nc2cc(-n3cnnn3)ccc2F)C2CC2)cc1 771791666 QMEYZYZSELHJRK-UHFFFAOYSA-N 409.469 2.471 10 20 HECD COc1ccc([C@@H](OC)[C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 772881062 JANGBIRMNOJGCQ-XIKOKIGWSA-N 408.476 2.278 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@](O)(c4ccc(F)cc4)C3)CC2)cc1 777735249 XTSPXCHMNGGMHF-HSZRJFAPSA-N 413.493 2.076 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)OCO4)cc2F)CC1 777992254 MUZBYQXOYHFANL-UHFFFAOYSA-N 421.494 2.175 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc4c(cc3F)NC(=O)CC4)ccc21 778594663 CXVMMGWMNKNRGH-UHFFFAOYSA-N 410.449 2.348 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@@H](S(=O)(=O)NC4CCCC4)C3)cc2)CC1 781921067 RPFKADCGBYCXIE-JOCHJYFZSA-N 420.623 2.265 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](Oc3ccncc3)C2)c1 788380511 ZSQNIXFLWNWILP-JOCHJYFZSA-N 411.502 2.475 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCCn1ccnc1 793738719 SWQBOSJMDWEZBN-UHFFFAOYSA-N 423.311 2.296 10 20 HECD CCOc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)ccc1[N+](=O)[O-] 794678951 KFFLSPHGQLGEHP-LJQANCHMSA-N 415.446 2.447 10 20 HECD CCOc1ccc(O)c(CNc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1 796433775 YPBYEIPPNNIHIU-UHFFFAOYSA-N 405.520 2.339 10 20 HECD COc1cc(N2CCN(C(=O)c3cn4c(n3)CCCC4)CC2)cc(OC)c1OC 799365811 OEFPGZLHPPDSGU-UHFFFAOYSA-N 400.479 2.208 10 20 HECD CC1CCN([C@H](C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 803541177 AIIQTJPNYAHGMI-GOSISDBHSA-N 400.567 2.480 10 20 HECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)NCCCSc2nccs2)o1 806276010 DAHYJRPOPMWRCQ-AWEZNQCLSA-N 409.533 2.497 10 20 HECD C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 808854846 MLKNYUYVEZMVFP-LJQANCHMSA-N 412.578 2.483 10 20 HECD CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1ccc(N2CCOCC2)cc1 857758521 JGIUQWNJRRCGQH-UHFFFAOYSA-N 410.474 2.453 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)COc1nsnc1N1CCOCC1 915117900 IIDSLPFUMXJMDJ-UHFFFAOYSA-N 419.551 2.257 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 917385957 DXOKJZQDHQMUIG-CQSZACIVSA-N 401.454 2.267 10 20 HECD Cc1ccccc1[C@@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)NC(N)=O 917708615 LCSKXBSBTARMSU-LJQANCHMSA-N 414.481 2.387 10 20 HECD C[C@@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918673735 QDQUOKTZKQJFCB-VQIMIIECSA-N 414.550 2.090 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 920240236 OJECADYWTTWJFC-GOSISDBHSA-N 408.568 2.242 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4nc(O)[nH]c4c3)CC2)cc1 920251613 DSTFTCUCCFLKDD-HJWRWDBZSA-N 421.457 2.121 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccn(-c4ccncc4)n3)CC2)cc1 1324654246 HHJBRGBUHUTQCL-UHFFFAOYSA-N 420.517 2.218 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2)[nH]n1)c1cc(O)nc(O)c1 1817844191 SNQMQZGYISORNC-OAHLLOKOSA-N 408.418 2.231 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1829728111 SKFWNRMUCYLUES-QGZVFWFLSA-N 413.478 2.071 10 20 HECD COc1ccc([C@@H](C)C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843248783 MPPJOWQSXBRDMX-CQSZACIVSA-N 411.458 2.122 10 20 HECD COCc1oncc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501234 POLVNBQEALDCBK-UHFFFAOYSA-N 421.837 2.016 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccnc2)no1 138516545 SKNAJNQMDUXGNA-SNVBAGLBSA-N 404.404 2.127 10 20 HECD CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 532121206 HPMRCCPFNYGDFK-UHFFFAOYSA-N 410.517 2.134 10 20 HECD O=C(Cc1nc2ncccn2n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726567625 ODKDAEJCFBGZAU-UHFFFAOYSA-N 402.405 2.053 10 20 HECD COc1cccc2c1OC[C@@H](NC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 728396498 MNNKEZGYUJQQPA-KRWDZBQOSA-N 415.465 2.474 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c1 730288050 RJINPFUPVZJGJK-ZDUSSCGKSA-N 411.430 2.051 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCCN(c3cccc(F)c3)C2=O)c1 734579480 URXAVIVGOPBWTE-KRWDZBQOSA-N 422.434 2.255 10 20 HECD O=C(CCCN1C(=O)CCC1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798479 OKPOMUNUDYFWQM-AWEZNQCLSA-N 409.433 2.302 10 20 HECD CC(C)N1C[C@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1=O 750639738 WURUWOBLLHSTFY-BFYDXBDKSA-N 406.502 2.248 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1cccc(Br)c1O 765755144 GTAJWRBLHWKNOY-UHFFFAOYSA-N 405.252 2.379 10 20 HECD CCc1ccc(CS(=O)(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 768835903 STZKOBRVYKPMBN-UHFFFAOYSA-N 417.575 2.499 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1F 769654563 WQSPAPXNFCOBAN-UHFFFAOYSA-N 402.469 2.114 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 769711531 CBHNZSQDIXPGSB-IBGZPJMESA-N 418.471 2.416 10 20 HECD CN(C)c1ccc(CN(C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)C2CC2)cc1 769849260 YJBURINKVBICEM-UHFFFAOYSA-N 402.520 2.203 10 20 HECD Cc1noc(CCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 769969726 BDZRANJCMKKBEP-UHFFFAOYSA-N 419.393 2.268 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCc1nnnn1CC1CC1 771374219 KFDFYIXFQOTAJW-UHFFFAOYSA-N 409.288 2.283 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC3CC(C)(C)NC(C)(C)C3)CC2)cc1 774495866 WLUDOTAYBLRUSW-UHFFFAOYSA-N 416.566 2.206 10 20 HECD O=C(NCc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774554814 YUPPSYHXURSOPU-UHFFFAOYSA-N 405.857 2.248 10 20 HECD Oc1c(F)cc(Cl)cc1CN1CCN(Cc2nnnn2-c2ccccc2)CC1 775676584 UTOBEBXQZKORJG-UHFFFAOYSA-N 402.861 2.478 10 20 HECD CC[C@H]1CN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCS1 778297053 FVQVIOSFBYTIMB-SGQUHAKNSA-N 403.548 2.254 10 20 HECD O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc(O)c(O)c1 783375458 OKNWDHSQDDXVMY-HNNXBMFYSA-N 423.425 2.252 10 20 HECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785434943 XRZLNEKKWWZHFH-UHFFFAOYSA-N 407.474 2.066 10 20 HECD CC[C@@H]1CCC[C@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785526990 HPHNRYPGOXHMAA-WIYYLYMNSA-N 416.566 2.018 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)Cc3ccccc3Cl)cc2)CC1 787321413 FFSARMLOSKHULG-OAQYLSRUSA-N 415.921 2.228 10 20 HECD Cc1ccc(C2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cn1 788331231 HTTFOAXATODTSJ-UHFFFAOYSA-N 422.529 2.249 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3cccc(O)c3)C2)cc1 788964259 LZNCEGBCJXJETL-NRFANRHFSA-N 411.502 2.455 10 20 HECD CN(C)c1ccc(CNCCS(=O)(=O)NC[C@@H]2CCCCO2)c(C(F)(F)F)c1 792989733 KUTIDLDZWCUUBU-INIZCTEOSA-N 423.501 2.350 10 20 HECD CN(C)S(=O)(=O)c1ccc(CC(=O)NCc2c(O)ccc3c2CCCC3)cc1 793690770 XZIYFMVCUNLHNQ-UHFFFAOYSA-N 402.516 2.380 10 20 HECD C[C@H](COc1ccc(F)cc1F)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 793802651 WEIOLRJWCSOUKX-GFCCVEGCSA-N 409.408 2.370 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(OC)cc2O)cc1OC 794762583 XLUUJFQWJBOCOK-UHFFFAOYSA-N 409.464 2.493 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc(N(C)C)cc1 804574532 NJEYRHZKRFYSBI-GJZGRUSLSA-N 408.502 2.326 10 20 HECD C[C@H](NC(=O)N1CC[C@@H](C(=O)N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 804988381 BOGKHQMJYGKAPP-PKOBYXMFSA-N 400.523 2.238 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)O2 806707343 RGUCFTARQRNIPR-COFLGROHSA-N 403.523 2.149 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12 918443841 HSOXROBSKRJWAO-UHFFFAOYSA-N 420.469 2.374 10 20 HECD C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)cc1 920887056 YRNUUWJMDWKZIS-LSDHHAIUSA-N 423.560 2.129 10 20 HECD COCCN1C(=O)/C(=C\N[C@@H](C)c2cccc(C(F)(F)F)c2)C(=O)NC1=S 920980621 RXGQVUSTKNPDKI-AVMBBCFPSA-N 401.410 2.130 10 20 HECD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)nc1 1796598756 FHOXZKGXEVBKNA-BCDXTJNWSA-N 410.474 2.081 10 20 HECD CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)[nH]n1 1796601490 PPQMECVCKWRXRE-BTTYYORXSA-N 413.478 2.079 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807998740 NXXFYOSNNCCREL-KYNLDRKZSA-N 410.474 2.420 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)NCCc3cccc(C)c3)nnc2n1 116397702 GASXZJLHJAJNDJ-UHFFFAOYSA-N 414.539 2.142 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 489610104 LFKGFAYQYXZBPH-UHFFFAOYSA-N 420.487 2.273 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)n(C)c2ccccc12 583460729 NLUFDQOXEQWVRL-AWEZNQCLSA-N 410.440 2.198 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1F 731408039 BSXUYWDCJOWOGT-UHFFFAOYSA-N 421.494 2.330 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccc(C)nc3)CC2)cc1 732251303 FJPCBOBNRBQGDE-UHFFFAOYSA-N 411.550 2.453 10 20 HECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 734943457 YTUKPJCNIWEESR-UWJYYQICSA-N 422.533 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN([C@@H](C)c4cccnc4)CC3)CC2)cc1 735871674 SXIFAVWLCWUMKJ-FQEVSTJZSA-N 423.561 2.118 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c1 740459757 ORDHJINQBMSRHD-UHFFFAOYSA-N 421.475 2.172 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cn1 743046032 LNSKPGVDHPZSQS-UHFFFAOYSA-N 414.415 2.259 10 20 HECD COC[C@@](C)(O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 745315849 CAWJSJRPNSBONL-OAQYLSRUSA-N 403.431 2.004 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n(C2CCOCC2)n1 746356970 VYTKWXHQLPHIIV-UHFFFAOYSA-N 411.506 2.398 10 20 HECD CC(C)(C)OC(=O)N1CC(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 751783717 VHDSZIPTWNUFGQ-UHFFFAOYSA-N 408.474 2.081 10 20 HECD COc1ccc(N2CCN([C@H](C)C(=O)N3CC(=O)Nc4ccccc43)CC2)cc1F 753858690 ZYLFXXYTMZUIHG-OAHLLOKOSA-N 412.465 2.330 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc1F 753914634 AAEWQPXCCWDGTK-CYBMUJFWSA-N 404.408 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nnc(C(C)(C)C)s3)CC2)cc1F 754211010 CVHNWWPKSMPMPG-UHFFFAOYSA-N 421.498 2.271 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)N3C[C@@H](C)Oc4ccccc43)CC2)cc1F 754212566 LHSQXQWFQGXYCH-OAHLLOKOSA-N 413.449 2.297 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2ccc(C(=O)O)c(Br)c2)ccc1O 757659608 YADJLPSKMNMSGD-UHFFFAOYSA-N 416.205 2.352 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@@H](C)N(C4CCC4)C3=O)CC2)cc1 760949741 HYLLOUITIVTWMC-QGZVFWFLSA-N 400.523 2.413 10 20 HECD Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 761260320 UIAAHMBXCHEAKB-UHFFFAOYSA-N 408.451 2.147 10 20 HECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)c1ccc(NS(C)(=O)=O)cc1 772774091 GSYCHYLYSIURTB-GFSSTFBJSA-N 405.428 2.297 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCN(S(=O)(=O)c3ccccc3)CC2)c1O 774854520 WFRNLPPXDKOASD-UHFFFAOYSA-N 421.475 2.206 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCCN2CCN(C(=O)OC(C)(C)C)CC2)c1O 775049613 AETFCYBPJCEEQP-UHFFFAOYSA-N 424.498 2.341 10 20 HECD C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1sccc1C(N)=O 775258475 BPMTXWPMTOWTQB-KGLIPLIRSA-N 402.520 2.361 10 20 HECD Cn1cc(S(=O)(=O)Nc2ccc(O)c(Cl)c2)cc1C(=O)NCC(F)(F)F 776751475 VPFFGHYIBRMBES-UHFFFAOYSA-N 411.789 2.477 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CC[C@@H](SC)C3)CC2)cc1 778287874 FLVFPOCXXSUWED-DKBRWSJVSA-N 403.548 2.300 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)O)c3C)c2)CC1 780407895 QPCDWWBMOOJKER-UHFFFAOYSA-N 417.487 2.163 10 20 HECD COCCOc1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786660209 BADBNMKHBDHCHJ-UHFFFAOYSA-N 411.502 2.310 10 20 HECD COc1ccc(C)cc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 789375131 QXTGPIGLCJMWDY-UHFFFAOYSA-N 411.502 2.115 10 20 HECD CC[C@H]1CCCC[C@H]1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 789969608 WOAGZCZRNGSOBC-GHTZIAJQSA-N 416.566 2.018 10 20 HECD CN(C)S(=O)(=O)c1cccc2c1CCN(Cc1ccc(N3CCOCC3)cc1)C2 793612620 JGZQQMDIUJRAKK-UHFFFAOYSA-N 415.559 2.332 10 20 HECD CC(C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 796680170 ZCMPGSSZTKBYRN-GJZGRUSLSA-N 417.485 2.472 10 20 HECD O=C(NC[C@@H](CO)[C@H]1CCOC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797445272 SHZDLZURAVSZFV-GJZGRUSLSA-N 413.465 2.201 10 20 HECD CC[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)OC 812369917 WTSIGYBYPXOBOV-CQSZACIVSA-N 423.447 2.256 10 20 HECD Cc1cc(C(=O)COC(=O)CCOC(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 914950476 KLOUBEPFYJBXPO-UHFFFAOYSA-N 422.503 2.283 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918294292 FFCZAPOBQSEJRI-GOSISDBHSA-N 412.442 2.325 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 918307495 XMTFDFKYNJASDL-UHFFFAOYSA-N 417.531 2.452 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)cc1 918429767 OQTFMHZIDCTINZ-UHFFFAOYSA-N 406.490 2.428 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769456 MZZCXMXHQAMFBF-BWOYXGKQSA-N 422.909 2.391 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C23CC(C2)C3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998118 IRMTUYUZKHNUPU-PDFHVRPRSA-N 408.458 2.008 10 20 HECD C[C@@H](NC(=O)NCCNC(=O)c1ccccc1F)c1ccc(N2CCOCC2)cc1 65434799 WZNZYSJTOGTURM-MRXNPFEDSA-N 414.481 2.453 10 20 HECD Cc1c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1-c1ccccn1 106096706 KSOHUIHENRQBLS-UHFFFAOYSA-N 407.474 2.457 10 20 HECD NC(=O)CC[C@@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 727158287 LVFLNEFVPLFFSA-HNNXBMFYSA-N 419.481 2.378 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc(O)cc3)cc2F)C[C@@H](C)O1 727484157 YCWVFJWDEHBPDD-GASCZTMLSA-N 415.465 2.191 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](N4[C@@H](C)CC[C@H]4C)C3)nc12 729265315 FWCRRKPXZQOFMQ-HLLBOEOZSA-N 401.511 2.449 10 20 HECD CC[C@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 730191387 VRQQHKQKOLICAW-UROBUVALSA-N 423.585 2.467 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 740907587 QKFGGIBKAJBXRL-FUHWJXTLSA-N 411.593 2.395 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741097284 NMJJZVWFLBFVQC-UHFFFAOYSA-N 413.499 2.030 10 20 HECD CN1CCC(O)(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745904420 PZADHLFTHUSGPO-HNNXBMFYSA-N 412.481 2.013 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2cc(S(=O)(=O)NCCOC)c[nH]2)cc1 746104548 AGLDKIGBSAQHEH-UHFFFAOYSA-N 422.551 2.058 10 20 HECD O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ccc(N2CCCC2)cc1 749215139 MAEUROSYOCXTIK-UHFFFAOYSA-N 421.545 2.435 10 20 HECD C[C@@H](NC(=O)N1CCOCC2(CCOCC2)C1)c1ccc(N2CCOCC2)cc1 753129883 YFBZAIYINKIYAK-GOSISDBHSA-N 403.523 2.423 10 20 HECD CCOCCS(=O)(=O)NCC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 757637438 IILABQBAYOVLCI-UHFFFAOYSA-N 411.568 2.028 10 20 HECD O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)c1cccc(O)c1O 758549144 ZLGFUFZXADBGAM-UHFFFAOYSA-N 404.850 2.252 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl 762260877 BIYOKJYHYYGDKQ-UHFFFAOYSA-N 410.879 2.118 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1c1ccccc1Br 768465684 PQUUCHVVDYDOIG-SJLPKXTDSA-N 419.275 2.254 10 20 HECD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCc1c(O)ccc2c1CCCC2 769563169 YIEXTQARIXPTAG-UHFFFAOYSA-N 412.446 2.295 10 20 HECD CC(C)CNC(=O)c1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769653415 QEBYMIYYSQNGHB-UHFFFAOYSA-N 405.476 2.402 10 20 HECD CO[C@H](C)c1noc(CN2CCCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 770283791 YCFJRAFBEZOCIO-GOSISDBHSA-N 415.538 2.322 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)c2)CC1 771638089 ZGLZFORFZXQJSS-HSZRJFAPSA-N 421.501 2.135 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)CC1 775141976 GFERYGMZCWUELR-CQSZACIVSA-N 415.494 2.070 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-n2cccn2)ccn1 777826850 TUQZJTAJVKVVAB-UHFFFAOYSA-N 400.822 2.442 10 20 HECD COC(=O)c1cc(F)cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 782398319 VXLQMUPEQFKFTJ-UHFFFAOYSA-N 408.451 2.132 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)c1 785296808 IKHIRTBSAJWWTK-AWEZNQCLSA-N 402.447 2.117 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](C)Cn1cccn1 790229851 WRWKZPLKHXCOAQ-ZDUSSCGKSA-N 423.311 2.152 10 20 HECD C[C@H](O)C[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790666239 PMYINDIDAIKLPH-QRFRQXIXSA-N 402.539 2.223 10 20 HECD CC(C)(C)OC(=O)N1CCN(C(=O)CNCc2c(O)ccc(Cl)c2F)CC1 790954635 VSGOBMKMDGGJSO-UHFFFAOYSA-N 401.866 2.354 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O 792701915 HIGOHRNBQGULQD-UHFFFAOYSA-N 402.881 2.432 10 20 HECD CCOC1CC2(CCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)C1 796525621 FIWUUOLLVHBJBN-UHFFFAOYSA-N 405.514 2.170 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3c3nc(C)no3)CC2)cc1 796668889 LYSDAGRZRBKJGU-PZJWPPBQSA-N 415.538 2.097 10 20 HECD CCOC(=O)[C@]1(COC)CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 799199010 NITWJKODPCSELT-JOCHJYFZSA-N 405.539 2.003 10 20 HECD Cc1nccnc1N1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 799366134 WWGAZPRWJUFBKJ-KRWDZBQOSA-N 410.522 2.214 10 20 HECD CCOC(=O)c1ccccc1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)cc1 799522546 OCKGOBUXMBLJNP-UHFFFAOYSA-N 412.489 2.426 10 20 HECD Cc1cc(C(=O)CS(=O)(=O)Cc2ncnn2CCF)c(C)n1-c1ccccc1 799752463 MASBAIULKHQFPU-UHFFFAOYSA-N 404.467 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3[C@H]3CCCO3)CC2)cc1 803599977 NKWTWTWMLNJKDN-VRDGUJSXSA-N 413.518 2.070 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1F 803660769 CMXCKANLWIQEAP-IBGZPJMESA-N 412.509 2.146 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@H]4CCCO[C@H]4C3(C)C)CC2)cc1 804318627 QHWZJOOQAUJOOO-VAMGGRTRSA-N 415.534 2.100 10 20 HECD C[C@H]1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(=O)N1c1cnn(C)c1 806884110 QPDXNOVGCOCNJI-XPTSAGLGSA-N 412.277 2.426 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cnc(CC2CC2)nc1 807387208 DGIXFPSFRBBFOC-UHFFFAOYSA-N 405.252 2.152 10 20 HECD CNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807954468 SQTUAVBPSAZKOC-AWEZNQCLSA-N 422.957 2.081 10 20 HECD CCN(CC(=O)NCCOc1ccc2c(c1)OCO2)c1ccc(OC)c(OC)c1 921062360 XOGOKTXWWYNJSD-UHFFFAOYSA-N 402.447 2.454 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Br)nc1 1116646574 JTUNWMOXRIVJJF-LBPRGKRZSA-N 409.236 2.160 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 1319887696 FPYPBBJDGLFBMA-UHFFFAOYSA-N 418.515 2.012 10 20 HECD CC(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777850620 KNMBOPISNGAUPP-IIBYNOLFSA-N 405.495 2.057 10 20 HECD CC[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)CC1 1846216521 YHJRNSKBQRHMOU-SHTZXODSSA-N 423.604 2.267 10 20 HECD Cc1scc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1C 1847055223 AWCHWHLTQRGOFI-UHFFFAOYSA-N 423.585 2.042 10 20 HECD C[C@@H](NC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc(N2CCOCC2)cc1 141044019 IYZHHUHCLWEDNU-QGZVFWFLSA-N 412.490 2.345 10 20 HECD C[S@@](=O)c1ccc(NC(=O)C2=S=C(S(=O)(=O)c3ccccc3)C=C2)cc1 467532354 ONWNVKCVCGXDFA-RUZDIDTESA-N 405.522 2.442 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN4CCC[C@@H]4C3)cc2F)CC1 730117450 YJZBKZQNGQKWMG-RBUKOAKNSA-N 403.546 2.394 10 20 HECD COC[C@]1(C)NC(=O)N(CN(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 733297931 FERGYCFVZYVIRJ-KRWDZBQOSA-N 402.417 2.031 10 20 HECD CC(C)CS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804946 CXOAJCNMORZVLP-AWEZNQCLSA-N 404.479 2.444 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(OC)n1 743310540 JLRLIFDKOTTZIX-HNNXBMFYSA-N 413.478 2.122 10 20 HECD O=S(=O)(CC[C@@H]1CCCO1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751373514 UIEYNWARVMZHCM-IRXDYDNUSA-N 402.944 2.499 10 20 HECD C[C@H](O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 753110482 YZQVNLZGOVVUJC-DZGCQCFKSA-N 401.429 2.454 10 20 HECD COc1ccc(N2CCN(C(=O)C3CCN(C(=O)N4CCCC4)CC3)CC2)cc1F 753745410 MZELCPRANQOQAO-UHFFFAOYSA-N 418.513 2.411 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1 759221926 SADYHALEMOSXQE-SFHVURJKSA-N 414.462 2.030 10 20 HECD COC(=O)[C@@]1(C)CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 760151888 GLKCPDRVBHFCDL-SFHVURJKSA-N 424.500 2.280 10 20 HECD O=C(COC(=O)[C@H]1C[C@]12CCOC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764640445 QKGKDSCAVYRTTN-JPYJTQIMSA-N 405.406 2.370 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCOC2(CCOCC2)C1 769036123 WXWSKMDMAZUUNU-QGZVFWFLSA-N 421.513 2.314 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCN(C)C3CC3)cc2F)C[C@@H](C)O1 770686254 XBCVKRADALMOIU-CALCHBBNSA-N 406.546 2.082 10 20 HECD CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 772775808 OQFCPPPFMIUQMY-CLFYSBASSA-N 418.833 2.405 10 20 HECD O=C(O)COc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1Cl 775285775 BLBHSEJLQUWNES-UHFFFAOYSA-N 402.768 2.218 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)cc1F 776126615 DTUBXHSJEJQOLA-OAHLLOKOSA-N 410.490 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c[nH]nc4c3)CC2)cc1 778225507 IIQVKDSMVDYWNF-HJWRWDBZSA-N 405.458 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3nc(C)c(C)s3)CC2)cc1 778294393 LSBWZNPXVJSXKA-CMDGGOBGSA-N 414.531 2.290 10 20 HECD CC(C)(C)c1cc(O)c(O)c(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)c1 779869563 JUNODASNENCJPX-KRWDZBQOSA-N 412.552 2.022 10 20 HECD O=C(O)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 780445096 ZLOLEWCBXUBHIW-HNNXBMFYSA-N 401.385 2.301 10 20 HECD COc1ccc(N2CCN(C(=O)COc3cc(OC)c(OC)c(OC)c3)CC2)cc1 784060617 WAIWWXCCDLNKJI-UHFFFAOYSA-N 416.474 2.449 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1c(C)noc1C 788333935 SOONMLGJJMTRTK-SFHVURJKSA-N 400.479 2.012 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c(F)c1 790405632 YJMYCYRLKICCBK-UHFFFAOYSA-N 407.467 2.304 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cccc(C)n3)CC2)cc1 792006601 KHEAYCPYNHJFRF-UHFFFAOYSA-N 411.550 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)c3c(C)nn(C)c3-n3ccnc3C)CC2)cc1F 793632622 LWZUCKWVHSMWFI-UHFFFAOYSA-N 412.469 2.333 10 20 HECD COc1cc2c(cc1S(=O)(=O)Nc1nc(-c3cccnc3)cs1)OCC(=O)N2 797429468 QXAFPOZYMMOSDH-UHFFFAOYSA-N 418.456 2.345 10 20 HECD NS(=O)(=O)Cc1cccc(CNC(=O)NCc2ccc(N3CCCC3)cc2)c1 799884546 PNBWQAPAUZIFQJ-UHFFFAOYSA-N 402.520 2.075 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)c3ncc(C)s3)CC2)cc1 804316780 IZQMNNANGRYIJB-CQSZACIVSA-N 416.547 2.465 10 20 HECD CC(C)[C@@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808853713 CIUMFEDUYNTAQI-GOSISDBHSA-N 400.567 2.338 10 20 HECD Cn1cc(/C=C\C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 917238326 QAQYQRUHDNXZOH-TWGQIWQCSA-N 415.405 2.391 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(F)c(F)c1 918173224 OBSIATOVFRFTPZ-UHFFFAOYSA-N 422.407 2.378 10 20 HECD CN(CCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC(F)(F)F 918210058 QYRCSYLEJXSKRX-UHFFFAOYSA-N 420.451 2.470 10 20 HECD CCCCN(C(=O)CN(CC)c1ccc(OC)c(OC)c1)[C@H]1CCS(=O)(=O)C1 921061630 IWXBRGSKNWCIQO-KRWDZBQOSA-N 412.552 2.346 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cc(Cl)ccn1 1318681338 IXDUXZOULDANQK-INIZCTEOSA-N 403.866 2.378 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)CC2)cc1 1324047628 WGFYWFIIQCXJEH-QGZVFWFLSA-N 407.511 2.008 10 20 HECD CCCCC[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1783225442 OJQZLVOSZDOEKV-VFNWGFHPSA-N 405.495 2.153 10 20 HECD Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843936 JAWSXBGIJBNCGW-CQSZACIVSA-N 410.434 2.472 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1cccn1 1845502273 HSXUYOJZLDCKAZ-LBPRGKRZSA-N 404.854 2.026 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)n(C)c2ccccc12 550376633 OCEZXTSYNXOXEX-UHFFFAOYSA-N 422.485 2.117 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](N4[C@@H](C)CC[C@@H]4C)C3)nc12 729265318 FWCRRKPXZQOFMQ-ZOBUZTSGSA-N 401.511 2.449 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(NC(C)C)CC3)CC2)cc1 732443226 FNLLEWRDCBVBOX-UHFFFAOYSA-N 417.598 2.379 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 743897975 BHIIGWVLHZEKPO-ZDUSSCGKSA-N 417.487 2.187 10 20 HECD CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCSCC2)cc1 745593826 YJCSQJSGJGKBAI-FQEVSTJZSA-N 406.596 2.492 10 20 HECD O=C(NCCCOC1CCOCC1)NCc1ccc(N2CCC(CO)CC2)cc1 745652727 NZENHNBXPYLUTE-UHFFFAOYSA-N 405.539 2.280 10 20 HECD Cc1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nc2nc(O)nc(O)c12 746167270 DCCIRMXYIAIKBR-ZDUSSCGKSA-N 409.446 2.072 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccncc3Br)cc2)C1 763279613 FPYVADTWONWJLO-AWEZNQCLSA-N 417.307 2.476 10 20 HECD Cc1cc(C(=O)NCc2cccc(Br)c2O)cc(S(N)(=O)=O)c1C 765753778 QBWODXGKSKINCY-UHFFFAOYSA-N 413.293 2.349 10 20 HECD CCc1nn(C)c(Cl)c1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 767834028 KOBZOSPGRHYTJD-UHFFFAOYSA-N 420.897 2.150 10 20 HECD Cc1cn2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc2n1 774118108 SINHSIQAFYPBAB-GOSISDBHSA-N 408.458 2.495 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1 774125546 ZUHGFJMVJPAYAS-UHFFFAOYSA-N 400.454 2.368 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)N1CCOCC1 774857062 FMTBYXJHYPCOMU-UHFFFAOYSA-N 417.550 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 778249679 APBHIWVVSAUEOB-MDZDMXLPSA-N 424.457 2.125 10 20 HECD NC(=O)c1ccccc1Oc1ncccc1C(=O)OCC(=O)c1ccc(O)c(O)c1 784066971 OUKKVHHSFLDNAU-UHFFFAOYSA-N 408.366 2.424 10 20 HECD O=C(CN1CCC([C@@H]2CCCO2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 784360807 AAXZUIDHWXXXJD-NRFANRHFSA-N 405.514 2.170 10 20 HECD COC(=O)[C@](C)(CNC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 787261498 KGRKLNMUFLRHBM-HSZRJFAPSA-N 411.502 2.453 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](C)NC(=O)C3CCCC3)cc2)CC1 787319067 JHARXBLTVQPLNH-QGZVFWFLSA-N 414.550 2.056 10 20 HECD COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 788931879 IOPMLJIKMDVAPE-QGZVFWFLSA-N 411.502 2.495 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc[nH]3)cc2F)C[C@@H](C)O1 789826658 PWWHUSJMAZQTIP-RBSFLKMASA-N 402.470 2.261 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789827616 TXPZZBJFQJMYCI-KBPBESRZSA-N 409.527 2.067 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 789835302 KTSBADKLAIZCTA-LBPRGKRZSA-N 418.881 2.440 10 20 HECD CCC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCC1 793716345 CJIZMUIEVQFXTN-GOSISDBHSA-N 414.550 2.091 10 20 HECD COc1ccc(CNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)c(O)c1 794389994 VXIGEIIEOPVMMA-UHFFFAOYSA-N 408.401 2.276 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1 797651368 ZRNGRRFMVUKEMG-ZDUSSCGKSA-N 411.466 2.023 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cccc(N4CCC4=O)c3)no2)c1 798188885 LQAWDNBTMZXYMI-UHFFFAOYSA-N 400.416 2.217 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H]1CCCO1 803678148 ZBXYEUCQTHYBDV-SFTDATJTSA-N 417.550 2.382 10 20 HECD C[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2ccccc21 803909809 CYRRZOWYEBBPSJ-AWEZNQCLSA-N 404.561 2.309 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(N2CCOC2=O)cc1 809428972 MOSNFDSDHWDXLT-UHFFFAOYSA-N 411.458 2.404 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc3c2OCC(=O)N3)cc1 810351376 LBBRKIPJVJCQAT-UHFFFAOYSA-N 410.474 2.461 10 20 HECD COCC[C@H]1COCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 812887058 PUXAWTPZFIRCQS-HNNXBMFYSA-N 408.454 2.138 10 20 HECD CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H]1CC(C)(C)OC1=O 817073334 KVCXNZDEZQYWHI-CYBMUJFWSA-N 424.500 2.421 10 20 HECD Cc1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1-n1cnnn1 915345883 WBOLVJAGYIXJHA-UHFFFAOYSA-N 407.478 2.471 10 20 HECD O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NCCc1ccc(O)c(O)c1 917356465 TWKQQHNUSOELEL-UHFFFAOYSA-N 419.286 2.042 10 20 HECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(OC)c1OC 918304167 PQWLOQVMLBEGCW-UHFFFAOYSA-N 401.463 2.376 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc(OC)c(OC)c1 1261909218 MWIFWXFUYGLUOY-BJIFSAINSA-N 415.442 2.419 10 20 HECD Cc1ncncc1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1317945467 BGBRIYRSWKZYSP-UHFFFAOYSA-N 401.378 2.356 10 20 HECD CCN1CCOC[C@H]1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1337093404 HIMMKBAVUFFMMS-OALUTQOASA-N 420.554 2.155 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc2sccn2c1 1796600686 ZMVKFRJFRQJITM-QDMKHBRRSA-N 412.471 2.373 10 20 HECD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)nc1 1808596196 WRADJSISCFXREZ-UHFFFAOYSA-N 410.474 2.355 10 20 HECD CC(=O)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822338711 CYWGMYWZNIKNRZ-IAQYHMDHSA-N 415.450 2.137 10 20 HECD O=C(c1ccnc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249302 URUCHRGFBOZUKV-UHFFFAOYSA-N 422.363 2.037 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(F)cc3F)CC2)cc1 56966087 NDXXGHBSZPANAG-UHFFFAOYSA-N 411.474 2.074 10 20 HECD COc1cccc(CNCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c1O 725848610 YWNZWCFXKQJDEO-GOSISDBHSA-N 400.475 2.365 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1csc(-c2cnccn2)n1 728378398 FWODCRDITASCJT-UHFFFAOYSA-N 411.487 2.482 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3OCCc4ccccc43)CC2)cc1 733345834 PIPFCRYMVPWWAV-QHCPKHFHSA-N 424.545 2.430 10 20 HECD CC(C)(C)c1nnc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 738902718 HBWWGUOXSYOQIU-UHFFFAOYSA-N 423.564 2.392 10 20 HECD CCN(CC)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 745690506 CHUIPSFUZRZTAH-AZUAARDMSA-N 401.555 2.014 10 20 HECD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CN2CCOc3cc(N(C)C)ccc32)n1 746497552 PETJAHDTMMKDES-UHFFFAOYSA-N 421.505 2.491 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)S(C)(=O)=O)cc2F)C[C@H](C)O1 748961334 RLJSSLLGVPRMOJ-KBPBESRZSA-N 415.531 2.062 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC3(CO)CCCCC3)cc2)C1 752878845 GSWMOGQWMDOZOS-SFHVURJKSA-N 402.539 2.130 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccccc1F 753121356 HKPCTFXAFSHJPF-HXUWFJFHSA-N 412.465 2.045 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)N3CCc4ccccc4C3)CC2)cc1F 754039678 CDWPQJCPFUZZHJ-UHFFFAOYSA-N 405.495 2.259 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCCc3c[nH]c4ccccc34)CC2)cc1 758184029 DKEGPLWPMIXOQY-OAQYLSRUSA-N 408.546 2.492 10 20 HECD COc1cc(N2CCN(CN3C(=O)[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]43)CC2)cc(OC)c1OC 758965673 SSXQMOIZPICBCK-QPAVJXABSA-N 401.507 2.049 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@]12CCCO2 759319708 PPLYOFFWKCRSLU-TUNNFDKTSA-N 403.523 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@@](C)(c4ccccc4)C3=O)CC2)cc1 763356560 UULYVLVXSFMLQP-DEOSSOPVSA-N 421.497 2.061 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@@H]2C1 766270678 KRYSXSGKAXTQFG-LSDHHAIUSA-N 417.465 2.096 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3cccc4c3OCO4)cc2)C1 769893363 KCWFNSBAFPMMOT-SFHVURJKSA-N 409.486 2.366 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N(C2CCCCC2)[C@H]2CCS(=O)(=O)C2)c1 775372735 HLKOGFTUFJMVNC-WBVHZDCISA-N 424.563 2.400 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)NC(=O)OC(C)(C)C 777825993 DISKLFOYNLKDBN-NSHDSACASA-N 400.859 2.460 10 20 HECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1S(=O)(=O)NC(C)(C)C 778923527 RFPWRNWHZRIOAV-UHFFFAOYSA-N 408.476 2.113 10 20 HECD C[C@@H]1C(=O)CC[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1(C)C 780404601 IQVZWBASVUTXCS-CRAIPNDOSA-N 406.548 2.179 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4CCCO4)CC3)cc2)C1 784477910 IFUGHKSFBVFCAS-TZIWHRDSSA-N 414.550 2.489 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(-n2cncn2)cc1 785394886 DXCSYAAGFUOBJK-KRWDZBQOSA-N 416.485 2.137 10 20 HECD COc1ccc(C[C@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785439851 XGRSNLSIMOPQJA-INIZCTEOSA-N 413.518 2.381 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc4cnccc34)cc2)CC1 786121164 BPLQPOQTBALCHU-UHFFFAOYSA-N 424.526 2.382 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1 788954802 PYZJYSXRVCESEX-KRWDZBQOSA-N 413.497 2.078 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCOC3CCCC3)cc2F)C[C@H](C)O1 789817192 GUOHTPVUFYCULT-HOTGVXAUSA-N 421.513 2.131 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C1CCOCC1 789855025 NQNVWPWTTLTUSH-IBGZPJMESA-N 405.564 2.177 10 20 HECD COC(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 792406365 JCBWWPNGNGMUPH-UHFFFAOYSA-N 416.453 2.219 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)c1cn(C)nc1C 793754973 FQZNMYAXBVKGNZ-LLVKDONJSA-N 423.311 2.423 10 20 HECD CC[C@](C)(OC)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 795015461 RWKILPYYBAOGFS-NRFANRHFSA-N 401.486 2.374 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(S(N)(=O)=O)oc1C 798332911 TVOZXKIVRVPSRC-UHFFFAOYSA-N 417.281 2.366 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cccc(S(=O)(=O)NCc2ccco2)c1 798333975 IXLMJSGCBANNML-UHFFFAOYSA-N 402.428 2.099 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)cc1 806952125 WBXCASKJXPRCOM-GOSISDBHSA-N 403.523 2.196 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(C(=O)NCCOC)c1 807006885 UMVRVVRIRDQNJA-UHFFFAOYSA-N 413.474 2.146 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)C(F)(F)F)CC2)cc1F 807032276 DWSQAQNVHRALJD-CQSZACIVSA-N 403.376 2.036 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3noc(COC(C)C)n3)CC2)cc1 810119866 XJTUUWWWYOHSIX-INIZCTEOSA-N 417.510 2.003 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@@H](CO)c4ccccc43)CC2)cc1 817783143 RLDJBCZOBZAEAF-ZGKFYVQTSA-N 421.497 2.023 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3c4ccccc4C[C@@H]3O)CC2)cc1 916196822 PVDRVCLHUUFQRK-GOTSBHOMSA-N 424.545 2.165 10 20 HECD CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 920636799 LVYHKEJHOWJCIP-GFCCVEGCSA-N 422.459 2.339 10 20 HECD CCN(CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O)c1ccc(OC)c(OC)c1 921061269 APDQLNRNGFHPIE-UHFFFAOYSA-N 418.494 2.062 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc1 1116410145 VGTVJWXZIQHPMP-UHFFFAOYSA-N 417.531 2.298 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCCCO1 1814505071 IJWKLJZKNSTWPJ-LSDHHAIUSA-N 415.450 2.091 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccsc2)C1 1842381775 OMNYCMAKIXKNDJ-HWKANZROSA-N 400.456 2.395 10 20 HECD Cc1ccc(O)c(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1844885403 JYNUPHNESLMUSN-VMPITWQZSA-N 424.453 2.348 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(-c3ncc[nH]3)cc2)C1 1846859159 QFEKCEWAGMQNDC-UHFFFAOYSA-N 419.441 2.014 10 20 HECD Cc1ccc(CC(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 725812543 LWTXWLYWJKLXNA-UHFFFAOYSA-N 408.546 2.064 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1 729065345 DDADMNKUHQPXRA-GFCCVEGCSA-N 422.445 2.205 10 20 HECD CN(C)c1ccc(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1F 733324624 OIKZRUVKVVPOKR-UHFFFAOYSA-N 421.538 2.344 10 20 HECD COC(=O)CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 733613530 AKXLJFRFKHXYQM-IRXDYDNUSA-N 423.529 2.329 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCN(CCN2CCOCC2)C1 734467973 NQRSZDSCVMVBKG-SFHVURJKSA-N 402.564 2.292 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)CC2)cc1 735749840 MAWXAEFQLUNPLV-UHFFFAOYSA-N 422.482 2.226 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c(OC(F)F)c1 737283988 JGRZALTURKTEGE-UHFFFAOYSA-N 424.356 2.044 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccc(F)c2)no1 743800150 SSOCYDJYTHIWGP-SNVBAGLBSA-N 420.422 2.444 10 20 HECD CS[C@@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752152058 UCFBYSQLJLNKIQ-HNNXBMFYSA-N 418.542 2.493 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3Br)nc12 756247625 ZMPHJMKAKDLQSG-UHFFFAOYSA-N 421.207 2.126 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(OC)cc(OC)c3)CC2)cc1 758224589 PKBATZFLHSBWET-SFHVURJKSA-N 402.491 2.274 10 20 HECD COc1cccc(CNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1O 775518813 ZCNWGCTXPKOVCX-UHFFFAOYSA-N 409.439 2.302 10 20 HECD CO[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 780201967 ZAVYHHODKLSVJA-OAQYLSRUSA-N 416.449 2.209 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 780822294 ZLZNPJMHUIFJCP-BFYDXBDKSA-N 418.513 2.249 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 782104978 OEVXJPNSNSQUFU-UHFFFAOYSA-N 415.465 2.298 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c(OC)c1 782113357 WZFZOZKOKIPSLH-UHFFFAOYSA-N 412.442 2.321 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2 785295582 WVMZUCDZNRHSPY-AWEZNQCLSA-N 420.469 2.458 10 20 HECD CSc1ncc(Cl)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)n1 786260031 VBNJZNFYFLHEFS-UHFFFAOYSA-N 419.938 2.450 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc4c3O[C@H](C)C(=O)N4)cc2)CC1 786659486 LFMSBIMBFIVALY-OAHLLOKOSA-N 422.485 2.005 10 20 HECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787318485 FLLNDXLEAFXYDO-LJQANCHMSA-N 418.538 2.275 10 20 HECD O=C(NCCN1CCCc2ccccc21)C(=O)NCc1ccc(N2CCCC2)cc1 788911157 PHHKJBNYSMKWRZ-UHFFFAOYSA-N 406.530 2.472 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c1O 789518267 WNIHDKOMOLPAKU-UHFFFAOYSA-N 416.384 2.334 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c(O)c1 797389833 APTDIZBPAOYRKN-MHZLTWQESA-N 410.879 2.188 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)[C@H](C)[C@H](C)C(=O)OC)ccc21 802153105 HXDJTDVGUJVZSY-DZGCQCFKSA-N 424.519 2.162 10 20 HECD COc1cc(F)cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803303446 NLUBBRGTECHGPA-HNNXBMFYSA-N 415.465 2.165 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCO[C@@H](C2CC2)C1 803451751 UXGVBPRTTSEYFS-GOSISDBHSA-N 423.460 2.010 10 20 HECD COc1cccc2c1CC[C@H]2NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 804530013 RDWWIEIKPCNXRX-OAQYLSRUSA-N 423.513 2.294 10 20 HECD O=C(NC[C@@H]1CSCCS1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806479434 XPUCULXQBFZUNU-MRXNPFEDSA-N 406.529 2.479 10 20 HECD CS[C@@H]1CCC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 807204868 JCXGIKHEXLNDLR-IEBWSBKVSA-N 405.564 2.272 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(Cc2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 807670515 GBMPTXUHELRRGM-KRWDZBQOSA-N 412.509 2.413 10 20 HECD O=C(CCNC(=O)c1ccc(Br)cc1)OCC(=O)c1ccc(O)c(O)c1 916595501 NCDXSQRRXYHQBR-UHFFFAOYSA-N 422.231 2.406 10 20 HECD Cc1nn(C)c2ncc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc12 918296488 KIYLOIXKSLWSSN-QGZVFWFLSA-N 423.473 2.129 10 20 HECD O=C(COC(=O)COCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 918994679 SLPRTHXXSBZCFX-UHFFFAOYSA-N 416.449 2.039 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)ncn4C)CC2)cc1 1319824256 NVSMIODWHHKDLU-UHFFFAOYSA-N 400.504 2.483 10 20 HECD CN1CCN(c2ccc(CNC[C@]3(O)CCN(Cc4ccccc4)C3)cc2F)CC1 1323122776 BLGMPDLPJZDUEI-XMMPIXPASA-N 412.553 2.304 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)c1ccc(Cl)cc1F 1324063793 YMTPSDQHLOUOKR-YOEHRIQHSA-N 411.813 2.214 10 20 HECD C[C@H](CN)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809652663 AUQUZEPHRUFDMT-CYBMUJFWSA-N 409.914 2.191 10 20 HECD C[C@@]1(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1(F)F 1810549847 DZBCIHIOIJNGNW-SFHVURJKSA-N 409.433 2.383 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc4ccccc4c3=O)cc2F)C[C@H](C)O1 108164674 RFBZIOATFVFJQQ-HOTGVXAUSA-N 424.476 2.466 10 20 HECD Nc1ccc(CC(=O)N2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)cc1 238071100 TUBPVSTWYPRSFH-UHFFFAOYSA-N 409.511 2.498 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c1C 730655717 AXZHZJMVGLJWMK-UHFFFAOYSA-N 419.441 2.213 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1 734703587 PTQZQERFRSQYHI-UHFFFAOYSA-N 422.485 2.278 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(N2C(=O)CCC2=O)cc1 736195613 JLOSLNUBOBUEMS-UHFFFAOYSA-N 421.497 2.479 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 736334953 XVNVUMCVLLBAMP-MRXNPFEDSA-N 418.515 2.490 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1 737182328 GGFVUFKGMRSNCU-CYBMUJFWSA-N 410.430 2.416 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1O 737283615 CZXUCJVCKVCWMA-UHFFFAOYSA-N 411.458 2.200 10 20 HECD O=S(=O)(CC1CCOCC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 742301734 XUJPHOCPWZJQMR-QGZVFWFLSA-N 402.944 2.356 10 20 HECD CC(C)(C)OC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 746751573 SDOYQRQNEOLFEL-SFHVURJKSA-N 421.563 2.492 10 20 HECD COCCn1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 748023407 CKYGUNOZHQSJQK-UHFFFAOYSA-N 422.488 2.350 10 20 HECD COc1cccc(CNS(=O)(=O)c2ccc(I)cc2)c1O 751306728 VAHVNGDHGSGDNA-UHFFFAOYSA-N 419.240 2.484 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1 752005163 NXEHCLLIZSOAKV-HRAATJIYSA-N 401.511 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4nc(O)oc34)CC2)cc1 752991648 YAXKLCQGNNWMCK-KTKRTIGZSA-N 422.441 2.386 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2)CC1 755304419 PFCAMSMHYKBNBH-LJQANCHMSA-N 415.446 2.082 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)Nc1ccc(CN2CCOCC2)cc1 759590310 WOBWDRMAFSWUIV-XBXARRHUSA-N 412.442 2.125 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 759603667 ZLLHWOFJMQAJPE-FCEUIQTBSA-N 405.583 2.361 10 20 HECD C[C@H](OC(=O)c1cncnc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 760803789 KCLIAUPXWRHVRO-LBPRGKRZSA-N 401.378 2.436 10 20 HECD O=C1N[C@H](c2ccc3c(c2)CCO3)C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 761093763 UAJCRMQUQXMRRD-HXUWFJFHSA-N 411.433 2.390 10 20 HECD CCOC(=O)c1c(NC(=O)CN2C[C@H](O)C[C@H]2CO)sc(C)c1-c1ccccc1 764980653 LXNIMTDPKKMOCC-JKSUJKDBSA-N 418.515 2.266 10 20 HECD O=C1CCc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2N1 765902717 CCJNTXDRPXWKIR-UHFFFAOYSA-N 418.247 2.294 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4nc[nH]n4)cc3)CC2)cc1 771105443 UWEHOUYRTUDTPJ-UHFFFAOYSA-N 420.517 2.422 10 20 HECD CC(=O)CCCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 772370133 FAMNSWNFKZPKFF-IYBDPMFKSA-N 408.470 2.358 10 20 HECD O=C1NC(=O)C2(CCC(NC3CCN(c4ccc(OC(F)F)cc4)CC3)CC2)N1 776153877 IHVBGTKGCHQYTD-UHFFFAOYSA-N 408.449 2.367 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCN(Cc2ccccc2)C1 779009869 GETROWPKALPWTJ-DOTOQJQBSA-N 417.531 2.404 10 20 HECD Cc1nn(CC(C)C)c(C)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 783812678 VCJROLLHVKDMIJ-UHFFFAOYSA-N 400.526 2.328 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2NC(=O)O[C@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 786069286 MTGUPXOFGFDDJW-ORAYPTAESA-N 414.414 2.088 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccccc4O[C@@H](C)C3)CC2)cc1 795411089 AGZNXNGNINADED-SIKLNZKXSA-N 411.546 2.461 10 20 HECD COC1CCC(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803309248 SLZWMDPMFKOFNX-ZRZPHAQCSA-N 403.523 2.022 10 20 HECD C[C@H]1COCCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448933 IOPVOZDKYJHCEE-AWEZNQCLSA-N 411.449 2.010 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](CN4CCCC4)C3)cc2)CC1 805023478 HPWRYMTUFXKGMN-OAQYLSRUSA-N 412.578 2.483 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 808543533 IXWUNDSOWAQGNS-UHFFFAOYSA-N 420.399 2.019 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N3CCN(c4ccccc4)CC3)CC2)cc1 812478032 MTIYPNSLQKNEGD-UHFFFAOYSA-N 422.529 2.083 10 20 HECD CCC(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 914671621 AGXKTHCWRMBYDZ-QWHCGFSZSA-N 422.437 2.247 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 918304041 MLCNJXLBPHUQOR-UHFFFAOYSA-N 419.489 2.338 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(N2CCNC2=O)c1 918307343 TVHHVHQWGRSICA-UHFFFAOYSA-N 409.490 2.269 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCCN(c4nccs4)CC3)CC2)cc1 920760543 SKYAZGVUBZFNGA-UHFFFAOYSA-N 415.563 2.013 10 20 HECD COCCN1C(=O)/C(=C/Nc2cc(C)nn2-c2cccc(Cl)c2)C(=O)NC1=S 920979664 GGFUSJLHLXTSAE-GXDHUFHOSA-N 419.894 2.020 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 1319733456 NFOCQPGVZFSUHS-UHFFFAOYSA-N 417.531 2.312 10 20 HECD C/C(=C/C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)C(=O)O 1792258037 YXMSCTKZWCGCPW-XFXZXTDPSA-N 411.414 2.271 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3ncccc23)C1 1843633341 AEZPJNSEMFSTMJ-UHFFFAOYSA-N 404.426 2.172 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)n(C)c2ccccc12 472805802 REZYFLQDBVOKET-UHFFFAOYSA-N 405.458 2.485 10 20 HECD O=C(NCCN1C(=O)Cc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 725863846 JCDIYKRFEMICRI-UHFFFAOYSA-N 412.465 2.051 10 20 HECD CN1CCCc2cc(CNC(=O)CSc3nnnn3CC(F)(F)F)ccc21 729948814 MTFQXPPZBKAHLW-UHFFFAOYSA-N 400.430 2.026 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1 735518151 IPZXRIJCLYTNBI-IAGOWNOFSA-N 413.522 2.367 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)nc3)cc2F)CC1 737187949 JHDQPYUWDLTXTO-UHFFFAOYSA-N 419.888 2.271 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H](CCO)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741788705 ZSQHQOIWJUDSCU-KRWDZBQOSA-N 419.547 2.019 10 20 HECD COc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)cc(OC)c1OCC(N)=O 743718526 FQNCQICSAYPRHH-UHFFFAOYSA-N 414.458 2.082 10 20 HECD CNC(=O)[C@H](C)CN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747967787 YKMPGZLVVXEGBI-KGLIPLIRSA-N 407.470 2.103 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 748961859 XHVZXBOWCRETAK-CTNGQTDRSA-N 417.598 2.331 10 20 HECD O=C1OCc2ccc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc21 751238846 DWCMPKIJHAIIFP-UHFFFAOYSA-N 416.499 2.044 10 20 HECD O=C(CN(CCO)Cc1cccnc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 754799611 MLICPDYWWAYNIG-UHFFFAOYSA-N 415.449 2.290 10 20 HECD O=C(COC(=O)c1cc(F)c(O)c(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 759543239 YNEJZAFYBDAKLB-UHFFFAOYSA-N 424.375 2.119 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1 761041103 BCOIYJVFNITPDN-UHFFFAOYSA-N 408.502 2.416 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc1OC 768442401 USHMAIFOLZCDPI-UHFFFAOYSA-N 400.431 2.096 10 20 HECD CN(CCCOc1cccc(S(C)(=O)=O)c1)Cc1cc2c(cc1O)OC[C@@H]2O 768443900 IRQQSXPNOHPFJX-IBGZPJMESA-N 407.488 2.122 10 20 HECD CC(C)N(CC(=O)Nc1ccc(F)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769652798 MEKDJZDMFQANMR-UHFFFAOYSA-N 423.466 2.392 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccn(C(F)F)n4)n3)CC2)cc1 771054630 BSUBTMRNJDUEBA-UHFFFAOYSA-N 418.404 2.228 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@@H]4CCCO4)n3)CC2)cc1 771055565 GEUDAZJWTLJKNA-SFHVURJKSA-N 400.479 2.081 10 20 HECD COC(=O)Cn1cc(CCOC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nn1 772672221 YKNYBCGVJYDAJZ-UHFFFAOYSA-N 400.410 2.397 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cc(Br)c(=O)n(C)c1)c1ccc(N(C)C)cc1 773847747 OORALZMEGUAJLL-LLVKDONJSA-N 421.295 2.030 10 20 HECD COCCCN(C(=O)/C=C/c1scnc1C)c1c(O)nc(=O)n(CC(C)C)c1N 776742122 DCDJCHXJCCPYJM-VOTSOKGWSA-N 421.523 2.035 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCOc3ccc(F)cc3)CC2)cc1 779213618 GQFCFSJQZLIULE-NRFANRHFSA-N 417.525 2.328 10 20 HECD CCOc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1S(=O)(=O)N(C)C 779476020 SSPVQZZUVLDHAM-POHAHGRESA-N 406.460 2.399 10 20 HECD COCc1noc([C@@H](C)SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 783907278 WJOIUMYZDZIFRE-CQSZACIVSA-N 406.508 2.368 10 20 HECD CCOC(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785302736 FOYLHMXOQWHGJW-GFCCVEGCSA-N 401.419 2.352 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCOC[C@H]3CCCO3)cc2)CC1 785563481 RXDWYZIOOSSAIJ-OAQYLSRUSA-N 417.550 2.241 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(NC(C)=O)cc3)CC2)cc1 786230012 KBNJZUMOKINGLB-UHFFFAOYSA-N 424.501 2.055 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 788187115 JVQFILFEPUEZQV-HOTGVXAUSA-N 414.481 2.075 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)NCCCC3CCCC3)CC2)cc1 788220946 XBXCHQAEKCRHDF-UHFFFAOYSA-N 416.566 2.020 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(-c4ncn(C)n4)c3)CC2)cc1 788825137 BKTPBFGVZJTGPD-FQEVSTJZSA-N 423.517 2.053 10 20 HECD CC(C)C[C@@]1(CO)CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 789514250 SBMLHDZLWIVDGX-JOCHJYFZSA-N 407.530 2.152 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC(=O)N(C2CC2)C1 790500929 IAUMBOMODZRGOR-UHFFFAOYSA-N 412.412 2.016 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C)O[C@@H](C4CC4)C3)CC2)cc1 792056909 ITXNUYKHARCHQL-LAUBAEHRSA-N 402.539 2.026 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc4n[nH]cc4c3)CC2)cc1 796123198 BKBYPHXFVIZISX-UHFFFAOYSA-N 408.458 2.006 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1C(N)=O 796680448 NYQMFVPJQKNHMH-UHFFFAOYSA-N 412.490 2.236 10 20 HECD COc1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 799775694 JKUDIQLQFLONLK-HNNXBMFYSA-N 411.911 2.392 10 20 HECD CS(=O)(=O)[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 800709107 ACAYEPNDKVLJRJ-XJKSGUPXSA-N 417.478 2.085 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 802609560 DCTCPZDKEUCPDI-UHFFFAOYSA-N 409.446 2.135 10 20 HECD CCOCCC1(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803312529 YQLAOMGEXWNTDD-QGZVFWFLSA-N 403.523 2.023 10 20 HECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665053 WANADLLAXFBUQX-INIZCTEOSA-N 401.438 2.157 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 804318626 QHWZJOOQAUJOOO-AQNXPRMDSA-N 415.534 2.100 10 20 HECD CCC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(N)=O 804808791 KXWWPHVDLSRRMD-IXJPEXDMSA-N 411.574 2.500 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 805008849 ILFHSTPLSAPFHC-AWEZNQCLSA-N 411.505 2.177 10 20 HECD Cc1cccc(OC[C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 920043030 DYRYDRIYSQVCDJ-SFHVURJKSA-N 417.481 2.210 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1-c1nc(C)no1 1323859692 KFMLYDJRTIMDHK-INIZCTEOSA-N 411.414 2.360 10 20 HECD CC(C)(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423820 JMKXFEZGTOYCKQ-QFBILLFUSA-N 419.522 2.133 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)on2)C1 1840994069 FDIARNZGCRTNTB-UHFFFAOYSA-N 420.425 2.279 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1 1842475364 BXAIXYWINKIBEU-UHFFFAOYSA-N 422.363 2.037 10 20 HECD O=C(c1cccc(F)c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442422 JPLYZJLAXVTTGT-UHFFFAOYSA-N 420.444 2.436 10 20 HECD CNC(=O)COc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c(C)c1 484842526 NCCJWTGDIWTXID-UHFFFAOYSA-N 422.485 2.175 10 20 HECD CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@H](c3nn[nH]n3)C2)C1 579311866 SMOMYOZVIBVLJN-INIZCTEOSA-N 407.522 2.327 10 20 HECD C[C@]1(c2ccc(CNCc3cc(Br)ccc3O)cc2)NC(=O)NC1=O 726189820 MYIGTLOCFLBBQV-GOSISDBHSA-N 404.264 2.499 10 20 HECD C[C@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 726707627 FCPNQIWTRZVOQB-SFHVURJKSA-N 422.529 2.468 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2O1 732479006 RNEIGUCKIFVXOU-QGZVFWFLSA-N 423.513 2.326 10 20 HECD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCCCSc1nccs1 733973293 YTIJXNPVEJSVEK-UHFFFAOYSA-N 403.526 2.249 10 20 HECD CN(Cc1ccc(S(C)(=O)=O)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 740908969 FQZUTIRFZFBUCT-UHFFFAOYSA-N 417.531 2.268 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3cccc(O)c3)CC2)cc1 760608345 WFZUOADCLBDQDA-QXPKXGMISA-N 409.486 2.483 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC1(O)CCS(=O)(=O)CC1 767998647 KOPLZDQCONZKFZ-UHFFFAOYSA-N 424.544 2.373 10 20 HECD CCOC(=O)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)cc1 769732083 FXIJAOMTNOCUJT-INIZCTEOSA-N 424.450 2.327 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cccnc1I 770487074 OFSYADMIKOOJTN-UHFFFAOYSA-N 423.254 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccn(C(C)C)n4)n3)CC2)cc1 771058775 WFCXRBPBSNZGIM-UHFFFAOYSA-N 424.505 2.338 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C(=O)NCc1ccc(F)cc1 777826044 GFBDRYLHKJMMLJ-UHFFFAOYSA-N 408.813 2.003 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 779513250 GCGVIZRHJWGZDH-DZFYGRHCSA-N 420.462 2.220 10 20 HECD O=C(NCCc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 786693584 ZQDUUQCYHPUOLY-UHFFFAOYSA-N 419.884 2.291 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCC2=O)c1)c1ccc(N2CCOCC2)cc1 790915827 NKZUQWQBKVLJGU-INIZCTEOSA-N 422.485 2.076 10 20 HECD COc1ccc(CNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(O)c1 794369611 IHFAZFGJYVMWMI-FGTMMUONSA-N 400.475 2.383 10 20 HECD O=C(COC(=O)C1CCC(O)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 795651538 VCVHQLHFQARNCF-UHFFFAOYSA-N 407.422 2.495 10 20 HECD CC[S@@](=O)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803471488 CPCXZWVKWBISSX-WUTCKBNWSA-N 413.451 2.101 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)ccc21 803685825 MLYZGLKSYKZURY-SIKLNZKXSA-N 410.562 2.161 10 20 HECD COc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803685978 RMOFVNICPAKOQX-UHFFFAOYSA-N 411.502 2.231 10 20 HECD CC[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007918 UWRXJZFDLUKYHR-GOSISDBHSA-N 404.530 2.375 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1 805326633 RDDTYLAWKUISSN-DZGCQCFKSA-N 422.528 2.405 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1 807098870 DKOAIVRGNGUENW-UHFFFAOYSA-N 403.486 2.451 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1nn(C)c2ccccc12 809321295 UZZOXYAHSDJLFZ-UHFFFAOYSA-N 407.518 2.347 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC(O)(c4ccccc4)C3)cc2F)CC1 812032703 KMNSLYRVIXZTOA-UHFFFAOYSA-N 412.509 2.381 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)cc2)C1 917835090 ZDOOARSQXBCMLS-RBUKOAKNSA-N 420.513 2.058 10 20 HECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 918266581 QFPIGZGMVOTVMK-UHFFFAOYSA-N 404.474 2.431 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 919155124 WHQLSZAFERMGKV-UHFFFAOYSA-N 407.488 2.190 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)O)c2)cc1 920482567 SWVZXORBZFOYIT-UHFFFAOYSA-N 404.491 2.399 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](c3nc(C)no3)C2)c1 921050327 ZWMIRPBGFIKOSF-QGZVFWFLSA-N 414.506 2.498 10 20 HECD Cc1ccc(SCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843249399 GQCLXVWGYHQJBA-UHFFFAOYSA-N 413.499 2.411 10 20 HECD CC(C)n1cnc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845501251 RMJOQPGNEHVKCG-UHFFFAOYSA-N 419.869 2.054 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc1 139088664 ITOULJFDJLOEMM-UHFFFAOYSA-N 403.429 2.442 10 20 HECD COc1ccc(CN2C[C@@H](C(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 726497349 PXDTXOGQUPIANQ-IBGZPJMESA-N 423.513 2.401 10 20 HECD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NCc2ccc(N(C)C)c(F)c2)c1 727602694 XXGSXLGYIPBJBA-ZDUSSCGKSA-N 408.499 2.360 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1 729061384 CGCYSXLZJPRWJA-ZDUSSCGKSA-N 417.437 2.192 10 20 HECD CCN(CC)c1ccc(CNC(=O)CSc2nnnn2CC(F)(F)F)cc1 729947130 KLCUWOBWJKKPOB-UHFFFAOYSA-N 402.446 2.490 10 20 HECD CC1CCN(c2ccc(CNC(=O)CN(C)S(=O)(=O)c3cccnc3)cc2)CC1 731015779 GHMRZISQLURWSO-UHFFFAOYSA-N 416.547 2.255 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc4c(nc3O)CCCC4)CC2)cc1 731620192 SIEQJWVGYOYDQY-UHFFFAOYSA-N 410.518 2.227 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)ccc21 737165266 DBIPNDKJRUXZQL-UHFFFAOYSA-N 408.437 2.044 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](CN3CCCC3)C2)c1 739874073 AMSPYYGGAZBRQN-LJQANCHMSA-N 401.551 2.345 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1F 743207169 ZLSUEZHGGKWGNQ-UHFFFAOYSA-N 411.503 2.235 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3c(C)nc(O)nc3SC)cc2F)CC1 747382782 ARHCMGLXANDOEN-UHFFFAOYSA-N 419.526 2.424 10 20 HECD CCc1ccc(O)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 748922200 XVDPGOYAVHRJSO-UHFFFAOYSA-N 416.449 2.404 10 20 HECD O=S(=O)(C[C@H]1CCCCO1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751358706 GCYFPQMZUUMXCT-DLBZAZTESA-N 402.944 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c(F)cccc3F)CC2)cc1 756634022 XAGCNHJUDFLDDL-UHFFFAOYSA-N 404.413 2.408 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc(F)n1 763984864 YAMOTYOCPHXCSQ-UHFFFAOYSA-N 410.428 2.406 10 20 HECD CC(C)CS(=O)(=O)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912817 RHQWXVFGMJNZRQ-INIZCTEOSA-N 402.944 2.197 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)CC1 770143624 QHCDKRHVZBQVSE-UHFFFAOYSA-N 416.547 2.331 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 770254699 NBPPGWAGMMXOSS-OAHLLOKOSA-N 418.471 2.387 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(-c2ccccc2)n1 772609272 JUXPNFAKJUNYCO-UHFFFAOYSA-N 424.526 2.252 10 20 HECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C(C)C)cc1 773739998 IEUHDFMSPDFGLA-YWZLYKJASA-N 420.531 2.457 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1O 774911584 HROMHJXASQMPET-IUODEOHRSA-N 411.455 2.423 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 781522952 HZMITBBDPGQHPD-UHFFFAOYSA-N 412.442 2.321 10 20 HECD C[C@@H](c1ccccc1)N(C(=O)C(=O)Nc1cccc(C(N)=O)n1)c1ccc(N)cc1 783483158 OEFIECYDILSQJF-AWEZNQCLSA-N 403.442 2.496 10 20 HECD COCCOC(=O)CSCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783530731 ZCZYNNCAOOLISG-UHFFFAOYSA-N 413.451 2.323 10 20 HECD O=C(CN1CCC([C@H]2CCCO2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 784360812 AAXZUIDHWXXXJD-OAQYLSRUSA-N 405.514 2.170 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 784703708 XXLCSVVPIMRSJE-ZDUSSCGKSA-N 416.430 2.159 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1O 787500157 RHHGFWXKCUWARY-UHFFFAOYSA-N 413.474 2.445 10 20 HECD COC(=O)[C@@H](C)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 802166667 HNQFMEMWNKSHCK-DZGCQCFKSA-N 422.503 2.360 10 20 HECD COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 804975078 CUSBPGRBCYWYGL-GOSISDBHSA-N 415.412 2.160 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CSc2ccccc21 806154019 ZVZMBGKSYLXNCF-LJQANCHMSA-N 411.527 2.445 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@]2(CCc3ccccc32)C1 807290285 HBJCEAJWGHKZFR-RUZDIDTESA-N 417.509 2.380 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1C 807384930 AAVSVRCIPZNDIW-UHFFFAOYSA-N 420.263 2.078 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1nccn1CC(F)(F)F)c1ccc(N(C)C)cc1 807673650 XGQOWEPDBDTCBB-CYBMUJFWSA-N 411.428 2.347 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H](c1cccnc1)C1CC1 808293999 MFJMENQDBOYLBM-NRFANRHFSA-N 408.502 2.144 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc2c1COC2=O 808944828 VSTDTKDJYLXHRY-UHFFFAOYSA-N 405.204 2.080 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]1[C@H]1CCCO1 812010199 MXZAKRYJYJRGDO-SXLOBPIMSA-N 414.550 2.487 10 20 HECD CCOCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313780 FKQRLKKEVSMVMQ-UHFFFAOYSA-N 421.544 2.017 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc(O)no1 1800716694 WBEBHGQWDBDNMW-JGPRNRPPSA-N 407.810 2.010 10 20 HECD C[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831647308 PTZDDOYYNOBZJS-LRDDRELGSA-N 410.898 2.365 10 20 HECD Cc1ncc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1843594057 KNTJFVJMZINDBS-UHFFFAOYSA-N 423.498 2.061 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)n1cccc1 1846540773 QRFJRZDJLCGHBT-KRWDZBQOSA-N 419.485 2.045 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(F)c1F 1846817301 SSOJBYQAVSOWTC-UHFFFAOYSA-N 403.385 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc(C)ccc3OC)CC2)cc1 26682761 GUUJEOSYSZMGRF-UHFFFAOYSA-N 412.486 2.447 10 20 HECD CC[S@@](=O)c1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 195632126 IPZFJVYKLKMVNY-AREMUKBSSA-N 406.529 2.301 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cc(O)cs2)NC(=O)N[C@@H]1c1ccccc1 731910959 XNVWZGZIUFEFLM-MRXNPFEDSA-N 402.428 2.482 10 20 HECD CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 732204819 DXHFQGXETUSNQE-DMPWYTOCSA-N 423.529 2.377 10 20 HECD CC[C@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H](C)O1 732443565 HYBHMGYTJOTHMM-QUCCMNQESA-N 404.555 2.416 10 20 HECD C[C@H](CS(C)(=O)=O)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 732700601 JQUNXTCAFZPEGG-CYBMUJFWSA-N 419.494 2.331 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)c1cccc(F)c1 734660648 UACNRTOGRUHDDR-IBGZPJMESA-N 405.445 2.459 10 20 HECD CC[C@@H](COC)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 738548784 MVDZTIGOTLDBCE-LBPRGKRZSA-N 423.447 2.256 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3nnc(C(C)C)o3)CC2)cc1 747067778 NYMFHLOEQCZUOJ-UHFFFAOYSA-N 416.478 2.026 10 20 HECD COc1ccc(N(C)Cc2nnnn2-c2ccc(S(C)(=O)=O)cc2)cc1Cl 757857827 PHAXROJRTSTSLF-UHFFFAOYSA-N 407.883 2.364 10 20 HECD Cc1cc(C(=O)NCCC(=O)NC(N)=O)c(C)n1-c1ccccc1Br 758584448 LOQMEGDOLHJPPS-UHFFFAOYSA-N 407.268 2.171 10 20 HECD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1cccc(Br)c1O 765754922 YHIBGUBYQUDTES-BETUJISGSA-N 409.280 2.336 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS(=O)(=O)CC1 768089549 MXBLAWCHKOXXFF-AWEZNQCLSA-N 417.478 2.087 10 20 HECD C[C@@H](C(=O)N(Cc1ccco1)Cc1ccccc1O)S(=O)(=O)C1CCOCC1 768110974 VYHDKTSWTMSPJN-HNNXBMFYSA-N 407.488 2.496 10 20 HECD CC(C)OCCS(=O)(=O)N1CCN(Cc2cc(Br)ccc2O)CC1 769556685 LLSCUXSTWINFDM-UHFFFAOYSA-N 421.357 2.027 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(S(=O)(=O)NC)ccc3C)c2)CC1 770286552 NOUSZDVHLBAXGP-UHFFFAOYSA-N 416.547 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)c3cnc4sc(C)cn4c3=O)CC2)cc1F 771697113 DFNVCBWEWCRYJE-UHFFFAOYSA-N 402.451 2.175 10 20 HECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N(C)C)c(F)c1 772530314 LJTDVSXBIHIFBR-OAHLLOKOSA-N 423.514 2.386 10 20 HECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1=O 773020644 PWUWWGAOLPDYJR-CMJOXMDJSA-N 424.501 2.406 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(OCc2ncnn2C)cc1)c1ccc(N(C)C)cc1 773087184 GUECMMRVSBVFAR-OAHLLOKOSA-N 415.519 2.500 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)s1 773616157 ISFNZXNGGBSZNE-CQSZACIVSA-N 410.565 2.461 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1F 774827937 SJYAKUUEMLYFMW-LJQANCHMSA-N 416.497 2.444 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(Cc4ccccc4)C3)ccc21 775044128 PGXAHHIJAYZTND-NRFANRHFSA-N 406.530 2.076 10 20 HECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 775370392 GAEBXKDSIDNQTF-GJZGRUSLSA-N 401.463 2.018 10 20 HECD Cn1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(-c2ccccc2)n1 782823935 BVLDWOCWUQRLJT-UHFFFAOYSA-N 400.460 2.094 10 20 HECD C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1CCN(c2ccc(F)cc2)CC1 783710851 LHHGFCVIIQTNGE-AWEZNQCLSA-N 402.422 2.174 10 20 HECD CC(C)Oc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 786855290 DOVBHWUFSANWAU-UHFFFAOYSA-N 411.502 2.243 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Sc1ccccc1 788333919 SFFSYYPZGYPXQF-KRWDZBQOSA-N 413.543 2.436 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc(-n2cccn2)c1 792342763 LHHAAQQBXUPTKT-ZDUSSCGKSA-N 410.430 2.411 10 20 HECD CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](CNC(=O)OC(C)(C)C)C1 793603368 HPHTZKRRKPERET-SFHVURJKSA-N 422.545 2.303 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c(O)c1 794382640 DXRGUAXUFWSYJE-ZACQAIPSSA-N 420.531 2.314 10 20 HECD CN(C)S(=O)(=O)C[C@H](NCc1cc(Br)ccc1O)C(F)(F)F 796453550 JTCGKPRXVVMSSN-NSHDSACASA-N 405.236 2.067 10 20 HECD Cc1noc([C@H]2CCCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 796666972 FJTYXYAUFPTJCL-LJQANCHMSA-N 417.485 2.197 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)CC2 804360864 RYFNEDHHXSHEKV-SFHVURJKSA-N 424.549 2.103 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@H](Cc2ccccc2)C1 806276702 KFZXFFHRDRKKOT-INIZCTEOSA-N 405.545 2.212 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)C2CC2)cc1 806686350 DFWVAIGAWNHZBS-LJQANCHMSA-N 401.507 2.046 10 20 HECD Cc1nnc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)s1 806725179 HMJIBQZWLLYBIQ-UHFFFAOYSA-N 413.503 2.351 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1nc(C2CC2)cs1 806855199 BZBRMMGMVXBLBN-UHFFFAOYSA-N 414.531 2.484 10 20 HECD CS(=O)(=O)C1(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCCC1 807538103 XQKALXRQGWMOJT-KRWDZBQOSA-N 410.536 2.440 10 20 HECD CC(=O)C(=O)CSc1nnc(-c2cccc(S(=O)(=O)N3CCCCC3)c2)o1 808012539 QQFLZVQIZZUWTN-UHFFFAOYSA-N 409.489 2.161 10 20 HECD CC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808851553 FGHRMJGPTBOSPR-IBGZPJMESA-N 412.578 2.483 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@H]4CCC(=O)[C@H]4C)n3)CC2)cc1 809464992 OGYVOGMFZQYRHW-JKSUJKDBSA-N 412.490 2.127 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1 810404070 CUWBDTCCVWZQEH-UHFFFAOYSA-N 419.286 2.302 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)O[C@@H]1CCN(C3CC3)C1=O)c2[N+](=O)[O-] 1318991725 RVJGDSAUJLCSFO-MRXNPFEDSA-N 420.377 2.290 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCN3C(=O)COc4ccccc43)CC2)cc1 1320422853 UTMKJTCEOOVNRX-UHFFFAOYSA-N 424.501 2.389 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1799767069 OWWKTVYAGALHGF-KCTHJMFYSA-N 420.893 2.001 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)on1 1804283645 IZKIBJDYHJBZIX-PLCSWTFUSA-N 413.430 2.065 10 20 HECD CCNC(=O)NC(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 10732445 VJTBSTXARYHPIG-UHFFFAOYSA-N 414.801 2.118 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C[C@H]2CCOC2)CC1 303810876 VGPDJCMYTVSPLO-HXUWFJFHSA-N 416.566 2.166 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCc2ccccc2C1 732274060 BTDZJZNQGGFDHD-XMSQKQJNSA-N 420.557 2.451 10 20 HECD CC(C)N[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 732449644 MICXJQHDIOBLPZ-OALUTQOASA-N 401.555 2.060 10 20 HECD CN(C)c1ccc(CN(Cn2cc(S(=O)(=O)N(C)C)cn2)CC(F)(F)F)cc1 738042047 QLJXPYREHBCGKJ-UHFFFAOYSA-N 419.473 2.221 10 20 HECD CS(=O)(=O)Nc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739767867 HHJUDRCVRJGFSI-UHFFFAOYSA-N 416.503 2.012 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(=O)n(C)c2)NC(=O)OC(C)(C)C)cc1 742754913 RTNURTWOKZTCAV-GOSISDBHSA-N 414.506 2.447 10 20 HECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 742952612 OECNZRQCWSPCQT-UHFFFAOYSA-N 407.467 2.229 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H](C)NS(C)(=O)=O)cc1 746244482 PTRFELQMNRLJPC-HNNXBMFYSA-N 405.520 2.232 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(-c2nnc(C)n2C)c1 746404994 CJSVTGNETQKBDR-UHFFFAOYSA-N 406.490 2.420 10 20 HECD Cc1cc(=O)c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c[nH]1 748454454 IQGDUORSZDCMDE-UHFFFAOYSA-N 416.389 2.254 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H]1C 748962293 WBVYSLJONRBAKC-DSKINZAPSA-N 415.582 2.403 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CNC(=O)CC3CCCC3)CC2)cc1 751302035 CPRWKWNFHJDQRF-UHFFFAOYSA-N 416.566 2.020 10 20 HECD COCc1nc(NCCCN2CCN(c3ccc(OC)cc3)CC2)cc(OC)n1 753550183 GSVHPHMVCVOEMU-UHFFFAOYSA-N 401.511 2.264 10 20 HECD C[C@H](NC(=O)NCCc1cn2c(n1)SCC2)c1ccc(N2CCOCC2)cc1 767312322 LFORTFWEMOKLMD-HNNXBMFYSA-N 401.536 2.428 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1O 768166574 PWJATOCWNDLFMH-UHFFFAOYSA-N 414.643 2.467 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1c(O)ccc3c1CCCC3)NC(=O)CC2 768171582 CAZJINBELMEJGI-UHFFFAOYSA-N 423.469 2.419 10 20 HECD CCOCCC1(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 770149416 LTJMQIMANQPHDK-UHFFFAOYSA-N 404.507 2.484 10 20 HECD CNC(=O)COc1cccc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 772456870 HISNAPUCXQXZFB-FQEVSTJZSA-N 412.486 2.267 10 20 HECD CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 772775810 OQFCPPPFMIUQMY-VQHVLOKHSA-N 418.833 2.405 10 20 HECD CNC(=O)CCOc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773847682 SAOSRCOFNRCBEY-OAHLLOKOSA-N 412.490 2.083 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(F)c(F)c(C(=O)OC)c1 775287008 VFJLBFANGHDYCL-UHFFFAOYSA-N 401.343 2.044 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)Nc2cc(-n3nnnc3C)ccc2F)c1 775375963 QCYOAOXHAZRBGW-NSHDSACASA-N 400.414 2.113 10 20 HECD O=C(COc1ccccc1-c1nnco1)NCc1ccc(N2CCOCC2)c(F)c1 776299521 PKJYEOPMRNJEME-UHFFFAOYSA-N 412.421 2.408 10 20 HECD C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424607 RAJGCKLGOSTNPO-RDJZCZTQSA-N 418.538 2.273 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N(C1CCCC1)C1CC1 789845286 VRLKTAFZEUEJGS-UHFFFAOYSA-N 403.498 2.337 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)ccc1O 790406739 GDWYEYRTJJWYAD-UHFFFAOYSA-N 424.422 2.206 10 20 HECD COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 792295359 MKHORISWOLQUFW-VIFPVBQESA-N 413.352 2.206 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)N(C)CC(F)(F)F)CC2)cc(OC)c1OC 793815098 LXLXNZBDCHDZMO-ZDUSSCGKSA-N 419.444 2.244 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c(O)c1 797388466 ZONBMKRYTPITBQ-UHFFFAOYSA-N 411.458 2.200 10 20 HECD CC(C)[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)N(C)C 803497793 XNZUXQKICOSKRQ-VWKPWSFCSA-N 423.529 2.185 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCN2CCSCC2)cc1)C1CCCCC1 803677126 GMZKELJGQIQVNX-UHFFFAOYSA-N 418.607 2.237 10 20 HECD O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCc1cc(Cl)cc(Cl)c1O 805195167 WENBCZYAJHVKKT-NBLIUIFLSA-N 424.284 2.305 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 807842566 UFDXNTFJLNEVAF-IBGZPJMESA-N 415.534 2.428 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCCN1CCCO[C@H](C)C1 807928599 BODIUVXJAXRXPC-GOSISDBHSA-N 405.539 2.138 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)c3nccs3)CC2)cc1 808816658 PVUIVNSSCAAAOE-OAHLLOKOSA-N 402.520 2.110 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)C(=O)OC4)cc2)C1 808887065 JNHWVVDELGFCGD-OAHLLOKOSA-N 408.458 2.380 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c1 808926235 NVZXQHZLIDQCOE-UHFFFAOYSA-N 416.384 2.428 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 810305279 JGRDMJAAWUMZHF-UHFFFAOYSA-N 419.503 2.068 10 20 HECD CC(C)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1(CO)CCC1 815250030 PSSFUQJVTWVGAJ-OAQYLSRUSA-N 407.530 2.055 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCO[C@H](C(C)C)C3)CC2)cc1 819406822 WQGOXWASIWAQHN-GLCJEOIMSA-N 415.534 2.174 10 20 HECD CN(C)C(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 917864797 YLNJURNBARETKG-UHFFFAOYSA-N 417.531 2.046 10 20 HECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 918372127 SPYXHUDKHQGXME-UHFFFAOYSA-N 409.895 2.337 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1 918429572 LGKRTPUMOBOULT-UHFFFAOYSA-N 403.504 2.191 10 20 HECD CC(C)C(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971740 VJBRRZFOGHXPMQ-HXUWFJFHSA-N 405.514 2.440 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](CC(N)=O)C1 1319326776 NJVOJLZECZMDAN-GJZGRUSLSA-N 419.481 2.376 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1scnc1Br 1325764519 SHUYBWKIZJYWBU-VIFPVBQESA-N 415.265 2.221 10 20 HECD NC(=O)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1357127661 HFVGWKMRVWPQEN-SFHVURJKSA-N 420.872 2.342 10 20 HECD C[C@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)c1ccccc1 27993225 IHBUQEFSXXKARP-QGZVFWFLSA-N 411.502 2.463 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 726630898 UVVRSRXSFNMIPX-HXUWFJFHSA-N 423.579 2.375 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1 728948576 HAXBXANHFAYEIW-APPDUMDISA-N 416.400 2.335 10 20 HECD COc1ccc(N2CCCN(C(=O)Cc3c(C)nc4[nH]n(C)c(=O)c4c3C)CC2)cc1 730280624 XSMICUORVPIAHI-UHFFFAOYSA-N 423.517 2.168 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c1 734016955 QLPNTMXYDAHQMH-UHFFFAOYSA-N 414.277 2.497 10 20 HECD CN1CCN(c2ccc(CNC(=O)NCc3ccc(N4CC=CC4)cc3)cn2)CC1 740904584 ILXGITSQNINGQC-UHFFFAOYSA-N 406.534 2.209 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1[N+](=O)[O-] 742556859 LZLPMHCGJHJLMF-UHFFFAOYSA-N 402.426 2.323 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)cc1 744463096 ALFWEBDKOOEEIO-UHFFFAOYSA-N 418.338 2.154 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1Cl 745976245 GGDKBSGLOZCZIO-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CN(C)CCN1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1=O 746118140 RRALOMVQHLJQBW-LJQANCHMSA-N 412.534 2.285 10 20 HECD COC(=O)C1(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCC1 747259123 CSQLNVFQCIQBNX-UHFFFAOYSA-N 408.366 2.196 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@]3(C)CCCC[C@@H]3O)CC2)cc1 748617263 XVVOHGSIWQQOLS-GMAHTHKFSA-N 418.582 2.448 10 20 HECD O=C(C1=CN2CCS(=O)(=O)N=C2C=C1)N(Cc1ccco1)Cc1ccccc1O 751292298 UDTWCUQYUQTVTR-UHFFFAOYSA-N 413.455 2.012 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc4nc(O)n(C)c4c3)cc2F)CC1 751917056 IRSDKCPMAKSYJQ-UHFFFAOYSA-N 411.481 2.490 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1F 752401892 PKEDCZMSDOOVTO-UHFFFAOYSA-N 421.494 2.095 10 20 HECD COc1ccc(N2CCN(C(=O)[C@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1F 753740534 QKYXFZWNQFPSSM-QHCPKHFHSA-N 413.493 2.120 10 20 HECD CCCCNC(=O)C1(NCc2cc(O)n3ncc(C(=O)OCC)c3n2)CCCCC1 754668048 LBLOUAXOGUDPCR-UHFFFAOYSA-N 417.510 2.320 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccn(CC(F)(F)F)c3=O)ccc21 757260931 UGAFFXCAFLISSG-UHFFFAOYSA-N 422.407 2.048 10 20 HECD COc1cc(N2CCN(C(=O)NCCN3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 759219416 AVKVNOSTOFOARX-QGZVFWFLSA-N 420.554 2.276 10 20 HECD COc1ccc(N2CCN(C(=O)NCCc3cn4c(n3)SCC4)CC2)cc1F 767940907 JAWNAFLBBUHIMJ-UHFFFAOYSA-N 405.499 2.211 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1 768073691 GWLHZUAVEFPWTA-UHFFFAOYSA-N 400.822 2.495 10 20 HECD COc1cccc(CN2CCN(S(=O)(=O)c3ccc(F)c(F)c3F)CC2)c1O 768159919 IGJVGDRBPWVPQJ-UHFFFAOYSA-N 416.421 2.325 10 20 HECD COCCCN(C(=O)NCc1ccc(N2CCCC2)cc1)[C@H]1CCS(=O)(=O)C1 774166889 FZGFKDBKMQPPHX-IBGZPJMESA-N 409.552 2.022 10 20 HECD COc1cccc(CNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c1O 776063565 VIDNGQBROBQKDV-UHFFFAOYSA-N 408.480 2.194 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCCNCc2cc(Cl)cc(F)c2O)c1 776082362 WGJGRMIZVJJKOT-UHFFFAOYSA-N 403.819 2.161 10 20 HECD CCN(CC)c1ccc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)cc1F 779607315 JLSGQASENBBELE-SFHVURJKSA-N 413.559 2.298 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1 788955401 RGTKUISSHHNXGH-QGZVFWFLSA-N 403.523 2.339 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F 789838739 IBMCORBVTNWGJC-NSHDSACASA-N 411.455 2.240 10 20 HECD CO[C@H]1CCOc2c(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cccc21 790966020 NWAZNENEIGRBNR-SGTLLEGYSA-N 400.431 2.254 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)ccc3ncccc23)cc1 797430992 FCLBRXJOGARAHR-UHFFFAOYSA-N 406.489 2.220 10 20 HECD CN(CCNCc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(F)cc1 797880595 ZHIPBCSFORGBKA-UHFFFAOYSA-N 407.511 2.073 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 799763761 CARZFEMYCKBDJN-KBPBESRZSA-N 409.483 2.321 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCOc4cc(OC)ccc4C3)CC2)cc1 801966988 STMUCDGVNKESGA-UHFFFAOYSA-N 411.502 2.247 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CN1Cc1ccccc1 803664717 PQJJMZJSRZCIKC-APWZRJJASA-N 412.509 2.287 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C)CC(F)(F)F 804138729 XMHXMMDZUFNVSE-UHFFFAOYSA-N 402.461 2.100 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@]3(CO)CC(C)C)CC2)cc1 804317065 RWAREAKHPPRLGX-QHCPKHFHSA-N 417.550 2.180 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1cc(F)ccc1F 805823759 JRUFLHNQNXDPJO-UHFFFAOYSA-N 417.456 2.119 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)cc1 806179659 UIOQPMGNSPAKFV-OALUTQOASA-N 416.566 2.254 10 20 HECD O=C(NCCOC1CCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807160387 YZYHBDVLYDSMKK-AWEZNQCLSA-N 411.449 2.058 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](N2CCN(Cc3cc4c(cc3O)OCO4)CC2)C1 808227396 DVEFCWUUKFJPIE-INIZCTEOSA-N 405.495 2.248 10 20 HECD CC(C)n1cnnc1CN(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 813589841 GONHMOPZXWRDFT-UHFFFAOYSA-N 404.490 2.301 10 20 HECD O=S(=O)(CC[C@@H]1CCOC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815016885 BRGXPERCUHWVMF-YOEHRIQHSA-N 402.944 2.356 10 20 HECD COc1ccc(CCNC(=N)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 848998557 SXDPLVKKGUVDMQ-IBGZPJMESA-N 409.534 2.254 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1C 917355390 APZRRUBZZHRINS-UHFFFAOYSA-N 406.504 2.409 10 20 HECD Cc1[nH]nc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1Br 919754021 LCTYUDZUCJZQLM-ZDUSSCGKSA-N 420.311 2.112 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccnc2N2CCOCC2)C2CC2)cc1 919795881 YRVGSPKVXVEVRV-UHFFFAOYSA-N 423.517 2.114 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 921078862 ZGBLHEJOWLGCGS-IBGZPJMESA-N 408.502 2.470 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Br)cc1O 1342913794 CKGMSIZKQXBEFA-ZDUSSCGKSA-N 424.247 2.470 10 20 HECD CC(C)C(CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(C)C 1343418680 LHOIBTVQIAWJCB-SFHVURJKSA-N 416.566 2.049 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncs1 1795293246 JTYVFPRTPKTFOW-LJWNITHASA-N 415.471 2.225 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccns1 1804283591 GKPNADWIYARUAJ-LJWNITHASA-N 415.471 2.225 10 20 HECD Cc1ccc(C(=O)OCC(=O)c2cc(C)n([C@@H]3CCS(=O)(=O)C3)c2C)c(O)c1O 110005703 ZZMSMCQHLUSRAK-CQSZACIVSA-N 421.471 2.224 10 20 HECD COc1cccc(CNC(=O)c2cc(S(C)(=O)=O)ccc2Br)c1O 729859282 KQEHBMGPECSSTG-UHFFFAOYSA-N 414.277 2.497 10 20 HECD COCC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 732811257 PTTPEMOLLUIOEN-IRXDYDNUSA-N 407.530 2.414 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)cc1 732990976 WSPRAAYDTORNHH-JOCHJYFZSA-N 421.545 2.385 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(C)cc3F)CC2)cc1 743432241 KTXJJPXQENYSER-UHFFFAOYSA-N 414.481 2.020 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2 746493430 WCZQBHZXBZHPPR-UHFFFAOYSA-N 412.446 2.071 10 20 HECD COC[C@@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 746756037 UHIQPABRZAFSPG-LJQANCHMSA-N 402.495 2.097 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CO)c3ccccc3C)CC2)cc1 746756082 VYSYJPTXWASMTF-JOCHJYFZSA-N 412.534 2.158 10 20 HECD COCCCS(=O)(=O)NCCOC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 746899622 ZJESHHMGFAWSQG-UHFFFAOYSA-N 412.483 2.346 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1[C@H]2CC[C@H]1CC(=O)NC2 748826513 SDIIXMDZDUJLEC-KBMXLJTQSA-N 417.465 2.142 10 20 HECD C[C@@H]1C(=O)Nc2cc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)ccc2N1C 750572399 FLDNEMMRKHUUCX-OAHLLOKOSA-N 424.501 2.345 10 20 HECD CN(C)c1ccc(CNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1F 751086987 PQWXMSYBRJKEIC-UHFFFAOYSA-N 421.561 2.318 10 20 HECD Cc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1C(N)=O 751136399 IKTYIFLYZIPXSK-INIZCTEOSA-N 404.488 2.169 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc12 751137665 UCMCLTSAVQNFCV-INIZCTEOSA-N 416.503 2.352 10 20 HECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c(O)c1O 751534865 ZTYZNENPKJFPFM-UHFFFAOYSA-N 416.908 2.268 10 20 HECD COCCn1nc(C)c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1C 754490388 WYTHZNATNWIHDA-UHFFFAOYSA-N 413.522 2.342 10 20 HECD CCc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 755066262 XJTFPTMONAOANG-UHFFFAOYSA-N 417.485 2.081 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnnn3C3CCCC3)CC2)cc1 758196166 BYNCFBCMKSMKHB-GOSISDBHSA-N 418.567 2.072 10 20 HECD COc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 759249706 INDHMEVHOVZIMP-UHFFFAOYSA-N 421.475 2.261 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)c3cnn(C)c3)CC2)cc(OC)c1OC 759265602 AASOKZJNNIHKEP-CQSZACIVSA-N 403.483 2.039 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)CC2)cc(OC)c1OC 759268412 WJHIZKFYAFCCHL-BEVDRBHNSA-N 419.522 2.358 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN(C)[C@H](C)C3)CC2)cc(OC)c1OC 759280547 AUOIUMVNHLVDBP-CVEARBPZSA-N 406.527 2.027 10 20 HECD CCc1noc2ncc(S(=O)(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cc12 762536925 GDHFABKHZNGGOK-UHFFFAOYSA-N 420.466 2.444 10 20 HECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)N(CC)Cc1ccc(N(C)C)cc1 764895207 PMPDHPFKCQDBLB-FQEVSTJZSA-N 407.522 2.389 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1OC 765904228 QAWNPEKQAVVBIX-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C3(C)COC(C)(C)OC3)CC2)cc1 767179311 OXFJUMUUEILPHV-UHFFFAOYSA-N 405.539 2.113 10 20 HECD COC[C@@H]1CCCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 768255769 IYMNNAHXZBXFLV-RTBURBONSA-N 402.539 2.346 10 20 HECD C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769957273 KQUOZXBBOKUYKR-HNAYVOBHSA-N 417.531 2.404 10 20 HECD CCOCCO[C@@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771057388 NSHZQQXXMVTTPR-INIZCTEOSA-N 418.494 2.084 10 20 HECD COCCn1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1=O 771065580 NRUWQZAYSVQJTA-GOSISDBHSA-N 419.909 2.248 10 20 HECD C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773613342 QBKNHPZSVCBFAN-MSOLQXFVSA-N 401.555 2.152 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1(N2CCOCC2)CCCCC1)c1ccc(N(C)C)cc1 774839914 CFUNUGAYUDPFQD-GOSISDBHSA-N 416.566 2.081 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4cn[nH]c4)CC3)cc2)C1 775422903 QONWOSQJOIMHCR-GOSISDBHSA-N 410.522 2.201 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)C2CC2)cc1 776076147 JXCJTQGBPMQXRO-UTKZUKDTSA-N 421.563 2.163 10 20 HECD CCCC[C@H](COC)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778285016 DBHALFILOLXALI-IENJSVCTSA-N 403.523 2.221 10 20 HECD C[C@H](NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccc(N2CCOCC2)cc1 780339818 SOINAXBQGBHDCU-MSOLQXFVSA-N 404.555 2.071 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](C)NC(=O)C3CCCC3)cc2)CC1 787319066 JHARXBLTVQPLNH-KRWDZBQOSA-N 414.550 2.056 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 788778753 ULFSVMZLUWPJME-INIZCTEOSA-N 414.472 2.149 10 20 HECD COc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 793866164 FPANNDGNNBMZGH-UHFFFAOYSA-N 411.502 2.115 10 20 HECD COc1ccc(CNS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 799820657 SBSRFSZTDANXCJ-UHFFFAOYSA-N 400.497 2.220 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1nc(C2CC2)cs1)c1ccc(N2CCOCC2)cc1 803300056 FBAFJXWLMZDRGW-CQSZACIVSA-N 414.531 2.351 10 20 HECD Cc1csc([C@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 807349784 APQDPNBHJUZCOT-OAHLLOKOSA-N 416.547 2.166 10 20 HECD Cc1csc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 807679761 VADLWMAOJYEGPT-OAHLLOKOSA-N 401.536 2.044 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 810076235 XXUBMGRHZOFYBC-UHFFFAOYSA-N 414.277 2.349 10 20 HECD O=C1COc2c(cccc2NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)N1 810416402 WOCDGOAZSYHBLD-UHFFFAOYSA-N 410.213 2.285 10 20 HECD Cc1cc(C(=O)COC(=O)c2cc3n(n2)CCO3)c(C)n1-c1ccc2c(c1)OCCO2 811350306 KKUVXKFMZPQATB-UHFFFAOYSA-N 423.425 2.494 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cn3cnc4ccccc43)CC2)cc1 849192375 AGCQLDWRQODASR-UHFFFAOYSA-N 407.518 2.373 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1nnc2n1CCCCC2 914534974 WCERPNPTTSXMTC-UHFFFAOYSA-N 412.538 2.225 10 20 HECD COC(=O)COc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918324817 YXFLARXQICXQNN-UHFFFAOYSA-N 402.422 2.144 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCOCC3)c2)cc(Cl)c1OCC(N)=O 918371067 CCYJGUMWQHNDJA-UHFFFAOYSA-N 419.865 2.302 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1ccccc1OC 1116669759 YAVCBRIXVWWZNC-AWEZNQCLSA-N 405.472 2.489 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCCC[C@@H]3C(=O)OC)CC2)cc1 1338267179 GODODJMNNRVGJM-RBUKOAKNSA-N 410.536 2.269 10 20 HECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1F 1792750160 XGLWZKDNWGXISD-QDMKHBRRSA-N 415.421 2.206 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cnccc3F)C2)CC1 1810335197 PSNGGVVJUMSZBS-UHFFFAOYSA-N 414.437 2.186 10 20 HECD COc1cc(CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)ccc1OC(F)F 730971286 PBEMUJLDGYZICZ-XYOKQWHBSA-N 413.446 2.169 10 20 HECD CN1CCN(c2cc(CNC(=O)NCc3ccc(N4CC=CC4)cc3)ccn2)CC1 740908122 SBPGCFJBYQCXFV-UHFFFAOYSA-N 406.534 2.209 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1 741145418 AESKCBICPPKNHV-IBGZPJMESA-N 421.497 2.253 10 20 HECD C[C@@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N(C)Cc1ccc(N2CCCCC2)cc1 741710163 YPRPZLXRNHKTKR-PXNSSMCTSA-N 407.580 2.143 10 20 HECD CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743955116 IBNNAJZGPMNOEE-UHFFFAOYSA-N 420.462 2.069 10 20 HECD CC(C)(C)n1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1 746363434 YEIIFIGPWDHFBX-QGZVFWFLSA-N 400.479 2.490 10 20 HECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 749631033 ACPHYHMVYIIXLV-UHFFFAOYSA-N 405.476 2.141 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)cn3)cc2F)C[C@@H](C)O1 751828461 WQNHJPMZEZDQNP-OKILXGFUSA-N 419.428 2.447 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2cc(S(N)(=O)=O)ccc2OC)cc1 752760464 ULQMJQPMCDVSJI-UHFFFAOYSA-N 405.520 2.461 10 20 HECD C[C@@H](O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 753110483 YZQVNLZGOVVUJC-HIFRSBDPSA-N 401.429 2.454 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(C)c3)CC2)cc(OC)c1OC 759410102 PDVJHNCJJGJRNU-UHFFFAOYSA-N 413.474 2.308 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)cc1OC(C)C 762001641 VEPYPJDLUKELNP-UHFFFAOYSA-N 414.505 2.278 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@@H]3CC(=O)N(c4ccccc4)C3)no2)c1 762151083 QHGIFSXDZQUGSA-GFCCVEGCSA-N 414.443 2.334 10 20 HECD Cc1ccccc1-c1nc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)no1 763231234 IZCXUHSLTFOVBJ-UHFFFAOYSA-N 402.432 2.052 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 763653183 CUFIMGRQSQPFCM-CYBMUJFWSA-N 407.492 2.259 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)c2)CC1 767382760 HPYHZDYDOMPFLF-UHFFFAOYSA-N 420.510 2.256 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1OC 768451071 LSKLURBSGHVIIN-SJLPKXTDSA-N 405.539 2.222 10 20 HECD CCOc1ccc(CNc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)c(O)c1 770525480 XFGYQIGBPMTVEB-UHFFFAOYSA-N 412.446 2.283 10 20 HECD Cc1cccc(CN2CCN(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1 772770073 QZNVVZQOCVJDFE-SOFGYWHQSA-N 410.470 2.307 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(N2CCOCC2)cc1 774778803 FIPPOVMGAZTBBI-XMSQKQJNSA-N 424.545 2.120 10 20 HECD NC(=O)[C@@H]1CCCC[C@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782539509 KPZKDDUOJDMOTB-NVXWUHKLSA-N 405.454 2.034 10 20 HECD CCOc1ccccc1[C@@H](CC(=O)OCC(=O)c1ccc(O)c(O)c1)NC(C)=O 783453907 ZSLNQPFMAPLNSR-MRXNPFEDSA-N 401.415 2.490 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 784562910 AOXWRTZOGSVUFN-UHFFFAOYSA-N 411.458 2.206 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(Cl)cc1-n1cccn1 788337474 LXFFBRDPFAVCQH-UHFFFAOYSA-N 400.822 2.234 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 789669123 SEGBJNMQWNGGFV-JOCHJYFZSA-N 418.541 2.460 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@H]1CCCC(F)(F)C1 789798013 AIBIMOFKYGJKAW-HNNXBMFYSA-N 413.440 2.220 10 20 HECD CN(C)c1ccc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)c(C(F)(F)F)c1 793156530 FGSRDKFWCARJJT-UHFFFAOYSA-N 419.513 2.466 10 20 HECD O=C(NC[C@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793793875 LELCSEQLAITWSA-WMLDXEAASA-N 411.449 2.058 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CC(=O)N3CCCCCC3)C(C)C)nc12 796600797 GJFDMPKUUKZEEY-UHFFFAOYSA-N 417.510 2.225 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OC)cc2Br)c(O)c1 797388818 ATMGLGNEDAJMEN-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CC(C)N(CCOCCO)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 801993575 KYRFLRDOCYTQCT-UHFFFAOYSA-N 410.470 2.120 10 20 HECD CC1CCN([C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 803542305 VLDJVGSUOLGNET-QUCCMNQESA-N 417.550 2.136 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](CC(C)C)C3)cc2F)CC1 805008004 XJQCAHSYTWKOHV-IBGZPJMESA-N 418.557 2.478 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccncc1OCC(F)(F)F 807100561 FMFXDLDLUBWZRG-UHFFFAOYSA-N 424.423 2.330 10 20 HECD COC1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 807768880 QCYHWXWAXSKIEC-AWEZNQCLSA-N 411.449 2.058 10 20 HECD CS[C@@H](C)CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769428 FUCGWPDXSMRADM-STQMWFEESA-N 401.479 2.241 10 20 HECD Cn1cc(/C=C\C(=O)N2CCN(C(=O)/C=C\c3cnn(C)c3)c3ccccc32)cn1 809239193 SUZVXQVOQZRSTF-XOHWUJONSA-N 402.458 2.260 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccn3)cc2)C1 810182228 AERYGKDTCPPTGJ-INIZCTEOSA-N 404.474 2.103 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 815579314 KFFAGULCMSVWIC-CQSZACIVSA-N 404.492 2.263 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 919899204 SUVUEUGTGLTACW-UHFFFAOYSA-N 402.520 2.309 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1CC=CCC1 1799229152 DIQORJWXESLLCN-FRQROOTJSA-N 420.893 2.311 10 20 HECD Cn1ccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715912 XHQZRWXYAKRYMM-CLLJXQQHSA-N 404.854 2.050 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc2c[nH]nc12 1800918495 RAHCRAVKEPATJG-BJWYYQGGSA-N 421.457 2.243 10 20 HECD Cc1n[nH]cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829740872 HJTKIXLRXNHJLD-QGZVFWFLSA-N 413.478 2.071 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)/C=C/c2ccoc2)C1 1841951995 WCCMCGJBCMGRTD-DDEVBNQJSA-N 410.426 2.326 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(Cc3nc4ccccc4c(=O)[nH]3)CC2)cc1 10262672 HSYGNXJUWHVMQW-UHFFFAOYSA-N 420.517 2.017 10 20 HECD CCn1c(=O)n(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc21 24618547 ZLZKXYBKCQECIJ-UHFFFAOYSA-N 408.502 2.318 10 20 HECD CCN1CCN(CCCCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 65698462 YYNLRERYNIDUPI-HXUWFJFHSA-N 417.598 2.301 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 110357538 OOKDHPPAZBRQCN-HXUWFJFHSA-N 423.579 2.375 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2nncn2-c2ccccc2)n(C)c2ccccc12 557935636 URNUMPWJONQWGV-UHFFFAOYSA-N 402.458 2.000 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccc(N3CCCC3)nc2)n(C)c2ccccc12 573151090 PEKVJBXYBPVUFV-UHFFFAOYSA-N 405.502 2.415 10 20 HECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1cnn(C)c1 726070688 FMZHWWOYIDKNJG-IRXDYDNUSA-N 417.529 2.311 10 20 HECD COCCN(CCN(C)C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729612342 VYSURXQELSDOKS-UHFFFAOYSA-N 414.497 2.476 10 20 HECD CCOc1ccc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c(O)c1 732913863 DHWIVYXVUAKNIC-GOSISDBHSA-N 413.522 2.176 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccnc3Cl)cc2F)CC1 738376720 AFKYDSRZYFTTFU-UHFFFAOYSA-N 412.918 2.495 10 20 HECD CS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739768993 ZHYHBVVWIPUEOV-UHFFFAOYSA-N 416.503 2.012 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](O)c3ccc(C)o3)cc2F)CC1 741413609 OUXAQJCEFRGJON-IBGZPJMESA-N 404.486 2.402 10 20 HECD C[C@@H]1[C@@H](C)[S@](=O)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744408332 WMRQLCYQEJTRAH-RVDBKZMJSA-N 410.495 2.242 10 20 HECD CCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 747979299 GNULBNFPTUXURB-KRWDZBQOSA-N 420.529 2.235 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc4ncccc4c3)c2)CC1 751212160 CRSUMUQOOQAIBH-UHFFFAOYSA-N 417.512 2.270 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3sccc3CN(C)C)CC2)cc1 756100433 VUNCPLHBVQMGRV-UHFFFAOYSA-N 402.564 2.370 10 20 HECD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(Cl)c(Cl)c1O 756736369 FIXNOTZVSKAQSM-STQMWFEESA-N 402.322 2.283 10 20 HECD CCN1C(=O)[C@H]2CN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CCN2C1=O 757689515 QBECTAYUBPVBHM-LJQANCHMSA-N 413.522 2.101 10 20 HECD COc1cc(N2CCN(c3ccc4nnc(C5CC5)n4n3)CC2)cc(OC)c1OC 758930371 GBMYNMARECRJCD-UHFFFAOYSA-N 410.478 2.354 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1nnnn1-c1ccc(OC(F)F)cc1 759587760 FCFSXWVGEFCEPE-WAPJZHGLSA-N 404.329 2.432 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1scnc1C1CC1 763120145 UMOTVVSUUPUELI-UHFFFAOYSA-N 418.494 2.376 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 766318940 JOZHENJPPUDWJS-UHFFFAOYSA-N 420.944 2.371 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCn3cc([N+](=O)[O-])cn3)cc2F)C[C@@H](C)O1 768521605 AEGYDGYAHSVVJS-OKILXGFUSA-N 420.445 2.043 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1O 775052122 SOYZZHCSUZXWLF-MRXNPFEDSA-N 414.462 2.301 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1=O 777459840 RVQVDVVCVFDARX-CALCHBBNSA-N 420.529 2.449 10 20 HECD COc1cc(OC)cc(N2CC[C@H](N(C)C(=O)/C=C\c3ccc(O)c(O)c3)C2=O)c1 779529565 DZECAWPOVXVJCB-YEODSOHDSA-N 412.442 2.392 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1O 785989094 QUEKVXFPUWASPU-UHFFFAOYSA-N 411.458 2.104 10 20 HECD CCOc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 787214889 QIPHKVKEEJPVJE-KRWDZBQOSA-N 411.502 2.416 10 20 HECD CCOC(=O)[C@@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 787640034 YBOBZSHBCMLXEO-FQEVSTJZSA-N 420.487 2.015 10 20 HECD Cc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788312029 AVKKFNLKDXBJDB-JOCHJYFZSA-N 423.513 2.048 10 20 HECD CCN(CCc1nccs1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856961 ZIFCKUIBTANIGQ-UHFFFAOYSA-N 418.588 2.404 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1 793621536 XRTFKSNVYCLFPE-GOSISDBHSA-N 418.538 2.131 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)CC2)cc1 793637307 DKYJXHSYNAPQNB-INIZCTEOSA-N 411.502 2.150 10 20 HECD CNC(=O)[C@]1(C)CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 797525806 SENRZQDAAKHPRR-LFPIHBKWSA-N 419.481 2.247 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 800621128 MCFNWFCNVQYASV-UHFFFAOYSA-N 416.327 2.475 10 20 HECD CS[C@@H]1CCCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803300451 SAQHGKQEBKIUJU-VQIMIIECSA-N 405.564 2.445 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@@](C)(O)C(F)(F)F)CC2)cc1F 803662114 RTAKFDBNTFPNLS-GOSISDBHSA-N 419.419 2.060 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)CC1 804761094 VUOAPYMDWFRIIR-UABRLCRWSA-N 417.506 2.265 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2ncc(Cl)n2C)cc1F 804852662 DCPPFHVBQBQXMT-UHFFFAOYSA-N 409.893 2.334 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@@H]1O 806444016 XSBMSGVWNLPNEJ-GUYCJALGSA-N 401.429 2.454 10 20 HECD C[C@H](NC(=O)C(=O)NCC1CCN(c2ccncc2)CC1)c1ccc(N(C)C)cc1 807663400 LZHXCRANJSFCSE-KRWDZBQOSA-N 409.534 2.358 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COc4ccccc43)cc2)C1 808368322 ZNGLPFYKFLOHEE-MSOLQXFVSA-N 408.502 2.364 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(CCOC(C)C)CC1 808519174 PXIKGGPCJRAQRT-UHFFFAOYSA-N 418.582 2.107 10 20 HECD COCCOCCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808792203 UFWLWSLUWBAADP-OAHLLOKOSA-N 410.470 2.384 10 20 HECD COc1ccc(N2CCN(C(=O)NCC3(SC)CCN(C)CC3)CC2)cc1F 811939843 CMCMRHVASNRCBQ-UHFFFAOYSA-N 410.559 2.493 10 20 HECD COC[C@@H](C)NS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1 863991637 KCYGWDPHGZCNBJ-QGZVFWFLSA-N 419.547 2.449 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CC)Cc3nc(O)c4ccccc4n3)nc12 916999212 GZHDOLNITMGLQH-UHFFFAOYSA-N 422.445 2.283 10 20 HECD COc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918286338 HBWIJEMLJAYEAM-KBPBESRZSA-N 416.453 2.098 10 20 HECD COC(=O)[C@H]1CCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1319832908 RRSLEGFEWUDZID-JSGCOSHPSA-N 424.500 2.326 10 20 HECD CCOc1ccc(N2CCN(C(=O)CNC(=O)NCc3ccc(F)cc3)CC2)cc1 1320393203 ALZCTERWBAELLL-UHFFFAOYSA-N 414.481 2.372 10 20 HECD CN1CCN(c2ccc(CNCc3ccc4c(c3)CCS4(=O)=O)cc2F)CC1 1337277634 AYCDUNLGCKHTMZ-UHFFFAOYSA-N 403.523 2.197 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC1(F)F)C1=NN(c2ccccc2)C(=O)C1 1797733910 KUICRBCXRIVUGN-UKMLZYKCSA-N 416.428 2.073 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423646 BEFWOGMGOZGUBT-NQYLQCIDSA-N 419.522 2.133 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3C=CCN3)C2)cc1 1843333636 OMTKMYADBKMYDN-NRFANRHFSA-N 404.514 2.439 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 56966079 OLKXJXVBLOBGSI-UHFFFAOYSA-N 403.548 2.413 10 20 HECD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)N(Cc1ccco1)Cc1ccccc1O 104725616 DYVHORRVGHLXSG-PBFVBANWSA-N 406.438 2.321 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)NCCOC)cc1 105450846 FEBTZCCDICMYLD-UHFFFAOYSA-N 419.547 2.340 10 20 HECD CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1O[C@H](C)C(=O)N(C)C 728697101 CPFUKXBXZVSYHI-QLENYVDCSA-N 423.469 2.402 10 20 HECD O=C(NCCCNC(=O)c1cccc(F)c1)NCc1ccc(N2CCOCC2)cc1 732243156 SDCJKMAKBNFEOL-UHFFFAOYSA-N 414.481 2.282 10 20 HECD O=C1C[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CN1Cc1ccccn1 735517870 GBXJOTSJLSHGNV-AZUAARDMSA-N 409.486 2.344 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3F)c2)cc1 742027305 QTCVUDWLCZHVRZ-UHFFFAOYSA-N 410.452 2.184 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1F 747012406 VOBVBVAIOHWVPQ-UHFFFAOYSA-N 414.437 2.099 10 20 HECD CN(CC(=O)NCc1ccccc1O)S(=O)(=O)c1ccc(Br)cc1 748345959 SMZKBVHZFRQEPZ-UHFFFAOYSA-N 413.293 2.092 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)cc1C 748639983 JOWRKFSOXOXZBW-UHFFFAOYSA-N 412.489 2.185 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CCC(=O)NCc1ccc(N2CCOCC2)cc1 751358335 MTVNKARGGWAXNW-UHFFFAOYSA-N 409.490 2.137 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 756535949 SSZHTMYAQSPODT-HNNXBMFYSA-N 407.511 2.382 10 20 HECD CC(C)N(C)S(=O)(=O)c1cccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 763278791 DVHMLOKAEPKIJC-AWEZNQCLSA-N 406.504 2.488 10 20 HECD C[C@H](NCC1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 765525381 FZBCWADDCVOZIR-HNNXBMFYSA-N 415.987 2.499 10 20 HECD Cn1cc(C[C@@H]2CC(=O)N(CN3CCCc4cc(OC(F)F)ccc43)C2=O)cn1 766353132 ZXMLYPQYCMEQDK-OAHLLOKOSA-N 404.417 2.349 10 20 HECD CN(C)C(=O)CN1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 770363270 GFLZCRCGNMPHOI-UHFFFAOYSA-N 415.582 2.371 10 20 HECD Cc1cc(C)c(NC(=O)CNC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c(C)c1 772773914 GITBVLRCJBADNK-ALCCZGGFSA-N 412.442 2.334 10 20 HECD CNC(=O)c1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 772903110 CWCWSIYQNACGNC-UHFFFAOYSA-N 414.481 2.059 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 773461776 PUJQIVNZPNREBX-UHFFFAOYSA-N 407.518 2.177 10 20 HECD COc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)N2CCCC2)cc1 774810609 LHABCJFLLMUMKI-JOCHJYFZSA-N 424.545 2.331 10 20 HECD CNS(=O)(=O)CCN[C@@H](C)c1cc(Br)cc(Br)c1O 784056990 OIROLAJFUBRLSD-ZETCQYMHSA-N 416.135 2.117 10 20 HECD CCCn1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784767559 PPQCMZJDBMWNOS-MRXNPFEDSA-N 419.913 2.371 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cnn(CC(F)(F)F)c2)cc1 788976017 VAMADVMLVGYEMN-UHFFFAOYSA-N 411.428 2.224 10 20 HECD CN(Cc1ccc(F)c(F)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812211 KQGRIVRBIFTQBC-UHFFFAOYSA-N 421.419 2.215 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1 790911640 JCFSASYVHGOJDS-KRWDZBQOSA-N 413.522 2.415 10 20 HECD C[C@H](O)C[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796386623 YBCJHRXYCWZGFM-HKUYNNGSSA-N 407.530 2.294 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(c3cn[nH]c3)CC2)cc1F 804852320 GROGFWANKZYQFC-UHFFFAOYSA-N 401.486 2.417 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@H](Cc2ccccc2)C1 807286925 FMLAPQMYMQOAQO-QFIPXVFZSA-N 405.498 2.149 10 20 HECD O=C(NCC(F)(F)F)c1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1 813470578 MRYXQLFZGONBIJ-UHFFFAOYSA-N 418.349 2.183 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@H](O)c3ccccc3)CC2)cc1 813850921 OYHZMHYPMOJEBO-KFORCOCHSA-N 423.513 2.138 10 20 HECD CCC[C@@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 814435373 DNSAMVQVMUNJDF-QGZVFWFLSA-N 404.555 2.247 10 20 HECD Cc1cc(CCNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)c(C)n1-c1ccccc1 915748589 JZXYFMJITGRZSM-UHFFFAOYSA-N 418.497 2.419 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 916502906 ASZHCVWCOAIOOR-UHFFFAOYSA-N 410.430 2.353 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cccnc1-n1cccn1 918206428 DLWBMBDKFSIGTQ-UHFFFAOYSA-N 424.480 2.367 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1Cn1cncn1 918307003 JXWQOFALNYBDFK-UHFFFAOYSA-N 406.490 2.380 10 20 HECD COCC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 918456373 JOBARVSNEOORLU-UHFFFAOYSA-N 424.501 2.467 10 20 HECD Cc1cccc2c(=O)n(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cnc12 919970842 FUUCCUZSSMEUET-UHFFFAOYSA-N 424.476 2.122 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NC3(C(=O)OC)CCCCC3)CC2)cc1 1319614785 YVEHDXFRAMKLEB-UHFFFAOYSA-N 403.523 2.199 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC34CCS(=O)(=O)CC4)cc2F)C[C@@H](C)O1 1325807616 HZMMPCVVPZDTRP-HLLBOEOZSA-N 424.538 2.270 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1O)c1cc(O)c(O)c(Cl)c1 1798703764 AQTUQLSIHVKBII-CLLJXQQHSA-N 417.849 2.417 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1799767068 OWWKTVYAGALHGF-FQRJBHLQSA-N 420.893 2.001 10 20 HECD CC(C)O[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286038 KZIJHZMTPPLIPH-ZLGQELQPSA-N 418.490 2.268 10 20 HECD COC(=O)[C@@H]1CC12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 733849235 WECNMQDBUGUIOL-KRWDZBQOSA-N 419.497 2.272 10 20 HECD COc1ncnc(OC)c1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742806646 SYYNZCURULDHLL-LBPRGKRZSA-N 408.405 2.494 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 743192589 CYUNPVNRELAWAD-UHFFFAOYSA-N 423.477 2.424 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1Cl 743252863 HNOAZZBQLBKELS-UHFFFAOYSA-N 422.843 2.350 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cnn(Cc2ccncc2)c1 746356402 RFSWHBCHYDRZHE-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccccc3Cl)c2)CC1 748675853 WOARDMUPAHNGPH-UHFFFAOYSA-N 400.909 2.376 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2nnc3ccccc3c2=O)cc1 748775424 SXZPHWRRDBKOIN-IBGZPJMESA-N 421.501 2.065 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(N(C)C)n1 750398598 JGNLEYJQPHTUFI-QGZVFWFLSA-N 410.522 2.479 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 751305272 IBZRKBLDCITANK-UHFFFAOYSA-N 423.517 2.480 10 20 HECD CC[C@H](C)OCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 751682933 FENWBELHYJJVKA-INIZCTEOSA-N 401.486 2.374 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(Cl)c2)cc1C(=O)O 755412077 HFEMIKAPSUZEFU-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cc(-c2ccccc2)ccc1O 768160839 SWTNDPAVIFEZGN-LJQANCHMSA-N 402.516 2.184 10 20 HECD O=C(CNC(=O)NCc1ccco1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912621 PXPOBWCGIMEXKH-INIZCTEOSA-N 420.897 2.219 10 20 HECD O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 769156852 UJVAHNPQRHWXGP-VWPQPMDRSA-N 417.550 2.461 10 20 HECD CCO[C@@H](C)c1noc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 769507035 JTYYRLMVQFCCMR-SFHVURJKSA-N 415.538 2.322 10 20 HECD O=C(COC(=O)c1cnccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 771061006 VYJNFPBGTIJVEA-UHFFFAOYSA-N 407.829 2.184 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(O)cc4F)n3)CC2)cc1 771066903 MAERTHBXOZRZMD-UHFFFAOYSA-N 412.421 2.481 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cn2cc(Br)cn2)on1 773747731 GSYRFOGECMSDNT-JTQLQIEISA-N 421.251 2.454 10 20 HECD CC(C)OCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774766828 IFCBXQZMSJHQAS-OAHLLOKOSA-N 413.465 2.304 10 20 HECD CS[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H]1N(C)C 776003447 XGHALLFIOUIJGS-OALUTQOASA-N 423.538 2.378 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H]1OC 776118483 QBHAVOCVJVLGOK-PDUQPXKCSA-N 409.502 2.431 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCN(Cc2ccccc2)C1 779009879 GETROWPKALPWTJ-WBVHZDCISA-N 417.531 2.404 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cn(-c2ccccc2)nn1 783150198 BAHFNXFXYHJLCX-GFCCVEGCSA-N 402.432 2.262 10 20 HECD COc1ncccc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766403 IEKBVVLQRZGIGJ-HNNXBMFYSA-N 418.881 2.169 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OCCN3CCCC3)cc2)cc1 785425417 PQBOIMQFIFSZSK-UHFFFAOYSA-N 424.545 2.160 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC3CCN(CC(C)C)CC3)CC2)cc1 786335833 ZJJUFOMMJIVRAT-UHFFFAOYSA-N 416.566 2.017 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCN1c1ccccc1 787087898 VNQIBMPTWULBHE-OAQYLSRUSA-N 413.543 2.207 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc(N(C)C)cc1 787299469 VWHPTZBRLBJQEK-QGZVFWFLSA-N 405.502 2.491 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@H]2CCc3n[nH]cc3C2)cc1)C1CCCCC1 788482473 BGEWIHRCXHONMU-SFHVURJKSA-N 409.534 2.469 10 20 HECD C[C@H](CN1CCOCC1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 789337112 YRXGZGZLMDHQGQ-MRXNPFEDSA-N 421.497 2.053 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H]1c1ccc(Br)cc1 794701722 CMFSGQXITRUPGL-WMZOPIPTSA-N 419.275 2.254 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)c1 795558204 SNXDFGFPNFWXAY-UHFFFAOYSA-N 403.504 2.464 10 20 HECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 795729603 XMNJIXFSFCZQTG-UHFFFAOYSA-N 421.515 2.496 10 20 HECD C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800570315 KPLLSXHQGGTWFJ-BIENJYKASA-N 407.942 2.468 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803300105 PLBZSIOWWLHMEM-QRFRQXIXSA-N 403.523 2.020 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1ccc(N2CCOCC2)cn1 804219844 ITHUZJGBYLCBPR-UHFFFAOYSA-N 402.838 2.246 10 20 HECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)NCCCSc1nccs1)n2C 806276114 IBFWFNGPOGWQJK-UHFFFAOYSA-N 403.533 2.253 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)NCc2ccc3c(c2)CCCN3C)ccc1F 806544736 CPXPDAGCPVKTTR-UHFFFAOYSA-N 406.483 2.438 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807095339 OEPIWCJZUAOMQZ-QFIPXVFZSA-N 403.523 2.115 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)o1 807672126 WRMWRGBBBZWRPO-QGZVFWFLSA-N 400.523 2.422 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3ncc(C)s3)CC2)cc1 808481704 BWIRQDMYVMKDQU-OAHLLOKOSA-N 402.520 2.376 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3(c4ccccc4)CC(=O)C3)cc2)C1 810183437 WAAKFQSEKHONMX-SFHVURJKSA-N 405.498 2.305 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)cn2ccnc12 815624152 QGMSEZZMSWIDIZ-UHFFFAOYSA-N 403.236 2.366 10 20 HECD CN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1cc(Br)ccc1O 816624863 JUBZRCPTTGDZKW-UHFFFAOYSA-N 415.309 2.313 10 20 HECD CN(C)C(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 915779075 WNTZGUKSKJZEGS-UHFFFAOYSA-N 424.501 2.009 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(CC(F)(F)F)CC1 918220362 CAMFMJZMCFKTQA-UHFFFAOYSA-N 418.435 2.176 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 65715917 JRYZBAPGIBREPL-OAHLLOKOSA-N 411.458 2.126 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc4c(c3)NC(=O)CC4)CC2)cc1 141964267 LKWFKHWIXZHCTN-IBGZPJMESA-N 411.502 2.142 10 20 HECD CCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 727483338 FNYYYLQOLAPVBM-LJQANCHMSA-N 405.564 2.213 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 729523922 YQWZDTFNQJLFST-UHFFFAOYSA-N 423.517 2.119 10 20 HECD CC[C@@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730122303 CXDWYLVGWBKLHX-CVEARBPZSA-N 407.534 2.070 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC3CCOCC3)cc2F)C[C@@H](C)O1 742278205 KQZJVBMGDLPWOX-GASCZTMLSA-N 400.516 2.285 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1 742830150 FHKRKAZMSWSBJA-KRWDZBQOSA-N 417.531 2.406 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1C 743254051 JUKKBFJQFASPHO-UHFFFAOYSA-N 416.452 2.395 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)Cn4c(cc5ccccc54)C3=O)ccc21 746879434 OJOMRHXBBWVYOB-UHFFFAOYSA-N 416.481 2.323 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(C)c2F)cc1 749140985 GVGZVYKADDCNKQ-UHFFFAOYSA-N 416.452 2.395 10 20 HECD Cn1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1=O 751063044 JPHSGHRAQBAMAI-UHFFFAOYSA-N 405.457 2.206 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](c4ccco4)C3)cc2)C1 753928301 FZZUROMJFYRNLE-PXNSSMCTSA-N 412.490 2.264 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N1CCN(c2ccccc2O)CC1 759579637 NGIHCIOMPTZHJR-VIHMKRCTSA-N 412.442 2.097 10 20 HECD COc1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc(C(=O)O)c1OC 761285977 BSSUPCKTVTVUBN-UHFFFAOYSA-N 420.487 2.263 10 20 HECD CC(C)c1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n[nH]1 763008428 ILNBRRSTGKXSGI-ZBFHGGJFSA-N 413.526 2.190 10 20 HECD C[C@H](N[C@H]1CCCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765422605 ANNPSGPFZRBLTE-GJZGRUSLSA-N 401.960 2.251 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 773580971 MSJFIQCPJLRXCF-UHFFFAOYSA-N 420.510 2.431 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccccc1CN1C(=O)CNC1=O 782251500 OBCCEOLWASJPTP-UHFFFAOYSA-N 409.446 2.235 10 20 HECD O=C(COC(=O)c1cccc(S(=O)(=O)CC(F)F)c1)c1ccc(O)c(O)c1 783603959 GJFWTTXKAXOHOC-UHFFFAOYSA-N 400.355 2.176 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nnn(-c4ccccc4)c3C)cc2)CC1 786255285 MOVLFMIJGJASLS-UHFFFAOYSA-N 418.501 2.174 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@H]12 788921075 UJOJCMVBFWRPHV-ZQOQTTQJSA-N 411.546 2.423 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccccc1 788931346 DMQBTWSMNVWTLC-YADHBBJMSA-N 406.530 2.465 10 20 HECD CN(C)C[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933471 VMBQKTCAXNAFFB-OAQYLSRUSA-N 408.546 2.192 10 20 HECD CCc1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 789861606 QKDCXRIQCIMEDA-UHFFFAOYSA-N 404.561 2.191 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC[C@H]1c1ccco1 789864759 QWHLTMUORWZMRX-SFHVURJKSA-N 415.515 2.049 10 20 HECD Cn1cc([C@@H]2CSCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 790241490 VMWFMTSXAVTGOU-IBGZPJMESA-N 401.536 2.256 10 20 HECD Cn1nccc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 802013182 WFBIYWOSWKEYGR-RTBURBONSA-N 424.549 2.211 10 20 HECD CC(C)OC1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803296431 CNLVZIWFSIORTP-QGZVFWFLSA-N 403.523 2.116 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NCc2ccc(OC)cc2O)s1 805877966 CBFXNTOTNLVUOB-MNOVXSKESA-N 407.496 2.277 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCCCSc1nccs1 806282734 RQDHKBPYQYXSJB-NVXWUHKLSA-N 418.588 2.378 10 20 HECD COCCOCCN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 808791709 KZFCKISOOVPKJD-OAHLLOKOSA-N 410.470 2.384 10 20 HECD O=C1COc2c(cccc2NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)N1 810350259 DSNIXPXBFYCHKQ-UHFFFAOYSA-N 421.409 2.484 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 915269080 RIEAFQMYDPBOLH-LJQANCHMSA-N 418.515 2.398 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@](CO)(C(C)C)C3)CC2)cc1 1327599068 KBXSBUCWEXFLCD-QHCPKHFHSA-N 418.582 2.257 10 20 HECD C[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294893 VKZLNSKFPQNWJF-NOZJJQNGSA-N 408.842 2.161 10 20 HECD Cc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2n1 1843751493 LCMVISHEJDAPBU-UHFFFAOYSA-N 418.453 2.480 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2[nH]cc3c2CCC3)C1 1844648179 HIKLQVXAZHVBJS-SOFGYWHQSA-N 423.469 2.151 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 24362464 BVPVFMWFTJZSGM-UHFFFAOYSA-N 404.488 2.131 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCNC(=O)c1ccsc1 45447964 ZSQCXDGKRQBFJW-UHFFFAOYSA-N 403.504 2.136 10 20 HECD COc1ccc(N2CCCN(C(=O)CS(=O)(=O)NC3CCC(C)CC3)CC2)cc1 110845619 GTZIVCAEOAGORW-UHFFFAOYSA-N 423.579 2.232 10 20 HECD CN1C[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 726537724 PPLBRONLVLVPGB-VSXLWIIGSA-N 409.558 2.076 10 20 HECD COc1cccc(CNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1O 727760938 FEPJNZDVWRTANL-IXDOHACOSA-N 400.475 2.383 10 20 HECD COC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 728467280 JMJAAFZFIGKNBA-QGZVFWFLSA-N 410.474 2.497 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2nnc3ccccc3c2=O)cc1 728839436 NRWNGDOJRZKOCA-UHFFFAOYSA-N 419.407 2.449 10 20 HECD C[C@@H]1CN(C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 729599301 FGJPXGTVMRUNHB-WOIUINJBSA-N 416.566 2.306 10 20 HECD Cc1cc(C(=O)CN2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(F)c(Cl)c1 730806913 YJUPJIQKHZOEAK-UHFFFAOYSA-N 406.889 2.172 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCn3cnc4ccccc43)cc2)C1 732591329 BDHDVTNTNOIPIT-SFHVURJKSA-N 420.517 2.237 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)ncn2C)c1ccc(N2CCOCC2)cc1 743898377 HBJUTNFPPCHYHD-HNNXBMFYSA-N 407.474 2.226 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(-c4nncn4C)c3)ccc21 747017416 GGGIGWZGRZEICE-UHFFFAOYSA-N 404.474 2.119 10 20 HECD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751238492 ZXKMPCFRPWPYOF-UHFFFAOYSA-N 423.466 2.421 10 20 HECD CC(C)CNC(=O)NC(=O)[C@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1 751930916 KBDCJHCYHVHCHT-LBPRGKRZSA-N 404.492 2.343 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 752097898 CGZHZYFVNKIODP-UHFFFAOYSA-N 412.490 2.026 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@H]3CCN(C)C[C@H]3C)CC2)cc1 754365166 XGBLXBAMANEUHK-KNQAVFIVSA-N 417.598 2.189 10 20 HECD CS(=O)(=O)N[C@@H]1CCC[C@H]1CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756903022 YRUSCYWXEFFWIG-DLBZAZTESA-N 410.540 2.393 10 20 HECD CCOC(=O)c1c(NC(=O)COC(=O)c2cccc(O)c2O)oc(C)c1C(C)=O 758548812 VVWXAZCTDJCYAY-UHFFFAOYSA-N 405.359 2.174 10 20 HECD COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN1CCOc2cc(N(C)C)ccc21 762335465 XINGFRNPPWDIOP-FQEVSTJZSA-N 409.486 2.078 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[S@](=O)C[C@H](C)C1 763853963 LXBACADSIPZQGC-PWUJBNGKSA-N 424.522 2.489 10 20 HECD C[C@H](NCc1ccc2c(c1)CCO2)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 765607327 APLXHBQNYJSYCU-AWEZNQCLSA-N 424.544 2.198 10 20 HECD Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NCc1ccc(O)c(O)c1 768914810 KMNVIRNZBKZQTK-UHFFFAOYSA-N 409.368 2.420 10 20 HECD CCc1nc(-c2ccccc2NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 770116207 LDYOTEZDZZYFQD-UHFFFAOYSA-N 401.448 2.364 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccn(Cc4ccccc4)n3)nc12 772465838 IWXLPTGDIOGZTG-UHFFFAOYSA-N 421.413 2.213 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F 774921206 URROFAGIKQMJTO-AWEZNQCLSA-N 403.429 2.295 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCSC(F)(F)F)CC2)cc1 778231683 HUFIAWHWTISLOJ-VOTSOKGWSA-N 417.453 2.269 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 779515806 CBBNUQDIEYGPFJ-XSBJJCPUSA-N 407.470 2.061 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)CC1 780408961 QSSYLQQYHZWPFM-UHFFFAOYSA-N 417.516 2.161 10 20 HECD Cn1nnc2cc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cnc21 780981526 MMTFCMYURWFWIB-UHFFFAOYSA-N 420.395 2.149 10 20 HECD Cc1cc(C(=O)CN(C[C@@H](C)O)[C@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 785533402 DVADZXRFHXENTM-HZPDHXFCSA-N 402.491 2.112 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C(F)(F)c3ncccc3C)CC2)cc1 787209573 PHMNWAIKGUEEBM-UHFFFAOYSA-N 419.428 2.382 10 20 HECD Cc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310129 IWBASGNSQGNNNC-UHFFFAOYSA-N 411.502 2.033 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1cccc(F)c1 788936365 KNLQSSYAYAVRPZ-OAQYLSRUSA-N 412.509 2.461 10 20 HECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NCCCSc1nccs1 790941442 WOEWLXXSXJZQCS-LBPRGKRZSA-N 409.537 2.008 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncccc1Br 793122044 CMISKABUUWDMRY-UHFFFAOYSA-N 424.320 2.009 10 20 HECD O=C(CN1CCOC[C@H]1[C@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796344014 FQYWJOMUENIZEK-LEWJYISDSA-N 420.465 2.280 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c(O)c1 797390424 FEYJGCYVPMYWIG-UHFFFAOYSA-N 424.461 2.063 10 20 HECD CN(Cc1cccnc1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449339 WRZOFYRJEWUEMC-UHFFFAOYSA-N 418.444 2.427 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3cc(Cl)cn3C)CC2)cc1 804319601 PWKWAKOWXVSCIB-UHFFFAOYSA-N 418.925 2.431 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](c3nccn3C)C2)cc1F 804853076 SPIDPNAOJMWCES-INIZCTEOSA-N 401.486 2.038 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC([C@@](C)(O)C(F)(F)F)CC1 807097837 PKXGJOASSJTXTG-LJQANCHMSA-N 415.456 2.229 10 20 HECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100146 KWVVARGMNJYZFT-WMZOPIPTSA-N 418.538 2.050 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1-n1cnnn1 807513845 WDBNYMGVBDTUAZ-UHFFFAOYSA-N 421.244 2.238 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ncccc2F)C1 807912677 MUFVDAIZVRWZKZ-KRWDZBQOSA-N 413.497 2.030 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 809697810 OVOJXDVPUBDPQW-FUHWJXTLSA-N 418.538 2.493 10 20 HECD CCOC(=O)c1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 810395040 KUXVBWYZZVYGCA-UHFFFAOYSA-N 411.502 2.424 10 20 HECD COC(=O)CC[C@@]1(C)NC(=O)N(CN(C)Cc2ccc(N3CCCCC3)cc2)C1=O 811730720 LLDPHFLZIQMOHV-JOCHJYFZSA-N 416.522 2.330 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCc3nnc(C)s3)cc2F)CC1 811924465 SZBXJQFQJCRIRR-UHFFFAOYSA-N 406.531 2.169 10 20 HECD CCCN(CC)C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 811975040 YWUZZIHEONUNOA-MJGOQNOKSA-N 403.571 2.308 10 20 HECD COc1cc(N2CCN(C(=O)c3ncn(C(C)(C)C)n3)CC2)cc(OC)c1OC 812543906 NBFIZDIODKYCAR-UHFFFAOYSA-N 403.483 2.021 10 20 HECD Cc1cc(C(=O)COC(=O)CCn2ncn(C)c2=O)c(C)n1-c1ccc2c(c1)CCC2 815271084 DNNSUOAZYLLPTD-UHFFFAOYSA-N 422.485 2.294 10 20 HECD O=C(NOCC1CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 817362544 MTVZIEBCGPLUSY-UHFFFAOYSA-N 407.404 2.173 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 912980767 UKKZCDFIRLSPIE-UHFFFAOYSA-N 418.880 2.299 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918294583 HBFCQVPLPIVCDZ-LJQANCHMSA-N 411.458 2.497 10 20 HECD COC(=O)CNC(=O)COC(=O)c1cc(C)n(-c2ccccc2Br)c1C 919448721 WDEXLEPADLLSSC-UHFFFAOYSA-N 423.263 2.303 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)s2)cc1 920482682 VHKWAUSPDABKFU-UHFFFAOYSA-N 418.518 2.487 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cncc2cnccc12 1796601452 KEUSGTHELSPUJZ-MUJYYYPQSA-N 419.441 2.002 10 20 HECD C[C@@H](CN)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821293733 NZNNSWWXAPXSAP-IINYFYTJSA-N 421.885 2.375 10 20 HECD C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387012 YUOZZOWLWBCGMT-PXNSSMCTSA-N 402.539 2.360 10 20 HECD Cc1c(CNC(=O)NCCN2CCN(C(=O)C3CCC3)CC2)n(C)c2ccccc12 471898148 JCCOYLKDBJWRSZ-UHFFFAOYSA-N 411.550 2.230 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2c(O)ccc3ccncc23)c(O)nc1=O 726590511 XUAZUMPFFHUAEF-UHFFFAOYSA-N 413.478 2.238 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN(C(=O)C4CC4)CC3)CC2)cc1 726613450 MLNXWUMLLBDVHX-UHFFFAOYSA-N 400.523 2.364 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)C3CCCCC3)cc2)C1 727940219 DRSKKGDZIZIGHF-UYAOXDASSA-N 402.539 2.129 10 20 HECD CC(C)CN(C(=O)/C=C/c1cncc(F)c1)c1c(O)nc(=O)n(CC(C)C)c1N 729647990 JDBYNFNCADUIFL-AATRIKPKSA-N 403.458 2.424 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 734276833 SRJNTFGFZYBFTN-LJQANCHMSA-N 415.582 2.132 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN(C[C@@H]4CCOC4)CC3)CC2)cc1 736392866 RVQQVOYLUSHAFB-IBGZPJMESA-N 416.566 2.418 10 20 HECD O=C(CN1CCC[C@@H](N2CCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 738336182 ZOGTYAHZSXZLKP-HXUWFJFHSA-N 418.557 2.229 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCN3Cc4ccccc4C3)cc2)C1 744305472 UCUQOUIGARGOFD-OAQYLSRUSA-N 421.545 2.203 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c(OC)c1 752125148 PWJMFGQPSMIUQL-INIZCTEOSA-N 410.536 2.098 10 20 HECD COc1ccc(N2CCN(C(=O)NCCC(=O)N3CCCCCC3)CC2)cc1F 753883240 BFCAPTRRNUDDAF-UHFFFAOYSA-N 406.502 2.459 10 20 HECD COc1cc(N2CCN(C(=O)c3cn(CCC(C)C)nn3)CC2)cc(OC)c1OC 759221519 AUQJFMNWWTWXBU-UHFFFAOYSA-N 417.510 2.312 10 20 HECD O=C(COC/C=C\c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 763279270 AOMMETVIOATOOQ-DAXSKMNVSA-N 414.527 2.268 10 20 HECD CS(=O)(=O)N1CCC(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 765077073 GXEQCFRNGONGEO-UHFFFAOYSA-N 421.485 2.056 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCCS1(=O)=O 767173474 WGPUCSRSBRTYRI-ZDUSSCGKSA-N 405.314 2.263 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1 772529259 IPDJODAYCQKKQN-SMDDNHRTSA-N 422.507 2.456 10 20 HECD O=C(CNc1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 772905095 BCYIAVXELWXUBG-UHFFFAOYSA-N 401.438 2.162 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 773750763 WOJXAFMZHPVMGL-JTQLQIEISA-N 407.352 2.453 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1ccccn1 774125354 ZZCCJVCQSSSOHH-UHFFFAOYSA-N 406.280 2.257 10 20 HECD COc1ccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)nc1 775090556 SXJFOLRWEFMLQP-UHFFFAOYSA-N 416.478 2.148 10 20 HECD O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775157910 BNXHYBWIOSAQEN-ZIAGYGMSSA-N 401.290 2.210 10 20 HECD COCCO[C@@H]1C[C@@H](CO)CN(Cc2cc(Br)cc(OC)c2O)C1 775203545 LUAWLOJFZYIJPM-IUODEOHRSA-N 404.301 2.009 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3cccc(C)c3O)CC2)cc1[N+](=O)[O-] 775643122 MRXYCXDFHBOFNN-UHFFFAOYSA-N 421.475 2.124 10 20 HECD CC1(C)CN(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 776861554 KLQTXJAMWORARS-CQSZACIVSA-N 419.494 2.202 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@H](C)[C@H]3C)CC2)cc1 778285961 RRGDIHNCJSMXGA-PIIXRYACSA-N 403.548 2.252 10 20 HECD CCc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)o1 785295426 VDPUDPSOBPLRQP-GFCCVEGCSA-N 410.430 2.396 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCC2CCN(CC(F)(F)F)CC2)cc1 785439638 TYQFLBLOCWRLAN-UHFFFAOYSA-N 414.472 2.149 10 20 HECD O=C(NCc1ccc(F)cc1F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786981976 SUHOXWBSQPVTLF-QGZVFWFLSA-N 404.413 2.494 10 20 HECD Cc1ccc(C)n1C1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788309624 FJVAIFIZTJXRRN-UHFFFAOYSA-N 424.545 2.421 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 788930585 CLOUIAANEMGEDX-NRFANRHFSA-N 420.513 2.215 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789825468 LWIYZYUBEYKURW-RKVPGOIHSA-N 403.498 2.314 10 20 HECD C[C@@H](O)C[C@H]1CCCCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796386624 YBCJHRXYCWZGFM-IEBWSBKVSA-N 407.530 2.294 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 796770056 YEVUWWBDJMDWIF-UHFFFAOYSA-N 415.469 2.312 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1ccccn1)C1CC1)c1ccc(N2CCOCC2)cc1 803297704 DFYGZNXCIMZMBQ-QGZVFWFLSA-N 408.502 2.287 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)O2 806707344 RGUCFTARQRNIPR-UEUGHCDMSA-N 403.523 2.149 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 806851317 NGBOCTREUCFABH-IBGZPJMESA-N 418.488 2.375 10 20 HECD C[C@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 809401521 UCGZJYWYMNELJU-HTAPYJJXSA-N 424.545 2.473 10 20 HECD Cn1nnc2c1C[C@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 810160109 UNFVOPMCZDTTOA-CYBMUJFWSA-N 423.439 2.092 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C[C@H]3CCCS(=O)(=O)C3)cc2F)C[C@@H](C)O1 815063041 UVNLOAVHHIPHBU-HLLBOEOZSA-N 412.527 2.270 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 918199437 AMVSFZJSSSDXOL-MDOVXXIYSA-N 414.481 2.465 10 20 HECD CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918443510 CRLUGCVAELEWEK-UHFFFAOYSA-N 413.474 2.237 10 20 HECD Cc1cc(C(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c(C)n1-c1ccccn1 920301203 IAAFPURAGKOHJE-MRXNPFEDSA-N 409.442 2.388 10 20 HECD C[C@H](NC(=O)Nc1cccc(N2C(=O)CNC2=O)c1)c1ccc(N2CCOCC2)cc1 920871420 KEXXWPCHJJRTMQ-HNNXBMFYSA-N 423.473 2.462 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@H](C)O[C@H](C)C1 921203185 DAPTUJCEALVTCU-FVJLSDCUSA-N 407.530 2.412 10 20 HECD CN1CCc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)ccc21 1797545082 QCKCVQXEVRASKE-BCDXTJNWSA-N 422.485 2.051 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C2(F)CCC2)[C@H]1c1cccnc1 1813682780 NKZPCECQTBHCLW-KBXCAEBGSA-N 414.437 2.100 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848510 NRMNNIDPWQRJNW-RSNWOKGLSA-N 423.832 2.446 10 20 HECD C[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740480 JSHYQJOZLSRBCT-BLLLJJGKSA-N 410.898 2.365 10 20 HECD CC(C)CNC(=O)NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 5452709 TVLMEISGRHJKAI-UHFFFAOYSA-N 408.410 2.101 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCC[C@@H](C(=O)NC(C)C)C2)n(C)c2ccccc12 553082565 HVQJQLQQYDCSAC-IAGOWNOFSA-N 412.534 2.303 10 20 HECD Cc1nccn1-c1ncccc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 726236230 JHHBQZINOYZGLG-UHFFFAOYSA-N 406.490 2.412 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN3CCC[C@H](C)C3)CC2)cc1 726239765 YHNGAZKZABSAJF-VQTJNVASSA-N 417.598 2.237 10 20 HECD C[C@@H](NC(=O)NCC(=O)N1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 726244716 FLLKONMFBJXBRD-QGZVFWFLSA-N 408.502 2.473 10 20 HECD CC(C)N1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 727832208 PJJPPNZOXXZDOO-KDURUIRLSA-N 420.573 2.472 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)c1 729062343 QMUKOWMAZGXRNX-STQMWFEESA-N 415.446 2.190 10 20 HECD C[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2O1 730017341 NWAPTFNAMJRHJB-CQSZACIVSA-N 406.479 2.464 10 20 HECD COC(=O)CNC(=O)[C@H](C)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036492 MUTQJICHWYCMAN-AWEZNQCLSA-N 405.495 2.142 10 20 HECD COc1ccc(N2CCC(NC(=O)COCCNC(=O)OC(C)(C)C)CC2)cc1 732553110 MBLUMESBALPANI-UHFFFAOYSA-N 407.511 2.322 10 20 HECD CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)c1ccccc1OCC(=O)NC 734065839 JKXMGRFQNUJGJI-QGZVFWFLSA-N 401.463 2.476 10 20 HECD CS(=O)(=O)c1cc(S(=O)(=O)NCCCSc2nccs2)ccc1F 735315104 BCKYCVKDJIODHF-UHFFFAOYSA-N 410.539 2.146 10 20 HECD C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N(C)Cc1ccc(N(C)C)cc1 735518146 IPOBZDZSKQLCSF-LJQANCHMSA-N 410.566 2.500 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)CC2)cc1 735750373 SIBORTPNULRHAD-UHFFFAOYSA-N 422.482 2.272 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[S@](=O)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 736653538 PRZNNLORADBYFK-FMOZCYMHSA-N 411.543 2.490 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 742497809 KQSKPRDVVOXLCU-QCFAMHMHSA-N 413.518 2.044 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc(N2CCOC2=O)cc1 743049074 LXKNICAYOFQLDG-UHFFFAOYSA-N 403.460 2.297 10 20 HECD C[C@@H]1CN(CCNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 745790573 BALZOEYHAZFPKQ-CVEARBPZSA-N 412.481 2.277 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3csc([C@H]4CCCO4)n3)nc12 756461500 JSPIRMNZHQBUAB-CYBMUJFWSA-N 418.431 2.277 10 20 HECD C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(Br)cc1O 756562700 IJKKRRAXBDTGTB-LBPRGKRZSA-N 405.358 2.314 10 20 HECD C[C@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)c(F)cc1O 756583479 ODNXFBHVWIUZAR-UONOGXRCSA-N 416.335 2.351 10 20 HECD CCn1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757272451 OTMFBPMROOPHFK-ZDUSSCGKSA-N 407.421 2.228 10 20 HECD COC(=O)c1cc(NC(=O)CN(C)c2ccc(OC)c(F)c2)cc(C(=O)OC)c1 757851239 GMHWDLWDSAHDLN-UHFFFAOYSA-N 404.394 2.482 10 20 HECD Cc1ccn2c(CN3CCN(Cc4cc5c(cc4O)OC[C@@H]5O)CC3)c(C)nc2c1 768442008 NFAJDWGJOWMREN-NRFANRHFSA-N 408.502 2.400 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N(C)C3CCCCC3)CC2)cc1OC 768451281 MFIKVZTWHFSJBM-UHFFFAOYSA-N 405.539 2.318 10 20 HECD CN(CCc1cnccn1)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 770826195 BEESGIIIUUJGKP-UHFFFAOYSA-N 416.393 2.475 10 20 HECD Cc1cc(Br)cc(CN[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 779432529 UHUMEEDTXGPTAS-GOEBONIOSA-N 404.326 2.289 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3[nH]2)cc1F 779627768 NPCLMMIYRKRQJC-MOPGFXCFSA-N 400.454 2.259 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1 785297733 RVWULHIFHLBUSH-SNVBAGLBSA-N 413.352 2.120 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc4c[nH]nc4c3)CC2)cc1 786556494 QQUXXPJAOVLYSE-UHFFFAOYSA-N 408.458 2.006 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 788669222 RSLUUASLKLMQCY-ROUUACIJSA-N 421.453 2.348 10 20 HECD CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799142 JLRAEMMSTICCBD-DLBZAZTESA-N 423.554 2.411 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccc(C)cn3)CC2)cc1 789868529 ZNLFJFDRWNGWDX-ZHACJKMWSA-N 408.502 2.262 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCOCC(F)(F)C(F)F)cc2)C1 790379765 QAJFJLFKWUNWFB-CQSZACIVSA-N 419.419 2.312 10 20 HECD CCc1nn(C)c(CC)c1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790380010 QUDDBIXXLNZRCP-QGZVFWFLSA-N 411.550 2.106 10 20 HECD CC[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793733238 LUPZDGXPROAWTF-JPYJTQIMSA-N 414.550 2.043 10 20 HECD CC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCCO1 799201287 UWBQADYPKXSTKP-SFHVURJKSA-N 419.547 2.425 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1cc(C)c2c(=O)n(C)c(=O)n(C)c2n1 801548347 SVEBTSNSQVPXHL-UHFFFAOYSA-N 410.474 2.089 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC(C)(C)c2ccc3c(c2)OCO3)cc1F 803661804 OADYFXLWOIWQSI-UHFFFAOYSA-N 415.465 2.331 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCc1cccc(C(=O)N(C)C)c1 807593426 LIUQTEXSOQFSHG-UHFFFAOYSA-N 411.502 2.192 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807768131 CWDKKRFDZUSUEM-GJZGRUSLSA-N 411.449 2.010 10 20 HECD O=C(N[C@@H]1CCOC2(CCC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809458813 XZDRLSMCTVEABH-QZTJIDSGSA-N 402.491 2.118 10 20 HECD COCCN(Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 809762993 GSQPGGKEZQRFFY-QGZVFWFLSA-N 411.524 2.221 10 20 HECD NS(=O)(=O)c1c(NCc2ccc(N3CCC(CO)CC3)cc2)cccc1[N+](=O)[O-] 917390758 FMNAVCWDLWQYBM-UHFFFAOYSA-N 420.491 2.063 10 20 HECD Cn1cc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)cn1 917722190 SJTQLTFLBCMGMO-LBPRGKRZSA-N 424.548 2.070 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1nncn1-c1ccccc1 918210407 VAWXCSQWGIJQLR-UHFFFAOYSA-N 420.517 2.475 10 20 HECD C[S@@](=O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1357681307 NHFVFRBCMBGISC-HHHXNRCGSA-N 407.458 2.110 10 20 HECD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)o1 1799767064 OUENNBKBZBSNBS-FVCICTRLSA-N 420.849 2.170 10 20 HECD Cc1cc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 728937736 JJFVVTWOXWZGKG-GOEBONIOSA-N 422.478 2.082 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)cc2)CC1 731131488 KZAWKRXRLKWASY-UHFFFAOYSA-N 419.489 2.154 10 20 HECD CC(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 746783058 HRONHIIWSOBWNP-GJZGRUSLSA-N 417.485 2.472 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(C[C@@H]2CCOC2)CC1 749554263 POBLUOVPIMFIED-IBGZPJMESA-N 404.580 2.104 10 20 HECD CNC(=O)Cc1nc(-c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cs1 749909871 TWYVWSLQHYWCEA-UHFFFAOYSA-N 404.517 2.154 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc4nc(O)oc34)CC2)cc1 751562545 FOQHLYRWXIGSNZ-UHFFFAOYSA-N 410.474 2.484 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc3cc([N+](=O)[O-])ccc3o2)c1 751650546 UAAXSFYCYKZPSS-UHFFFAOYSA-N 407.360 2.170 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nc2nc(O)nc(O)c12 752147870 CRSUNLCUAIEMTK-AWEZNQCLSA-N 410.430 2.271 10 20 HECD Cc1nnccc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 753524584 JRUBGPHOEKOXFA-OKILXGFUSA-N 416.453 2.011 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2cc(C)cc(OC)c2O)c(O)nc1=O 754729523 ABTUOLJXMRZWBI-UHFFFAOYSA-N 406.483 2.007 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H](O)c3cccc(F)c3)CC2)cc1 756264674 XLXXVCGMHRQTRU-FQEVSTJZSA-N 416.449 2.150 10 20 HECD CCCN(CC(=O)Nc1ccccc1OC)C(=O)COC(=O)c1cccc(O)c1O 758580222 JPIKKRFQFLXWSL-UHFFFAOYSA-N 416.430 2.141 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)Oc3cccnc3)CC2)cc(OC)c1OC 759225177 MFLNQMDSWZDTLC-OAHLLOKOSA-N 401.463 2.224 10 20 HECD COc1cc(N2CCN(C(=O)c3c(C)nn4cccnc34)CC2)cc(OC)c1OC 759237586 LEYKSTRCXZQHAF-UHFFFAOYSA-N 411.462 2.026 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 759380153 WELJDAHIAIALFF-CYBMUJFWSA-N 400.431 2.007 10 20 HECD Cn1ccnc1[C@@](O)(CC(=O)NCc1cccc(Br)c1O)C(F)(F)F 765730401 URDLECWVDKBVAY-AWEZNQCLSA-N 422.201 2.345 10 20 HECD CC(C)CN1N=C(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCC1=O 768168025 VANGYACOLMBDKW-UHFFFAOYSA-N 400.523 2.146 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 772448741 XKTLIGFHXJYXSH-ROUUACIJSA-N 412.577 2.391 10 20 HECD C[C@@H](NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(N(C)C)cc1 773981962 HWUJRQJHDKWSAF-GFCCVEGCSA-N 406.460 2.262 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H](c1ccco1)N1CCCC1 774871390 QGGQLUQFPVBSIJ-HXUWFJFHSA-N 410.518 2.449 10 20 HECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(O)c(C)c2)s1 776747451 DYCSJPDBCWLHSD-UHFFFAOYSA-N 404.535 2.045 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(O)(C(F)F)CC1 779528487 JOGPXQDIVHQBBU-UHFFFAOYSA-N 401.429 2.088 10 20 HECD COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 781540818 XBVUJUYHVPOQJO-UHFFFAOYSA-N 400.431 2.305 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](OC)c3ccccc3)CC2)cc1 786659426 ZHQWMWPISKTZBW-NRFANRHFSA-N 411.502 2.284 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1cccc(F)c1)C1CC1 788319719 MUPWPDNZSQFASE-UHFFFAOYSA-N 411.477 2.470 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccc(N2CCOC2=O)c1 789542218 RJDGOAHLMFXLSI-UHFFFAOYSA-N 411.458 2.404 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nccs1 789802467 YOJHRNICYDJNKO-OAHLLOKOSA-N 406.483 2.003 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)cc2F)C[C@@H](C)O1 789826659 PWWHUSJMAZQTIP-ZNMIVQPWSA-N 402.470 2.261 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860196 JLHHDWSSDBOBIJ-AWEZNQCLSA-N 416.547 2.208 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@H](C(C)(C)C)C3)CC2)cc1 791153750 GWBSCRGXVLUACY-QJRAZLAKSA-N 415.534 2.174 10 20 HECD CN1CCN(c2ccc(CN3CCc4ccc(S(=O)(=O)N(C)C)cc43)cc2)CC1 792178263 ZGVOKPKTITZXBR-UHFFFAOYSA-N 414.575 2.251 10 20 HECD COc1ccc(CNC(=O)[C@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)c(O)c1 794378853 WYWSRBBKTYKSBH-QHCPKHFHSA-N 421.453 2.159 10 20 HECD COCn1nccc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 795092453 GCBFURINDCERNT-UHFFFAOYSA-N 416.450 2.036 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)NCCF 800710832 XRIKKGVTEHPSKR-QWHCGFSZSA-N 402.417 2.030 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(Cl)cn1)c1ccc(N2CCOCC2)cc1 803300431 RZFVFAFBDGQJDV-CQSZACIVSA-N 402.882 2.065 10 20 HECD COc1ccc(N2CCN(c3cc(S(=O)(=O)N4CCCC4)ccn3)CC2)cc1F 804539133 BOKVPEYKRBUZCW-UHFFFAOYSA-N 420.510 2.340 10 20 HECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(C)c(O)c1O 804885208 MFHPMUSMWYTYAS-CQSZACIVSA-N 408.451 2.031 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](O)C(C)(C)C3)CC2)cc1 806334430 OMBWYMCHLIPUOH-FQEVSTJZSA-N 404.555 2.010 10 20 HECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807286974 FZHNDJVMYVGCBJ-KRWDZBQOSA-N 409.486 2.271 10 20 HECD CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807610871 MUTVVLKLJLKTSU-CUDHKJQZSA-N 416.518 2.220 10 20 HECD C[C@@H](c1nccs1)N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807675663 ZNSIISGAATZEJN-CVEARBPZSA-N 415.563 2.292 10 20 HECD NC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCCC3)cc2)=NN1c1ccc(F)cc1 915081038 DJKBQXGTKNSABF-FQEVSTJZSA-N 409.465 2.162 10 20 HECD Cc1cc(C)cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918463556 KPTMJDPPXJUXMM-SFHVURJKSA-N 408.502 2.260 10 20 HECD NC(=O)CSc1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968589 JCPPIDHPHQLSOT-UHFFFAOYSA-N 413.543 2.403 10 20 HECD CCc1ccc([C@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N(C)C)cc1 920980563 QEVHLNCYISZZQG-RLGUWMIQSA-N 402.564 2.225 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@H]1CCc2ccoc2C1 1796600963 LQSYRXWZWUBSFL-LLLHUVSDSA-N 411.458 2.143 10 20 HECD Cc1[nH]ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818314893 WTOKQMZOUNGKSC-OAHLLOKOSA-N 410.434 2.472 10 20 HECD O=C(CCc1ccoc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442235 IEFFWZSHCNFGQN-UHFFFAOYSA-N 420.469 2.209 10 20 HECD COc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846851583 HLFXUHUHKFVSGU-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CCN(C(=O)COC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@@H]1CCS(=O)(=O)C1 5643805 BPMFCWWXMRGBAB-LJQANCHMSA-N 418.515 2.287 10 20 HECD O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 303056304 ZDBSIWPFZKWNCE-UHFFFAOYSA-N 421.419 2.111 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccc(Cl)nc3)cc2)C1 725825506 OOGXMEBOBSRXQO-INIZCTEOSA-N 422.938 2.056 10 20 HECD Cc1cccc(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 726829579 MUGJYVRMMIGMOU-UHFFFAOYSA-N 400.450 2.373 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)N2CCN(c3ccccc3O)CC2)c(O)c1O 727005470 QNYAUFPJQOGOCK-CQSZACIVSA-N 400.431 2.006 10 20 HECD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 728022023 KSQBAYCGRQWLJO-HPMVAKFTSA-N 403.548 2.397 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1 728943064 FLXNYSJAZUMXOH-ZDUSSCGKSA-N 404.467 2.016 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3CN3CCCC3)cc2)C1 729599179 OGNAPGVZLYMSNN-CTNGQTDRSA-N 413.566 2.158 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 730808976 UVUYSFGWHGZXMH-ZHALLVOQSA-N 407.530 2.414 10 20 HECD O=C(COC(=O)c1cc(O)cs1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 732353664 JJKVJQQLYXBKSZ-UHFFFAOYSA-N 424.500 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)N[C@@H]3CCN(c4ccccc4C(N)=O)C3)ccc21 732575601 FTSXFODICBSJEM-GOSISDBHSA-N 407.518 2.246 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1O 737285846 LRAICQLUABFIPD-UHFFFAOYSA-N 417.849 2.201 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(-n4cccn4)c3)CC2)cc1 739495173 UBUYZOHMNSIOBH-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1OC 740609861 NOEHRBKWDREBMB-UHFFFAOYSA-N 419.503 2.206 10 20 HECD Cc1nc2cc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc2n1C 743889039 JMLUQYKKWBRMOX-UHFFFAOYSA-N 421.501 2.315 10 20 HECD COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 747860303 SRDNXJJDWBDUBW-UHFFFAOYSA-N 408.461 2.140 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1c(F)cccc1F 752657182 OWXBZBVCQBXOJF-UHFFFAOYSA-N 411.474 2.358 10 20 HECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc3c(c1)CCCN3C)C2=O 756957635 XOYNJMWXVQTUED-HZPDHXFCSA-N 412.534 2.432 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC1(C)OCCO1 758701535 MQGSRLNAJNKBHA-HNNXBMFYSA-N 409.502 2.375 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCC[C@H]3OC)CC2)cc(OC)c1OC 759297014 HGOSLHRTZMJXII-NVXWUHKLSA-N 407.511 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(OC)cc(C)c3N)CC2)cc1 759744433 LLTCIWJTODUDSU-UHFFFAOYSA-N 413.474 2.100 10 20 HECD CC(C)[C@@H](CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)N1CCN(C)CC1 760989840 HRCVBPGKZAWKAF-QGZVFWFLSA-N 408.930 2.082 10 20 HECD CN(C)c1ccccc1N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 762927872 XSDIMWADLUDJMA-UHFFFAOYSA-N 400.498 2.481 10 20 HECD O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NCCCSc1nccs1 765490955 IDNJVZHRESLJTK-UHFFFAOYSA-N 406.493 2.137 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCn4nc(C)cc4C)n3)CC2)cc1 771059271 ZDSSSILICHILMU-UHFFFAOYSA-N 424.505 2.026 10 20 HECD COc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772953007 IWTNUYVSUNGVNO-UHFFFAOYSA-N 411.502 2.467 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773084906 UKOZRLBVKHRQBK-INIZCTEOSA-N 417.531 2.265 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773846786 OIXUKWGCLKNPFU-AWEZNQCLSA-N 407.478 2.242 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCc4ccccc4C3)CC2)cc1 775124473 YFNFYAOVQFQYPJ-FQEVSTJZSA-N 407.514 2.408 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CC[C@@H](SC)C3)CC2)cc1 778287877 FLVFPOCXXSUWED-LBDIVEORSA-N 403.548 2.300 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 779473620 VPCUDRJLFHVDKV-WQLSENKSSA-N 404.488 2.458 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nnnn1C1CCCCC1 787675471 QTRAHQIFSREYSM-LLVKDONJSA-N 409.468 2.173 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(c3nccs3)CC2)cc1 788977455 OABLOUKWBPXTLP-UHFFFAOYSA-N 415.563 2.391 10 20 HECD CC(C)[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789860471 LTHQPBIZXPJLAJ-PKOBYXMFSA-N 405.564 2.176 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1ccc2ccccc2c1=O 790727943 ZBWZPQWRBSKPCW-UHFFFAOYSA-N 407.470 2.269 10 20 HECD CNC(=O)Oc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 793906190 DMTGONPYUNUIIS-UHFFFAOYSA-N 416.453 2.109 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2COC(=O)N[C@H]2CCOC2)cc1 796623547 LWVHFKMVZONMPM-PKOBYXMFSA-N 404.511 2.332 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1OC 796668858 BEHBJVUWEJFRRJ-UHFFFAOYSA-N 411.458 2.337 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccoc1C1(O)CCOCC1 798152834 DXQJMYWOPNXUKV-UHFFFAOYSA-N 400.475 2.386 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3ccc(C=O)cc3)cc2)CC1 803161889 JBUYGOSMLYPRCA-QGZVFWFLSA-N 409.486 2.251 10 20 HECD C[C@H](CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803300340 RHUZZOYAKYNKRU-HZPDHXFCSA-N 416.547 2.419 10 20 HECD Cc1cccnc1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449026 LWAQQKSAMJLODU-UHFFFAOYSA-N 418.444 2.393 10 20 HECD C[C@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807013606 AQXPRCHRMNEKGP-RXVVDRJESA-N 412.578 2.387 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1C(F)(F)F 807385183 CYGKYMJWUXVGOG-UHFFFAOYSA-N 421.173 2.162 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)c1ccc(N(C)C)cc1 807678102 FRPLWLKVCHPZFA-OAHLLOKOSA-N 418.538 2.493 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 810449805 OBOHPLMLKCMYBA-UONOGXRCSA-N 405.449 2.307 10 20 HECD Cc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918441177 XNVIPUUGXXXMCT-UHFFFAOYSA-N 403.429 2.489 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(-c4ccccc4)c3C)nc12 919031609 RCSGMEJNWDGZAK-UHFFFAOYSA-N 421.413 2.463 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2C1 919793950 AHOWGSODFAYTDB-HXUWFJFHSA-N 409.486 2.484 10 20 HECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCC[C@H](C)C1 920636292 QKNFJVQOBOZELO-SUMWQHHRSA-N 412.508 2.204 10 20 HECD C[C@H](OC(=O)[C@@]1(F)CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1117344682 CIQQFIFPDNJBMN-AMXDTQDGSA-N 411.385 2.461 10 20 HECD Cc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1794976779 BGMHZENXDVZWIX-CLLJXQQHSA-N 423.585 2.169 10 20 HECD CC(C)CC(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1809053228 DXLGTTVEHWRQSN-UHFFFAOYSA-N 411.593 2.124 10 20 HECD CCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828199505 WNCQSDANYRJUDC-SOZJPDODSA-N 403.460 2.295 10 20 HECD C[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)Oc1ccccc1 1843250760 MFMQSIRKXIQASH-OAHLLOKOSA-N 411.458 2.167 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(Cc2ccccc2)C1=O 725866246 PAPJAPRRSKMRMI-OAQYLSRUSA-N 408.502 2.124 10 20 HECD CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NCc3ccccc3O)c2)CC1 728394333 VSLWPVKMKPPDCF-UHFFFAOYSA-N 418.519 2.040 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N(C)C)cc2C)cc1 734522514 PPZISBQGFUOFKU-UHFFFAOYSA-N 404.536 2.147 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1C 735928791 SDOXBKJPUGYGPB-HXUWFJFHSA-N 424.545 2.065 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1 741145312 RIVXIZRFFYRRIM-SFHVURJKSA-N 421.497 2.299 10 20 HECD CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 743736431 XPOFLBQKYJCURD-KRWDZBQOSA-N 403.504 2.110 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745903260 FCOBWXLWPZDMMK-HUUCEWRRSA-N 410.465 2.424 10 20 HECD COc1cc(Br)cc(CNCCNS(=O)(=O)c2cccs2)c1O 746746755 ACHAALGBVKOLIY-UHFFFAOYSA-N 421.338 2.293 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCOc3ncccc3F)cc2F)CC1 746795639 KUJJEXQQPZIYTR-UHFFFAOYSA-N 419.476 2.380 10 20 HECD COc1ccc(-n2c(C)cc(CN(C)C(=S)NCCS(C)(=O)=O)c2C)cc1 749833437 OIMKYRHFZGBYHJ-UHFFFAOYSA-N 409.577 2.454 10 20 HECD COc1cccc(OC)c1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756916305 LBIKPUQQDWOGFJ-KRWDZBQOSA-N 411.502 2.264 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3cc(N4CCCC[C@@H]4CO)ncn3)cc2)CC1 764916089 DYPUDNHYISWJGJ-OAQYLSRUSA-N 424.549 2.108 10 20 HECD CC(C)(C)n1ncc2c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ncnc21 766406148 PFLAMKITJHGISJ-UHFFFAOYSA-N 414.535 2.428 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c(C)s1 768441183 WWMQDANSGVAEQJ-QGZVFWFLSA-N 424.544 2.003 10 20 HECD O=S1(=O)CC[C@H](N(Cc2cc3c(cc2O)OC[C@@H]3O)Cc2ccccc2F)C1 768463478 JOMBKXJNCSOZSQ-KXBFYZLASA-N 407.463 2.146 10 20 HECD CC(=O)[C@H](Cc1c(F)cccc1F)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 768630733 ISYVIGNMUSZYFI-KRWDZBQOSA-N 413.398 2.399 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCNC(=O)OCc1ccccc1 771775243 WAPCKDBFRCBXDU-UHFFFAOYSA-N 419.503 2.208 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cnn(CC(F)F)c3)n2)c[nH]1 777668690 ZXJMKELLPHSRLM-UHFFFAOYSA-N 417.419 2.187 10 20 HECD O=C(CN1CCC[C@@H]1C1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 777741867 CKPIESBFBLDKRD-HXUWFJFHSA-N 405.514 2.170 10 20 HECD O=C(COC(=O)c1ccc2cc[nH]c2n1)NCc1ccc(N2CCOCC2)c(F)c1 782374271 NRVNBFNPVBHVJR-UHFFFAOYSA-N 412.421 2.012 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1N1CCOCC1 783319829 UXRZMVLEBDGZHS-UHFFFAOYSA-N 422.529 2.469 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](c3ccccc3)c3nccn3C)ccc21 785601461 VFLIHVWEEVYXMD-OAQYLSRUSA-N 417.513 2.325 10 20 HECD CN(CCN1CCOC(C)(C)C1)C(=O)NCc1ccc(N2CCSCC2)cc1 788874761 NAHLNLDVRBUJKU-UHFFFAOYSA-N 406.596 2.492 10 20 HECD CCOC(=O)C1CCC(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788935718 CVXFGLKGHXOMGK-UHFFFAOYSA-N 401.507 2.141 10 20 HECD CCCCN(CCOC)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820361 PYYVXNKQHMRTSG-IAGOWNOFSA-N 423.529 2.331 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@@H](C4CC4)C3)CC2)cc1 792010583 ZFQYOGXOIABTJG-PGRDOPGGSA-N 416.566 2.416 10 20 HECD COCCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 793801623 KJSLWCQQRGNXAP-UHFFFAOYSA-N 409.486 2.021 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 795905910 CBLCEAXHRAJMMM-NUJGCVRESA-N 422.497 2.415 10 20 HECD CCn1ncc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C(F)(F)F 799262945 NGNCVXSRMWEBKB-VIFPVBQESA-N 400.357 2.019 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)cc1 806688930 AYJMZLPTYCSAEK-IBGZPJMESA-N 403.523 2.293 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@@H]([S@@](=O)CC)C1 809234548 NCRFGOSUQPEUJB-YPQLRWHESA-N 407.580 2.297 10 20 HECD O=C(O)CCc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917918666 RTEMOLHLEQUVTN-UHFFFAOYSA-N 422.478 2.158 10 20 HECD C[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(F)cc1 917955056 WFBYZIYUNXIDBW-MRXNPFEDSA-N 420.506 2.483 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(-c4ccc(C)o4)[nH]n3)nc12 919329731 SQYTXIYDWHIPLX-UHFFFAOYSA-N 411.374 2.260 10 20 HECD CC(C)CN1C[C@H]2CN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CCN2C1=O 1324829314 PYHDISSBNNIGNJ-LJQANCHMSA-N 403.546 2.155 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1 1335132784 HBRNIJUKMLDRKP-UHFFFAOYSA-N 422.485 2.100 10 20 HECD COCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806493401 FXZOPNFHTDFGCY-FZKQIMNGSA-N 419.865 2.112 10 20 HECD Cc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543063 QQFKYHYSTLXQCB-UHFFFAOYSA-N 410.474 2.355 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCn1cnc2ccccc2c1=O 26128290 IYXXPFVBGGYSHQ-UHFFFAOYSA-N 422.485 2.054 10 20 HECD CS(=O)(=O)c1ccc2c(c1)N(S(=O)(=O)c1cccc3nsnc13)CCC2 604571396 BQPGZGZWPVEPML-UHFFFAOYSA-N 409.514 2.236 10 20 HECD COCCCN1CCC(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 727034103 GMSUXQHFAABLMS-UHFFFAOYSA-N 404.555 2.464 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2Cl)cc1C(=O)O 728015988 ZWKAODLGDLNFCR-UHFFFAOYSA-N 404.853 2.211 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)C1 731217569 FEFCEXDQINYXSQ-UYAOXDASSA-N 415.582 2.275 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCOc3cccc(C=O)c3)cc2)C1 731613278 XEURCXNFYVNYMA-IBGZPJMESA-N 409.486 2.286 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)c1ccccc1 732757020 FAYUJYABBLORFJ-QGZVFWFLSA-N 414.527 2.447 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 734703071 IYQLGIQJMSJIGP-UHFFFAOYSA-N 403.504 2.110 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCN2CCOC2=O)NC(=O)OC(C)(C)C)cc1 742751997 YRBUNXJBNSQZNA-QGZVFWFLSA-N 420.510 2.277 10 20 HECD Cn1cccc1CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 743556113 GAPGKCZMSDZXPL-UHFFFAOYSA-N 423.496 2.280 10 20 HECD COc1ccncc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743974678 DGINQPPVSFIMCT-ZDUSSCGKSA-N 420.416 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)c3c(C)noc3C)CC2)cc1 750271585 UFRNTMPCGDMYDA-AWEZNQCLSA-N 401.463 2.296 10 20 HECD Cc1nnc2n1C[C@H](C(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CC2 750731838 WILBVXDBHSZWLV-CKEIUWERSA-N 401.486 2.218 10 20 HECD C[C@@H](CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCCC1 753121150 JMSMSQLJDFRFGN-ICSRJNTNSA-N 415.582 2.452 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)CCc3ccccc3)cc2)C1 753122634 SSPQYVOGTDMXLH-RBBKRZOGSA-N 424.545 2.181 10 20 HECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc(N(C)C)c(F)c1)C2=O 756957044 JZGMXQANIGCZJI-GFENJXEQSA-N 404.486 2.255 10 20 HECD COc1cc(N2CCN(C(=O)CCc3cnn(C)c3C)CC2)cc(OC)c1OC 759242846 SMUPZLMLQYWQNY-UHFFFAOYSA-N 402.495 2.036 10 20 HECD COc1ccc(C(=O)NCCc2ccc(O)c(O)c2)nc1I 764850192 TYTBDUKQCYEZRT-UHFFFAOYSA-N 414.199 2.079 10 20 HECD COc1ccc(/C=C\C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1O 772320573 TVAXYLXCAMHLFO-RLGIIYIFSA-N 409.486 2.432 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccc(N(C)C)cc1 773856475 INYICKIYQPFGEK-ZDUSSCGKSA-N 421.494 2.252 10 20 HECD CC1(C)CC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC(C)(C)N1 774495231 OOYKCHAUXSCXEB-UHFFFAOYSA-N 418.607 2.281 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1 777765359 MFEBNDBUCLMKRN-CQSZACIVSA-N 413.540 2.211 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(Oc4ccccc4)C3)CC2)cc1 778257452 SIEPUECCTJWZSH-VAWYXSNFSA-N 421.497 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4cc(F)c(C)cc4c3=O)CC2)cc1 783920528 VDZQGJMFVSEIBP-UHFFFAOYSA-N 410.449 2.201 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCN(c2ccccc2)C1=O 785423242 UHLGFCXLCPVVMA-FQEVSTJZSA-N 408.502 2.023 10 20 HECD C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787003584 YUTLGKAQTMVPOL-QGZVFWFLSA-N 420.529 2.057 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC[C@@H]2c2cnn(C)c2)cc1 788950474 BFVHFUTXZGMKJH-LJQANCHMSA-N 415.563 2.199 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]1C 789863841 JZJNENUGXZGSPV-XLIONFOSSA-N 418.607 2.187 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(O)c1 792893738 YUKBUERIMZQLGZ-KRWDZBQOSA-N 412.490 2.102 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(F)cc3F)CC2)cc1 793822042 GYQBSFWCVKEWPM-UHFFFAOYSA-N 417.456 2.417 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c(O)c1 797390126 OKCLHOUQWDSIMU-UHFFFAOYSA-N 419.865 2.447 10 20 HECD COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 804975079 CUSBPGRBCYWYGL-SFHVURJKSA-N 415.412 2.160 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCc2ccccc21 805961194 VXMPOFDCIAGRLY-FQEVSTJZSA-N 407.514 2.328 10 20 HECD CC(C)(C)[S@](=O)CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 806197543 FGSKUKWILVRXOH-MUUNZHRXSA-N 406.504 2.177 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806953888 KTULCXQCJMGXKO-QLFBSQMISA-N 411.449 2.057 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCO[C@]2(CCOC2)C1 808115039 MGABDYJPRDVSPD-WMZHIEFXSA-N 415.534 2.090 10 20 HECD COCC(C)(C)CCCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 813631667 YATRPDCYJFHPQP-KHPPLWFESA-N 417.550 2.469 10 20 HECD CC(C)[C@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCOCC1 916254151 IWHOPKKDZWGTRT-UXHICEINSA-N 405.539 2.440 10 20 HECD Cc1ccnn1-c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 916676249 DIZFOHYCYUBMNV-UHFFFAOYSA-N 424.526 2.346 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1ccc(N2CCCC2)cc1 917117327 PCCBFOHZZGZNDU-UHFFFAOYSA-N 420.517 2.294 10 20 HECD CNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 917364875 PXWZLCGZQPLKKX-KRWDZBQOSA-N 404.488 2.122 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCNC(=O)c3n[nH]c4ccccc34)CC2)cc1 1116421040 HCPUDUJWQIITQY-UHFFFAOYSA-N 421.501 2.430 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nn(-c2ccccc2)cc1C 1116647125 VZXKGJWKWIBHJG-KRWDZBQOSA-N 409.442 2.496 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1CCCCNC1=O 1340795745 WLJAVIPNBSVATQ-IBGZPJMESA-N 405.454 2.001 10 20 HECD O=C(Cc1cc[nH]n1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791115790 BZCUKAKXIIIHSR-UHFFFAOYSA-N 407.430 2.206 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030193 DWTWWDORMYIHAH-JLCFBVMHSA-N 417.506 2.151 10 20 HECD COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1847927721 HNLILKMXKPGAEZ-GJZGRUSLSA-N 417.849 2.284 10 20 HECD Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)Cc4ccc(N)cc4)CC3)cccc2c1 237931712 LWNXZQXKYARREV-UHFFFAOYSA-N 424.526 2.201 10 20 HECD COc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1C(=O)N(C)C 525226296 YCTCAJAFKCHYBV-UHFFFAOYSA-N 419.503 2.051 10 20 HECD C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 726615843 HETNIIZACXPNJC-JKSUJKDBSA-N 420.529 2.376 10 20 HECD Cn1c(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc(=O)n(C)c1=O 731036921 SKAWGSQSJDDFKK-UHFFFAOYSA-N 414.506 2.062 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)CN3CCCCC3)CC2)cc1 743363207 NLDQGVGQIRUPCH-FQEVSTJZSA-N 417.598 2.238 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(SC)CCOCC3)CC2)cc1 743566620 INLXYILWWZEHLO-UHFFFAOYSA-N 422.595 2.029 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(CCNC(=O)c3ccccc3F)CC2)c1O 750822985 YFHXSRUQSUVOHR-UHFFFAOYSA-N 417.456 2.421 10 20 HECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751359945 MABGRZSYNFWOMQ-MRXNPFEDSA-N 412.943 2.339 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 751716083 GVZYVKMJOLTYOC-INIZCTEOSA-N 417.531 2.278 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CC=CC2)cc1 752674958 ZKRMUXZXTPYOAH-QFIPXVFZSA-N 422.529 2.236 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 753446261 JMFOZAWGFVAUGV-WRHNGFHOSA-N 407.515 2.123 10 20 HECD COC(=O)CC1(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 754063740 MFITXZNDFAEDEW-FQEVSTJZSA-N 419.566 2.034 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(-c4nnco4)c3)CC2)cc1 758232848 UDOHUDUDFBVNHM-LJQANCHMSA-N 410.474 2.307 10 20 HECD Cc1cc(NC(=O)NCCCSc2nccs2)n([C@@H]2CCS(=O)(=O)C2)n1 758520439 XFHHCCQCJKOKLI-GFCCVEGCSA-N 415.566 2.312 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c1C(=O)O 761258425 FMDQTTHMHRDKTE-UHFFFAOYSA-N 404.488 2.317 10 20 HECD CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NCCc2ccc(O)c(O)c2)cn1 761647207 QSRSVOXFRRBXFF-UHFFFAOYSA-N 416.459 2.051 10 20 HECD C[C@@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)C[C@@H](C)O1 765063370 YNCMRXIVWNOALU-CHWSQXEVSA-N 416.459 2.273 10 20 HECD COCC[C@@H](C)S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 766480017 SCKDGKMWXYZXBO-CYBMUJFWSA-N 410.458 2.386 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccccc1NS(=O)(=O)C(F)(F)F 767779790 STQDKKLUMYORQN-UHFFFAOYSA-N 404.366 2.332 10 20 HECD C[C@@H](NC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1)c1ccc(N2CCOCC2)cc1 771462572 USDGCMYRADOSOP-MRXNPFEDSA-N 422.489 2.290 10 20 HECD C[C@@H](CO)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 771779028 GPFBLQWMLZLCKZ-DAVUEJTQSA-N 415.334 2.147 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](c3cccs3)N(C)C)ccc21 774851888 DDWAFIOLGJNXAQ-SFHVURJKSA-N 400.548 2.166 10 20 HECD COC(=O)CCCN1CCC(NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 775620617 DJOADUTXXDIZQA-UHFFFAOYSA-N 407.530 2.294 10 20 HECD C[C@@H](C(=O)NCc1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 778930347 UQMDOXYWQOTUPS-VIFPVBQESA-N 419.231 2.161 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccnc(OCC(F)(F)F)c2)cc1 785423297 VSXRMQLDDDKXEP-UHFFFAOYSA-N 410.396 2.021 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cccc(C)c3)cc2F)CC1 787026886 JPJHSGQUIZHDKM-UHFFFAOYSA-N 412.509 2.209 10 20 HECD CCNc1nc(C)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)s1 788003304 IXNOJVLBJRJZNL-UHFFFAOYSA-N 401.536 2.482 10 20 HECD CCC(O)(CC)CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789820136 PMENLIOPGHXPIP-IYBDPMFKSA-N 423.529 2.113 10 20 HECD CC1CCN([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789865055 WAVZGOHUSJOZLD-SFHVURJKSA-N 418.607 2.093 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H]1c1ccc(OC(F)(F)F)cc1 790460162 INYNSWJTUMTGPF-WMZOPIPTSA-N 424.375 2.390 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 793012060 JWSKIBOUERGTJJ-UHFFFAOYSA-N 424.207 2.066 10 20 HECD COc1ccc(CNC(=O)CC(C)CC(=O)NCc2ccc(OC)cc2O)c(O)c1 794381018 HZERLJMUBNAMGB-UHFFFAOYSA-N 416.474 2.464 10 20 HECD COc1cc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)ccc1OCCO 794782146 QYVGSMSJCPTYSM-UHFFFAOYSA-N 420.849 2.390 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCCc4nn(C)cc43)CC2)cc1 798362618 ZOMNLCSUNVGBFW-FQEVSTJZSA-N 411.550 2.177 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3O[C@H](C)C[C@H]3C)cc2F)C[C@@H](C)O1 800296893 ZWKMJCXAASRUOH-FICUIRKSSA-N 422.497 2.412 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)cn3C)cc2Cl)C1 800344414 RHXVWPZXMKIRJC-ZDUSSCGKSA-N 424.954 2.492 10 20 HECD Cc1nn(C)c(Br)c1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 800847753 IXPIVZJSPGUUSP-UHFFFAOYSA-N 411.275 2.397 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 801549354 KXNICCZEWIAPJM-NRFANRHFSA-N 417.506 2.137 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CCOc1ccccc1)c1ccc(N2CCOCC2)cc1 803302436 OHWAPPXGRXWJLN-GOSISDBHSA-N 411.502 2.238 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCOC[C@@H]3C)CC2)cc1 805820945 AOMZPZSUGTVIIT-RBUKOAKNSA-N 404.555 2.179 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(N2CCCC2)n1 807100029 GQPXDJWEBAPXAV-UHFFFAOYSA-N 409.534 2.297 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)c1 807101663 ZUEIZGLVJGNCFI-UHFFFAOYSA-N 410.518 2.035 10 20 HECD COc1ccc(N2CCC(N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)CC2)cc1 809693524 WQROYOHZYWJSSX-INIZCTEOSA-N 409.474 2.076 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3cc(F)cc(F)c3)cc2)CC1 810695906 KCIZDIUWJDHEOV-UHFFFAOYSA-N 403.429 2.329 10 20 HECD CNS(=O)(=O)c1ccccc1N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 816502937 WQDGAHRRVLTFDA-UHFFFAOYSA-N 413.902 2.415 10 20 HECD NS(=O)(=O)c1ccc(NCc2cccc(Br)c2O)cc1[N+](=O)[O-] 864015339 CSLUYABWUKWMPI-UHFFFAOYSA-N 402.226 2.322 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCOC4=O)c3)cc2)C1 917837620 YUYXSJWYHIVXMD-GOSISDBHSA-N 422.485 2.275 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccn(-c2ccccc2)n1 918763335 INJTUUGKGLTNSP-UHFFFAOYSA-N 423.448 2.103 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)C(=O)OC4)CC2)cc1 1319599390 YVVXGQLZNQLSFZ-UHFFFAOYSA-N 402.472 2.267 10 20 HECD Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1320506908 LKBDANLCMVVUIX-UHFFFAOYSA-N 418.519 2.076 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)OCCCO2 1320691569 CBQXHIAHJYDVAI-HNNXBMFYSA-N 401.415 2.163 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1800716318 AHYMGOFDJHSYSG-CLLJXQQHSA-N 404.854 2.348 10 20 HECD Cn1cc(/C=C/C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)cn1 30063314 HNYDAPOESDNTAV-VMPITWQZSA-N 400.504 2.197 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3nn(C)c(=O)c4ccccc34)cc2F)CC1 730193058 CALRGEBQRYXPRF-UHFFFAOYSA-N 423.492 2.145 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OC)cc3)cc2F)CC1 730391463 NPEAYRMTYKLOHF-UHFFFAOYSA-N 414.481 2.231 10 20 HECD CC(=O)N1CCN(C(=O)CCNC(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 730783029 BVUYUVBTVFKVSM-UHFFFAOYSA-N 410.518 2.213 10 20 HECD CCC1(CC)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 731857263 YTQXCXQABZSRFH-INIZCTEOSA-N 403.479 2.010 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@@H]1C1OCCO1 732449095 LWPCCGUWRLMTDA-LJQANCHMSA-N 407.486 2.224 10 20 HECD COC(=O)NCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733545057 VSJLNAFUENIUSW-GFCCVEGCSA-N 424.409 2.078 10 20 HECD Cc1cc(O)c(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1C 734476441 QUIAMXJJJVRXPZ-UHFFFAOYSA-N 402.516 2.371 10 20 HECD CC1CCC(NS(=O)(=O)CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 735516717 XLOSRLWWINCOAB-NKELODKYSA-N 424.563 2.398 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3COc4ccccc4C3)CC2)cc1 742939908 LOUPUIHEWGSAPC-IBGZPJMESA-N 424.545 2.368 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3ccn(CCN(C)C)n3)cc2F)CC1 743204296 OGUDYFHSAHMHCP-UHFFFAOYSA-N 417.533 2.047 10 20 HECD CNS(=O)(=O)c1cccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 743535834 ICQQPBXPPMFNSW-UHFFFAOYSA-N 403.504 2.179 10 20 HECD CCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 747967959 ZODYEULBUVLFLN-ZIFCJYIRSA-N 407.530 2.414 10 20 HECD CN(Cc1ccccc1O)C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 749242009 VBRRJTOJAXZIDJ-OAHLLOKOSA-N 404.492 2.490 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1[N+](=O)[O-] 751227050 BGVGUJQZFPGYDM-UHFFFAOYSA-N 423.466 2.482 10 20 HECD O=C1C[C@H](N2CCN3C(=O)NC[C@H]3C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 751925741 SXMGBTKNCXGQIZ-OALUTQOASA-N 418.457 2.443 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H]1CCCS(=O)(=O)C1 758663121 NLEQHUJYVJXRPX-AWEZNQCLSA-N 417.478 2.133 10 20 HECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 761650922 KSYPPPXWHSKSLB-ZDUSSCGKSA-N 415.446 2.143 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C(=O)OC)c3ccc(F)c(C)c3)nc12 767885768 UXUAZTHYGXUWCD-KRWDZBQOSA-N 416.409 2.063 10 20 HECD Cc1nc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1Br 773722576 MEQWSZNEPSUSHD-VIFPVBQESA-N 408.252 2.250 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccc(N(C)C)cc1 773844970 FNLXXQMHUSKRTM-OAHLLOKOSA-N 422.485 2.218 10 20 HECD COc1cc(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)ccc1OCC(N)=O 776116105 CUNAZCMVUQHXCB-CQSZACIVSA-N 400.479 2.186 10 20 HECD NC(=O)COc1ccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)cc1 784062256 IKILHDGYAWFXRN-UHFFFAOYSA-N 410.474 2.437 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)cc1 785435469 ZVOMHWAXKZFIBT-DEOSSOPVSA-N 408.546 2.397 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(Cl)nc3)CC2)cc1 786614599 PTMGVSNHTWDPOS-UHFFFAOYSA-N 402.882 2.145 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)O[C@H](C)C2 786631474 UQDIODXYMQNMFS-OAHLLOKOSA-N 411.502 2.326 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCO[C@H]3CCCC[C@@H]3C)CC2)cc1 787988396 NWUHWMNSXCMJMC-UWJYYQICSA-N 417.550 2.492 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1 791724624 HLYIOYHTAKSFMQ-UHFFFAOYSA-N 420.469 2.387 10 20 HECD COc1c(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(Cl)cc1C(N)=O 793032764 ILCFRUIPGYUORB-LLVKDONJSA-N 418.881 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C4CCC4)C[C@H](C)C3)CC2)cc1 795119611 GJZFDPGPPVANRV-LJQANCHMSA-N 400.567 2.150 10 20 HECD C[C@H]1CCCN(c2ccc(CNS(=O)(=O)[C@@H](C)C(=O)N(C)C)cc2Cl)C1 800148482 MJVPAAGNXUICNB-KBPBESRZSA-N 401.960 2.472 10 20 HECD O=C(NCCCOC(F)F)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450623 MQFCFKLQVQRBKG-UHFFFAOYSA-N 421.391 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCc3cccc(C)n3)CC2)cc1 804143876 BAKFUROBAHVMLH-SEYXRHQNSA-N 422.529 2.352 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCCN(c2ccccc2)CC1 806277266 VWSMKFZFCBWUBL-UHFFFAOYSA-N 404.561 2.480 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnc(C4OCCO4)s3)cc2F)CC1 806810662 YUSBLLCAJSJGBN-UHFFFAOYSA-N 420.510 2.400 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807674746 QDRCTRMOUSRUQR-YQVWRLOYSA-N 416.566 2.473 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOCC2(CC2)C1 807771108 RRFZMERYULNVFO-HNNXBMFYSA-N 423.460 2.012 10 20 HECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1[C@@H]1CCCO1 810024844 TWIVFYPQMSJHQJ-PZJWPPBQSA-N 405.514 2.168 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@](C)(OC)C3CC3)CC2)cc1 812921471 KTZNDGJHSXRTOA-JOCHJYFZSA-N 404.555 2.322 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc(CO)c1 813422243 VQEHZFPPPYBOKJ-UHFFFAOYSA-N 421.476 2.365 10 20 HECD O=c1c(Br)c(NCCc2ccc(O)c(O)c2)cnn1-c1ccccn1 814858399 WQZBJRJVIBJPKE-UHFFFAOYSA-N 403.236 2.456 10 20 HECD O=C(NCCCN1CCCCCC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 918186488 LUGGTQJAGYKPOS-UHFFFAOYSA-N 416.566 2.487 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1[N+](=O)[O-] 918284407 FRXGKLLYFVDWOB-UHFFFAOYSA-N 416.409 2.134 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(-n2cccn2)nc1 918439183 UMULBQYMOFHLTF-UHFFFAOYSA-N 422.514 2.075 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cncnc1)c1cc(O)c(O)c(Cl)c1 1794450623 OSTZWCSLKKNDNK-QDMKHBRRSA-N 416.865 2.036 10 20 HECD Cc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n1 1810549441 QAGBBLFZUXIEDR-UHFFFAOYSA-N 424.501 2.284 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)Cn2ccnn2)C3)cc1 1845398392 HLRLQBDLBSDILV-UHFFFAOYSA-N 418.501 2.203 10 20 HECD Cc1onc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1C 1845500612 UTSTZEJWSVOVOE-UHFFFAOYSA-N 405.838 2.487 10 20 HECD Cc1cc(C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c(C)n1-c1ccccn1 728550384 ZAHWJEURUACORX-UHFFFAOYSA-N 405.458 2.347 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CC(=O)NC)cc2)cc1F 731408733 DCMLDCIUMFKPTP-UHFFFAOYSA-N 414.481 2.215 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@]1(O)CCN(Cc2ccccc2)C1 735854879 SZMAXNUCDPENQS-HSZRJFAPSA-N 411.571 2.493 10 20 HECD Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 748981100 UGJQUEGMJYHSAT-UHFFFAOYSA-N 424.545 2.490 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4nc(O)n(C)c4c3)CC2)cc1 751565142 SOEMWXXADDOUCT-UHFFFAOYSA-N 423.517 2.230 10 20 HECD C[C@H]1C[C@H](NCc2ccccc2S(=O)(=O)N(C)CCO)c2c(O)ccc(F)c21 756704694 KXXLRXQDJZEFTL-BBRMVZONSA-N 408.495 2.482 10 20 HECD COC(=O)C1CCC2(CC1)NC(=O)N(Cc1ccc(N3CCSCC3)cc1)C2=O 761097544 JGGQBDQPZCEMHE-UHFFFAOYSA-N 417.531 2.394 10 20 HECD Cc1ccccc1-n1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 761897480 JIAWDSWHAQZXHC-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1 765483212 KWWDABDXFHEERB-UHFFFAOYSA-N 410.478 2.497 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)CC2)cc1 771458485 CCXJRLCCZLQBMT-UHFFFAOYSA-N 422.489 2.370 10 20 HECD CC(C)C[C@@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772899798 ZAUOJWIHZXVLAM-QFIPXVFZSA-N 419.497 2.090 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 774364388 YSSJBHIHNYVMLH-OAHLLOKOSA-N 418.421 2.092 10 20 HECD COCCN(Cc1cc(Br)cc(Br)c1O)[C@H](C)C(N)=O 775682349 WINZSUVPPIZHJL-MRVPVSSYSA-N 410.106 2.239 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@]3(C)CCCS3)CC2)cc1 778323864 LEFUSHPLKFBHDX-MHNQQFQPSA-N 403.548 2.302 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 779091254 QFLITRHKQQHKQL-UHFFFAOYSA-N 409.439 2.302 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 783451589 LQGVDPPUYVGUSJ-MRXNPFEDSA-N 412.398 2.022 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](C3(C)OCCO3)C2)c1 784029114 DVYNNEKPZNYBNT-OAQYLSRUSA-N 418.534 2.402 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cc1 785444283 RIMKMQXSIKIGOR-VQTJNVASSA-N 416.472 2.209 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3NC(=O)O[C@@H]3C)c2C)cc1 786072585 QFXGXJCMHQOTMH-FZKQIMNGSA-N 414.414 2.104 10 20 HECD COc1cc(N2CCN(C(=O)CCc3ccc(O)nc3)CC2)cc(OC)c1OC 787521675 SZPHJSIRZLZIAY-UHFFFAOYSA-N 401.463 2.094 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 788954229 HUHADARVGSMQCG-UHFFFAOYSA-N 418.538 2.228 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN(C)C3CC3)cc2Cl)C1 793936079 HUIVJYVPMPSOHU-HNNXBMFYSA-N 406.958 2.403 10 20 HECD NS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 798334067 LUTLZPWWMXOEGB-MRXNPFEDSA-N 423.922 2.087 10 20 HECD CO[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)[C@H](C)C1 799344096 RZGOJJARWHEFQW-KDOFPFPSSA-N 419.547 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](c4n[nH]c(C5CC5)n4)C3)ccc21 803686063 UUMGXEUPMUCYSW-GOSISDBHSA-N 422.533 2.087 10 20 HECD Cc1cccc(N2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)c1 803686194 YWYPKANFGVGTDE-UHFFFAOYSA-N 406.530 2.342 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc2ccccc2c(=O)n1C 803871301 FHBOZMHMWMGKAR-UHFFFAOYSA-N 407.470 2.420 10 20 HECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 804852072 YHSWKYGPQUYMNR-MSOLQXFVSA-N 404.530 2.373 10 20 HECD CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290430 IWHAQLOSQLCCKO-UHFFFAOYSA-N 424.520 2.409 10 20 HECD CC[C@H](C)[C@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)OC 914905466 IKIPMCGIRCEFJY-DJJJIMSYSA-N 401.463 2.350 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc2c1OCCO2 917709714 WPEQUXLLRWEOCF-UHFFFAOYSA-N 402.422 2.372 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCC[C@H]1C 918007658 QBBSVTIQURUINV-WSTZPKSXSA-N 415.582 2.450 10 20 HECD COCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284634 LFUKXJVWOHMLCI-UHFFFAOYSA-N 401.438 2.064 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(N2CCCC2)nc1)c1ccc(N2CCOCC2)cc1 920922344 DJFPZLGPRSTFRO-QGZVFWFLSA-N 423.517 2.334 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(-c4ccccc4)nc3)nc12 921212370 OCJZVIHCSNPGND-UHFFFAOYSA-N 419.397 2.426 10 20 HECD CC(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)no1 1796599213 GRVICOXDVIEUPJ-BTTYYORXSA-N 400.435 2.170 10 20 HECD O=C(CCc1ccccn1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546416 ANHLRTIFJYFMBQ-UHFFFAOYSA-N 424.501 2.365 10 20 HECD C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825104040 XZLYBAZMLZQMEZ-MJMJCPQHSA-N 400.460 2.307 10 20 HECD O=C(c1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426771 GGXOLZDLLZVIFK-GOSISDBHSA-N 410.474 2.435 10 20 HECD O=C([C@@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428199 LLXWCEIVIUBWNB-MSOLQXFVSA-N 415.490 2.419 10 20 HECD Cc1ccc(CNC(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 9975515 ASGQGLHXBUUQPN-UHFFFAOYSA-N 410.518 2.289 10 20 HECD Cc1c(CNC(=O)C(=O)NCC2CCN(CC(F)(F)F)CC2)n(C)c2ccccc12 574477188 DKLSZYMUWIPKEV-UHFFFAOYSA-N 424.467 2.493 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN([C@H](C)c3cccnc3)CC2)n(C)c2ccccc12 580852935 CFVCGOWPCPXLOZ-GOSISDBHSA-N 419.529 2.403 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)C[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 725823894 GYPWFGCHRNXMDP-BFYDXBDKSA-N 400.516 2.428 10 20 HECD Cc1cccc(-n2cc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)nn2)c1 725964534 UKIZIKDMURFZIH-UHFFFAOYSA-N 407.474 2.457 10 20 HECD Cc1ccnc2nc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)nn12 726566388 XNRHIUJSTYGGQJ-UHFFFAOYSA-N 402.405 2.433 10 20 HECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)NC(=O)NC1CC1 731036773 QGEHMIRRFCLZQX-UHFFFAOYSA-N 402.495 2.452 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCS(=O)(=O)NCC2CCC2)cc1 731686158 USDZFBLPSZYFPD-UHFFFAOYSA-N 410.584 2.394 10 20 HECD CC(C)NC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 732451559 WFHKXVXZVGFZFP-GOSISDBHSA-N 401.555 2.060 10 20 HECD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCCCSc1nccs1 733883894 GRLKADYQXKASJX-UHFFFAOYSA-N 402.501 2.013 10 20 HECD CN1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 740837793 RFGMWWWKPMFAFD-RAXLEYEMSA-N 409.558 2.030 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 743888952 IFIBJVKGEWVLTK-UHFFFAOYSA-N 410.474 2.095 10 20 HECD C[C@H](N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1)C(F)(F)F 749561205 FDBLMLWRGIGTOI-HNNXBMFYSA-N 400.445 2.301 10 20 HECD O=C(NC[C@@H](O)c1ccncc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 750538761 NCGVZCJETOEVGD-MRXNPFEDSA-N 419.484 2.113 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 751318341 MQLRLDAENNFPKO-SECBINFHSA-N 400.840 2.275 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@]1(O)CCc2ccccc21 752650315 PIXGBFHYXOYFNK-HSZRJFAPSA-N 413.493 2.420 10 20 HECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 753786623 WNIWUMNWRYDNAJ-INIZCTEOSA-N 418.943 2.121 10 20 HECD CNC(=O)Cc1ccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753875612 AZXMGRKTJLQANV-UHFFFAOYSA-N 400.454 2.477 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3c3cc(C)on3)CC2)cc1 754001178 YZVUWKZLIYTXCE-DENIHFKCSA-N 400.523 2.312 10 20 HECD C[C@@](O)(CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 755628127 FXLGGHJEALSMJF-JOCHJYFZSA-N 413.497 2.110 10 20 HECD CCc1noc2ncc(S(=O)(=O)Nc3ccc(NS(=O)(=O)CC)cc3)cc12 762439582 LSVZLFCCAUVRRX-UHFFFAOYSA-N 410.477 2.348 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCCO)Cc2cccc(Cl)c2)c1 770123377 FNFQOFWLYOQHNO-UHFFFAOYSA-N 412.895 2.442 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771058053 LLHVZGCRRZJOTJ-INIZCTEOSA-N 404.898 2.359 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCC[C@H]3CCO)CC2)cc1 776039243 QMWPNQQCXIELCN-FQEVSTJZSA-N 404.555 2.154 10 20 HECD COC(=O)c1ccc2c(c1)C(=O)N(CN1CCN(c3ccc(OC)c(F)c3)CC1)C2 776762412 HCXGPLUXVLCADF-UHFFFAOYSA-N 413.449 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3COc4ccc(C)cc43)CC2)cc1 778375977 OAKAPOGAWGFBRF-LCCNJJIFSA-N 421.497 2.458 10 20 HECD CN1CCC(N2C(=O)/C(=C\c3cc(Br)nn3C)SC2=S)CC1 779204082 OFZGCMPHMQOJCU-YRNVUSSQSA-N 401.355 2.478 10 20 HECD COc1ccc(CN(C(=O)c2ccc(C)c(O)c2O)[C@@H]2CCS(=O)(=O)C2)cc1 780934178 HUFUIEKHJNQCMN-OAHLLOKOSA-N 405.472 2.244 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(-n2cncn2)cc1 785395544 MHFCJOMDQMVNCE-KRWDZBQOSA-N 418.501 2.361 10 20 HECD CCN(CC)C(=O)CCCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787327858 OOLWKIMXCIEILX-UHFFFAOYSA-N 402.539 2.010 10 20 HECD C[C@H]1c2nncn2CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 791162659 XLUPELCMGSTHMQ-NSHDSACASA-N 419.488 2.063 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C)O[C@H](C4CC4)C3)CC2)cc1 792056914 ITXNUYKHARCHQL-UWJYYQICSA-N 402.539 2.026 10 20 HECD COCCN1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 798225120 NUBSBNFEQBERIT-UHFFFAOYSA-N 413.518 2.327 10 20 HECD CC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C1CCOCC1 803304939 FSRXLHBEZHMFNU-JXFKEZNVSA-N 403.523 2.022 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccccc3F)C2)cc1F 803661680 JQRRCIVMBGIJMD-INIZCTEOSA-N 416.472 2.432 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3c(C)noc3C)CC2)cc1 804317305 ZFYNXIJLGLQHPU-ZDUSSCGKSA-N 400.479 2.262 10 20 HECD C[C@@H]([C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)N1CCOCC1 804774040 ALNGGEHCZVDJFM-MSOLQXFVSA-N 417.550 2.279 10 20 HECD O=C(NCCCn1nc2n(c1=O)CCCC2)NCc1cc(Cl)cc(Cl)c1O 804972039 XARAFJAFYBSBKR-UHFFFAOYSA-N 414.293 2.283 10 20 HECD CN(Cc1nccn1CC(F)(F)F)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289917 MVHPTDLBTAEPMO-UHFFFAOYSA-N 421.423 2.096 10 20 HECD CN1CCN(C(=O)c2ccc(CNC(=O)N(C)Cc3ccc(N(C)C)cc3)cc2)CC1 916389825 AMZCZUXFHPTXBO-UHFFFAOYSA-N 423.561 2.482 10 20 HECD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364965 UGRVINBBVSTRIQ-GBESFXJTSA-N 414.502 2.465 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc4cnccc34)cc2)C1 917930261 OOKZLOBBLZNCDH-GOSISDBHSA-N 424.526 2.415 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[nH]c2c1C(=O)CCC2 918373345 WONVYXHFFWRCPS-MRXNPFEDSA-N 408.502 2.474 10 20 HECD CSc1ccccc1NC(=O)CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 919806260 UPQNLUCIOYIYMN-UHFFFAOYSA-N 423.516 2.196 10 20 HECD CC(=O)Nc1ccc(C(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920635145 CZQSLXKPBYHQEN-LLVKDONJSA-N 420.443 2.150 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(c3cccc(F)c3)CC2)c1 1254026903 BNPQOVGPFFMJLU-UHFFFAOYSA-N 407.467 2.302 10 20 HECD Cc1c[nH]cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845261 IQQPADHDZGNMSD-HNNXBMFYSA-N 410.434 2.472 10 20 HECD CC(C)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819505324 VVKOVZMPCARZNY-DOMZBBRYSA-N 417.466 2.335 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc(F)c[nH]1 1822236898 VEGVXZZQNGWWSP-AWEZNQCLSA-N 414.397 2.303 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1822641658 FSQUHYSMXDBOPA-YRBGZSCZSA-N 402.476 2.221 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 140950515 JMOUTZLDISHBBT-SFHVURJKSA-N 402.539 2.484 10 20 HECD Cc1c(CNC(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)n(C)c2ccccc12 472239372 LQEPHWPXFKDLBB-OAHLLOKOSA-N 411.458 2.455 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN1C(=O)OCC(F)(F)F 727798456 APARCEVWQNLCLY-INIZCTEOSA-N 415.412 2.303 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](N4CCCCC4)C3)cc2)C1 730905404 XJZDQOYZGIAGRI-CTNGQTDRSA-N 413.566 2.158 10 20 HECD O=C(CN(Cc1ccco1)Cc1ccccc1O)N1CCN(c2cnccn2)CC1 732202294 LNXIZJRYMDQLGW-UHFFFAOYSA-N 407.474 2.126 10 20 HECD O=C1CCCN1C[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 732452639 HSNBTLZQZCFNAR-FQEVSTJZSA-N 400.523 2.210 10 20 HECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCCCSc1nccs1 733883974 IOHYDTNSGCYAON-UHFFFAOYSA-N 423.564 2.015 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1O 737278671 NHZUTWIEGWBOCQ-HNNXBMFYSA-N 413.474 2.049 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1 741093171 NUVPGBYZZDMIGU-PKOBYXMFSA-N 409.552 2.020 10 20 HECD Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 741915034 RDRZVQDGFLHJRS-DNVCBOLYSA-N 411.550 2.234 10 20 HECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958335 RMNDVPAMWMOTSP-UHFFFAOYSA-N 409.486 2.157 10 20 HECD Cn1cnc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)c1 751260841 GPNOHQZTLSTMER-LBPRGKRZSA-N 424.548 2.070 10 20 HECD COC(=O)CC1(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCC1 754063743 MFITXZNDFAEDEW-HXUWFJFHSA-N 419.566 2.034 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C12CCC2 754099700 XPLKNIXAYLENBP-MDNUFGMLSA-N 417.594 2.458 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC)c(OC)c3)CC2)cc1F 754213788 VBUWOJHOVSLYOZ-UHFFFAOYSA-N 417.437 2.139 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)[C@H]3CCCN(C4CCC4)C3)nc12 754465822 QBIKLOUJDSRLDF-CABCVRRESA-N 401.511 2.354 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)cc2F)CC1 757681350 CEKUPPVDZUPBRM-JXFKEZNVSA-N 403.546 2.250 10 20 HECD COC(=O)c1cc(NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc(S(C)(=O)=O)c1 758647209 AYWTWBWQKAHYFB-LLVKDONJSA-N 422.459 2.474 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](CO)OC[C@H]3C)c2C)cc1 766945050 PCKXEMGLEKYBMH-BEFAXECRSA-N 400.475 2.145 10 20 HECD CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCOCC2)cc1 767685790 KDVDHZIAQTVMBS-SFHVURJKSA-N 407.511 2.069 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)nn1 773621371 XWUBLZSVQLIXRG-WMLDXEAASA-N 400.483 2.238 10 20 HECD CSC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 773741143 SCGSUWFXMRYBPD-SYAUCNOPSA-N 420.531 2.052 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCn3ccnc3)cc2Cl)C1 775099006 JUFVREWTQWJBDU-OAHLLOKOSA-N 403.914 2.205 10 20 HECD C[C@H](N[C@@H]1C[C@H](C)N(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)c(F)c1 777116562 SNUVDASAIWAQNA-YZVOILCLSA-N 401.486 2.240 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 778821447 YIMXBEXZDJXWGM-UHFFFAOYSA-N 417.393 2.354 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(NCc3cc(F)ccc3O)CC2)cc1OC 779082036 LEOCRROSOMKUGT-UHFFFAOYSA-N 424.494 2.491 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](OCC4CC4)C3)CC2)cc1 779544693 MQKZXYLLAVKVBN-QFIPXVFZSA-N 416.566 2.418 10 20 HECD Cc1nc(Cn2nnc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)c2C)no1 785070134 NYOIMINFPRRBJL-UHFFFAOYSA-N 409.494 2.493 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785295611 XERUIIGLMHFFDI-LBPRGKRZSA-N 422.865 2.462 10 20 HECD C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438670 DUBJKRUSFGUNCC-DOTOQJQBSA-N 418.538 2.131 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCCCC2)nc1 787198164 IXWCHLUDUPDOBS-UHFFFAOYSA-N 409.534 2.413 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2cccc(F)c2)CC1 788312062 BTPOUEBVRLJFRD-UHFFFAOYSA-N 411.477 2.127 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Sc1ccccc1 788333920 SFFSYYPZGYPXQF-QGZVFWFLSA-N 413.543 2.436 10 20 HECD CN1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859706 FHOYFXZIZVQWOA-IBGZPJMESA-N 418.607 2.093 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4nccnc4cc3F)cc2)C1 791532133 HTOVYBXOXYIYAV-HNNXBMFYSA-N 407.449 2.401 10 20 HECD COc1ccc(CNC(=O)c2ccc(OC)c(I)n2)c(O)c1 794390550 LIMTZMPAESKTMY-UHFFFAOYSA-N 414.199 2.339 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1F 796862150 LHAILWUXNKCXLV-UHFFFAOYSA-N 415.396 2.383 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1OC 796865258 ZCOSADROIVUERU-UHFFFAOYSA-N 409.442 2.113 10 20 HECD COc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1OCCO 798316842 LRAWOTXDQRAKPK-UHFFFAOYSA-N 400.475 2.175 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCOC4(CCCC4)C3)CC2)cc1 804315892 UPIWMXOSOSPRKT-SFHVURJKSA-N 415.534 2.388 10 20 HECD CO[C@H](C)CN(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977726 XNWUBFAJUNZITC-MRXNPFEDSA-N 416.501 2.119 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)C[C@@H](C)C3)cc2F)CC1 805006992 BYHUFFSVASBPPL-IAGOWNOFSA-N 404.530 2.088 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H]2C[C@]2(C)NC(=O)NC2=O)cc1F 806772345 OPOXBYVPXRHOET-VFNWGFHPSA-N 419.501 2.334 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O 808193710 MBZQMHMIWPMYEP-IBGZPJMESA-N 424.501 2.228 10 20 HECD CCn1c(O)nnc1SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917185465 ZMLFBBFODPHBPF-CHWSQXEVSA-N 423.514 2.165 10 20 HECD C[C@H]1CN(c2ccc(CNC(=S)NCCCN3CCOCC3)cc2F)C[C@H](C)O1 917581145 OBNVVRBUOBEPHP-IRXDYDNUSA-N 424.586 2.126 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CN3CCCC3=O)cc2F)C[C@@H](C)O1 918099010 HSPBHYPUAPCIEQ-OAGGEKHMSA-N 406.502 2.249 10 20 HECD CCOC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 918224200 NGSVGUHOIHLCEO-MRXNPFEDSA-N 408.474 2.082 10 20 HECD COc1ccc(N2CCCN(C(=O)Cn3cc(C(N)=O)c4ccccc43)CC2)cc1 918369831 VZFZMPNQVQYHIS-UHFFFAOYSA-N 406.486 2.488 10 20 HECD CC(=O)Nc1ccc(C(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920635149 CZQSLXKPBYHQEN-NSHDSACASA-N 420.443 2.150 10 20 HECD COCCN1C(=O)/C(=C\N[C@H](C)c2cccc(C(F)(F)F)c2)C(=O)NC1=S 920980622 RXGQVUSTKNPDKI-PEHNMLCRSA-N 401.410 2.130 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCN4CCC[C@@H]4C3)CC2)cc1 1252063589 PCMKXZUZOSLTJZ-OAQYLSRUSA-N 415.582 2.087 10 20 HECD COc1ccc(N2CCC(NC(=O)Cc3ccccc3NS(C)(=O)=O)CC2)cc1 1318421683 LTCAYQBXYJMVGL-UHFFFAOYSA-N 417.531 2.394 10 20 HECD CCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783135750 KQQNADAINRAGQX-XOPAWIAISA-N 418.490 2.083 10 20 HECD CC1=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CCO1 1827425836 AWIRBHMZTRJFMS-SFHVURJKSA-N 415.490 2.420 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Cn4cccn4)o3)CC2)cc1 106114270 PXHMSJCGZWVRNG-UHFFFAOYSA-N 424.457 2.039 10 20 HECD CCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 303274237 GXIAVUGICWGVDV-LJQANCHMSA-N 422.570 2.285 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 728981421 ZHGAQEQQEXQQND-UONOGXRCSA-N 412.442 2.402 10 20 HECD COc1ccc(N2CCCN(Cn3nnn(C4CCOCC4)c3=S)CC2)cc1 729981680 OAMSVJCAVWIBRU-UHFFFAOYSA-N 404.540 2.339 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)c3cccs3)cc2F)CC1 730235863 PXVNXZBBUWJFTE-HNNXBMFYSA-N 418.538 2.464 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)c1 731455224 FWEOYNKFUIBUKP-UHFFFAOYSA-N 422.478 2.381 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C2=CC=S=C2NC(=O)c2ccco2)cc1 731472217 RPJQSXHPDNLDPX-UHFFFAOYSA-N 419.484 2.015 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 734217248 UTQUXHYGQZDBSU-IRXDYDNUSA-N 406.502 2.109 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 743888504 VIVRCVNRGUKATN-CQSZACIVSA-N 418.471 2.387 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(CC(F)F)c3)CC2)cc1 746032113 ULKIUGSIZZOZEB-UHFFFAOYSA-N 408.453 2.101 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)c1O 750034909 BLXWEMLMSIDTTA-UHFFFAOYSA-N 423.922 2.218 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1c[nH]c2ncccc12 751240515 OOEWZYLQJJLBLO-UHFFFAOYSA-N 400.504 2.250 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)c(OC)c1 752108465 ALXVCPFDNBQLDP-UHFFFAOYSA-N 407.492 2.043 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(C)ccc3S(N)(=O)=O)CC2)cc1 758015545 CEFYINOUUAYFDT-UHFFFAOYSA-N 403.504 2.050 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 759221499 RQDOBSZPYXGGSW-DZJHOTPTSA-N 409.502 2.433 10 20 HECD C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 760200455 LPVUTIISWBIRHI-INIZCTEOSA-N 411.506 2.288 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[S@@](=O)C[C@H](C)C2)c([N+](=O)[O-])c1Br 763039989 DDKWOJPYSCGQLA-KFKUIPHHSA-N 422.257 2.479 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)cc1OC 768441908 LMCFWTBMQLHFRN-IRXDYDNUSA-N 405.539 2.032 10 20 HECD COC(=O)c1cn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1 768517530 CMGUOLFWOYLKBA-KBPBESRZSA-N 418.469 2.047 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N[C@@H]4CCCC[C@H]43)cc2F)C[C@@H](C)O1 769033283 LQZALUJZEHEFKN-BAAGSCJXSA-N 418.513 2.392 10 20 HECD CCCCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774652770 LFXCZHCFCCSOPZ-WMZOPIPTSA-N 402.539 2.090 10 20 HECD CC[C@@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1cccc(S(N)(=O)=O)c1 775616500 FHBVMJAOBGLFHA-HXUWFJFHSA-N 418.563 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 778221965 ZDWJFAPGWOBVRC-KTKRTIGZSA-N 410.430 2.447 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 779498584 ITTMVHRUTZTCEO-YRNVUSSQSA-N 404.488 2.456 10 20 HECD CN(C)CCCCNS(=O)(=O)c1cccc(NCc2cc3c(cc2O)OCO3)c1 796429579 ITQSANWJLRVTFM-UHFFFAOYSA-N 421.519 2.353 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](OCC2CC2)C1)c1ccc(N2CCOCC2)cc1 803299598 MBMLCNWNSGXYCF-DYESRHJHSA-N 415.534 2.118 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)c3nccs3)CC2)cc1 804318524 MUHAKNBQJBCXCZ-CQSZACIVSA-N 402.520 2.157 10 20 HECD CCOCCCN1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)[C@H](C)C1 806225562 RHLLSHSFFKXGDR-LQWHRVPQSA-N 418.582 2.183 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCc3c[nH]nc3C2)cc1 806303495 XAIYEJLCGLHQRU-SFHVURJKSA-N 421.501 2.271 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 918199439 AMVSFZJSSSDXOL-STXHMFSFSA-N 414.481 2.465 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cn2ccnc2)cc1 918338078 RLDVRQSXTJLZHK-UHFFFAOYSA-N 424.526 2.096 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C(F)(F)F)nc1 918339838 ICZVODTYJBQCGV-UHFFFAOYSA-N 413.421 2.265 10 20 HECD COc1ccc(N2CCCN(C(=O)CSCC(=O)Nc3cc(C)on3)CC2)cc1 918369928 XTMSDMZTZBZBQC-UHFFFAOYSA-N 418.519 2.402 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCS(=O)(=O)C2)cc1 919654213 GFTOKYZASOCGAB-QGZVFWFLSA-N 405.520 2.492 10 20 HECD C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccn1)c1ccc(N2CCOCC2)cc1 1115897574 ILGCUTZXMWBMFK-AWEZNQCLSA-N 402.882 2.179 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OCC2CC2)nc1 1116646438 GJEBLTPDIOTAJC-INIZCTEOSA-N 400.431 2.186 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)COc1ccc(OC)c(C)c1 1320692366 KTKDCDRUWHCAFE-INIZCTEOSA-N 403.431 2.084 10 20 HECD O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1813804795 MEUYPYGJFNNFAW-CQSZACIVSA-N 424.482 2.418 10 20 HECD Cc1cccc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)cc12 1844048028 ULALCMSAIAPMLG-UHFFFAOYSA-N 406.442 2.413 10 20 HECD COc1cccc(CNCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c1O 725848612 YWNZWCFXKQJDEO-SFHVURJKSA-N 400.475 2.365 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726562048 AYHQCAWEWKLFQJ-UHFFFAOYSA-N 417.531 2.392 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3onc(C)c3c2)cc1C 726766721 IZJKIFCIKRDNOF-UHFFFAOYSA-N 410.477 2.402 10 20 HECD COc1cc(/C=C2\SC(=S)N(CC(N)=O)C2=O)ccc1OCC(F)(F)F 727176712 YIOCLIQTLKMDFN-WZUFQYTHSA-N 406.407 2.323 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)NCc2cccc(OC)c2O)cc1OC 727840077 KFYFWZIIAAGYBY-UHFFFAOYSA-N 409.464 2.493 10 20 HECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NCc2ccc(N(C)C)cc2)c1 728151743 SGEABDVDLNATCV-UHFFFAOYSA-N 404.492 2.013 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)cc2)CC1 731037992 ASOWFSTVNHZXAF-UHFFFAOYSA-N 423.560 2.049 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)N(C)Cc2ccccc2O)c1 732202899 INOMDUGSKZECFF-ZDUSSCGKSA-N 400.431 2.424 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)c3ccccc3C)CC2)cc1 732824685 PEKKYILXDIRUSW-JOCHJYFZSA-N 412.534 2.158 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnc1Cl 735314928 XPIKSGYCVQWPGR-HNNXBMFYSA-N 422.938 2.224 10 20 HECD CN(C1CCOCC1)S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 739955027 QANVHPIRMFPEJM-UHFFFAOYSA-N 419.494 2.202 10 20 HECD COc1cccc(C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)n2nnnc2C)c1 746814536 NUXHZKIIYPERFU-JOCHJYFZSA-N 420.517 2.473 10 20 HECD CN(C)c1ccc(CNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1F 748343955 PJBXMUBOBDCTJE-UHFFFAOYSA-N 414.529 2.298 10 20 HECD Cc1cc(C(=O)CN(C)[C@H](C)CS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 749840226 LUTRMTKHHGPDMC-OAHLLOKOSA-N 420.531 2.413 10 20 HECD CC[C@@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)N1CCOCC1 753058043 OZSBGJYHDFSKRV-HXUWFJFHSA-N 402.539 2.456 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCN(Cc2ccsc2)CC1 759592446 HAPOZUZSSMIUHM-RQOWECAXSA-N 402.472 2.060 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nc([C@@H](C)SCC)no3)nc12 767105879 BYQBMWJLTIKPSA-LLVKDONJSA-N 420.495 2.441 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)Nc3ccc(F)cc3)CC2)cc1OC 768442601 USWFGYFFLUKNBK-UHFFFAOYSA-N 403.454 2.305 10 20 HECD O=C(COc1ccc(F)cc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768467706 IFMDCSBDYDJZTA-UHFFFAOYSA-N 413.493 2.386 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(-n4ccnn4)c3)cc2)C1 769017006 NSOGKPHBFWGUSW-KRWDZBQOSA-N 419.489 2.291 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)c1 769732449 JCKMILIYAKGCDT-UHFFFAOYSA-N 418.515 2.221 10 20 HECD COc1cc(N2CCN(C3CN(C(=O)OC(C)(C)C)C3)CC2)cc(OC)c1OC 769793960 FIPPLACGPXRKSB-UHFFFAOYSA-N 407.511 2.454 10 20 HECD COc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1F 770731361 NUPSZVIVNOTUMC-CQSZACIVSA-N 401.438 2.487 10 20 HECD CC(C)c1[nH]nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 771292931 GUMIILWLUPKCHL-CQSZACIVSA-N 414.466 2.073 10 20 HECD CN(C)C(=O)COc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 771881565 UXQXTWDYBGRYNX-UHFFFAOYSA-N 417.849 2.481 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 771953569 QQWZUWRAVKPVGC-WIYYLYMNSA-N 404.555 2.320 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccnc1 774131217 VKDDBMRISOFWKC-OAGGEKHMSA-N 414.481 2.328 10 20 HECD O=C(NCCCN1CCCC1=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 774461382 KHGAIPQVIJINRS-UHFFFAOYSA-N 401.507 2.182 10 20 HECD COCc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 774708895 YQTSDGJVLMVTCT-UHFFFAOYSA-N 403.504 2.336 10 20 HECD CN1CCN(c2ccc(CN3CCO[C@@H](CNC(=O)OC(C)(C)C)C3)cc2)CC1 776015054 ACKSRQZERULSGB-FQEVSTJZSA-N 404.555 2.164 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(=O)(=O)N(C)C)cn1C 778634059 GHFOYHDIRFEMAF-UHFFFAOYSA-N 406.552 2.392 10 20 HECD O=C(CNC(=O)c1cccc(O)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 779001003 OUDGBAGXGGAMLK-QGZVFWFLSA-N 417.893 2.262 10 20 HECD CCOc1ccc(CN2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785424750 MLNPIPKCUWJGNH-UHFFFAOYSA-N 424.545 2.112 10 20 HECD CO[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 786652797 AZKKRCAODZIHRM-UTKZUKDTSA-N 411.502 2.204 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCc3n[nH]cc3C2)cc1 788484591 JWXAMDAAOHBGFO-GOSISDBHSA-N 421.501 2.271 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc4ccn(C)c(=O)c4c3)CC2)cc1 789681321 FECAXWUJPLEHMJ-UHFFFAOYSA-N 406.486 2.308 10 20 HECD C[C@H]1c2ccsc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797194 ABTKUFJVFWZPCP-AWEZNQCLSA-N 417.506 2.486 10 20 HECD CCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccn1 789812933 QFFAPXMJMODOEO-IBGZPJMESA-N 414.481 2.331 10 20 HECD COCCN(C(=O)CSc1ncc(C(C)(C)C)s1)[C@@H]1CCS(=O)(=O)C1 789930119 QRZDUPNPLQAZEH-GFCCVEGCSA-N 406.595 2.195 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCN(c4ccc(F)cc4)C3)ccc21 793865466 UNZMYKBACZMXPE-SFHVURJKSA-N 424.520 2.467 10 20 HECD O=S(=O)(Nc1ccc2nc(N3CCOCC3)oc2c1)c1cccc2nsnc12 799184692 DEQPBYQSNLJDDV-UHFFFAOYSA-N 417.472 2.470 10 20 HECD CO[C@H](C)CS(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 799820509 NTRMGMOQNLHBEL-PBHICJAKSA-N 415.556 2.273 10 20 HECD CCN(CCOCCO)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 800429142 GFYJPEDHSJGGOL-OAHLLOKOSA-N 410.470 2.120 10 20 HECD Cc1cc(-c2nnc(N3CCNC(=O)C3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 802757230 SNCGUOSTYBHAFR-GOSISDBHSA-N 420.517 2.325 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C12CCC2 803308760 JPJQDJHMPQOEMW-FFZOFVMBSA-N 415.534 2.164 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1C 803450752 PCKAWCBSWWLPDN-KGLIPLIRSA-N 411.449 2.009 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(N2CC=CC2)cc1 806281889 NNLKJJRNSCHENB-UHFFFAOYSA-N 402.545 2.434 10 20 HECD COCc1cnc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 806843499 JHTSOOAARSYAGI-AWEZNQCLSA-N 405.476 2.141 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 806853967 YATSWQAEYGMZCT-LJQANCHMSA-N 418.488 2.408 10 20 HECD COCc1csc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1 806881861 CXWHCMAJBZNXEJ-UHFFFAOYSA-N 404.492 2.022 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC(C)(C)CCCO 807508457 CQSLJHDDESQDAV-UHFFFAOYSA-N 415.328 2.418 10 20 HECD NS(=O)(=O)c1ccc2c(c1)[C@H](NCc1ccc(N3CCOCC3)cc1)CCC2 810213539 UYRXYPTUXBTAOP-OAQYLSRUSA-N 401.532 2.338 10 20 HECD CC(C)[C@]1(CO)CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 815232204 SVYVPUSADSPUGA-JOCHJYFZSA-N 407.530 2.009 10 20 HECD O=C(CN1CCO[C@H](c2ccccc2)C1)NCc1ccc(N2CCOCC2)c(F)c1 917047698 CRHJQXIZYGUOMN-QFIPXVFZSA-N 413.493 2.352 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)C1 920090797 ILAOXDIWHSCEHH-LSDHHAIUSA-N 417.510 2.128 10 20 HECD C[C@H](OC(=O)CO[C@H]1CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1318976411 XFZKIVMQKFEWII-KBPBESRZSA-N 423.421 2.138 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C)c4ccccc43)cc2)CC1 1321207635 OUUBBNNREQVEGX-NRFANRHFSA-N 420.513 2.122 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(O)nc2cc(F)ccc12 1324120352 DOWVCJVELOVALK-INIZCTEOSA-N 414.389 2.395 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)C(F)F)cc2)CCC1 1787709834 GRNIOXLJTVCNAL-UHFFFAOYSA-N 413.471 2.246 10 20 HECD O=C(Cc1cncnc1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424336 WOSLAEXZDIXBAP-UHFFFAOYSA-N 419.441 2.273 10 20 HECD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)n1ccnn1 1788429112 VTIMLORXTMOSOF-ZDUSSCGKSA-N 422.445 2.093 10 20 HECD Cc1cccnc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546612 FOCAWIYBXIPVCT-UHFFFAOYSA-N 410.474 2.355 10 20 HECD CC(=O)N1CCc2ccc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)cc21 525726230 IXCHBMIJPULRHU-UHFFFAOYSA-N 401.488 2.249 10 20 HECD Cc1nc(CN2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)oc1C 569494169 BYQYRHVOMPVGSX-UHFFFAOYSA-N 423.517 2.052 10 20 HECD CC1CCC(NS(=O)(=O)CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 728071747 XJKASDNEGNUQHO-TVRKMHQQSA-N 423.579 2.199 10 20 HECD Cc1nc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1-c1ccccc1 731577448 OFMGUOOLKCGFLL-SFHVURJKSA-N 418.501 2.207 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NCCCN1CCCCCC1=O 732202086 HDNRIJXODFYEQJ-FQEVSTJZSA-N 417.550 2.282 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ccn(C(C)C)n3)CC2)cc1 735168184 DKYJDCZPWKZKES-NDEPHWFRSA-N 404.536 2.070 10 20 HECD CCN(CC)CCO[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 746756321 NFIOSORKTPEFHE-NRFANRHFSA-N 404.555 2.166 10 20 HECD COc1cccc(S(=O)(=O)CCN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753856956 KHYRDIGXYBQYSQ-UHFFFAOYSA-N 408.495 2.439 10 20 HECD C[C@@H](OC(=O)Cc1cc[nH]n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753888959 QFJIBLQEZGSZJQ-GFCCVEGCSA-N 403.394 2.298 10 20 HECD C[C@H](Sc1ccccn1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 754224211 LAYXNCLMVDZGOQ-HNNXBMFYSA-N 405.545 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@]3(C)CCCO)CC2)cc1 755732147 XFPMTZNVMQPTRB-JJNABOQBSA-N 415.534 2.054 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCNS(=O)(=O)c2cc(C)sc2C)c1 756762073 SLABLZRORJTLBS-LBPRGKRZSA-N 412.533 2.486 10 20 HECD CS(=O)(=O)N[C@H]1CCC[C@H]1CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756903025 YRUSCYWXEFFWIG-IRXDYDNUSA-N 410.540 2.393 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)c3nnc(C)s3)CC2)cc(OC)c1OC 759314901 RXHHLCVVSWFEGS-LBPRGKRZSA-N 421.523 2.465 10 20 HECD O=C(COC(=O)[C@H]1C[C@]12CCOC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 764634615 GJXNFVKRCUCGQX-MWTRTKDXSA-N 405.406 2.370 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnc(Cl)c(OC)c3)CC2)cc1F 767823882 VOMKSXKDVLJRBU-UHFFFAOYSA-N 415.874 2.402 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC([C@@](C)(O)C(F)(F)F)CC3)nc12 767897555 PBVUIHHVUVVXCE-QGZVFWFLSA-N 416.400 2.137 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)CC2)cc1 778258037 XGFDQWCBBIQUQW-CNZFZVQHSA-N 423.517 2.029 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](c4ccc(F)cc4F)C3)nc12 778281247 CTLBYTVSENWKDS-KRWDZBQOSA-N 418.400 2.463 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cccc([N+](=O)[O-])c3C)cc2)CC1 786255236 MDKOJZMNCJEMOZ-UHFFFAOYSA-N 410.474 2.431 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)Cc3c(C)nn(C)c3C)cc2)CC1 786260069 VXWOOCGLGSREJA-INIZCTEOSA-N 411.550 2.200 10 20 HECD O=C(Nc1nc2c(s1)CCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 789370396 LVQDKQSWGYJIFQ-CQSZACIVSA-N 401.488 2.484 10 20 HECD CC1(C)Cc2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c2O1 789558358 NWQCISLMNZFZQK-UHFFFAOYSA-N 409.486 2.492 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3c(O)ccc(Cl)c3F)CC2)cs1 792167244 FVIFEKJGWFGOGX-UHFFFAOYSA-N 405.904 2.456 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1 792703528 YMSMXNVFXMLNNL-UHFFFAOYSA-N 402.519 2.165 10 20 HECD C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793722520 UBQCLURHLFCMQX-YVWKXTFCSA-N 414.550 2.042 10 20 HECD CC(=O)N1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 795788991 RYTLLXYFXCEYLL-HNNXBMFYSA-N 419.481 2.343 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1C 797389773 XOXATZLYXBUYCR-UHFFFAOYSA-N 400.435 2.106 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C 803089761 IJUDMVOBYLWDIA-SCLBCKFNSA-N 418.494 2.487 10 20 HECD C[C@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2ccccc2C1 803882371 VRGKOFDYTPHMOB-OAHLLOKOSA-N 418.588 2.305 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3[C@@H]3CCCO3)cc2)C1 806494720 VUSFPPJZIWSRRE-HOJAQTOUSA-N 400.523 2.241 10 20 HECD Cc1c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cccc1-n1cnnn1 807512871 MZKKSUCTUTZYLD-UHFFFAOYSA-N 421.244 2.238 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807674158 HGMULMHCRBNAJK-UTKZUKDTSA-N 422.529 2.237 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1O 816664861 HYJSXMUGHFZFFG-UHFFFAOYSA-N 416.390 2.175 10 20 HECD O=C1NC2(CCCCC2)C(=O)N1CCCNCc1ccc(N2CCOCC2)cc1 916833573 UWUMRMGDXLFDNH-UHFFFAOYSA-N 400.523 2.258 10 20 HECD CCOC(=O)N1CCC(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)CC1 917074333 YDLJSFUFVSQKEU-UHFFFAOYSA-N 402.539 2.454 10 20 HECD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(O)n1 917710026 ZGSWFSPQZLHBHR-UHFFFAOYSA-N 420.510 2.437 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(C)(=O)=O)c1 918307061 LDBOMMHGOHAXIH-UHFFFAOYSA-N 403.504 2.143 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2 918307579 ZKYOKVZBHXBBME-AWEZNQCLSA-N 410.474 2.459 10 20 HECD NC(=O)c1ccc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 920180630 RGSGLXCNPBXNAN-UHFFFAOYSA-N 420.492 2.331 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 920635646 JESKBZXVURMMRN-YGJAXBLXSA-N 424.519 2.250 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC1(F)F 1797741332 CSTOTKXNMAYWGM-PLPCNPGISA-N 408.401 2.110 10 20 HECD O=C(C1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426102 LESSVWYPSPVKLW-GOSISDBHSA-N 417.506 2.153 10 20 HECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827427514 BNIBQMXJJVBTEF-QGZVFWFLSA-N 413.478 2.071 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)n(C)c2ccccc12 673315434 CWULAHBGTFVTEZ-VFNWGFHPSA-N 401.532 2.274 10 20 HECD Cc1cc(C)n2nc(NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nc2n1 725855168 MYYLGEHVFAFNFX-UHFFFAOYSA-N 409.494 2.272 10 20 HECD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 728948505 BJSVMHARTYFMFW-STQMWFEESA-N 407.492 2.430 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1 729064688 VPGHGJNHCZXBOF-AWEZNQCLSA-N 401.463 2.157 10 20 HECD CCN(CC)CC(=O)N1CCN(C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731404858 SPOFPYBFPSCJQK-UHFFFAOYSA-N 421.561 2.368 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(-c2nc(=O)o[nH]2)cc1 732273781 CUBHSSMKDZUHBW-UHFFFAOYSA-N 412.421 2.060 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc(F)cc4)n3)cc2)C1 737516794 DORXSSHWGGDNNJ-INIZCTEOSA-N 422.464 2.038 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(S(=O)(=O)N(C)C)ccc1F 742951945 CBBPBEZFEMCJJJ-UHFFFAOYSA-N 407.467 2.181 10 20 HECD C[C@H](NC(=O)[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 746168803 QUBXIOGLAODHGQ-CYFREDJKSA-N 409.530 2.337 10 20 HECD CCOc1ccc(N(CC)CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1 748306616 XKCHIOMWIDDUSX-KRWDZBQOSA-N 420.535 2.415 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 750874877 OYYZYBHENJOOPJ-GOSISDBHSA-N 401.467 2.374 10 20 HECD C[C@@H]1C[C@@H](NCc2ccccc2S(=O)(=O)N(C)CCO)c2c(O)ccc(F)c21 756704696 KXXLRXQDJZEFTL-CZUORRHYSA-N 408.495 2.482 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc2c1=O 758118437 KZQRDRYDJPZVCE-QGZVFWFLSA-N 418.497 2.170 10 20 HECD COC(=O)C1CCN(C(=O)[C@@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C(C)C)CC1 759597856 TULJUFVJWXHQJN-WPGJWXSHSA-N 405.447 2.090 10 20 HECD Cc1cc(NC(=O)CN(C)c2ccc(OC(C)C)cc2)n([C@H]2CCS(=O)(=O)C2)n1 759929830 YPYSJQCRCCBEGF-KRWDZBQOSA-N 420.535 2.413 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 764255446 SVXQBXVLQGWSLG-UHFFFAOYSA-N 415.515 2.070 10 20 HECD C[C@@H](CN1CCOCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 767173978 PTNGIJWAMFPYNG-HNNXBMFYSA-N 415.456 2.127 10 20 HECD Cc1ccc(O)c(CN2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1 768155148 BJUPGHJJFBESOM-UHFFFAOYSA-N 405.476 2.424 10 20 HECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NCc1ccc(N(C)C)cc1 768270738 XEGKWZYJLBSMJX-SFHVURJKSA-N 406.527 2.034 10 20 HECD NC(=O)C1CCN(C(=O)C2CCN(Cc3cc(Br)ccc3O)CC2)CC1 768334733 PVGGOXACSRZWTL-UHFFFAOYSA-N 424.339 2.091 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCC(C(=O)NCCCO)CC3)c2C)cc1 769380853 DGCCCQUIEVBTOF-UHFFFAOYSA-N 413.518 2.454 10 20 HECD CCN(CC(=O)NCc1cccs1)C(=O)CN1CCOc2cc(N(C)C)ccc21 774753792 OXYQAYUVTGCHJM-UHFFFAOYSA-N 416.547 2.178 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)C(=O)N(c1ccc(N)cc1)C1CCCCC1 784058077 KNOWHIDBLYHXDG-UHFFFAOYSA-N 412.494 2.438 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(CCc2ccccn2)Cc2cccnc2)cc1 785427206 AHEGSRMMKASKQA-UHFFFAOYSA-N 417.513 2.430 10 20 HECD C[C@H](O)CN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](C)CO 785871091 XPXUQCNUOCCVAN-QLFBSQMISA-N 401.454 2.030 10 20 HECD COc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 786756825 BJVJGOLWJOYNJK-HNNXBMFYSA-N 415.465 2.165 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(OCCN(C)C)cc1)c1ccc(N(C)C)cc1 787175098 NBTOKBDKFZYBRB-KRWDZBQOSA-N 412.534 2.187 10 20 HECD CN(CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)Cc1ccc(F)cc1 788932980 NTIBPGKGYPVHNP-UHFFFAOYSA-N 412.509 2.290 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)CCc3cccs3)CC2)cc1 790021284 POCFWBAPPZUXSG-UHFFFAOYSA-N 409.577 2.041 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCCCNS(=O)(=O)c1ccccc1Cl 799025559 ZKUBNFLKNYYPIH-CLFYSBASSA-N 410.879 2.249 10 20 HECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1 799231413 LIDAOENVKHSJPR-BETUJISGSA-N 417.441 2.338 10 20 HECD CC(C)n1cc2c(n1)[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)CCC2 803663464 ZUBAWYBMUUUFKZ-QGZVFWFLSA-N 401.486 2.479 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1 806425697 LKFZMHMLWMRPCQ-QFIPXVFZSA-N 408.546 2.492 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccnc(SC)c3)CC2)cc1 808329270 GZROFOBZVVQTAC-UHFFFAOYSA-N 414.531 2.167 10 20 HECD CO[C@H](C)c1nsc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 809924663 RORGIBVBJVIBOL-TZMCWYRMSA-N 418.523 2.269 10 20 HECD CC(C)(C)Oc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc1 814330660 VXSDLCNPZSBFDL-UHFFFAOYSA-N 417.531 2.424 10 20 HECD COCc1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc(C(=O)OC)c1 815471178 YIDDLICJQGCCPT-LBPRGKRZSA-N 416.430 2.150 10 20 HECD CON(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1 863993503 QGTQKTJUXQREQT-UHFFFAOYSA-N 409.483 2.456 10 20 HECD CC(C)[C@@H](CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCOCC1 916254233 PPEDCLLSHBCBBV-OAQYLSRUSA-N 404.555 2.021 10 20 HECD CNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 917364876 PXWZLCGZQPLKKX-QGZVFWFLSA-N 404.488 2.122 10 20 HECD CC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918188711 WBOAUOXHHORURY-HUUCEWRRSA-N 406.502 2.249 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccc(F)cc3)CC2)cc1 920255456 XIBUGOCGHGQINX-ZHACJKMWSA-N 411.477 2.398 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(S(=O)(=O)CCO)cc1 1116420096 LRTRQHBQZNDQES-UHFFFAOYSA-N 404.532 2.110 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc(O)cn1 1800715343 LVXJDYRJQBMZCF-CLLJXQQHSA-N 417.849 2.417 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC=CO3)CC2)C1 1810546627 KHBNQFAYUVSEIO-INIZCTEOSA-N 401.463 2.030 10 20 HECD O=C(/C=C/c1cnc[nH]1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502276 IGZCLKYHMIOXSE-NSCUHMNNSA-N 402.838 2.005 10 20 HECD COc1ccc(N2CCC(NC(=O)CCc3c(C)nc4ncnn4c3C)CC2)cc1 726561958 AZNMBCRDCGZXEZ-UHFFFAOYSA-N 408.506 2.468 10 20 HECD CO[C@@](C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 730211121 KBYKWVJXURDGGM-OAQYLSRUSA-N 402.516 2.099 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1 734061251 CYAKEDZBSLMWAV-UHFFFAOYSA-N 404.854 2.312 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cccnc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 742277835 GDEVCHNONXBNPK-CHWSQXEVSA-N 424.454 2.221 10 20 HECD COCCNS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 743212320 GMRJOPABADXUCM-UHFFFAOYSA-N 424.498 2.138 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 748054397 XMGRSVVMBCJWEX-AWEZNQCLSA-N 408.476 2.332 10 20 HECD COCCNC(=O)[C@H](CC(C)C)NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 756690384 SETRJGJLNPQWEI-PXNSSMCTSA-N 420.554 2.061 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(CO)CC3)cc2F)C[C@@H](C)O1 762626484 WUYLLTOONKCGPJ-CALCHBBNSA-N 407.530 2.150 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)oc4cccnc43)cc2F)C[C@H](C)O1 768518102 NDFCYECBJUZNIE-KBPBESRZSA-N 414.437 2.059 10 20 HECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 769561727 BLVAMYGALWWCAB-HSZRJFAPSA-N 407.470 2.354 10 20 HECD Cc1cccc(F)c1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 772452789 XGEJLZIMXPXLIX-INIZCTEOSA-N 405.495 2.314 10 20 HECD COc1cc(Cl)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 773242128 AEZONRSYRXYAAL-UHFFFAOYSA-N 403.866 2.440 10 20 HECD C[C@@H](NCC1=Nc2ccccc2S(=O)(=O)N1)c1ccc(N2CCOCC2)cc1 775257980 NSYROAACFPJIPM-OAHLLOKOSA-N 400.504 2.196 10 20 HECD CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 783285229 MGQGHZXBRJLHOC-UHFFFAOYSA-N 421.471 2.355 10 20 HECD Cc1nccn1-c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1F 785427925 HPVOKUXCLVMBRJ-UHFFFAOYSA-N 409.465 2.318 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 785670935 PNOACMXIGLGUPT-STQMWFEESA-N 420.510 2.137 10 20 HECD CCC(O)(CC)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 788117349 FXOVXKWTDYQLMS-UHFFFAOYSA-N 409.527 2.485 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 788326544 GVLRIOGMDVSFJV-UHFFFAOYSA-N 423.922 2.407 10 20 HECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788910502 LPDLTZQHWHESLB-YPQLRWHESA-N 405.564 2.099 10 20 HECD CC(C)CN(CC(C)C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793715800 AXJQTKWPHRNBSS-IBGZPJMESA-N 416.566 2.145 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(N2CCOCC2)ccc1C 797533851 RDLJVOMFOFHEFA-UHFFFAOYSA-N 410.518 2.461 10 20 HECD CC(C)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 803677138 GTFNVNSTUUYNGO-HXUWFJFHSA-N 414.550 2.197 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3C(C)C)cc2F)CC1 805007732 ZABHIDXTRYFTHE-LJQANCHMSA-N 404.530 2.231 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1O 809765248 LRLULFVJEIYSPG-MSOLQXFVSA-N 401.463 2.282 10 20 HECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCSCC3)cc2)CCCC1 809809055 PYSVGNKOVOXJCI-UHFFFAOYSA-N 412.577 2.393 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnnc(-c4ccccc4)c3)nc12 811286784 LQACAXWHKUSGLE-UHFFFAOYSA-N 419.397 2.426 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](CNC(=O)C(F)(F)F)C2)cc1F 812017669 HLDRADVGLPSRAV-ZDUSSCGKSA-N 404.408 2.492 10 20 HECD COC[C@]1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 813513732 RSRAZJIDUCGCFQ-SZNDQCEHSA-N 408.495 2.419 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3Cc4ccccc4C(=O)O3)CC2)cc1 843443791 RECGJRKNZVWGNU-JOCHJYFZSA-N 423.513 2.105 10 20 HECD COC(=O)c1cccnc1SCC(=O)N1CCN(c2ccc(OC)cc2)CC1 863931206 WZZKDIUJLXNJDT-UHFFFAOYSA-N 401.488 2.318 10 20 HECD CCOC(=O)NCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 915027115 OFMXZQLSFQKQDI-UHFFFAOYSA-N 424.409 2.080 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCCC4=O)cc3)cc2)C1 917832222 OHHQVCBNVLQVLK-LJQANCHMSA-N 420.513 2.445 10 20 HECD CCOC(=O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918220388 XHPXDLPPBVOJLY-UHFFFAOYSA-N 407.486 2.272 10 20 HECD O=C(Nc1cccc2c1OCCO2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918298292 YMNQEFDPZJDJQJ-MRXNPFEDSA-N 412.442 2.310 10 20 HECD Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918462551 CEMFZEISBZFHNL-INIZCTEOSA-N 412.465 2.091 10 20 HECD Cc1nccc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 919464854 DVJYYAJRYBNVQF-ZIAGYGMSSA-N 416.453 2.011 10 20 HECD Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637526 IAEDOJGMTUINPZ-UONOGXRCSA-N 420.487 2.495 10 20 HECD C[C@H](OC(=O)[C@@]1(F)CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1328754431 YKBMHIJSLXXECG-AMXDTQDGSA-N 411.385 2.461 10 20 HECD CC(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826308786 WFQNYBQYDQDGTB-HNNXBMFYSA-N 411.593 2.122 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CCCc2ccccc2F)C1 1841334882 MIXMBBHWJFGQJT-UHFFFAOYSA-N 413.449 2.472 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccnc3N3CCCC3)CC2)cc1 14676280 JNIYYQWGIIHPMV-UHFFFAOYSA-N 424.501 2.196 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(NC(N)=O)c3)CC2)cc1 32764243 VPMRUTSLZZUNIE-UHFFFAOYSA-N 411.506 2.128 10 20 HECD Cc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)cc1 108805602 VYRUDMJVLHMQJL-NRFANRHFSA-N 407.514 2.497 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1 140950446 OQQMIZNCYBULQZ-UHFFFAOYSA-N 402.520 2.202 10 20 HECD Cc1c(CNC(=O)N[C@@H](CC(C)C)C(=O)NCCN(C)C)n(C)c2ccccc12 472221729 IQMNKXXXDYYRJS-SFHVURJKSA-N 401.555 2.378 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC3CCN(CC(=O)N(C)C)CC3)c2C)cc1 731655599 PHWTWHOCZJKOQJ-UHFFFAOYSA-N 412.534 2.385 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCn2cncn2)NC(=O)OC(C)(C)C)cc1 742754258 OCYGUKRUEKKHFR-KRWDZBQOSA-N 402.499 2.116 10 20 HECD CCN(CC)[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 743867060 JYUSNQNKDRZKGX-CMKODMSKSA-N 420.573 2.472 10 20 HECD C[C@H]1C[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C(=O)N1c1cnn(C)c1 745919910 XHZDDXOPXFZDFT-YWZLYKJASA-N 410.522 2.354 10 20 HECD CSc1nc(O)nc(C)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 747395690 IRGLXYWPSRCNEI-UHFFFAOYSA-N 402.520 2.351 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(OCC4CC4)CC3)CC2)cc1 754050704 QWUGVSKMUWLVBG-NRFANRHFSA-N 403.567 2.069 10 20 HECD COc1cc(N2CCN(Cn3nc(C(C)(C)C)ccc3=O)CC2)cc(OC)c1OC 758955437 PKDYINOSDFOHKM-UHFFFAOYSA-N 416.522 2.346 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cn(Cc2cccc(F)c2)nn1 759152229 FMWJARDSICMSGX-UHFFFAOYSA-N 413.428 2.371 10 20 HECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C(=O)[C@H]2C1 761088218 BSFDCGYBEKMCNZ-QHHYFVSCSA-N 405.470 2.381 10 20 HECD CCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)n[nH]1 763017344 SVLGVRNWNLLVAO-CQSZACIVSA-N 403.506 2.209 10 20 HECD C[C@H](NCCCN1CCC[C@H]1C(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 765626635 QDULTBMLUIRWKN-UWJYYQICSA-N 406.546 2.256 10 20 HECD COCOc1ccc(OC)cc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 766468717 ILFNXCNXDGOHMZ-UHFFFAOYSA-N 420.531 2.203 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 766879563 QRKCBOPDNYBAQF-MRXNPFEDSA-N 407.486 2.272 10 20 HECD CCS[C@@H](C)c1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 767307376 VAGBFHFYAWDHNW-VIFPVBQESA-N 401.466 2.318 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 769320447 PKWSKUXKDAJKLT-IRLDBZIGSA-N 414.594 2.336 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1C 772409252 FZZPYVBLYVZYTM-UHFFFAOYSA-N 418.519 2.061 10 20 HECD CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773746168 ZAGMEOMGLQOQRQ-UKRRQHHQSA-N 421.519 2.138 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)n1 775205563 MLJXLDLCHMRKTA-UHFFFAOYSA-N 412.538 2.113 10 20 HECD COc1cc(OC)c(CNC(=O)CN[C@H](C)c2cc(OC)ccc2O)c(OC)c1 775369140 KSUINUFSSCJVFZ-CYBMUJFWSA-N 404.463 2.394 10 20 HECD CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C[C@]1(O)CCN(Cc2ccccc2)C1 778491151 SPYIMLUFMQDOCH-RUZDIDTESA-N 424.589 2.280 10 20 HECD COC(=O)c1cc(F)cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 782426635 OLXHZAGJBTUUOV-AWEZNQCLSA-N 422.478 2.488 10 20 HECD CCCCCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785439084 KPQCMUAJUFCEIP-LJQANCHMSA-N 416.566 2.304 10 20 HECD Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 788153768 QJGFVHQXLDBABB-HOTGVXAUSA-N 414.481 2.075 10 20 HECD CC(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834225 KXGZBWIIKYDUFT-KRWDZBQOSA-N 405.514 2.298 10 20 HECD CS(=O)(=O)CC[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 789905822 RTLCENJTGFYADE-NRFANRHFSA-N 416.543 2.358 10 20 HECD COc1cc(N2CCN(c3nnc(C4CCOCC4)n3C)CC2)cc(OC)c1OC 794671248 KVEJJOOESNAVOL-UHFFFAOYSA-N 417.510 2.062 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C4CCC4)C[C@@H](C)C3)CC2)cc1 795119608 GJZFDPGPPVANRV-IBGZPJMESA-N 400.567 2.150 10 20 HECD C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN(C2CCC2)C1 795122946 SQRNHLBPNUVKPQ-SFHVURJKSA-N 418.557 2.085 10 20 HECD CCOc1ccc(NCc2cccc(OC)c2O)cc1S(=O)(=O)N1CCOCC1 796409432 ZJXYRRSDVXAKKP-UHFFFAOYSA-N 422.503 2.433 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c(O)c1 797389844 BHNZXDGDFZJTTM-UHFFFAOYSA-N 400.460 2.270 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC(CNC(=O)C(F)(F)F)CC2)cc1F 798393044 JTIHRFUEBRIOFG-UHFFFAOYSA-N 404.408 2.492 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O 807095090 KBZTZNRFLZDVGA-QAJUQPOASA-N 401.551 2.465 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)c3c(C)noc3C)CC2)cc1 809526188 NPEIYNAIKUHWGF-HNNXBMFYSA-N 414.506 2.259 10 20 HECD COc1cc(Br)cc(CNCC(=O)NCCN2CCCCCC2)c1O 816620788 LNQBUMVEKCNTDL-UHFFFAOYSA-N 414.344 2.245 10 20 HECD CN(C)c1ccc(CN(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C2CC2)cc1 914480630 KZDCQANPTFHKPV-UHFFFAOYSA-N 422.441 2.448 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(Cn2cncn2)cc1 915778631 MOHFUNUYUQFJKN-UHFFFAOYSA-N 404.474 2.182 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)c1ccc(S(C)(=O)=O)cc1 917020843 WGUYAUHYVDPXFL-OAQYLSRUSA-N 404.532 2.092 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(C(=O)O)c(O)cc3C)CC2)cc1 917759797 ZTRFJSDPRBEAKV-UHFFFAOYSA-N 420.487 2.308 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@@H](C)O[C@H](C)C1 921203183 DAPTUJCEALVTCU-CBGDNZLLSA-N 407.530 2.412 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCn3nc(O)c4ccccc4c3=O)CC2)cc1 1116350786 NONNROJJUWNFEW-UHFFFAOYSA-N 422.485 2.240 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnc(OC)c4)n3)CC2)cc1 1343848330 SCZDOTPYBBJOOB-UHFFFAOYSA-N 409.446 2.040 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)C2=COCC2)CC1 1832411126 ZIXQVVMDSCGRIL-QGZVFWFLSA-N 401.463 2.030 10 20 HECD COc1ccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c2c1 1843249531 UTFXUMCIVMHSCR-UHFFFAOYSA-N 422.441 2.114 10 20 HECD O=C(c1cccc(Cl)c1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055218 DZZMCTNOILUCTN-UHFFFAOYSA-N 423.947 2.017 10 20 HECD CCNS(=O)(=O)c1ccc(C)c(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 437004056 BACJFUFXQXYDRY-UHFFFAOYSA-N 403.504 2.398 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N(C)[C@@H]3CCN(S(C)(=O)=O)C3)ccc21 552837766 XWNZIPFKCJSONH-QGZVFWFLSA-N 407.536 2.010 10 20 HECD CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 726622324 WMMASCVWKWGBHM-QHCPKHFHSA-N 407.514 2.489 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(OC)cc(OC)c3)CC2)cc1 726726470 RQXDYTNYWVMDMD-UHFFFAOYSA-N 413.474 2.436 10 20 HECD CC(C)C(=O)N1CCCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 727842738 CZGSROOOQNNYLF-GOSISDBHSA-N 402.539 2.484 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1 728979992 SOGQIJXGVNKXML-NSHDSACASA-N 421.413 2.293 10 20 HECD CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 730120367 KEWAVTKEYVTWJR-KRWDZBQOSA-N 404.511 2.332 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)C2CC2)cc1 735393526 PYSLKDJFTXHFFL-UHFFFAOYSA-N 406.486 2.168 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[S@](=O)[C@H](C)[C@H]3C)cc2F)CC1 737050409 RMAQQHYDSKVPKJ-XWBFJWKOSA-N 410.559 2.019 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3ccc(-n4cccn4)cc3)CC2)cc1 742919441 IPASZDWDEMCMRI-UHFFFAOYSA-N 419.529 2.362 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSCc3ccncc3)CC2)cc1 742920715 RESDSTMYSAXOCF-UHFFFAOYSA-N 400.548 2.262 10 20 HECD NC(=O)[C@@H]1CC(C(=O)NCc2c(O)ccc3c2CCCC3)=NN1c1ccc(F)cc1 743719157 QZDIHMVVRVATGD-IBGZPJMESA-N 410.449 2.147 10 20 HECD CN1CCCC[C@H]1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 745080097 RKDUAGMETHZUAB-SFHVURJKSA-N 406.438 2.428 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc4c(N(C)C)ncnc4n3C)CC2)cc1 747218297 ROXSPGFGBYSJAY-UHFFFAOYSA-N 408.506 2.442 10 20 HECD CCc1cc(N2CCC(NC(=O)NCc3ccc(N4CCOCC4)cc3)CC2)ncn1 748622869 BLYWRDPUNZWXQC-UHFFFAOYSA-N 424.549 2.344 10 20 HECD CN1CCC[C@@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751067792 AIYKBLLYZCLDPG-ZDUSSCGKSA-N 409.533 2.326 10 20 HECD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1c(-c2ccccn2)nc2ccccn12 751308169 RSKJOIFSSDPOEF-LSOMNZGLSA-N 413.437 2.142 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\c3ccc(Cl)nc3)nc12 758697788 FUGRLWKIWUUOOH-XQRVVYSFSA-N 402.794 2.417 10 20 HECD C[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@]1=O 759855666 CQNOYZGDAZYQCV-MMEWPQADSA-N 410.495 2.243 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)N(C)CC(F)(F)F)CC2)cc1 763972594 MXVDCCCBNOCEKH-INIZCTEOSA-N 416.488 2.206 10 20 HECD C[C@@H](NCc1ccc2c(c1)CCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 765608056 HPIQIRAZPLJUGD-MRXNPFEDSA-N 402.516 2.493 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3ccc4nnc(C(F)F)n4n3)cc2)C1 768522782 PQCPOFPMPPTLSI-CYBMUJFWSA-N 401.421 2.376 10 20 HECD COc1ccc(N2CCN(CC(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1F 771764263 XVARDVABEVGUIN-NRFANRHFSA-N 414.525 2.375 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2nc(O)[nH]c2n1 773822499 HPDVAXNISKZXEF-UHFFFAOYSA-N 421.379 2.449 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(CCC(=O)OC)C[C@H]2C)cc1F 774715677 KBZXVWPBLHZODS-MRXNPFEDSA-N 408.518 2.451 10 20 HECD O=S1(=O)N=C(N2CCN(Cc3cc(Cl)cc(F)c3O)CC2)c2ccccc21 775655450 ZARVGZBQXVQBKU-UHFFFAOYSA-N 409.870 2.451 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2nc(N(C)C)no2)cc1 776640707 JPSHGGBBGJEYIR-SFHVURJKSA-N 401.511 2.342 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1F 777247026 BBMOVEOZELHSMS-UHFFFAOYSA-N 400.454 2.395 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCO4)c2)CC1 780407593 MSANKNDWOBZJPF-UHFFFAOYSA-N 415.515 2.481 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2Br)c(O)c1O 781006856 PFVKUTRVBDSJAU-AWEZNQCLSA-N 405.248 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@](OC)(C(F)(F)F)C3)CC2)cc1 781986621 WBGUBYROYUVJSV-LJQANCHMSA-N 415.456 2.387 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N(C)CC(=O)Nc2ccc(C)cc2)cc1 784564023 LTDIRWVDKLTFFA-UHFFFAOYSA-N 413.474 2.080 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cn3ccccc3n2)cc1F 786146287 WJUIZZCMOPQNEH-UHFFFAOYSA-N 411.481 2.295 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1F 787759206 PBFJIVWKKMZZBH-HXUWFJFHSA-N 412.509 2.461 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCc3n[nH]cc3C2)cc1 788484595 JWXAMDAAOHBGFO-SFHVURJKSA-N 421.501 2.271 10 20 HECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931849 HVYCCHVAXVXFIT-QGZVFWFLSA-N 411.502 2.495 10 20 HECD C[C@@H](Oc1ccc(C=O)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795396981 NOBIBWNUAWGYRT-VQIMIIECSA-N 409.486 2.285 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3CCOc4ccccc43)CC2)cc1 804082566 RJCXMVHJWKEUAV-QGZVFWFLSA-N 423.513 2.463 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3c3cc(C)no3)CC2)cc1 804318866 UUORFZYYZMUOTD-LJQANCHMSA-N 412.490 2.440 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc1F 804852234 CYYMKGVHVDMFPR-KFKAGJAMSA-N 403.498 2.362 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](N4CCCC4)C[C@@H]3C)CC2)cc1 805014402 ZAFFQXGJFAYPIN-PZJWPPBQSA-N 415.582 2.085 10 20 HECD CC[C@@H](C)N(CCO)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 805791132 JGRLXBCSQZKIQR-CQSZACIVSA-N 407.536 2.017 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@H](Cc2ccccc2)C1 806276703 KFZXFFHRDRKKOT-MRXNPFEDSA-N 405.545 2.212 10 20 HECD Cc1cc(C(=O)N2CCC[C@H](CNS(=O)(=O)C3CC3)C2)c(C)n1-c1ccccn1 807900545 ZLCWYTKEFWZEAH-QGZVFWFLSA-N 416.547 2.423 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ncnn2C(C)(C)C)cc1 809926952 XBPFHHNIXFAXAU-UHFFFAOYSA-N 400.527 2.154 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccc(Br)cc1O 877845350 HLUYMSZFPSEHLL-KRWDZBQOSA-N 404.264 2.492 10 20 HECD COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)c1 912980546 OPKHJBWPCPNUOB-UHFFFAOYSA-N 422.488 2.066 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2cc(F)ccc2[nH]1 918339743 GRCHPIRMGHKMTP-UHFFFAOYSA-N 401.463 2.472 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC(=O)N(C2CCCC2)C1 919970864 GWFPGSMOLIAWLM-INIZCTEOSA-N 403.498 2.194 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC[C@H](C)c1ccccc1 920636731 YXICHKYANJFOGG-UONOGXRCSA-N 420.487 2.229 10 20 HECD Cc1cccnc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806266704 RJIVISDWHUCMFA-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(c1ccccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442381 GZZDAIZIWFTRQR-UHFFFAOYSA-N 402.454 2.297 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCc2ccco2)=NN1c1ccccc1 1848225416 XMERSEZYBRGWES-PMACEKPBSA-N 420.469 2.207 10 20 HECD COC[C@@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 23564730 BTHRUEKKDIEPHD-CQSZACIVSA-N 401.463 2.420 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1 726726244 QJGYZZZLTOPNBT-UHFFFAOYSA-N 424.501 2.121 10 20 HECD COC(=O)c1ccc(O)c([C@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)c1 726797074 ZTAAXLOKEOZUDK-KRWDZBQOSA-N 409.402 2.187 10 20 HECD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NCc3ccc(N(C)C)cc3)n(C)c2)C1 730162415 SWZKHRCMQOSOPL-INIZCTEOSA-N 418.563 2.442 10 20 HECD O=C(N[C@H]1CCSC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743733091 BJVUIZTWWNHFOJ-LBPRGKRZSA-N 423.472 2.337 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C1CCC2(CC1)NC(=O)NC2=O 743809376 RHKFSTDCWUDDGZ-UHFFFAOYSA-N 424.295 2.272 10 20 HECD O=C(NCCCOC1CCOCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 745649188 ZJZURTQUEVOMMI-UHFFFAOYSA-N 409.502 2.172 10 20 HECD COc1ccc(C[C@@H](CO)CNC(=O)NCc2ccc(N(C)C)cc2C)cc1O 745826700 CFMMBQUHARFQPI-QGZVFWFLSA-N 401.507 2.426 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCS3)cc2F)C[C@@H](C)O1 750900759 IAFFNVIWNVCIMB-LBTNJELSSA-N 410.511 2.494 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)c(C)o2)cc1C 751147199 ZPOOBLNIWFTKOL-UHFFFAOYSA-N 416.477 2.245 10 20 HECD C[C@H](O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 752147597 PPQBAYDDKOSSPQ-DWRORGKVSA-N 407.530 2.291 10 20 HECD COC[C@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 752327540 VDYVZRNEEZFXAU-QGZVFWFLSA-N 405.520 2.035 10 20 HECD O=C(CN1CC(=O)N[C@@H]2CCCC[C@H]21)Nc1cccc2c1C(=O)c1ccccc1C2=O 758772925 QTICYUQAHIPAFW-IEBWSBKVSA-N 417.465 2.144 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NC(=O)NC12CC3CC(CC(C3)C1)C2 759588078 HNIYNDVYOFYIRX-RQOWECAXSA-N 414.458 2.449 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(S(C)(=O)=O)c(F)c3)ccc21 760559548 GEKJHAWWUYTQLS-UHFFFAOYSA-N 412.508 2.090 10 20 HECD CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 762261507 NVJJLFCAARKUDU-QGZVFWFLSA-N 402.516 2.237 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 764681654 DTGIQFNEICKVKK-JXXFODFXSA-N 423.529 2.416 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n1 766859911 CIMHKVPETLXPOO-UHFFFAOYSA-N 400.483 2.137 10 20 HECD CCN1CCN(C(=O)CC2CCN(Cc3cc(OC)c(OC)cc3O)CC2)CC1 768449355 GOJYYIWRDBBQGD-UHFFFAOYSA-N 405.539 2.176 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CN(C)C1=NS(=O)(=O)c2ccccc21 769289431 FIMKOZRKJGFFDX-UHFFFAOYSA-N 401.488 2.212 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 770255064 REEQGSGRZWUMFJ-HUUCEWRRSA-N 400.454 2.398 10 20 HECD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Cl)c(Cl)cc1O 774250058 BAYIZCOWPYHAQM-STQMWFEESA-N 402.322 2.283 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccc(OC)c(OC)c1 774728817 PHTGYJNLOPCTJZ-UHFFFAOYSA-N 413.518 2.477 10 20 HECD C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(N2CCN(C)CC2)cc1 775664631 NNZIESBWXMVBBP-QGZVFWFLSA-N 402.564 2.279 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1O 776243252 DEGUJNSFRZKLSR-UHFFFAOYSA-N 423.466 2.079 10 20 HECD C[C@H](NC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N(C)C)cc1 776243563 DUQGIXVNBCTOOT-YOEHRIQHSA-N 401.463 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3cccc(O)c3)CC2)cc1 778326775 RFELADOELFHWST-ZHACJKMWSA-N 409.486 2.264 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4nc(O)oc4c3)c2)CC1 780406921 AXDPKFJXENBYIO-UHFFFAOYSA-N 416.459 2.003 10 20 HECD O=C(NCCc1ccncc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786793243 PWIALLQLOUDYDF-INIZCTEOSA-N 418.444 2.127 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 787251116 DMZPWKIJEOFYQD-FQEVSTJZSA-N 423.517 2.053 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1 787636297 HEPFJOOZSWBTSK-NRFANRHFSA-N 412.509 2.461 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCO[C@@H]3CCCC[C@@H]3C)CC2)cc1 787988392 NWUHWMNSXCMJMC-LAUBAEHRSA-N 417.550 2.492 10 20 HECD COc1ccc([C@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788312058 BQCWMESHHCLTHJ-FQEVSTJZSA-N 423.513 2.164 10 20 HECD O=C(NCc1nccs1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793549519 YGCTZIMEVXXCSS-UHFFFAOYSA-N 410.446 2.146 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662320 AUZSIOJOAMGNSQ-NVXWUHKLSA-N 420.529 2.051 10 20 HECD CC(C)n1cc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 806161037 WGYKFQAYXRXLOU-KRWDZBQOSA-N 413.522 2.136 10 20 HECD CNC(=O)c1cccc(CCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 807357740 HXTWBUORDKQKOC-UHFFFAOYSA-N 424.545 2.208 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807674157 HGMULMHCRBNAJK-LAUBAEHRSA-N 422.529 2.237 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676016 BYKRNNYXCOZJGZ-MAUKXSAKSA-N 418.538 2.398 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NC(=O)COC)cc1 918303319 DDENQRHUZVPBIY-UHFFFAOYSA-N 412.490 2.325 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(CC(N)=O)cc1 918309099 CBEWTCITEOUXDN-UHFFFAOYSA-N 408.502 2.302 10 20 HECD Cc1ccn2cc(CNC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)nc2c1 919653757 CBJJVHVWODSCQC-SFHVURJKSA-N 420.517 2.344 10 20 HECD COC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1323170467 XOMGIYIBRQNGJF-CJNGLKHVSA-N 422.393 2.442 10 20 HECD O=S(=O)(C1CCOCC1)N1CCC(NCc2ccc(N3CCCC3)cc2)CC1 1328880434 KAFGHHXENMPOCY-UHFFFAOYSA-N 407.580 2.350 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(OC)c1ccccc1F 1343688509 RALFAANYOMEYMR-HRAATJIYSA-N 405.422 2.389 10 20 HECD O=C(C1=COCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428757 HVGUUOMQCRQSBU-GOSISDBHSA-N 415.490 2.420 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)O1 1828403931 NBSWVRYSPVQPKD-FHLIZLRMSA-N 417.506 2.294 10 20 HECD CC(C)(C)OC(=O)NC(C)(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 116024712 DCNPXSOODXUPJX-INIZCTEOSA-N 418.538 2.308 10 20 HECD COCCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)Cc1ccc(C)o1 215657809 SPOSNYLXVAHLPI-UHFFFAOYSA-N 401.507 2.394 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)n(C)c2ccccc12 472776657 KLGKQOUXWDSROX-UHFFFAOYSA-N 404.470 2.370 10 20 HECD CCOC(=O)Cn1nc(C)c(/C=C2\CCn3c2nc2cc(C(=O)O)ccc2c3=O)c1C 526080786 DHXSSCIHPSHXJL-NTEUORMPSA-N 422.441 2.415 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)Sc3nnnn3C3CC3)CC2)cc1 726562563 LVOJUXQQHUNIDY-ZDUSSCGKSA-N 402.524 2.282 10 20 HECD CC[C@@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 734489233 PTVSYBDOMFLXRQ-MRXNPFEDSA-N 405.520 2.035 10 20 HECD CC(C)(C)c1nsc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 737107636 NQSOBHLRTBAJAJ-UHFFFAOYSA-N 421.498 2.066 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1 737207203 KUQROPDLNPSRFY-UHFFFAOYSA-N 407.430 2.318 10 20 HECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741099508 BJGAPDGWDYOGBX-INIZCTEOSA-N 422.485 2.291 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H](NC(=O)C2CC2)[C@H](C)O)c(C)n1-c1cccc(F)c1 745748665 TXDKINWBSRBSRI-XOBRGWDASA-N 416.449 2.235 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 747012255 NWOUKRWXSZWWKW-UHFFFAOYSA-N 410.453 2.425 10 20 HECD COc1cc([N+](=O)[O-])ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 750959432 JPHGEIDFRRXROW-UHFFFAOYSA-N 419.409 2.274 10 20 HECD CCCO[C@H]1CCCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754028697 BQPGYVWBCOTVLC-GMAHTHKFSA-N 405.583 2.459 10 20 HECD COC(=O)Cc1csc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)n1 756327736 PYRPUYWSFPQKSD-MRXNPFEDSA-N 419.503 2.184 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(-c4nnco4)c3)CC2)cc1 758232845 UDOHUDUDFBVNHM-IBGZPJMESA-N 410.474 2.307 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3cccnc3)CC2)cc(OC)c1OC 759215401 DAVHOJHCMAEDIO-UHFFFAOYSA-N 400.479 2.182 10 20 HECD CCC(=O)N1CCC[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759221216 NYZRKGQNZGFQPX-MRXNPFEDSA-N 419.522 2.010 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc4c3OCCO4)CC2)cc(OC)c1OC 759223953 XDWBDJJLNPZLAX-UHFFFAOYSA-N 414.458 2.446 10 20 HECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N1CCN(c2ccccc2O)CC1 759579633 NGIHCIOMPTZHJR-LOWQCSRCSA-N 412.442 2.097 10 20 HECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)Nc1ccccc1S(C)(=O)=O 759594067 FHBARIGAOGJDSY-ZJNQMXKESA-N 405.428 2.085 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)c1 760105302 RDCLOGCLNSFAAT-DZGCQCFKSA-N 400.431 2.384 10 20 HECD O=C1[C@@H]2CSCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761094685 GHFNNVGUNMNIAG-HNNXBMFYSA-N 415.437 2.422 10 20 HECD Cc1ccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)nc1 761784385 BVCPWEBIFMWQRR-NVNXTCNLSA-N 405.526 2.439 10 20 HECD COC(=O)c1nn(CN2CCCc3cc(OC(F)F)ccc32)c(=O)c2noc(C)c12 766350064 FCVOHGAVDLUYRW-UHFFFAOYSA-N 420.372 2.491 10 20 HECD O=C(CN1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1)Nc1ccc(Cl)cc1 768465952 UIDJIIUMRMQEBN-LJQANCHMSA-N 417.893 2.228 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H]3CN(C)CC[C@H]32)c1 768498812 JBECZRGVBAUHML-PGRDOPGGSA-N 401.551 2.343 10 20 HECD COC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 769245077 ATABKFMZIDCGKK-UHFFFAOYSA-N 403.454 2.448 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3nn(-c4ccccc4)cc3C)nc12 770611502 JJVNLEZSUPLATR-UHFFFAOYSA-N 421.413 2.463 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(C)c1 773844533 CPDBTGPTMSJQBV-OAHLLOKOSA-N 413.474 2.429 10 20 HECD CCO[C@H](CCNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 778300491 UHJWHVKAZIUEIS-RQWLHQTBSA-N 417.550 2.467 10 20 HECD COC(=O)c1cc(Cl)cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785294013 JFPVUHUNPJUVQW-SNVBAGLBSA-N 406.822 2.224 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 785428814 SJTFELTYZHSRIM-GHTZIAJQSA-N 408.546 2.396 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(Cn2ccnc2)c1 787300364 ZMFRPRKWVUCZMB-UHFFFAOYSA-N 405.502 2.272 10 20 HECD C[C@H]1CN(c2ccccc2F)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 789870389 OHSNFCVAOPWINV-ZDUSSCGKSA-N 407.467 2.254 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H](C2CC2)O1 792043472 GBUBBRAZQLSCDN-ZTNFWEORSA-N 400.523 2.097 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c(O)c1 797387110 DKWZQXHNTIOBEC-UHFFFAOYSA-N 400.822 2.495 10 20 HECD Cc1ncsc1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451516 NMAIDVZPMIVYDQ-UHFFFAOYSA-N 424.473 2.454 10 20 HECD C[C@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccs1 812359502 IHRXKNDHKODOFY-ZDUSSCGKSA-N 421.548 2.340 10 20 HECD COc1cc(N2CCN(C(=O)CCc3ccnc(C)n3)CC2)cc(OC)c1OC 816100527 IBAZMZWTFZLFSI-UHFFFAOYSA-N 400.479 2.092 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c[nH]nc3-c3ccncc3)CC2)cc1 916132942 OSTMVLFGTUCVIE-UHFFFAOYSA-N 420.517 2.422 10 20 HECD Cc1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1797151196 ZOBFPSZHOCHSDD-ZURAMSNBSA-N 423.469 2.472 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccnnc1 1800715933 YPDJWEVDYWFDIX-BTTYYORXSA-N 402.838 2.107 10 20 HECD COCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806493403 FXZOPNFHTDFGCY-SCLBCKFNSA-N 419.865 2.112 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 303958935 LYWCBIDPZIWXPN-NRFANRHFSA-N 422.529 2.429 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)C3CCCCC3)cc2)C1 727940216 DRSKKGDZIZIGHF-AZUAARDMSA-N 402.539 2.129 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1 729065346 DDADMNKUHQPXRA-LBPRGKRZSA-N 422.445 2.205 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](N3CCCCC3)C2)c1 730806287 GMMCAQIPHOCPNV-QFIPXVFZSA-N 401.551 2.487 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C\c3cnc(C)s3)CC2)cc1 732869873 WGRUOUVZMQABGP-FPLPWBNLSA-N 401.488 2.365 10 20 HECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 732999992 LQLNALKPMPIVTD-QGZVFWFLSA-N 419.459 2.112 10 20 HECD CN(C)c1ccc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)cc1F 733326590 NKJHTKLOBNRGAO-SFHVURJKSA-N 414.529 2.277 10 20 HECD C[C@@H]1CCCCN1C[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 733806467 DFTPVPOIEIJLFO-HZPDHXFCSA-N 409.552 2.490 10 20 HECD COCCNS(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743716117 IWJMLOPNPOPFPT-UHFFFAOYSA-N 418.515 2.126 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCCN2CCC[C@H](C(N)=O)C2)C2CC2)cc1 745830760 PYKPWOHMTFCNEY-SFHVURJKSA-N 401.555 2.014 10 20 HECD COc1ccc(N2CCN(C(=O)CSCc3nc([C@H](C)OC)no3)CC2)cc1 747847665 SMKLJGAOHJQCSX-AWEZNQCLSA-N 406.508 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(-n4cccc4)nc3)CC2)cc1 753489738 RQHYGIFLRSSNRG-UHFFFAOYSA-N 420.469 2.387 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCCS1(=O)=O 753497496 HRLAYBSUTACVBE-CZUORRHYSA-N 402.463 2.340 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3ccccc3o2)cc1C(=O)O 753982641 VBUOSVBUZJRNFL-UHFFFAOYSA-N 410.429 2.303 10 20 HECD Cc1cc(C(=O)CN2CCN(CC[S@](C)=O)CC2)c(C)n1-c1cccc(F)c1 755956961 TZFLCQWKZOTPHO-NDEPHWFRSA-N 405.539 2.412 10 20 HECD CC[C@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 760913035 SHEMGLJVSTWPPH-XCGNWRKASA-N 423.529 2.377 10 20 HECD Cc1nn(C)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1[N+](=O)[O-] 761981111 GHQKJPUXFUJGMS-AWEZNQCLSA-N 407.858 2.390 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1 764157388 NJTHYXOPRIDITL-MRVPVSSYSA-N 402.831 2.332 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1C 765927443 RTQWSIQWCPOUAI-UHFFFAOYSA-N 420.263 2.078 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)c1 769896208 UOWXPKFZMGBUER-AWEZNQCLSA-N 406.464 2.392 10 20 HECD CS(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)Cc2ccccc21 770379282 JWGKFJFMRXBRQB-UHFFFAOYSA-N 419.522 2.444 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccco2)N2CCCC2)cc1F 774866838 JQSLUSSKNWPOTO-GOSISDBHSA-N 402.470 2.054 10 20 HECD NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C\c2ccc(O)c(O)c2)CC1 779475193 GPOUOFKPQLLGOE-VURMDHGXSA-N 409.442 2.087 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(C)CCN(C)CC3)CC2)cc1 780818274 XZKCYIVCNVDHSM-UHFFFAOYSA-N 417.598 2.238 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C(=O)OC(C)(C)C 785432409 BRKYUZPYTJMCJK-WBVHZDCISA-N 418.538 2.273 10 20 HECD CCS[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789810553 BDGZFFZZRTYVSV-IEBWSBKVSA-N 423.554 2.459 10 20 HECD COC(=O)c1cnc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c([N+](=O)[O-])c1 790102113 WYYDUXWHCQCPTQ-CQSZACIVSA-N 413.434 2.090 10 20 HECD CCOc1cccc(CN[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 793245945 FDVMSOCTKWTCJW-LJQANCHMSA-N 401.511 2.101 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cn4ccc(C)cc4n3)CC2)cc1 793752069 VDJZWQZMAXFOHJ-UHFFFAOYSA-N 421.501 2.053 10 20 HECD CCS[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 803659049 JHMZIFMRHQJWBU-LBPRGKRZSA-N 423.514 2.364 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@H](C(=O)N(C)C)C1 806177639 FAMSDPQUTFSYRI-RBUKOAKNSA-N 416.566 2.253 10 20 HECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCN(c2ccccc2)C1=O 806276878 MUTWWASWIGHUMF-HNNXBMFYSA-N 418.544 2.005 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806539528 RNVLUGJDAMZVEB-KRWDZBQOSA-N 403.523 2.374 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1COC2(CCCCC2)O1 806700807 VVSXPGXLULYTRR-IBGZPJMESA-N 403.523 2.293 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC[C@@H]1C1CC1 807768421 JHYIKEHSMBWAHW-CRAIPNDOSA-N 423.460 2.010 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccccc3)cc2)C1 918116884 BUUIPYKGFJRVHG-LEWJYISDSA-N 424.545 2.039 10 20 HECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1ccc(O)cc1 1800102870 SBMHZNXSQOXZBS-VDNDLQMASA-N 411.458 2.254 10 20 HECD Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cn1 1810543099 VFFHWKQJXUQUBI-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1 1841243848 RLCFBLCCRKRUKV-DLBZAZTESA-N 411.433 2.253 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N1CCOc3cc(N(C)C)ccc31)C2=O 437018984 MINQWCMQJGLYCJ-UHFFFAOYSA-N 414.506 2.369 10 20 HECD COCCN(CCN(C)C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 729598131 XQZOZUZIJYJCJR-CALCHBBNSA-N 410.534 2.159 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4cnnn4)c(C)c3)cc2F)CC1 730193054 BUQKDSKCKQQTBC-UHFFFAOYSA-N 423.496 2.182 10 20 HECD COc1ccc(N2CCCN([C@H]3CC(=O)N([C@@H](C)c4cccnc4)C3=O)CC2)cc1 731218803 JSVCBTQLRLWPIL-UWJYYQICSA-N 408.502 2.491 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1cc(OC)ccc1O)O[C@@H](C)C2 734072531 FPVLPLWUYLTJMA-LBPRGKRZSA-N 400.431 2.378 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 734073661 UCAGTXAZWWEQFT-UHFFFAOYSA-N 411.317 2.165 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C3CC3)[C@@H](C)O)c2C)cc1 745741222 AOBKNWZHBALZHT-IERDGZPVSA-N 412.486 2.404 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 749648669 NSMAPEFQOVJKBM-UHFFFAOYSA-N 418.519 2.078 10 20 HECD C[C@@H](CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1 753121145 JMSMSQLJDFRFGN-AZUAARDMSA-N 415.582 2.452 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 753640271 NEXUSQWJFBASNJ-FXHACXQTSA-N 418.490 2.127 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)C1 753862402 ZIZFWQSKJWEVSI-IAGOWNOFSA-N 421.513 2.147 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccccc2CN2CCOCC2)cc1F 757856491 BUAYCNCJTHGGQY-UHFFFAOYSA-N 401.482 2.419 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1 760322921 PJVIXCHBYIXWCI-CYBMUJFWSA-N 412.421 2.168 10 20 HECD COc1ccc(C(=O)NCCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 761027400 PLXHZONETVQAKP-UHFFFAOYSA-N 417.849 2.248 10 20 HECD COCc1nc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n[nH]1 761863553 BKFCTFZADACHGU-UHFFFAOYSA-N 408.439 2.457 10 20 HECD CCOc1cccc(CN2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)c1O 768155123 AJKQHOXCYDHBAS-UHFFFAOYSA-N 406.504 2.306 10 20 HECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCSCC3)cc2)CCOCC1 781796582 MWTIUVFKTULUBH-UHFFFAOYSA-N 407.536 2.009 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(N2CCOC2=O)cc1 785423633 DQSUFWHMNOGORY-HNNXBMFYSA-N 410.474 2.203 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccnc(OC)c1 786582005 GHRJTUYBGJHFAO-UHFFFAOYSA-N 422.279 2.223 10 20 HECD C[C@H]1CN(C2CCOCC2)CCN1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 787063958 IROHRQXTWLGBLQ-RBUKOAKNSA-N 416.566 2.479 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(OCC(F)(F)F)c1 787277694 KUKJGHYQEYAOTN-UHFFFAOYSA-N 424.423 2.364 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(N(C)C)cc1 788320926 RQBQHSJJRJRBEH-KRWDZBQOSA-N 410.518 2.083 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@@H](Cc2ccccc2)C1 788910599 MLPIXYDFYVMCIT-QFIPXVFZSA-N 407.514 2.373 10 20 HECD C[C@H](Cc1ccsc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801971 YAKBEXBNYAJFIY-CQSZACIVSA-N 405.495 2.087 10 20 HECD CO[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789816633 DSQRWUBADDQKQU-XCGNWRKASA-N 421.513 2.083 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC(C)(C)C1 789833203 FLSSQZOFOGLALR-HNNXBMFYSA-N 405.514 2.298 10 20 HECD CCc1nn(C)c(CC)c1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790380006 QUDDBIXXLNZRCP-KRWDZBQOSA-N 411.550 2.106 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(-n2cnnn2)c1C 802609936 ORZQAIRIXVZFKL-UHFFFAOYSA-N 408.462 2.444 10 20 HECD Nc1nnc(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)o1 803149517 KCEJODLFJFHRPS-LUAWRHEFSA-N 423.545 2.054 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2ccccc2S(N)(=O)=O)cc1F 806772104 JRRURSDIKOBQCT-UHFFFAOYSA-N 408.499 2.319 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)cc1 918312346 YKAIJMYYDHSFNM-UHFFFAOYSA-N 421.505 2.414 10 20 HECD Cc1ccn(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820357551 WUMPHPBNTBONKR-OAHLLOKOSA-N 424.461 2.483 10 20 HECD COc1ccc(N2CCN(CCCNc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)cc1 18063082 IRFCAPGLGJRSCX-UHFFFAOYSA-N 413.478 2.327 10 20 HECD CCOC(=O)c1c(NC=C2C(=O)N(C)C(=O)N(C)C2=O)sc2c1CCSC2 29006407 ZOKZVTNSJLHOGG-UHFFFAOYSA-N 409.489 2.060 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3c(C)cccc3C)CC2)cc1 56966420 KMWCGSIINYFRJN-UHFFFAOYSA-N 410.518 2.189 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 726563121 VHYDWBIFRVQGNM-RYGJVYDSSA-N 413.518 2.344 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(S(N)(=O)=O)ccc3Cl)CC2)cc1 726627925 QIQOAXTYZTWEBR-UHFFFAOYSA-N 423.922 2.395 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCOc1ccc(S(N)(=O)=O)cc1 726867175 AOLQQDDSMJAIHA-UHFFFAOYSA-N 405.520 2.218 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(OC(F)F)cc2)SC1=S 727178069 RJDYVCRXFPOAQU-FLIBITNWSA-N 408.473 2.038 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2nc3c(s2)COCC3)C2CC2)cc1 735584650 PQOXRXDMQOXPQV-UHFFFAOYSA-N 400.504 2.412 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1O 737283524 BLQUWRRZPSTINX-UHFFFAOYSA-N 405.838 2.011 10 20 HECD Cc1nc(-c2ccc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2)n[nH]1 746146327 FYMVTJLOUDGQFN-IBGZPJMESA-N 418.501 2.412 10 20 HECD COCCN(CC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(OC)c(OC)c1 746475497 UZOWJZMNTOGOFZ-UHFFFAOYSA-N 422.503 2.199 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@H](OC)[C@H](OC)C2)c([N+](=O)[O-])c1Br 752980960 JQFGJIONBTUPEB-AOOOYVTPSA-N 406.189 2.124 10 20 HECD CCOC(=O)N1CCC(NC(=O)CCCN[C@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 756641455 HMZBYFSPADFTQQ-CQSZACIVSA-N 422.482 2.468 10 20 HECD CN1CCC2(CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 768930716 OUUOXYBNHOATKX-IBGZPJMESA-N 413.566 2.158 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc(S(C)(=O)=O)sc2Cl)cc1 770651252 SVRXIEAVJHCQIC-UHFFFAOYSA-N 408.954 2.350 10 20 HECD CC[C@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780142219 LRBQCGBOZXCUQU-SJORKVTESA-N 408.470 2.027 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])c2)CC1 780407603 NLIAFGNIDYLEAZ-UHFFFAOYSA-N 404.448 2.064 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2)CC1 780408098 AFJRSPDSELYSJH-UHFFFAOYSA-N 404.448 2.064 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C)C3=CCN(C)CC3)cc2F)CC1 781373113 CSMRYUBKHCJEMZ-KRWDZBQOSA-N 403.546 2.417 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)O[C@@H](C)C2 786625465 IJHKELNVKVGNPA-ZDUSSCGKSA-N 415.465 2.156 10 20 HECD Cc1ncsc1CN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803304511 CFOWXATWYXVKOR-AWEZNQCLSA-N 402.520 2.124 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(F)c(F)c1 803686053 ULQRFNWTWQQRQK-IBGZPJMESA-N 417.456 2.467 10 20 HECD CC[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291846 PBYANYZCBAEFBL-JOCHJYFZSA-N 407.514 2.479 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1O 810367019 HAUVNRCYKDYVAC-UHFFFAOYSA-N 424.207 2.326 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCC[C@]13CCOC3=O)c2[N+](=O)[O-] 813282079 JYHUJHDXRLXXNR-JOCHJYFZSA-N 420.377 2.292 10 20 HECD Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n[nH]1 918633800 OXOWJSDUACNTPM-UHFFFAOYSA-N 412.469 2.333 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccn3C)cc2F)C[C@H](C)O1 918800843 NNPFDLOOFTZTMS-GJZGRUSLSA-N 403.454 2.251 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(=O)N(C)c4ccccc43)CC2)cc1 1324500436 REUTVTQHDWEKRQ-NRFANRHFSA-N 422.529 2.084 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ccc(O)nn3)CCC2)cc1)c1cc(O)nc(O)c1 1788424276 QBEPXNJHTWUDDI-UHFFFAOYSA-N 421.413 2.050 10 20 HECD Cc1[nH]ccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817726710 UMTJOKVIGDXTBT-NSHDSACASA-N 413.459 2.125 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)cc2F)C1 1841145000 LYVVYPREQFIUSL-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C(c1ccc(-c2ncc[nH]2)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251380 ZHJSWCUGYHTWJD-UHFFFAOYSA-N 419.441 2.014 10 20 HECD Nc1ccc2c(N3CC=C(CCN4C(=O)c5ccccc5C4=O)CC3)ncnc2n1 480821930 BUJUKDMIMIADFN-UHFFFAOYSA-N 400.442 2.430 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 726975515 CZXVEFXGSNPAGV-UHFFFAOYSA-N 422.572 2.325 10 20 HECD Cc1ccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 727979594 QLENXRPXROANIX-UHFFFAOYSA-N 419.576 2.245 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCC3CCN(S(C)(=O)=O)CC3)cc2)CC1 731116375 OOJAMSAVIIECMK-UHFFFAOYSA-N 422.595 2.394 10 20 HECD C[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)n1cncn1 742750829 QFGWDQFGOLNDEL-YOEHRIQHSA-N 402.499 2.287 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(OCC(F)F)cc2)SC1=S 743283041 USIYGDIBSYADKW-XYOKQWHBSA-N 422.500 2.081 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc4c3OCCO4)CC2)cc1 743306362 YFFKYRQLXKVXOO-UHFFFAOYSA-N 412.490 2.410 10 20 HECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)N(C)Cc1ccccc1O 743314713 OBGMTKADEBHPTN-UHFFFAOYSA-N 412.490 2.452 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC3CCN(CC(C)C)CC3)CC2)cc1 743358979 PJZOARGXUASBML-UHFFFAOYSA-N 417.598 2.237 10 20 HECD CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 746038869 VUBDUQDPKZIZPQ-UHFFFAOYSA-N 424.501 2.026 10 20 HECD CCn1c(N)c(C(=O)CN(Cc2ccccc2)c2ccc(OC)cc2)c(O)nc1=O 747523630 NEALUXBIXPBXMR-UHFFFAOYSA-N 408.458 2.449 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)o1 748059636 OXELFXGKKZOORK-UHFFFAOYSA-N 408.476 2.412 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)cc1Cl 748641334 TUMLQSXTWRLUSD-UHFFFAOYSA-N 418.880 2.139 10 20 HECD CC(=O)c1cc(F)cc(CN2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)c1O 750817057 IDOSNUHMOCHVET-FQEVSTJZSA-N 414.433 2.360 10 20 HECD O=C(Nc1nn2cnnc2s1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060396 VMCNBJIUQFIDGA-UHFFFAOYSA-N 422.473 2.006 10 20 HECD CN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758478069 LAPYGVAJIDBZSB-GFCCVEGCSA-N 424.422 2.250 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)CC2)cc1 761652454 WHVVZPPIQBYAGE-PWRODBHTSA-N 402.539 2.074 10 20 HECD Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 766249304 PSWZHYVQLZUPBK-UHFFFAOYSA-N 410.518 2.461 10 20 HECD CCN1C[C@H](C)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H]1C 766252513 GWWJJWYFSVPKTD-HCXYKTFWSA-N 420.573 2.470 10 20 HECD COc1cc(CN2CCN(CCNC(=O)c3ccccc3F)CC2)c(O)cc1C 768453459 XVBIGAMEARQSND-UHFFFAOYSA-N 401.482 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H](C)c3c(C)n[nH]c3C)nc12 772030405 IJQUBPVGFBEPCA-JTQLQIEISA-N 401.423 2.189 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccn1 774884002 GWEFEWOUYKSKOF-GOSISDBHSA-N 421.545 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 778248810 ZACCXTGPTMWYFA-ZHACJKMWSA-N 424.457 2.125 10 20 HECD Cc1cccnc1C(F)(F)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 782724646 FBBBTPCLKKFLNX-MRXNPFEDSA-N 402.445 2.500 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1CCc1ccccc1 785293283 FZURZIGLFXYGLO-OAHLLOKOSA-N 408.458 2.223 10 20 HECD C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801773 UBBUQERWTWVZMI-SZVBFZGTSA-N 403.498 2.458 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1 792337316 BDRBEQKIXGOLRH-UHFFFAOYSA-N 400.435 2.058 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](C(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797710279 WNHHLKDZKYXVEP-PJIJBLCYSA-N 423.485 2.118 10 20 HECD CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCOC1 802761802 RVPOZSFGBFPAKA-MRXNPFEDSA-N 419.501 2.325 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H]1c1cccn1C)c1ccc(N2CCOCC2)cc1 803303422 NAXLZTOOQVYEKZ-DYESRHJHSA-N 410.518 2.403 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)O2 803686519 BYYFOMSBSGOHRG-DWVUQKNYSA-N 415.534 2.123 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](OCc4ccncc4)C3)CC2)cc1 805752257 BKLRTVFRXPVZEN-QFIPXVFZSA-N 410.518 2.030 10 20 HECD O=C(NCCc1ccc(Cl)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806592292 UYULVGPGORPBCB-KRWDZBQOSA-N 417.893 2.307 10 20 HECD CN1C(=O)COc2ccc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)cc21 807513340 LPSPFMWICCMHAS-UHFFFAOYSA-N 424.240 2.309 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(OC)n1 811970737 MTBABQGOYOWVKJ-UHFFFAOYSA-N 414.506 2.307 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)n3)cc2F)C[C@H](C)O1 814476212 PBUDZJACZLYDQU-KBPBESRZSA-N 417.437 2.013 10 20 HECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)OCCO 913362061 SOOARLGAZNWNHD-XFFZJAGNSA-N 402.291 2.186 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1 918211727 AGMWUIKNVVZTHD-UHFFFAOYSA-N 418.563 2.452 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CNC(N)=O)C3)cc2F)C[C@@H](C)O1 918219313 IKCOFOVKGFZLRB-UXLLHSPISA-N 421.517 2.029 10 20 HECD CC1(C)NC(=O)N(CCCOC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)C1=O 918848763 UPQTZVYFMCTGMP-UHFFFAOYSA-N 420.421 2.339 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC[C@@H](C)c1ccccc1 920636730 YXICHKYANJFOGG-KGLIPLIRSA-N 420.487 2.229 10 20 HECD CCC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1799622493 QZPRHICQOXVDMJ-HATOLVCRSA-N 423.513 2.276 10 20 HECD Cc1cnoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820066942 OWZRHOUFZQNZSQ-CYBMUJFWSA-N 412.406 2.132 10 20 HECD Cc1ocnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428494 RDVFIWMTOZWWMN-MRXNPFEDSA-N 414.462 2.336 10 20 HECD CCC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837651928 SGQNZSFXDDGPGZ-GQCTYLIASA-N 418.490 2.225 10 20 HECD O=C(c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1F)N1CCOCC1 548280113 NZANTTCGFXDLLE-UHFFFAOYSA-N 422.463 2.104 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](NS(C)(=O)=O)C3)ccc21 590701322 CUSWMILEQMQKFF-QGZVFWFLSA-N 407.536 2.058 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(=O)n(CC)c3)cc2F)CC1 730109975 FNCMPOVDWPRBGO-UHFFFAOYSA-N 401.486 2.471 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 740129040 RHFFLFWARISJBZ-UHFFFAOYSA-N 407.448 2.425 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 740907586 QKFGGIBKAJBXRL-AEFFLSMTSA-N 411.593 2.395 10 20 HECD CCN1C[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751970 YMEYVCRXFFSBQP-AEFFLSMTSA-N 418.538 2.303 10 20 HECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1c(O)ccc2c1CCCC2 743716648 VPDYZTMKKKEFLQ-UHFFFAOYSA-N 405.458 2.391 10 20 HECD COC(=O)c1cc(C)c(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 747604725 REDWSVFPBUETKH-UHFFFAOYSA-N 412.489 2.262 10 20 HECD CNS(=O)(=O)[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)C1 750218355 ZXDKTEWMTBFFFV-FQEVSTJZSA-N 415.559 2.389 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227430 IIZHISKURXIPEQ-UHFFFAOYSA-N 422.478 2.052 10 20 HECD C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)Nc1ncnc2[nH]cnc12 751945952 SJNZKXRGBSISHH-SNVBAGLBSA-N 423.458 2.166 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1 752022969 JBKROOFTUPAACQ-VGOFRKELSA-N 415.538 2.395 10 20 HECD COc1ncc(/C=C\C(=O)N(C)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cn1 754630382 OWWKHCBZJORFQV-WDZFZDKYSA-N 404.492 2.190 10 20 HECD C[C@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(Br)cc(F)c1O 756563845 OLSHHNOKALKAAP-NSHDSACASA-N 402.308 2.497 10 20 HECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCCCSc2nccs2)C1 759578406 FMNBEQMDZXSADM-CYBMUJFWSA-N 405.549 2.302 10 20 HECD O=C1CC[C@]2(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)SCCN12 761983394 RELDXXKSULOSOE-DNVCBOLYSA-N 409.939 2.192 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cc(Cn2cc(Br)cn2)on1 762263195 AYNXNALESAXOPL-UHFFFAOYSA-N 407.224 2.066 10 20 HECD O=C(NCC1(N2CCOCC2)CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 764832451 YCGFLBCJWVHUOK-INIZCTEOSA-N 424.492 2.421 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 769279822 AXCUOAHWLXPOBD-UHFFFAOYSA-N 418.393 2.228 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccccc3)cc2F)CC1 774316414 BEPZPNMGAQNOFT-KRWDZBQOSA-N 412.509 2.461 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1c(C)c(C)sc1=O 777828691 OQRPRQBWKSTXND-UHFFFAOYSA-N 412.895 2.478 10 20 HECD COc1ccc(CN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@H]2CCS(=O)(=O)C2)cc1 779513382 ISOMWQYFHVZQCN-OOYWPUHTSA-N 417.483 2.336 10 20 HECD O=S(=O)([C@@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1)N1CCOCC1 779607933 QYTYTGRIVBTMRW-OAQYLSRUSA-N 407.580 2.303 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 780822295 ZLZNPJMHUIFJCP-HLLBOEOZSA-N 418.513 2.249 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1-n1cnnn1 781681760 YXIGGGYWWOFDTI-UHFFFAOYSA-N 410.503 2.154 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)CC2)cc1 782776941 CWIGEZVKMZXCKQ-UHFFFAOYSA-N 420.473 2.158 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 784557774 UWCSLLUYZSXVDH-UHFFFAOYSA-N 403.391 2.230 10 20 HECD COc1ccncc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784767712 RDVZAYRHEBKWKE-OAHLLOKOSA-N 418.881 2.169 10 20 HECD CCCC(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786655566 FQRHBQUJDSJNSL-NRFANRHFSA-N 414.550 2.153 10 20 HECD CCN1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 787324525 HQFBTHNYOBLMRU-OAHLLOKOSA-N 419.481 2.343 10 20 HECD CCOc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788319597 MGOBPWMSAGRJLN-KRWDZBQOSA-N 411.502 2.416 10 20 HECD CCSCC[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800826 PUVCVPBHOGGTFJ-HNNXBMFYSA-N 411.543 2.269 10 20 HECD COc1ccc(N2CCCN(CN3C[C@]4(CN5CCC4CC5)OC3=O)CC2)cc1 790365264 BRXXNNJSNWBDDU-QFIPXVFZSA-N 400.523 2.081 10 20 HECD COc1ccc(C(=O)N2CCC(NC(=O)c3cccc(O)c3O)CC2)cc1OC 790746353 RAVQKPONNFKJRJ-UHFFFAOYSA-N 400.431 2.150 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H](CN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1 801001747 PRTSXMZZTDBLBX-WOJBJXKFSA-N 416.566 2.338 10 20 HECD Cc1cccnc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804033891 ILWSVJOOFZWDRD-OAHLLOKOSA-N 418.444 2.393 10 20 HECD CCc1cnc(CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 804315464 LVNSMPZDCZIINX-UHFFFAOYSA-N 416.547 2.458 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)N(C)C1CC1 804427725 GMAAQDYNVVMCCZ-KRWDZBQOSA-N 412.534 2.473 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1 806846418 NJFYSMGKZUFPPJ-GOSISDBHSA-N 418.563 2.066 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C)[C@H]3CO)cc2Cl)C1 807952719 KCTJRNXJOQTTRG-SPYBWZPUSA-N 407.942 2.422 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1)N1CCCC1 915227478 XLSSASWOIMOVBR-UHFFFAOYSA-N 415.538 2.325 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c(Cl)nc2ccccn12 918337761 NMXNHDBJJAHZHL-UHFFFAOYSA-N 418.906 2.153 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N2CCNC2=O)cc1 919970828 DYMBLALIOTURIO-UHFFFAOYSA-N 412.465 2.246 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccccc2CN2CCOCC2)cc1OC 921234257 OONIOIDRTRLWCP-UHFFFAOYSA-N 413.518 2.289 10 20 HECD CC(C)C(CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)C 1343418678 LHOIBTVQIAWJCB-GOSISDBHSA-N 416.566 2.049 10 20 HECD Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)co1 1816465288 NCZLOHJIXMVTQS-CQSZACIVSA-N 412.406 2.132 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2CC(F)(F)C2)C1 1841121882 OVJMZNXAPILMGL-UHFFFAOYSA-N 416.428 2.028 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1O 1845303796 SEHHXCAJVKQWLB-SOFGYWHQSA-N 424.453 2.348 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 726281748 CNJPYKZOZAQNEZ-JOCHJYFZSA-N 409.490 2.149 10 20 HECD Cc1cc(C(=O)COC(=O)c2cscn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 728336860 GYMZLNJSVFATRY-UHFFFAOYSA-N 419.484 2.238 10 20 HECD CCN(C)C(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 729179147 XUAXRPQXKCHITG-FQEVSTJZSA-N 422.529 2.410 10 20 HECD COC(=O)NC(C)(C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729737035 UNDGVKMJKNUGIY-UHFFFAOYSA-N 424.409 2.078 10 20 HECD CN(C)C(=O)C1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCC1 733354223 WOANHUPJOWBUHR-UHFFFAOYSA-N 416.566 2.343 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3ccsc3)CC2)cc1 740466965 LTDGXFZKWXOQFL-HXUWFJFHSA-N 418.563 2.302 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3Cc4cc(F)ccc4O3)CC2)cc1 740644347 AREZDGMKAQNLKH-JOCHJYFZSA-N 413.493 2.466 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 740901598 FFWGUXRMLMNVDG-UHFFFAOYSA-N 414.531 2.111 10 20 HECD O=C(COc1ccccc1CNC(=O)NCc1ccccc1O)NC[C@@H]1CCCO1 748459634 HRHCBWQZANRZIT-SFHVURJKSA-N 413.474 2.066 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@](C)(C(N)=O)c1cccc(Cl)c1 749360383 KNUJKEHTYFZWQI-OAQYLSRUSA-N 402.926 2.355 10 20 HECD C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)NC(=O)NC(C)(C)C 751929615 ALHAGHDABXFAQY-LLVKDONJSA-N 404.492 2.486 10 20 HECD C[C@H]1C(=O)N(C)S(=O)(=O)N1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 752889577 ZIBXYIVPUMFWGQ-ZDUSSCGKSA-N 401.448 2.448 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc4c(c3)OCO4)CC2)cc1 754000624 PJGUSBFTTIOYEC-HXUWFJFHSA-N 413.518 2.039 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)oc1C 754039681 CFSLLUQPBISFTQ-UHFFFAOYSA-N 412.439 2.033 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(CN(C)C)c3)CC2)cc1F 754212068 GBLLXDCTFHSJDH-UHFFFAOYSA-N 414.481 2.183 10 20 HECD O=C(Nc1cnn(-c2ncccn2)c1)C(=O)N(Cc1ccco1)Cc1ccccc1O 754919617 DDDLBMJKSAGIBJ-UHFFFAOYSA-N 418.413 2.128 10 20 HECD COC(=O)c1cc(NC(=O)CN(C)c2ccc3c(c2)OCO3)cc(C(=O)OC)c1 756653312 GKLYDNKTSFSVFJ-UHFFFAOYSA-N 400.387 2.063 10 20 HECD Cc1ccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 758274760 DXQANLXRWDMYAH-UHFFFAOYSA-N 402.432 2.303 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccn1 758295500 UBIYWEPAALBZBR-UHFFFAOYSA-N 401.410 2.416 10 20 HECD CCCN(CCC)S(=O)(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759104500 XHIMLZVVJRAIHT-UHFFFAOYSA-N 415.556 2.201 10 20 HECD CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NCc1ccc(O)c(O)c1)=NO2 760455349 PPCSNBQPXICVBQ-UHFFFAOYSA-N 405.451 2.260 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CS(=O)(=O)c4ccccc43)CC2)cc1 763035174 JBAAUGNXWOLALF-LJQANCHMSA-N 415.515 2.492 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)NCCCSc3nccs3)C2)nn1 763138204 DCCFKWQMGSLSLO-GFCCVEGCSA-N 410.525 2.050 10 20 HECD C[C@H](NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 765519549 YOQGOSJNKHRMOV-FQEVSTJZSA-N 423.561 2.308 10 20 HECD Cc1cc(C(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 770168334 JWCJDBYFWBUKMC-SFHVURJKSA-N 403.442 2.492 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 773749164 PJPDBXXULANVCU-YPMHNXCESA-N 419.459 2.420 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCC[C@H]3C)CC2)cc1 774760253 GQLNIQIHLCUSNS-NQIIRXRSSA-N 416.566 2.018 10 20 HECD CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785423891 IFLAMYPFSATCHI-OAQYLSRUSA-N 408.546 2.349 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3c(F)cccc3F)CC2)cc1 787916153 WBAGPEJSBHIIKU-UHFFFAOYSA-N 417.456 2.417 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)cc1 788950072 CTABOQCNZNMWPA-OAQYLSRUSA-N 422.529 2.413 10 20 HECD CC(C)OCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822064 VHFHMVIQIRZALE-IRXDYDNUSA-N 423.529 2.377 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 790220534 YCFAQNINWVPHGY-JFIYKMOQSA-N 418.513 2.346 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](c1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803308332 WKBSGPVEFXEHOG-IERDGZPVSA-N 408.502 2.363 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(F)c(F)c1 803659370 QPAFMEZLMUWAPG-KRWDZBQOSA-N 409.408 2.290 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(CC(C)C)C2)cc1F 804851655 KJIODEWLGJFIIA-GOSISDBHSA-N 406.546 2.382 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cnn(C)c1 805733295 QEPBCDUBQDDXJL-MRXNPFEDSA-N 409.490 2.485 10 20 HECD COc1cccc(CNC[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1O 816610742 WLMAKVKPOPPOFV-OAHLLOKOSA-N 407.511 2.254 10 20 HECD Cc1cc(C)nc(SCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 918372064 KBPYBMKPHCDHDV-KRWDZBQOSA-N 413.547 2.204 10 20 HECD CCCNC(=O)c1cccc(C(=O)N[C@@H](Cc2ccc(O)c(O)c2)C(=O)OCC)c1 1342435462 UUMNAOMZKCPWDA-KRWDZBQOSA-N 414.458 2.142 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)cn1)c1cc(O)c(O)c(Cl)c1 1795371409 PKEQOBOXWZUTPA-CLLJXQQHSA-N 417.849 2.417 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C(F)(F)C(F)F)CC2)C1 1810547919 ZCCPPUKNWXWODI-UHFFFAOYSA-N 419.375 2.238 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1)CC2)c1cc(O)nc(O)c1 1816727345 PREWZVPXORIVGG-CYBMUJFWSA-N 410.455 2.489 10 20 HECD O=C(c1ccc(C(F)(F)F)nc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249328 YTNDHOCLQFBYQW-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1cc(F)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1F 1843251304 RIUVASOTIUCJLG-UHFFFAOYSA-N 403.385 2.210 10 20 HECD COc1cccc(CNCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1O 725849111 HNYAJIMZJSMSRY-QGZVFWFLSA-N 406.504 2.148 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc1 726628291 WYTZXLJZAKMERC-UHFFFAOYSA-N 403.429 2.488 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nc2ccccc2c(=O)n1C 732203270 UBUGHGKIRPGXEU-UHFFFAOYSA-N 401.850 2.468 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCc2ccc(N(C)C)cc2C)cc1 734516466 AFHBTOKOVTYIKL-UHFFFAOYSA-N 404.536 2.110 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCO[C@H](C(F)(F)F)C1 740470151 VEOMWDWGDGLDAM-INIZCTEOSA-N 405.392 2.260 10 20 HECD CCN1CC[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C 740883387 OFVSQODQPPOPMP-MJGOQNOKSA-N 406.546 2.083 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 741093749 VADPVYXDICGTHJ-KZNAEPCWSA-N 410.536 2.439 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 745778541 DIMPXHXVASKAHW-PMACEKPBSA-N 417.598 2.157 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccccc1Cn1cccn1 746164623 YUWXZNJSUOKERU-UHFFFAOYSA-N 410.499 2.419 10 20 HECD Cc1ccccc1[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746759005 ZJCRJPTUWZVCGN-RXVVDRJESA-N 410.518 2.230 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(N4CC=CC4)c3)nc12 747712602 LDSWRHZXFCGWLO-UHFFFAOYSA-N 408.414 2.345 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)NCCNS(=O)(=O)Cc3ccon3)c2C)c1 750074915 CRDKPMAATUOQIQ-UHFFFAOYSA-N 416.503 2.240 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)C(C)(C)NS(C)(=O)=O)c2C)c1 751694201 GOISXUNIZIATKO-UHFFFAOYSA-N 406.504 2.456 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CSCCS3)cc2)C1 752880370 ITHFEZJESBHPCV-DOTOQJQBSA-N 408.593 2.036 10 20 HECD COc1ccc(N2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)CC2)cc1F 753739221 ADLBSPQPIMYQMN-UHFFFAOYSA-N 411.433 2.169 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nc(C)c(C)s3)CC2)cc1 755035896 ISVJFHNBFSKWHP-MHZLTWQESA-N 407.561 2.366 10 20 HECD C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 755128571 YMGSCDRAYGSCQV-LJQANCHMSA-N 413.566 2.125 10 20 HECD CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 755328120 CVGBPGWECXRSDV-SWLSCSKDSA-N 410.517 2.488 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1 757879463 KTAAUSGMUVNNRH-MCIONIFRSA-N 403.479 2.325 10 20 HECD COc1cc(N2CCN(C(=O)c3cccnc3N(C)C)CC2)cc(OC)c1OC 759225610 RHKVIXXPNONFFC-UHFFFAOYSA-N 400.479 2.136 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc([C@H]3CC(=O)N(c4ccccc4)C3)no2)c1 762151086 QHGIFSXDZQUGSA-LBPRGKRZSA-N 414.443 2.334 10 20 HECD CS(=O)(=O)c1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 766199593 FPPZQRUHCOVQBN-UHFFFAOYSA-N 420.306 2.037 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)c1 767794355 RMOZLSRGRHQIRF-ZDUSSCGKSA-N 418.471 2.068 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)COC4)cc2)C1 770041303 LNTLBVNADAOVEL-GOSISDBHSA-N 408.502 2.418 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 781507263 PGGPLAAORWMQTD-SECBINFHSA-N 408.357 2.282 10 20 HECD O=C(Cn1cnc(NCc2ccc(N3CCOCC3)c(F)c2)n1)NCc1ccccc1 783636851 YONCUKUOMMHMPD-UHFFFAOYSA-N 424.480 2.182 10 20 HECD Cc1nc(Cn2nnc(C(=O)Nc3c(-c4ccccn4)nc4ccccn34)c2C)no1 784054860 NNKOZCJZQUYECY-UHFFFAOYSA-N 415.417 2.288 10 20 HECD CC(C)[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789860467 LTHQPBIZXPJLAJ-IEBWSBKVSA-N 405.564 2.176 10 20 HECD O=C(NCCc1nccs1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 793762920 VLLXLIMZLSNTTR-UHFFFAOYSA-N 424.473 2.188 10 20 HECD COc1ccc(CNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c(O)c1 794376194 CMPVJGNZAPUSJJ-UHFFFAOYSA-N 418.247 2.190 10 20 HECD Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 798082243 LTDAUCWBPFZOPT-UHFFFAOYSA-N 406.464 2.418 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3CCCN(C(C)C)C3)CC2)cc1 803563803 DASIUYAWVPBUPC-SFHVURJKSA-N 416.566 2.017 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(Oc2ncccc2F)CC1 807099329 RYORJKIATCOVEJ-UHFFFAOYSA-N 414.481 2.281 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)NC(=O)OC(C)(C)C 807288874 BDELJZHKBFMLCO-UHFFFAOYSA-N 416.522 2.099 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C1CCN(c2ccc3nnnn3n2)CC1 807838921 CRQOYOOACFNBGY-UHFFFAOYSA-N 422.276 2.065 10 20 HECD CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cc1 808104827 PPHAEALHYVJKPN-UHFFFAOYSA-N 413.473 2.163 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3ncc(C)s3)CC2)cc1 808481703 BWIRQDMYVMKDQU-HNNXBMFYSA-N 402.520 2.376 10 20 HECD CNS(=O)(=O)NC1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 811500102 UJBSBWLESMWYDK-UHFFFAOYSA-N 414.575 2.268 10 20 HECD Cn1cc(Br)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 815730835 RIEFDXCLFWFPKU-UHFFFAOYSA-N 411.275 2.213 10 20 HECD COC(=O)c1cccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 916633264 SIPCNRYZRWOASI-LJQANCHMSA-N 400.475 2.044 10 20 HECD C[C@H]1CN(C[C@H]2CCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 921231728 KSMSQBDTHOQJEY-XQBPLPMBSA-N 402.583 2.285 10 20 HECD Cc1cc(C(=O)NC2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)no1 1319700046 JAUFMVVCIVQXCG-UHFFFAOYSA-N 402.470 2.353 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3cc(C(C)(C)C)n[nH]3)CC2)cc1 1339275313 HUDYJPQGTPCYAG-FQEVSTJZSA-N 415.582 2.331 10 20 HECD Cc1ocnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846435 XSVLWKYTPVIDFR-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD O=C(O)CCCN1C(=O)/C(=C/c2cc3c(cc2[N+](=O)[O-])OCCO3)SC1=S 63454104 KCSJCIYIRMZCFB-QPEQYQDCSA-N 410.429 2.432 10 20 HECD CCOc1cccc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 732914228 JDHLVWAOVKXMAV-SFHVURJKSA-N 413.522 2.176 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(-c4ccccc4)n3)CC2)cc1F 753740915 YQUDINWFZQXWMV-UHFFFAOYSA-N 408.433 2.343 10 20 HECD CCC1CCC(N(CCO)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 753816522 XRFGVXCZRICADV-SDVLMSEASA-N 419.610 2.441 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)c3ccc(OC)c(F)c3)CC2)cc1 754058643 CNPZMYVWXHBRAA-IBGZPJMESA-N 403.498 2.462 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 754864941 CPMOVCRDZUFZBV-HZPDHXFCSA-N 417.529 2.314 10 20 HECD COc1cc(N2CCN(C(=O)c3c(C)cc(C)nc3O)CC2)cc(OC)c1OC 759222861 LXYOBOGNVDOPBP-UHFFFAOYSA-N 401.463 2.392 10 20 HECD COc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)c(Br)c1O 761015593 OAZCOCRYNHSEED-XBXARRHUSA-N 404.263 2.449 10 20 HECD O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 769156845 UJVAHNPQRHWXGP-KCZVDYSFSA-N 417.550 2.461 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCN(C)C2=O)c(C)n1-c1ccc2c(c1)OCCO2 772538281 YSOBSSCXHRGCMJ-MRXNPFEDSA-N 412.442 2.070 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3cccs3)N(C)C)ccc21 774851887 DDWAFIOLGJNXAQ-GOSISDBHSA-N 400.548 2.166 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCc2ccccc2C1 775122268 RGWJBNNMNBIVSA-OAQYLSRUSA-N 407.514 2.155 10 20 HECD COc1cc(O)c(CN(C)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1OC 775677579 PGGUUGNJDJPXFG-UHFFFAOYSA-N 409.527 2.394 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 779509157 KSMSEOILHZOQEJ-KRXBUXKQSA-N 408.458 2.203 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCNC(=O)c2cc[nH]n2)cc1 780877444 HLDNPBKGPZCUDQ-UHFFFAOYSA-N 410.478 2.211 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21 784023587 DZFPPRVBQKKBBC-IBGZPJMESA-N 412.442 2.098 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)cn1 784058601 XDBMRMITQIYLMY-UHFFFAOYSA-N 416.503 2.372 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1 788279419 MYJRMWWTEFBUSU-KRWDZBQOSA-N 418.538 2.227 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c(O)c1 792808656 IDGGRFLCBZPPKM-UHFFFAOYSA-N 419.503 2.185 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCc2cnccn2)cc1 793499264 UGORIYLYCRIOIB-UHFFFAOYSA-N 407.474 2.023 10 20 HECD O=C(NC[C@@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793793876 LELCSEQLAITWSA-YOEHRIQHSA-N 411.449 2.058 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(Cn3cccn3)c2)cc1F 793815130 WDIWGTGGOKAMBW-UHFFFAOYSA-N 409.465 2.069 10 20 HECD Cc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(N)c1C 796114358 JHAIALMQCLXSOI-UHFFFAOYSA-N 415.465 2.335 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCOc2cc(Cl)c(Cl)cc21 797353422 JBSTVMTWCIUCMU-UHFFFAOYSA-N 414.270 2.216 10 20 HECD C[C@H](OC(=O)[C@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 800242875 LAXRYGQJPSEACP-KPZWWZAWSA-N 420.421 2.001 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)cc1F 804853417 XMZMYKDVGARDIB-IERDGZPVSA-N 423.554 2.459 10 20 HECD CCCN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805006839 HVYRYPBNAAEAGQ-UHFFFAOYSA-N 404.530 2.232 10 20 HECD CCNC(=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385352 IZUIKZNRLZVRNO-UHFFFAOYSA-N 420.263 2.159 10 20 HECD C[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807768132 CWDKKRFDZUSUEM-HUUCEWRRSA-N 411.449 2.010 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1 808341728 KXJGVAUPXIFSMC-PZJWPPBQSA-N 417.550 2.015 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(C)[C@@H]3[C@H]3CCCO3)CC2)cc1 810024779 RHVOWGWURRQACX-NNWRFLSQSA-N 403.567 2.068 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncccc3CSC)nc12 811438566 XKIKURCUSMLPJV-UHFFFAOYSA-N 402.432 2.227 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCc1ccc(OC)c(S(N)(=O)=O)c1 812429838 YYMPDFNOYPOAOF-UHFFFAOYSA-N 407.492 2.170 10 20 HECD C[C@H](NC(=O)N(C)CCOc1ccc(S(N)(=O)=O)cc1)c1ccc(N(C)C)cc1 814321985 WFEWUJLDLGRTEV-HNNXBMFYSA-N 420.535 2.181 10 20 HECD Cc1cc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)ccc2[nH]c1=O 820787178 KRGIDMDKAWHLIR-UHFFFAOYSA-N 413.499 2.152 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 920865860 PMRVRYMGXOPAEH-ZDUSSCGKSA-N 410.517 2.411 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@](O)(C2CC2)C1 1256166571 ACTKXQIXDDKGJP-GOSISDBHSA-N 408.501 2.242 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cn(CC(OCC)OCC)nn3)CC2)cc1 1323193461 PIWURXCFUZLVLF-UHFFFAOYSA-N 417.510 2.038 10 20 HECD C/C=C(/C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790246043 HDMLAWHAUKMLTD-ODCKRZMPSA-N 408.882 2.311 10 20 HECD CSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601423 GWOOZNVINOAFCM-BTTYYORXSA-N 414.487 2.175 10 20 HECD O=C(C[C@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547363 LZHRSABCFSMSON-QGZVFWFLSA-N 417.506 2.297 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1cc(O)nc(O)c1 1817843875 FMHWMMWWDFBMFG-GFCCVEGCSA-N 414.447 2.292 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)[nH]n1)c1cc(O)nc(O)c1 1817846464 ZFUJJYAOWFSSSH-CABCVRRESA-N 413.434 2.215 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817847260 RBYSQMOSXVKQRK-CQSZACIVSA-N 414.397 2.303 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2c[nH]c3ccccc23)C1 1845058246 FKSKXUBBXXKKHG-UHFFFAOYSA-N 406.442 2.034 10 20 HECD Cc1cccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)n1 1847039226 VDHOJOAPWMGRAZ-VQHVLOKHSA-N 409.442 2.037 10 20 HECD Cc1csc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)c1 1848201793 PMFICFZIABGOIJ-HOTGVXAUSA-N 401.488 2.311 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccccn1 1848266438 GDQFRUBCDNZMED-ZGCXVMDJSA-N 423.469 2.046 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(OC)c(C)c3)CC2)cc1 56966077 PYAZOLZTKPBTNB-UHFFFAOYSA-N 419.547 2.113 10 20 HECD CCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1nc2ccccc2c(=O)[nH]1 96954981 HVUAOGJZBVVKCS-UHFFFAOYSA-N 407.518 2.470 10 20 HECD Cc1cc(C(=O)NC2CCN(CCS(C)(=O)=O)CC2)c(C)n1-c1ccc(F)cc1 97555390 GOKOPSBUIOXTFB-UHFFFAOYSA-N 421.538 2.472 10 20 HECD OC[C@H]1CCCN(c2cc(NCc3ccc(N4CCOCC4)c(F)c3)ncn2)C1 301220982 ADZOLGJPLDPJGF-KRWDZBQOSA-N 401.486 2.273 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 301833932 JYKUWSXKNQJUCJ-UHFFFAOYSA-N 411.474 2.446 10 20 HECD COCCS(=O)(=O)c1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437008212 OMZCAJLFJHFWLP-UHFFFAOYSA-N 404.488 2.212 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)C[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 725823897 GYPWFGCHRNXMDP-UXLLHSPISA-N 400.516 2.428 10 20 HECD COCC[C@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237191 PCUGEZHOQSFNDF-INIZCTEOSA-N 416.501 2.167 10 20 HECD Cc1cc(C(=O)COC(=O)CN2CCC(=O)NC2=O)c(C)n1-c1ccc2c(c1)CCC2 733560369 YENOQSZXSFJXKQ-UHFFFAOYSA-N 423.469 2.251 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)n(C)c2)cc1 740812816 CPMXXLFXYLRLRA-UHFFFAOYSA-N 415.493 2.066 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 754075753 QYHLEOOHRJAUOH-UKILVPOCSA-N 424.589 2.167 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 754133382 HXYUXCNEIOUPHV-UTKZUKDTSA-N 414.506 2.437 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(=O)NC4CC4)cc3)cc2)C1 756938538 QJSJSQMJIXKNMY-LJQANCHMSA-N 420.513 2.211 10 20 HECD COC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 757640107 XBRBNSBTCKBMOE-IBGZPJMESA-N 424.501 2.174 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21 760491003 DYYZMAIRZMFIDB-FATZIPQQSA-N 412.486 2.220 10 20 HECD CC(C)N1CCN(C2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)CC1 761121883 HXZNKLIBRIGUJW-UHFFFAOYSA-N 415.626 2.201 10 20 HECD O=C(CN(c1ccccc1)S(=O)(=O)c1cccc2nonc12)N1CCCCC1 765079177 PJTPOSNIDWSNDC-UHFFFAOYSA-N 400.460 2.431 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1F 766548983 IRBDUJORSCAAMX-UHFFFAOYSA-N 414.393 2.383 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cc(C)n(CC(=O)NC)n1 767968170 GTHGGISYDJWHOP-UHFFFAOYSA-N 424.299 2.460 10 20 HECD Cc1nn(C)c(N2CCOCC2)c1CN(Cc1ccccc1O)C[C@H]1CCCO1 768161488 FTJIWSUROGRKGH-LJQANCHMSA-N 400.523 2.452 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCO[C@H](C)C3)CC2)cc1 770826556 JGFINJDULNROKC-MOPGFXCFSA-N 404.555 2.322 10 20 HECD O=C(NCc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774553777 NGEFGMHKDOWFBF-UHFFFAOYSA-N 419.884 2.373 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 774765195 XNEXTVCHZRECKM-DOTOQJQBSA-N 419.522 2.056 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnc(OC(C)C)c3)CC2)cc1F 778651098 AJJHILPSJNYWDR-UHFFFAOYSA-N 416.453 2.304 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N=c3cc[nH]cc3[N+](=O)[O-])cc2F)C[C@H](C)O1 781452392 CYUPMXJOPXDPGH-STQMWFEESA-N 403.414 2.486 10 20 HECD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)OCC(=O)c1ccc(O)c(O)c1 782470496 RGEBPZATTXKRDZ-FQEVSTJZSA-N 401.415 2.044 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](CC3CCC3)NC(C)=O)cc2F)CC1 783321740 KQWMRWMJHUOGGC-HXUWFJFHSA-N 404.530 2.279 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784762038 AZVSCVNACNKIRA-INIZCTEOSA-N 418.881 2.169 10 20 HECD C[C@H]1CCCCN1C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785423287 VPYWLJXYVIRHRR-AZUAARDMSA-N 400.567 2.482 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3-c3nnc(C)o3)nc12 786371709 QQFQFBBPGKEVTM-UHFFFAOYSA-N 423.385 2.327 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1 788931108 FLKFENRNRPMPIS-UTKZUKDTSA-N 403.548 2.074 10 20 HECD C[C@@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 789798198 DAYARHDIQSWDHZ-JFIYKMOQSA-N 405.514 2.467 10 20 HECD Cc1c(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)cnn1C 794017833 UMOUZAHMZDKLPY-UHFFFAOYSA-N 412.518 2.056 10 20 HECD C[C@@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@@H](C)S1(=O)=O 794159646 FNHRIFONBLNALT-HUUCEWRRSA-N 410.561 2.049 10 20 HECD Cc1cnc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 803450975 AGSSUIRKLAEYQL-UHFFFAOYSA-N 424.473 2.454 10 20 HECD CC(=O)OCCCS(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 804986698 RRFGSNZUDDSRKI-UHFFFAOYSA-N 406.451 2.129 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(C)(C)N1CCC(OC)CC1 805159513 OCGFIQBFHROQDO-UHFFFAOYSA-N 405.539 2.136 10 20 HECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)C1 806457239 HBPRJMGOLSZUCL-XDNAFOTISA-N 422.545 2.036 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)C[C@H]1CCOC1 807602539 FGCXWYXXTQYWQC-CHWSQXEVSA-N 413.312 2.435 10 20 HECD NS(=O)(=O)c1ccc2onc(NCc3ccc(N4CCOCC4)c(F)c3)c2c1 820635866 YXTOKYZRCZICIT-UHFFFAOYSA-N 406.439 2.063 10 20 HECD CC(=O)N1CCN(CCNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 915765023 VZWRSBHQUURSSM-UHFFFAOYSA-N 422.489 2.321 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C 918310660 NIOJZQILCMUJDN-UHFFFAOYSA-N 424.501 2.387 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCc3c(cccc3NS(C)(=O)=O)C2)cc1 918541203 AIMVEYABQBQJBJ-UHFFFAOYSA-N 402.520 2.392 10 20 HECD CCNC(=O)CN(C)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 918638157 PJZQUSDJROWTMO-JLHYYAGUSA-N 411.574 2.324 10 20 HECD CS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919969041 VOHDJCJJRUFTDN-UHFFFAOYSA-N 402.516 2.229 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(NC(N)=O)cc3)CC2)cc1 920254801 NEXCWCAZBKSBIK-KHPPLWFESA-N 423.473 2.029 10 20 HECD COCCN1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 920814321 VHLCWBGCAXZQIQ-CALCHBBNSA-N 422.545 2.349 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](c3ccccc3)n3cccn3)nc12 920908476 DLSFPTLIIRRQCB-SFHVURJKSA-N 421.413 2.141 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCSc1nccs1 1320621140 ISFOFJFBMJRRKV-UHFFFAOYSA-N 417.490 2.299 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc[n+]([O-])cc3)CCC2)cc1)c1cc(O)nc(O)c1 1788427026 LFJYGUBNZISCFA-UHFFFAOYSA-N 420.425 2.188 10 20 HECD Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995392 YQXJWZUSZFLLNW-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2C2CC2)C1 1841270372 DJTGZQGQRCIWCX-ROUUACIJSA-N 406.486 2.029 10 20 HECD Cc1cnc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)s1 1843441428 WEYFMZONXSDPBP-UHFFFAOYSA-N 423.498 2.061 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)n(C)c2ccccc12 522027620 XVEVDZMXGOAHIE-UHFFFAOYSA-N 420.517 2.052 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(C(C)=O)cc1 727170065 FXWDKVSUQUJBNB-UHFFFAOYSA-N 404.488 2.312 10 20 HECD COc1cccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1O 727760935 FEPJNZDVWRTANL-BBWFWOEESA-N 400.475 2.383 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)c3ccsc3)cc2F)CC1 730194973 UKFKNVBDXDCJKO-UHFFFAOYSA-N 418.538 2.465 10 20 HECD CC1CCC(N(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C2CC2)CC1 733464803 VWJIULQNBGLDEV-UHFFFAOYSA-N 424.519 2.490 10 20 HECD Cc1cc(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1-c1cccc(Cl)c1 739697269 YNBVFFFNUUZGOD-OAHLLOKOSA-N 424.954 2.393 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C3CCN(C(C)C)CC3)CC2)cc1 742241906 WMJJJUYTROXLSJ-UHFFFAOYSA-N 402.583 2.444 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)n1nnc(-c2ccccc2)n1 743315328 SQMQIFLYRYSZSZ-OAHLLOKOSA-N 424.480 2.318 10 20 HECD CNC(=O)[C@@H](C)CN(C)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 748282400 MMJKSPFDTVRXLB-ZETCQYMHSA-N 405.205 2.092 10 20 HECD COC(=O)c1nscc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751135955 BTYCDXXZHQOYSU-CYBMUJFWSA-N 412.489 2.005 10 20 HECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccc(F)cc4)C3=O)CC2)cc1F 753976874 DDDCEZXBHYMGHK-SFHVURJKSA-N 401.413 2.428 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H](C)c3c(C)noc3C)nc12 754290446 RTZCYETVMVGPNT-JTQLQIEISA-N 402.407 2.453 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 756648274 VJVGDTBINTVFDF-JTQLQIEISA-N 410.414 2.143 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ccc4c(c3)C(=O)NCC4)CC2)cc1F 758684213 OSWIESYYVSLOPJ-UHFFFAOYSA-N 412.465 2.152 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCc4c[nH]nc4C3)cc2F)CC1 758754584 VCSSSZSENVBJCY-QGZVFWFLSA-N 400.502 2.047 10 20 HECD COc1cc(N2CCN([C@@H](C)C(=O)Nc3cc(C)no3)CC2)cc(OC)c1OC 759877306 FZNIAPACEJUIBA-AWEZNQCLSA-N 404.467 2.158 10 20 HECD O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440779 DPRSBLPKTOBYNP-GOSISDBHSA-N 412.442 2.397 10 20 HECD Cc1cc(S(=O)(=O)NCCNCc2ccc(N3CCOCC3)cc2)c(C)s1 771980384 PEFAYOUZTKZBAP-UHFFFAOYSA-N 409.577 2.270 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1 773740483 PIVUKUMRSYEATI-AEFFLSMTSA-N 412.486 2.463 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1ccc(N(C)C)cc1 773857599 MPYFPDYHIWGFQU-CQSZACIVSA-N 419.485 2.225 10 20 HECD C[C@H](N[C@H](C)C(=O)Nc1sccc1C(N)=O)c1ccc(N2CCOCC2)cc1 775258476 BPMTXWPMTOWTQB-UONOGXRCSA-N 402.520 2.361 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](COC)c3ccc(F)c(F)c3)nc12 775535001 COQSMKIGOJKGEA-MRXNPFEDSA-N 406.389 2.367 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3ccc([S@](C)=O)cc3)CC2)cc1 775620440 YXKRCVLUBSSWFD-JWRCQZCYSA-N 415.559 2.432 10 20 HECD COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NCc1ccc(O)c(O)c1 778926919 HFRANMKQOOMVAG-OAHLLOKOSA-N 404.488 2.274 10 20 HECD CCOc1ccc(NC(=O)CN2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)cc1 780983905 QNLMFAHGKLYKKZ-UHFFFAOYSA-N 413.474 2.201 10 20 HECD CCN1CCN(C(=O)[C@@H](C)OC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 784670966 HEUJPJPAOZCHPI-CQSZACIVSA-N 402.520 2.026 10 20 HECD CN(C)C(=O)CCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785832923 KMVXRMTWUQUZPJ-UHFFFAOYSA-N 422.437 2.202 10 20 HECD CO[C@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cs1 788933004 OFXZJPDLAQEGPN-CQSZACIVSA-N 402.520 2.383 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCCS3)cc2F)C[C@@H](C)O1 789816270 CNJCSJLXYMHYSN-HLLBOEOZSA-N 423.554 2.457 10 20 HECD CC(C)CCOCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822569 BOCUKOOVHVHCLS-IRXDYDNUSA-N 423.529 2.234 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1 789836771 TZKQXKWVADSOGR-HNNXBMFYSA-N 413.474 2.252 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](N3CCCC3)C[C@H]2C)c1 795707138 YABCXUXRWPQKOG-VGOFRKELSA-N 401.551 2.486 10 20 HECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(N)=O)C1 802514015 VWFRBBXTCJPATN-KRWDZBQOSA-N 408.506 2.311 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803304150 WFMCONVBRQVCAK-LJQANCHMSA-N 422.529 2.049 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)cc1 803306965 VPKMZINNLGMETL-PKOBYXMFSA-N 423.513 2.383 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 806282422 KROTUGMMWNJYBV-OAHLLOKOSA-N 409.508 2.481 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 806767308 DECIANSVWAVULY-HNNXBMFYSA-N 418.538 2.273 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@]2(CCOC2)C1 807769527 GXXNKJGYALQUND-BTYIYWSLSA-N 423.460 2.012 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC4(OC)CCC4)n3)CC2)cc1 809464860 NBANMMWVRLPWTF-UHFFFAOYSA-N 400.479 2.081 10 20 HECD CCOCc1nc([C@@H](C)NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)no1 812567832 KIFGOSSFEKBYSU-CYBMUJFWSA-N 407.446 2.347 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CN(c2ccc(Br)cc2)C1=O 817028986 UGJGZBGQCAPEIH-LPSTVZDBSA-N 403.232 2.405 10 20 HECD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(O)c(O)c1 916590236 OWHBTXYPJKNZMN-UHFFFAOYSA-N 419.455 2.312 10 20 HECD COc1ccc(N2CCCN([C@H]3CC(=O)N(c4ccc(C(=O)O)cc4)C3=O)CC2)cc1 917638417 KJSQZVMBNIKGET-FQEVSTJZSA-N 423.469 2.238 10 20 HECD COCCn1cc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cn1 918250424 OXPIEOGRCAQXTP-UHFFFAOYSA-N 409.490 2.234 10 20 HECD COc1ccc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442931 XWYMVDHAMUHGCT-UHFFFAOYSA-N 411.502 2.467 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1 920482091 HUAWVOOLAMMUGW-UHFFFAOYSA-N 410.473 2.310 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCN(c2ccccc2F)C1 1343733140 PLSGAGZHXLJQEC-RDJZCZTQSA-N 416.449 2.354 10 20 HECD O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)C1=S=C(NC(=O)C2CC2)C=C1 1533767569 UCQYQCKCDQYCGQ-AREMUKBSSA-N 402.419 2.384 10 20 HECD CC[C@H](C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777849256 PPPKLMQDQWSEBW-CMPZQBNXSA-N 405.495 2.057 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)CC2CC2)[nH]n1 1823496268 JUMDXRCOPMPKBC-CYBMUJFWSA-N 421.548 2.062 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1)c1cc(O)nc(O)c1 1827286730 YYDQQBMTYYFSGY-PWSUYJOCSA-N 420.516 2.071 10 20 HECD Cc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)ccc2n1 1843249477 OHDMFGLYFULRDY-UHFFFAOYSA-N 418.453 2.480 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1 15443277 OFZIHEBVBYGKLF-UHFFFAOYSA-N 411.506 2.441 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC[C@@H](CNS(C)(=O)=O)C3)cc2)CC1 731048348 JQMKNKDMEHSVKA-IBGZPJMESA-N 422.595 2.394 10 20 HECD COC(=O)/C=C1/SCC(=O)N1CCCN(Cc1ccccc1O)C[C@@H]1CCCO1 731844260 FJIZVJHHHBEMTK-RONKMWSCSA-N 420.531 2.353 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCS(=O)(=O)CC1 732936245 HSFQMSVSWDPWKX-UHFFFAOYSA-N 402.463 2.198 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3C[C@H]4CC[C@H]3O4)cc2F)C[C@@H](C)O1 733840425 DRWKQAHICOAJPK-BKFWEMOKSA-N 420.481 2.166 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 734271860 MWCJNGGOBOTNKX-AZUAARDMSA-N 415.582 2.052 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1 734687020 CBRRPDOPDSDKFI-UHFFFAOYSA-N 415.582 2.337 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 741093748 VADPVYXDICGTHJ-FGTMMUONSA-N 410.536 2.439 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)c3ccc(C)o3)CC2)cc1 741401793 FNPPWTRNTVLBFU-FQEVSTJZSA-N 416.522 2.142 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1 742497811 KQSKPRDVVOXLCU-VURPSTOHSA-N 413.518 2.044 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2ccc(O)nn2)NC(=O)OC(C)(C)C)cc1 742752820 HKXDXTSJLSYVIG-INIZCTEOSA-N 401.467 2.244 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(-n4cccn4)nc3)CC2)cc1 743294541 NLEIPKVYLWACOM-UHFFFAOYSA-N 421.505 2.220 10 20 HECD Cn1cc([C@@H](O)CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 745801178 WWEYKBNXUKKWAY-KRWDZBQOSA-N 409.437 2.023 10 20 HECD C[C@@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 747502755 ZMXUFSSJDOKKLF-GOSISDBHSA-N 402.539 2.090 10 20 HECD O=C(CSc1nnc(N2CCOCC2)n1CC(F)(F)F)c1ccc(O)c(O)c1 748151881 SJCXLENMAGLSKV-UHFFFAOYSA-N 418.397 2.063 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccccc3[N+](=O)[O-])CC2)cc1 753993785 JBSWBUCUONGMNH-FQEVSTJZSA-N 414.506 2.218 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](C[C@H]4CCOC4)C3)CC2)cc1 754115259 SQIUUQQGFZISAU-XPNTWCBSSA-N 417.594 2.317 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(-n4ccnn4)c3)CC2)cc1 755426919 FKJCSJRZFRLFTR-UHFFFAOYSA-N 420.517 2.218 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnn(C)c3Br)cc2F)CC1 760250691 MWOSWDOIHLQQKD-UHFFFAOYSA-N 424.318 2.394 10 20 HECD C[C@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 764818596 KZDIPBAQFRNIOI-AWEZNQCLSA-N 401.960 2.251 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765777990 NZBSNINTZXLZMS-XKQJLSEDSA-N 410.465 2.471 10 20 HECD O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 766783383 RDMKPNDMAHARBF-UHFFFAOYSA-N 405.476 2.094 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)CC2)cc1 769153499 HWBNZYYHFRPYAC-FCHUYYIVSA-N 416.566 2.341 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)n1 770684682 YOSDPZPIHXZJSU-UHFFFAOYSA-N 424.505 2.447 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)Cc3cccc(O)c3)CC2)cc1 778388171 CPDHZZYDGCTPDS-RXQFDZFGSA-N 423.513 2.353 10 20 HECD CN(C)C1CCN(C(=O)CC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)CC1 779503926 XFPRENZPYVYCAQ-GQCTYLIASA-N 415.534 2.292 10 20 HECD CCOc1ccc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)cn1 781867976 JCVBOBADDGRQFW-UHFFFAOYSA-N 400.460 2.402 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(=O)N(C)Cc1ccccc1 787754808 PTURGZMYRXLCTG-UHFFFAOYSA-N 424.545 2.264 10 20 HECD CCCCCN(CCO)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822427 AUULPHIQJSBWRY-CALCHBBNSA-N 423.529 2.067 10 20 HECD CC1(C)CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793733640 NOIDASIRSCYGIO-MJGOQNOKSA-N 414.550 2.090 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc(F)cc1F 793823813 RWHUTUXZVYBXHY-UHFFFAOYSA-N 417.456 2.119 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c(O)c1 797615070 ORNGHERNHDBQQY-UHFFFAOYSA-N 404.854 2.312 10 20 HECD CO[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)[C@@H](C)C1 799344095 RZGOJJARWHEFQW-KBXCAEBGSA-N 419.547 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCCN4C4CC4)C3)ccc21 803685823 MLYZGLKSYKZURY-DENIHFKCSA-N 410.562 2.161 10 20 HECD O=C1N[C@@H](Cc2cnc[nH]2)C(=O)N1[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174570 HATJLFADSIQAOM-HOCLYGCPSA-N 405.405 2.143 10 20 HECD CN(CCn1cc(Br)cn1)C(=O)NCc1ccc(N2CCOCC2)cc1 808243644 NSSBIVSXCSKXML-UHFFFAOYSA-N 422.327 2.324 10 20 HECD O=C(NCCCO[C@H]1CCOC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 808275766 JJUPKOGLOASQMC-IBGZPJMESA-N 404.507 2.365 10 20 HECD CC[C@H]1CCC[C@@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808736612 WSANCWYIPGNQPI-RDJZCZTQSA-N 419.522 2.056 10 20 HECD NC(=O)c1ccccc1NCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 809727706 SNFCXSSAGSHOKU-INIZCTEOSA-N 416.909 2.337 10 20 HECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc1F 1796603200 DAPJCCWJUIZODT-QDMKHBRRSA-N 415.421 2.206 10 20 HECD Cc1[nH]ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286442 OXWFQNKZHVBSSW-NCSLWMNCSA-N 411.458 2.405 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cncs1 1816582575 OBLCSIVVMZYWRY-LBPRGKRZSA-N 414.447 2.292 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C1(O)CCC1 1845500213 DEQFDUGMPQMKRM-LBPRGKRZSA-N 408.882 2.119 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCCN1CCCCCC1=O 302890361 DPRXQPNBKZLTET-UHFFFAOYSA-N 402.539 2.457 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)C[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 725823896 GYPWFGCHRNXMDP-INMHGKMJSA-N 400.516 2.428 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)C2=Cc3ccccc3CC2)cc1C(=O)O 728014524 CKGBNAVCIFUTFF-UHFFFAOYSA-N 422.484 2.485 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3CCCN(C(C)C)C3)CC2)cc1 729607578 QUBQFCQGCTYQGA-HXUWFJFHSA-N 417.598 2.237 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1 732256507 FHZLSUPJBRGVGT-ZDUSSCGKSA-N 407.492 2.357 10 20 HECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 740491271 KKFYTXPKBNLZCG-BETUJISGSA-N 404.442 2.245 10 20 HECD CC1(C)[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]2CCO[C@H]21 741278634 FQCYEKZFIMAYEH-JCHJZTRSSA-N 400.523 2.001 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCCN3C)cc2F)C[C@@H](C)O1 745080943 YSTCWYPNPJHMTQ-JXXFODFXSA-N 421.513 2.083 10 20 HECD CS(=O)(=O)Cc1ccccc1NC(=O)NCc1ccc(N2CCOCC2)cc1 746770924 VSUKJTUYRSRINI-UHFFFAOYSA-N 403.504 2.390 10 20 HECD CCc1ncsc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 747476742 KTXFXQIEULVQOD-UHFFFAOYSA-N 402.520 2.169 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-c2nnnn2CC)c1 749629976 WULABKOGZFGMNR-UHFFFAOYSA-N 421.505 2.413 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730726 CHBTXRBMLONDKD-UHFFFAOYSA-N 413.546 2.174 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 753640273 NEXUSQWJFBASNJ-GFJSAUFNSA-N 418.490 2.127 10 20 HECD CCCN(CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 754498721 IDVVAHRFCKRYNB-UHFFFAOYSA-N 415.512 2.141 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCC[C@H]3CCCCO3)CC2)cc1 760670793 WKCHSCCGONJHSS-OAQYLSRUSA-N 404.555 2.466 10 20 HECD C[C@H](O)C[C@H]1COCCN1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768385944 WDFHWLWAGFBPCX-UXLLHSPISA-N 413.465 2.438 10 20 HECD CC(C)Cn1c(N)c(C(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)c(O)nc1=O 771791718 RHQCGOHQOMCCSE-UHFFFAOYSA-N 413.522 2.100 10 20 HECD C[C@@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 774176072 AUXHAZQMECHIIW-DYESRHJHSA-N 417.550 2.070 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](CO)C3)cc2Cl)C1 774241101 CXVGQIMSYNLZCJ-DOTOQJQBSA-N 407.942 2.423 10 20 HECD C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775254355 HLIRAFWBKNDRCO-KKSFZXQISA-N 404.532 2.311 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(C)n3C(C)C)CC2)cc1 777665977 SRPYUYQXWQGFHV-GOSISDBHSA-N 405.568 2.451 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(C)=O 779459533 SFKJLGZOEXZTJO-NSHDSACASA-N 404.444 2.277 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1CCN(C)C)c1ccc(N2CCOCC2)cc1 782473584 CMWHUTQMWKIZOJ-SFHVURJKSA-N 424.545 2.443 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)cc1 785422955 RGQNLNSJEFNQJK-GOSISDBHSA-N 418.538 2.275 10 20 HECD CCOCCOCCN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787329344 KMLPVXBGJYTREA-UHFFFAOYSA-N 410.470 2.385 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCc2ccccc2C1 787716321 HBXFQLDAFYCEHM-UHFFFAOYSA-N 408.546 2.276 10 20 HECD CCOC(=O)C1CCC(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC1 793675394 NZIGYFFPZMGNPO-UHFFFAOYSA-N 403.523 2.339 10 20 HECD COc1ccc(O)c([C@H](C)N[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794830736 KIXCHHGRKQJUSH-XOBRGWDASA-N 401.511 2.272 10 20 HECD CCN(CCCN1CCCC1)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803313646 AIDNWCZJSSNLTD-IBGZPJMESA-N 416.566 2.035 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1)c1ccc(N(C)C)cc1 804106951 XCBVTQSDCRVJKO-KRWDZBQOSA-N 405.502 2.474 10 20 HECD COC(=O)N1CCC(CNC(=O)NCc2cccc(Br)c2O)CC1 805833573 AFICVZNMBUWIBM-UHFFFAOYSA-N 400.273 2.432 10 20 HECD CC[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291847 PBYANYZCBAEFBL-QFIPXVFZSA-N 407.514 2.479 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@H](N(C)C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676019 BYKRNNYXCOZJGZ-QAPCUYQASA-N 418.538 2.398 10 20 HECD COC(=O)C1(CS(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCCC1 809818427 IOLPXFQKDGAYIU-KRWDZBQOSA-N 411.520 2.436 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1)[C@@H]1C[C@H]1C 815550074 BXLLTSMGWSSUTJ-FZKQIMNGSA-N 411.458 2.157 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(CC(N)=O)CC1 917132544 SNUYAISWNSKDTF-CQSZACIVSA-N 419.481 2.376 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)s1 917759058 ANRJSMMLMMQTMI-UHFFFAOYSA-N 410.517 2.444 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1 918428897 BFVCVDVEIJVBNZ-UHFFFAOYSA-N 403.504 2.191 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712664 PILPMSDHUCFCGF-OBSCOMINSA-N 410.898 2.410 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843970699 XHHPRBCYFYAFKK-JNYVMKGUSA-N 400.475 2.456 10 20 HECD O=C([C@H]1[C@H]2SC=C[C@H]21)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502110 PWVUEXHBMCGTCJ-PEYYIBSZSA-N 406.891 2.443 10 20 HECD Cc1c(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)n(C)c2ccccc12 576732096 NAWALQGQDUBBNR-PBPSECFOSA-N 413.518 2.288 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)cn3)cc2)C1 727308942 WHPSQQYWIJIDDH-CQSZACIVSA-N 417.307 2.476 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCN(C(C)C)CC3)CC2)cc1 727938211 FFMSXFHGQIGXPP-UHFFFAOYSA-N 417.598 2.333 10 20 HECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)NCc1ccc(N(CC)CC)c(F)c1 731356398 FWSIRMSKBNJHFY-QGZVFWFLSA-N 401.504 2.034 10 20 HECD O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 732589884 GHCUQMLJJOMLPZ-CABCVRRESA-N 415.412 2.246 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnc1Cl 735314929 XPIKSGYCVQWPGR-OAHLLOKOSA-N 422.938 2.224 10 20 HECD CN(CC(=O)NCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 738459526 KXMSSMBBVSXXFB-UHFFFAOYSA-N 414.481 2.120 10 20 HECD COCCN(CC(=O)NC[C@@H]1COc2ccccc2O1)c1ccc(OC)c(OC)c1 746475405 SAGSCCCQBNOQFC-QGZVFWFLSA-N 416.474 2.113 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CC3(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 746831465 DHMIEQCEIJRJDM-HUUCEWRRSA-N 412.527 2.270 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cn3cc4ccccc4n3)CC2)cc1 748515205 HJNFUWZLZDOZGR-UHFFFAOYSA-N 407.518 2.373 10 20 HECD CNS(=O)(=O)c1csc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 748707144 UZIYXRLVWHVTQP-UHFFFAOYSA-N 409.533 2.064 10 20 HECD CC[C@H](C)OCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 751867907 TTWPSUQXBKEFTF-AWEZNQCLSA-N 422.503 2.283 10 20 HECD O=C(NCc1ccno1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 758538423 SMYOSVDAMRTCLD-UHFFFAOYSA-N 418.387 2.019 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cnn(C)c1C(F)F)c1ccc(N2CCOCC2)cc1 758982504 LMZDAKKQFOMCAO-LBPRGKRZSA-N 407.421 2.010 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)CC2)cc1 760910226 UHPRCKYIYURCFB-BDTNDASRSA-N 416.566 2.464 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NCCc2ccc(O)c(O)c2)ccc1[N+](=O)[O-] 762268404 DRUROJRYLJNRGZ-QGZVFWFLSA-N 413.430 2.278 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNc3ccc4nnc(C(F)F)n4n3)cc2)C1 768522791 PQCPOFPMPPTLSI-ZDUSSCGKSA-N 401.421 2.376 10 20 HECD CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCN(c2ccccc2)C1=O 769806387 TWBFQCGXIJHINH-KRWDZBQOSA-N 417.487 2.031 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCc2ccccc2)[C@H]2CCOC2)c1 769966763 XHQCZIQQNMVSLK-KRWDZBQOSA-N 404.488 2.238 10 20 HECD CO[C@@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 770630154 FYYAOOBCUXQWHF-QEEYODRMSA-N 410.486 2.270 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 773740266 JHBSMEYKMHLYRJ-AWEZNQCLSA-N 418.515 2.219 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc(C3CC3)nc21 773740764 PDEWQCBKORNGMT-LLVKDONJSA-N 424.457 2.167 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H]1OC 776118485 QBHAVOCVJVLGOK-YURUWKFZSA-N 409.502 2.431 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)COc3ccccc3)CC2)cc1 778244061 BLCRWUQDWCAWFC-JXOMPUQVSA-N 423.513 2.484 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCN(Cc2ccccc2)C1 779009874 GETROWPKALPWTJ-RDJZCZTQSA-N 417.531 2.404 10 20 HECD O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc(O)c(O)c1 783659401 MJFNHPVHVDFKEF-LLVKDONJSA-N 420.399 2.098 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 784716283 BDSNLBKREORCGC-UHFFFAOYSA-N 423.469 2.260 10 20 HECD Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 786223139 AYRIAVZGXWBFRI-LEWJYISDSA-N 424.545 2.100 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCn2cnc3ccccc32)C2CC2)cc1 786987421 VGDAUZFRTJLRRT-UHFFFAOYSA-N 405.502 2.410 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3nc(C)c(C)s3)cc2F)CC1 789474572 VMUPBIOTVZYINY-UHFFFAOYSA-N 419.526 2.296 10 20 HECD C[C@@H](O)[C@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)Cc1ccccc1 791417254 KIBKQECZZHCKJW-VLIAUNLRSA-N 406.504 2.123 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccc(Cl)c(-c3nn[nH]n3)c2)c1 799774153 NZYRHSDWQVBOFM-SECBINFHSA-N 409.855 2.274 10 20 HECD CC(C)n1cc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 803310345 JCDVOKMCDBACAJ-DLBZAZTESA-N 413.522 2.355 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@]3(CCc4ccccc43)C2)cc1F 803661766 MGXGRHYPLCIMFJ-HSZRJFAPSA-N 411.477 2.208 10 20 HECD CCc1ccc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 804064865 JMWUCZWFYHRLNI-UHFFFAOYSA-N 409.530 2.403 10 20 HECD CC(C)[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc2ccccn12 804099815 BDRKVIXXSYGLFC-FQEVSTJZSA-N 418.501 2.235 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCC[S@](=O)C(C)(C)C 806198388 NBIKAQPNXYTLPN-NDEPHWFRSA-N 407.580 2.299 10 20 HECD CCOC1CC2(CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)C1 806495025 BBJSYGZSUYUIQC-TWEIKEKHSA-N 414.550 2.489 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 807095727 DVUKQWVQSMZZED-UHFFFAOYSA-N 404.536 2.117 10 20 HECD COc1ccc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)cc1 809734192 YCVXCDFWWSCHHM-UHFFFAOYSA-N 408.546 2.405 10 20 HECD CNC(=O)Oc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 815647136 ADTUSLOCRCUNPZ-UHFFFAOYSA-N 422.235 2.128 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)C3CCCCC3)cc2)C1 918120722 BSSQGQJUVNTXMQ-UYAOXDASSA-N 402.539 2.129 10 20 HECD NC(=O)[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 918601787 JHVVMCYYYBBNIM-VSXLWIIGSA-N 409.558 2.063 10 20 HECD CCOC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 919969219 QNMMENGKQFFRFP-IBGZPJMESA-N 403.523 2.380 10 20 HECD O=C(/C=C/C1CC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1803183271 KIHILQPESBBBFT-YONMQOAISA-N 408.458 2.174 10 20 HECD C[C@H](Cn1cccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842121512 GBOHCHANQYIRQD-CYBMUJFWSA-N 418.881 2.101 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2csc3c2CCCO3)C1 1843225283 ZUKSSZDRPRSAHV-UHFFFAOYSA-N 415.471 2.010 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(OCC#N)c1)c1ccc(N2CCOCC2)cc1 141680241 SCAGTJCXYMHOIA-INIZCTEOSA-N 408.458 2.241 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCC[C@@H](C(=O)NC(C)C)C2)n(C)c2ccccc12 553082567 HVQJQLQQYDCSAC-SJORKVTESA-N 412.534 2.303 10 20 HECD CCOc1ccc(C(=O)NCC(=O)NCc2cccc(OC)c2O)cc1OCC 727760902 CNMRNCKLIPBZJH-UHFFFAOYSA-N 402.447 2.244 10 20 HECD COC(=O)CSCCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 729855703 IANIDCGPQLKVJL-ZIAGYGMSSA-N 413.515 2.145 10 20 HECD CCNS(=O)(=O)CCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 731763792 CELSNXGNFAMXIT-UHFFFAOYSA-N 403.464 2.096 10 20 HECD CCOc1cccc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1O 732914227 JDHLVWAOVKXMAV-GOSISDBHSA-N 413.522 2.176 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)COc3cccc(C=O)c3)CC2)cc1 733251180 FQXKSBTUNXGESF-UHFFFAOYSA-N 411.502 2.215 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741097814 ZGNLRJADBZIMRW-UHFFFAOYSA-N 413.499 2.030 10 20 HECD CN(C)c1ccc(CNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1F 746725049 YJUIVPDMLLKMGK-KRWDZBQOSA-N 417.407 2.265 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCCCSc2nccs2)c(F)cc1F 749730201 LGDADHWFQYOWTM-UHFFFAOYSA-N 415.443 2.445 10 20 HECD Cc1cc(C(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)c(C)n1-c1ccccn1 755587578 CFBBUBGNOQCLKR-LJQANCHMSA-N 409.534 2.258 10 20 HECD Cc1ccc([C@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c(O)c1 756587556 BDKRXDRZQTVFFE-KRWDZBQOSA-N 403.548 2.488 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765902682 BMOMCHJNXUQPBS-UHFFFAOYSA-N 423.263 2.435 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773849165 XGXZTTOMQBXWLW-INIZCTEOSA-N 424.501 2.041 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774280544 QJEQHJKLXVHTPE-CYBMUJFWSA-N 421.448 2.308 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C 785296297 CJIKMQNUMLUVMU-LLVKDONJSA-N 419.865 2.139 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN(C)c3ccccc3)CC2)cc1 785622424 IGKHLAODXUXYQG-UHFFFAOYSA-N 410.518 2.033 10 20 HECD CC1CCN(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 787663430 FJZZZALTXWSSHX-UHFFFAOYSA-N 400.567 2.483 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@@]2(N(C)C)CCSC2)cc1 788249668 ZOKPLVPDPLKNHH-NRFANRHFSA-N 406.596 2.045 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(C)cs1 788309231 DFQWGYZBZPSXPT-KRWDZBQOSA-N 402.520 2.172 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CCCc2occc21 788629959 YCGQFLJWTJXXCN-GOSISDBHSA-N 415.465 2.190 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 788812182 AHDJRJGBAYQGME-HNNXBMFYSA-N 404.561 2.384 10 20 HECD Cc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789798375 GJTVDUREOUBXQD-OAHLLOKOSA-N 417.481 2.317 10 20 HECD CO[C@H]1CCC[C@@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 796052040 FXUOXQGLHLRVIV-AEFFLSMTSA-N 422.497 2.417 10 20 HECD O=C(CN1CCOC[C@H]1[C@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 796340596 MNSPSBXZLYNWFV-VQTJNVASSA-N 420.465 2.280 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1 798097867 DUUUVMCXFGHHRO-UHFFFAOYSA-N 422.526 2.320 10 20 HECD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803298846 FMIBLDMIYCDIAZ-AVRDEDQJSA-N 423.513 2.301 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@@H](Cc2ccncc2)C1)c1ccc(N2CCOCC2)cc1 803304249 FNTWVJDGFKZVJP-QUCCMNQESA-N 422.529 2.187 10 20 HECD CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663809 BEJRANRNRXPAPT-UHFFFAOYSA-N 418.488 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CC45CCOCC5)n3)CC2)cc1 809464471 GFZBEWCISDGOLH-SFHVURJKSA-N 412.490 2.254 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(Cl)c4nonc34)CC2)cc1 814377357 YIACGDJZTZQKFP-UHFFFAOYSA-N 408.867 2.396 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(N4C(=O)CNC4=O)c3)CC2)cc1 916688999 NUDHDDQAVPHFCN-UHFFFAOYSA-N 409.446 2.106 10 20 HECD C[C@@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918673734 QDQUOKTZKQJFCB-APWZRJJASA-N 414.550 2.090 10 20 HECD Cc1cc(CC(=O)OCC(=O)N[C@H](C)C(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 919011513 FCYGTXCVDHRDLR-CQSZACIVSA-N 419.909 2.426 10 20 HECD CC(=O)N1CCC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 920180054 IWDAIGBUVIWHEX-UHFFFAOYSA-N 412.513 2.043 10 20 HECD CN1CCN(c2ccc(CNc3ccc(C(=O)NCCCO)cc3)cc2F)CC1 1321298496 DRNNMUNEEYEONK-UHFFFAOYSA-N 400.498 2.302 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1C1CC1)C1=NN(c2ccccc2)C(=O)C1 1792956114 CARDMWQCOWOPBE-HKUYMTLNSA-N 420.513 2.464 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1F)c1cc(O)nc(O)c1 1801826003 ISHHCNWMXBHCHM-QDMKHBRRSA-N 417.412 2.266 10 20 HECD COc1ccc([C@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843249103 WPJQNFZBSKOHMW-QZTJIDSGSA-N 423.469 2.122 10 20 HECD COCc1c[nH]c(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1844680654 RGFHLOUUMMFZKB-UHFFFAOYSA-N 419.865 2.357 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(F)ccc2Cl)C1 1845371800 CGLAJPMBOAYFLA-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 85597932 MCCCSNHWCNBFSN-UHFFFAOYSA-N 421.519 2.328 10 20 HECD COCC(=O)N1CCc2cc(NS(=O)(=O)c3cccc4nsnc34)ccc21 548608946 QJHXTJRZNPIVAA-UHFFFAOYSA-N 404.473 2.028 10 20 HECD CCOc1ccc(NC(=O)c2cc(O)cs2)cc1S(=O)(=O)N1CCOCC1 732265620 COSXCCRHHVKHOZ-UHFFFAOYSA-N 412.489 2.126 10 20 HECD COCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1 732921049 HQWBMDXEDOVGDI-UHFFFAOYSA-N 402.470 2.170 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)cc3F)CC2)cc1 732922986 JSYQLVFXJHRUBM-UHFFFAOYSA-N 407.511 2.243 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)Nc3ccccc3)cc2)C1 733644329 FHBWWELIPKIHEF-GOSISDBHSA-N 423.517 2.216 10 20 HECD CCOC(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741099783 HZKUQHMTOADNEO-UHFFFAOYSA-N 407.470 2.423 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3-c3nc(C)no3)nc12 745256955 BNFXOZVVUBPDTR-UHFFFAOYSA-N 423.385 2.327 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCCO[C@@H]1CCOC1)c2[N+](=O)[O-] 757426696 YXDGHHTXIYXCKM-CYBMUJFWSA-N 424.409 2.296 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4cccs4)CC3)CC2)cc1 757851977 YTLYESVYJVWWNG-UHFFFAOYSA-N 400.548 2.228 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCCn3c(C)nc4ccccc43)CC2)cc1 758213701 DHMJNXCGOQZYSW-OAQYLSRUSA-N 423.561 2.126 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccn(-c2ncccc2F)n1 759015796 MJTCQJKNXSVECN-UHFFFAOYSA-N 406.421 2.038 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)NC4(CCCCCC4)C3=O)CC2)cc1 761186687 SQPCTYZCIMTNDA-UHFFFAOYSA-N 400.523 2.462 10 20 HECD CC(=O)O[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 765075088 JIRQTTSODCAQQD-AWEZNQCLSA-N 424.500 2.422 10 20 HECD CCNc1ncc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 770096868 YEDYADJBWMXSEQ-UHFFFAOYSA-N 404.492 2.089 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)c1ccc(F)cc1 770261845 KVTMPRWHMUQRJM-HXUWFJFHSA-N 405.445 2.459 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2)CC1 770285843 GLBZFZATCBIITN-UHFFFAOYSA-N 422.938 2.382 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCSC[C@@H]3c3nccs3)nc12 770699125 ICMHQKMJBJOPBS-CYBMUJFWSA-N 405.505 2.358 10 20 HECD C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(c2ccccn2)CC1 775259694 XHRBQNLEPTUKQI-PMACEKPBSA-N 423.561 2.306 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)O)c(F)cc1Cl 775286923 QGYROROHLTUGLB-UHFFFAOYSA-N 403.771 2.470 10 20 HECD Cc1ccc(C(=O)N2CCN([C@@H](C(N)=O)c3ccc(Cl)cc3)CC2)c(O)c1O 780863119 QRLSFQZHCDVJTJ-MRXNPFEDSA-N 403.866 2.044 10 20 HECD CO[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 783022850 ZKCVRKFDVOKAIA-GOSISDBHSA-N 419.547 2.425 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCCCC2)nc1 787203805 UMXCIFVOLOSTDS-UHFFFAOYSA-N 409.534 2.379 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(OCCS(C)(=O)=O)c1 789835241 MKEBAULCCDOBFC-CYBMUJFWSA-N 408.476 2.274 10 20 HECD CCC1(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCC1 789843393 KMARQLXTHDCLQE-UHFFFAOYSA-N 405.514 2.490 10 20 HECD CC(C)NS(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249783 VTTOWCTWLFZDMX-INIZCTEOSA-N 400.545 2.151 10 20 HECD COC(=O)CN(CCN1CCN(C)CC1)Cc1c(O)ccc2oc3c(c12)CCCC3 799145351 UENIIEILBFEVHM-UHFFFAOYSA-N 415.534 2.240 10 20 HECD CCOc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 800013860 JXFAFXDFDZZQLF-KRWDZBQOSA-N 417.531 2.266 10 20 HECD CCCCOc1ncccc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803148985 ZHIHXOXHZXAJKD-UHFFFAOYSA-N 402.470 2.398 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1COC2(CCCCCC2)O1 807290536 YEPWRLDFGNXJJR-FQEVSTJZSA-N 413.518 2.261 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc4c3COC4=O)CC2)cc1 808921331 QPCWTPNQCYANKR-UHFFFAOYSA-N 409.442 2.043 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC4(CCC4)[C@@H]3[C@H]3CCCO3)CC2)cc1 810092433 ALBBBCCODIKFKV-WWNPGLIZSA-N 415.578 2.212 10 20 HECD O=C(COC(=O)c1conc1C1CC1)NCc1ccc(N2CCOCC2)c(F)c1 811316389 GTOBWNQULUEXIQ-UHFFFAOYSA-N 403.410 2.001 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=S)NCCCN3CCOCC3)cc2F)C[C@@H](C)O1 917581143 OBNVVRBUOBEPHP-IAGOWNOFSA-N 424.586 2.126 10 20 HECD CCS(=O)(=O)N1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 918065289 VQXVGFIGHBTVRK-UHFFFAOYSA-N 408.568 2.241 10 20 HECD O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(N2CCOCC2)c(F)c1 918215435 HBCZXXPWAOEPOP-UHFFFAOYSA-N 417.437 2.269 10 20 HECD CC(C)NS(=O)(=O)c1cccc(C(=O)Nc2cccc(N3CCOCC3)c2)c1 918374698 WNZQUQLKCWDTTQ-UHFFFAOYSA-N 403.504 2.462 10 20 HECD Cc1cc(C)cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918463553 KPTMJDPPXJUXMM-GOSISDBHSA-N 408.502 2.260 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1nc2ccccc2[nH]1 1320519488 GGRJFMUUYBJYRI-HNNXBMFYSA-N 415.471 2.357 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncc(OCC(F)F)c1 1325764585 UIRGMIJULWYBGH-AWEZNQCLSA-N 410.373 2.041 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007299 BOOVITBCZIUZSA-OITMNORJSA-N 408.882 2.241 10 20 HECD O=C(C[C@@H]1OCCc2ccccc21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249074 UAIIMHJXKMBQCC-SFHVURJKSA-N 423.469 2.014 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=S)NCCCN2CCOCC2)cc1 58954832 CNGNWXDHZFEOGK-NRFANRHFSA-N 420.623 2.330 10 20 HECD Cc1cc(C(=O)N2CCC(NS(C)(=O)=O)CC2)c(C)n1-c1ccc(C#N)cc1 261397572 YTNSQHBJSFGMAE-UHFFFAOYSA-N 400.504 2.120 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3oc4ccccc4c3CO)nc12 726015820 PAPBHACNMHXHOM-UHFFFAOYSA-N 411.370 2.207 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 728944006 HWXLDYOKQRLJTF-AWEZNQCLSA-N 418.494 2.406 10 20 HECD CC(=O)N1CCC(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 729497619 WTRLWQZOQKSXRB-HZPDHXFCSA-N 420.529 2.497 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](N(C)C)C3)cc2F)C[C@@H](C)O1 732205313 OJPIMTWNHMHWSG-LMMKCTJWSA-N 406.546 2.082 10 20 HECD CC(C)[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 734269228 JMZCNFWELJUCJD-CLCXKQKWSA-N 406.502 2.105 10 20 HECD COc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1C(=O)N(C)C 735315238 IKGDQLQUFHFIEM-UHFFFAOYSA-N 415.562 2.314 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@H]3c3ccc(CC)o3)nc12 736318056 DTKSVJLCXSGHOT-INIZCTEOSA-N 400.435 2.341 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@](C)(O)c3cccs3)CC2)cc1 740038220 JAHOKEMUBYPJDX-NRFANRHFSA-N 418.563 2.086 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1 741145419 AESKCBICPPKNHV-LJQANCHMSA-N 421.497 2.253 10 20 HECD COC[C@@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 741795182 OQNQINNKHIWZSC-CABCVRRESA-N 408.454 2.136 10 20 HECD CCNc1scnc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 749371364 OUBIJUDYKGXVIE-UHFFFAOYSA-N 404.492 2.089 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)o1 759003104 HSIVEIVVAWYHCV-UHFFFAOYSA-N 419.272 2.496 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc(-n4cccn4)n3)CC2)cc(OC)c1OC 759238705 CDBHIRFTGQQXQT-UHFFFAOYSA-N 423.473 2.256 10 20 HECD C[C@@H](NCc1ccc2c(c1)CCO2)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 765607328 APLXHBQNYJSYCU-CQSZACIVSA-N 424.544 2.198 10 20 HECD CCOC1CC(O)(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 770496591 XIDKNJTWTXQGIL-UHFFFAOYSA-N 413.465 2.486 10 20 HECD CN1CCN(c2ccc(CN[C@@H]3CC(=O)N(CCOc4ccccc4)C3)cc2)CC1 771843101 RLSRLWLZVDOELX-OAQYLSRUSA-N 408.546 2.208 10 20 HECD COc1cc(C[C@@H](CO)CNCc2ccc(N3CCN(C)CC3)cc2)cc(OC)c1 771844421 UUUJHHPIACUDDY-OAQYLSRUSA-N 413.562 2.396 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O)c1ccc(N(C)C)cc1 773845057 GDFNILMJGWGPFY-LBPRGKRZSA-N 410.396 2.293 10 20 HECD C[C@@H](NC[C@@H](O)Cn1c(-c2ccccc2)noc1=O)c1ccc(N2CCOCC2)cc1 775262184 ZHCWVGDHNRJJMB-DYESRHJHSA-N 424.501 2.052 10 20 HECD CCOCCOC1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 777720120 FEDPZZUGVOPKEH-HOTGVXAUSA-N 409.502 2.386 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)cc1 785422956 RGQNLNSJEFNQJK-SFHVURJKSA-N 418.538 2.275 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)s1 788074341 GYLMJYCFYYSDMO-UHFFFAOYSA-N 419.488 2.023 10 20 HECD CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(CCN(C)C)C2)sc2c1CCCC2 790930316 VGDQUIUQQRJWFT-CYBMUJFWSA-N 407.536 2.152 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 793822481 JVPXNWFCOBNFLB-HNNXBMFYSA-N 417.456 2.338 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN(C)c1ccccc1F 793828740 RNJDBPHHAGXCKJ-UHFFFAOYSA-N 400.498 2.493 10 20 HECD O=S(=O)(NCCNCc1cc2c(cc1O)OCO2)c1cccc(Cl)c1Cl 796469463 JEFPYHMIIABIKO-UHFFFAOYSA-N 419.286 2.496 10 20 HECD C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)O1 799915977 DXQUNCDAYVELBQ-QINHECLXSA-N 413.497 2.372 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC[C@@H]4C3)cc2Cl)C1 800721235 YRRJIASRECFJNB-GOEBONIOSA-N 405.930 2.495 10 20 HECD C[C@H]1CSCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449054 MSYFJWLKMDIZPI-ZDUSSCGKSA-N 413.490 2.337 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1F 803662562 XWAIUSZOVSUZIW-OAHLLOKOSA-N 420.435 2.181 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC(C(C)C)C(C)C)cc2F)CC1 805010048 SDPQLNFMJJMELG-UHFFFAOYSA-N 406.546 2.381 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3ncc(OC)s3)CC2)cc1 806514445 ZFPBLXXBNNKWDJ-UHFFFAOYSA-N 405.524 2.494 10 20 HECD COCc1nc2n(n1)C[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)CC2 806953443 AIBBCUCFJMRZRW-LLVKDONJSA-N 400.266 2.251 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](COc2ccccc2)C1)c1ccc(N(C)C)cc1 807673486 UMUQTBCWUYXISL-UTKZUKDTSA-N 411.502 2.236 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(OC)c(OCCO)c3)CC2)cc1 918705821 LKKWCAYOLVJLDH-UHFFFAOYSA-N 400.475 2.427 10 20 HECD Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)co1 1816465287 NCZLOHJIXMVTQS-AWEZNQCLSA-N 412.406 2.132 10 20 HECD Cc1cc[nH]c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843935 JAWSXBGIJBNCGW-AWEZNQCLSA-N 410.434 2.472 10 20 HECD Cc1ccc(NCCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(C)c1 1843250063 GZFJHXYAHZFZPA-UHFFFAOYSA-N 424.501 2.429 10 20 HECD Cc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c1cccc2nsnc12 19107891 OCTNKCQYBOEONQ-UHFFFAOYSA-N 412.518 2.051 10 20 HECD CCC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 147131751 ODTQUAMOFCZYIA-UHFFFAOYSA-N 410.474 2.127 10 20 HECD Cc1c(CNC(=O)N2CCN(c3ncccc3C(N)=O)CC2)n(C)c2ccccc12 472232729 KFQHSTZEHPNMCN-UHFFFAOYSA-N 406.490 2.012 10 20 HECD CS(=O)(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1cccc2nsnc12 523242203 MQBGMXIUSGBZSL-UHFFFAOYSA-N 409.514 2.236 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)[C@H](C)N3CCOCC3)cc2F)C[C@@H](C)O1 729597462 POQLRPYFRSXJAB-XDNAFOTISA-N 422.545 2.348 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(S(N)(=O)=O)c(C)c3)CC2)cc1 730842286 FUXNXZXVKMMYLG-UHFFFAOYSA-N 403.504 2.004 10 20 HECD C[C@H](NC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1)c1ccc(N2CCOCC2)cc1 731979586 HOKPLRJOODWGBE-INIZCTEOSA-N 419.485 2.299 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cccc(CN4CCOCC4)c3)c2)CC1 739768333 OVMANAAXJFQSKB-UHFFFAOYSA-N 422.529 2.473 10 20 HECD Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCOc4cc(N(C)C)ccc43)C2=O)cc1 742952628 PILVCTZHGDBQMN-HSZRJFAPSA-N 422.485 2.254 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCC4(CCOCC4)C3)cc2)C1 745691814 OGGRNYHMKMJJGS-IBGZPJMESA-N 414.550 2.491 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)NCc1ccc(N(C)C)c(F)c1)C2=O 746805288 PGKVJXDVDDYITE-UHFFFAOYSA-N 404.486 2.399 10 20 HECD CN(C)c1nc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 747507251 BASQLNMQWXLTAY-UHFFFAOYSA-N 407.515 2.309 10 20 HECD Cc1cscc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 748743560 HAMDTYSCRNJELN-HNNXBMFYSA-N 400.504 2.013 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(S(=O)(=O)N(C)C)oc3C)CC2)cc1 753200370 FCAZQXLKVFNECD-UHFFFAOYSA-N 421.519 2.199 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4cccs4)CC3)CC2)cc1 754061633 MCENYLWKJONUNO-HXUWFJFHSA-N 416.591 2.062 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1F 765468299 NMANMISONGNTJS-AWEZNQCLSA-N 400.516 2.270 10 20 HECD Cc1c(C(=O)NCc2c(O)ccc3c2CCCC3)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 769564411 ZFDNMSYRKBZOEY-UHFFFAOYSA-N 419.459 2.065 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc([N+](=O)[O-])cnc1O 771054997 AWLIEKTVJBGITP-ZDUSSCGKSA-N 406.826 2.449 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3COCCN3CC(F)F)cc2F)C[C@@H](C)O1 771623875 QYNUCRXLSYDGDA-HBUWYVDXSA-N 415.456 2.021 10 20 HECD C[C@@H](NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 772997262 FEFHCIKZONQKJI-MRXNPFEDSA-N 417.531 2.265 10 20 HECD C[C@@H](CCO)C1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC1 776041476 JIUMCWLJUHPUDT-PKOBYXMFSA-N 416.566 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H]3CSC)CC2)cc1 778388131 AQOPZIIMPDNQAE-LPADLIQXSA-N 403.548 2.254 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O 779484199 ATDAHZUVLFEYIR-OXQOHEQNSA-N 420.531 2.167 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCCNC(=O)c1cccc(Br)c1 779507650 CMXIAEQWSPRVJD-FNORWQNLSA-N 405.248 2.420 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)cc1 785423637 DSTMGFFAJWSZQX-OAHLLOKOSA-N 402.445 2.042 10 20 HECD C[C@@H]1c2ccccc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800891 RLXRRUPVNOLQAX-MRXNPFEDSA-N 411.477 2.424 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)cc2F)C[C@@H](C)O1 789823026 XUIMEBFTVMUXCR-JRLUCQMDSA-N 415.509 2.216 10 20 HECD CN(C)c1ccc(CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C(F)(F)F)c1 792773190 QHPZZNAHXLXTRE-MRXNPFEDSA-N 405.486 2.076 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1F 796830682 VFYMMBUHLMKCDY-UHFFFAOYSA-N 405.401 2.381 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cncc(F)c3)cc2F)C[C@H](C)O1 799251952 YUVQUXTUXAYGAO-STQMWFEESA-N 404.417 2.228 10 20 HECD Cc1cnc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803299738 NEYRGVZXNPUUMH-GJZGRUSLSA-N 402.520 2.343 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C[C@@H](O)c2ccc(F)cc2)C2CC2)cc1F 803664677 NGQVPZOVUJJOEI-HXUWFJFHSA-N 417.456 2.372 10 20 HECD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677307 MEBBYVWEDDSWHO-PMACEKPBSA-N 414.550 2.103 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 804318352 IIZCRMRXSGUHKB-PXNSSMCTSA-N 416.566 2.111 10 20 HECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 806879187 WNSJHVBCHYQZPP-UHFFFAOYSA-N 409.412 2.385 10 20 HECD Cc1nc(Cl)ccc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 808088766 BJJYIWJIANTZDS-UHFFFAOYSA-N 415.924 2.079 10 20 HECD CC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808851554 FGHRMJGPTBOSPR-LJQANCHMSA-N 412.578 2.483 10 20 HECD C[C@@](O)(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCC1 813422369 ZENVGQBNGZQTAI-QFIPXVFZSA-N 413.497 2.110 10 20 HECD C[C@@H]1[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1Cc1ccccc1 813824631 QDRQWTKUVSTQOL-RDTXWAMCSA-N 403.504 2.157 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(F)cc1C 814997549 TYVYASUJZJKGKX-UHFFFAOYSA-N 422.478 2.236 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)C/C=C\c3ccccc3)CC2)cc1 912934907 XYLAGJLGYWZZKI-YVMONPNESA-N 414.527 2.472 10 20 HECD CCCc1noc(CCCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 918372618 NKHSBTOKMBDOAT-KRWDZBQOSA-N 413.522 2.363 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442272 DBJREWFKJPCVGR-UHFFFAOYSA-N 415.465 2.298 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(-n2cccn2)c(F)c1 1318331680 UMFPAWBMJFNSHK-UHFFFAOYSA-N 414.462 2.499 10 20 HECD CN(C)c1ccc(CN(c2ccc(S(=O)(=O)N3CCOCC3)cn2)C2CC2)cc1 1319005601 PEXAJCYRDJLQGF-UHFFFAOYSA-N 416.547 2.338 10 20 HECD Cc1ncc(Br)c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1 1320718938 IZJOBCLBCHIJBH-UHFFFAOYSA-N 421.295 2.429 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 1320772107 CHLCRUJMEJHGFA-LRDDRELGSA-N 402.403 2.400 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(O[C@@H]2CCOC2)cc1 1322313867 XQWPHUKPEYIHMM-MSOLQXFVSA-N 415.442 2.170 10 20 HECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 1323829678 LLCQWYMNAHBARS-WMLDXEAASA-N 404.536 2.425 10 20 HECD CCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CCC1 1797908880 QQUIOCLQHIVAAV-BTTYYORXSA-N 409.577 2.065 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1 1832867067 BISREYOOOZRVLD-WMZOPIPTSA-N 417.506 2.153 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3cnccc23)C1 1844092661 DTYDGTLUNKYEOH-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)cc1F 1847353963 WLIHADXJOASQBK-GJZGRUSLSA-N 405.813 2.415 10 20 HECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)ccc1OCC(=O)O 109764581 BLPJQXISCNHXLC-UHFFFAOYSA-N 406.460 2.096 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(N3CCNC3=O)cc2)n(C)c2ccccc12 472809471 KRASWTFTJCPJTJ-UHFFFAOYSA-N 405.458 2.271 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1F 731408613 SAXMTMPYDYUAQN-UHFFFAOYSA-N 421.494 2.330 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NCCS(=O)(=O)NC[C@@H]2CCCCO2)cc1 732030784 ROEIOVXVFGCOEC-FQEVSTJZSA-N 419.547 2.312 10 20 HECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C1 732572428 VGLWHCVIDCGKEJ-SFHVURJKSA-N 407.518 2.464 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cc(C(C)C)no3)CC2)cc1 734009253 MPROMITYDAJCEN-UHFFFAOYSA-N 401.511 2.428 10 20 HECD O=C(CCNS(=O)(=O)c1cccs1)N(Cc1ccccc1O)C[C@@H]1CCCO1 735519747 UBJDQXOZEDUTKM-INIZCTEOSA-N 424.544 2.330 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1Cl 741096694 BHOKJCZVESUNHX-UHFFFAOYSA-N 412.877 2.331 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](c3ccccc3)N(C)CC)nc12 745097998 PKXUAIHMRKJVAM-SFHVURJKSA-N 412.446 2.348 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)CC[C@H]3CCCCN3C)CC2)cc1 745784013 KSGBTAACKNJOQU-HXUWFJFHSA-N 417.598 2.333 10 20 HECD C[C@H]1Cc2cc(S(=O)(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc2O1 751213319 PUKVBNNTSMKJAR-AWEZNQCLSA-N 422.528 2.046 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCc3ccccc3F)CC2)cc1 754043341 NXOCHCWESCIZKW-OAQYLSRUSA-N 401.526 2.492 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CC(c4nc5ccccc5[nH]4)C3)CC2)cc1 754072278 RRGPXVLAYPAWQW-HXUWFJFHSA-N 421.545 2.154 10 20 HECD CN1Cc2ccccc2[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 757629928 RGAHDRPYSISQGH-UGKGYDQZSA-N 421.545 2.374 10 20 HECD COc1ccc(N2CCC(NCCNS(=O)(=O)Cc3ccccc3)CC2)cc1 765281677 VXCANABPZBMOPT-UHFFFAOYSA-N 403.548 2.373 10 20 HECD O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1cccc(Br)c1O 765754925 YHIBGUBYQUDTES-CHWSQXEVSA-N 409.280 2.336 10 20 HECD COc1ccc(CCC(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc1 768440079 NRZOIHMROOLRBG-NRFANRHFSA-N 412.486 2.104 10 20 HECD Cc1cccc([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 769037353 LZFRMDJXKCTHBJ-PZJWPPBQSA-N 410.518 2.230 10 20 HECD C[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)c(F)c1 773008643 WWACHPRWEPCIEO-QUCCMNQESA-N 418.557 2.400 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F)c1ccc(N(C)C)cc1 773090215 WANYEYYKXZZMDL-LBPRGKRZSA-N 415.512 2.303 10 20 HECD Cc1cn2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccc2n1 774165526 OTBLCXLZKFZXID-INIZCTEOSA-N 407.474 2.295 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3c(C)noc3C)CC2)cc1 774193787 XKBFXTUSWQUADX-UHFFFAOYSA-N 400.479 2.044 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1O 774911586 HROMHJXASQMPET-SWLSCSKDSA-N 411.455 2.423 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccccc3C)cc2F)CC1 775126780 QDKOASGOBLOHFC-UHFFFAOYSA-N 412.509 2.209 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn([C@@H](C)COC)n2)cc1F 778607804 RSFFUHVWOOCOJE-AWEZNQCLSA-N 405.474 2.331 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 778915955 YVWCQANXPZGOPB-UHFFFAOYSA-N 402.428 2.099 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccccc2)c2nccn2C)cc1F 785599007 LRJFXMQZMHTHNV-IBGZPJMESA-N 409.465 2.147 10 20 HECD COC(C)(C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 787128370 VPWHBZLKGZKLCX-UHFFFAOYSA-N 422.503 2.283 10 20 HECD COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 787890544 KRWWYNCJJVNBAN-LBPRGKRZSA-N 422.865 2.462 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(O[C@@H]4CCOC4)cc3)cc2)CC1 788774818 MJEYKWYPZDBVFW-HSZRJFAPSA-N 423.513 2.453 10 20 HECD CCCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789799530 ISNPNRMHYWUWOC-SFHVURJKSA-N 421.513 2.086 10 20 HECD CC(C)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCS1 789853882 AQBIGYJZPJNAFY-GOSISDBHSA-N 407.605 2.456 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](C)(O)Cn1ccc(C)cc1=O 790811665 CFNWJIRTMJMFTM-IBGZPJMESA-N 423.307 2.425 10 20 HECD CS(=O)(=O)[C@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 800709105 ACAYEPNDKVLJRJ-CJNGLKHVSA-N 417.478 2.085 10 20 HECD C[C@H](NC(=O)C(=O)NCC(C)(C)c1ccncc1)c1ccc(N2CCOCC2)cc1 803298672 WEQZBKDROKPSSV-KRWDZBQOSA-N 410.518 2.189 10 20 HECD C[C@H](NC(=O)C(=O)N1CCc2ccc(F)cc2C1)c1ccc(N2CCOCC2)cc1 803302950 VSYPREMNWCPNCF-INIZCTEOSA-N 411.477 2.424 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)cc1F 804852583 KOFAVVVYPHAIOS-AWEZNQCLSA-N 408.518 2.050 10 20 HECD O=C(CN1C(=O)CCOc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 917709597 RQOBHUWHRDRQSQ-UHFFFAOYSA-N 413.449 2.094 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)s2)cc1 917751153 BXQRNPKMNTVPPW-UHFFFAOYSA-N 404.491 2.097 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCCC(=O)NC3CC3)cc2F)C[C@@H](C)O1 918210489 ZDWKWRWTZSQRMN-HUUCEWRRSA-N 406.502 2.297 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(F)cc(F)c1 918441360 ZCLJCQXKBAQRNH-UHFFFAOYSA-N 407.392 2.320 10 20 HECD O=C(Cc1cc[nH]n1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429048 PDGWJCDQIDPCHB-UHFFFAOYSA-N 407.430 2.206 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ncccc2F)C1 1844571244 GVXBPHQYNTZRKS-UHFFFAOYSA-N 405.813 2.416 10 20 HECD Cc1c(CNC(=O)C(=O)NC[C@@H](Cc2ccccc2)N(C)C)n(C)c2ccccc12 550414387 LTDQSFJPTVGESS-LJQANCHMSA-N 406.530 2.392 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 727177127 CJBCAZMEJSAHFX-DHZHZOJOSA-N 421.363 2.200 10 20 HECD CCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 727483337 FNYYYLQOLAPVBM-IBGZPJMESA-N 405.564 2.213 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCC3CCN(C)CC3)cc2F)CC1 730128662 XITYWQUSRXUUNB-UHFFFAOYSA-N 405.562 2.499 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)OC)o3)n2)c[nH]1 730933246 ZRJXEBMOSILGIV-UHFFFAOYSA-N 411.417 2.105 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)NCc2ccc(N(C)C)cc2C)cc1 734644054 LLOUHAUFEAQNGP-UHFFFAOYSA-N 412.490 2.214 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)cc1 734686888 XVFMVWVPXXVBOR-OAQYLSRUSA-N 417.598 2.081 10 20 HECD O=C(COC[C@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 746396268 ZPAKJLYALMECRT-MRXNPFEDSA-N 402.413 2.354 10 20 HECD CC(=O)c1cc(CN(C)CCCn2ccnc2C)c(O)c(CN2CCOCC2)c1 746630266 AUFJIAYAMDCEBK-UHFFFAOYSA-N 400.523 2.454 10 20 HECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccccc4F)C3=O)CC2)cc1F 753977580 FWHGVLBUJGXQAF-GOSISDBHSA-N 401.413 2.428 10 20 HECD COc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc(OC)c1O 754272533 SIXOCIHPWKJLTA-UHFFFAOYSA-N 402.447 2.291 10 20 HECD C[C@@H](OC(=O)CC1(CO)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759962180 QYZOIBFZKUCDAB-CYBMUJFWSA-N 407.422 2.495 10 20 HECD CCC(=O)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 760405487 CKLZZSJKCJXJNR-UHFFFAOYSA-N 400.500 2.444 10 20 HECD CCCn1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 762415005 XADDGUYHPDQKAD-GJZGRUSLSA-N 417.485 2.301 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc1 765983030 PSZXBWJFZNXVCX-INIZCTEOSA-N 401.429 2.437 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1 768168652 VHTJDTFSYCWYCP-UHFFFAOYSA-N 419.489 2.169 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@]4(C3)OCc3ccccc34)CC2)cc1 770687810 DYAWPULIRWLTFV-WIOPSUGQSA-N 423.557 2.310 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)NC3CCCCCCC3)CC2)cc1 774588458 NPMMFJAJMXPVAY-UHFFFAOYSA-N 416.566 2.163 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2ccc(NC(=O)CN3CCOCC3)cc2)c1O 774935883 PNRVMRIYCUHXGP-UHFFFAOYSA-N 416.434 2.192 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1=O 777459846 RVQVDVVCVFDARX-IRXDYDNUSA-N 420.529 2.449 10 20 HECD C[C@H](Nc1cccc(C(=O)NCCC(N)=O)c1)c1ccc(N2CCOCC2)c(F)c1 777677567 VJPCRWGKAJKCRW-HNNXBMFYSA-N 414.481 2.441 10 20 HECD CCc1cnc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 778289338 OHTSRVVVGMRLGC-CMDGGOBGSA-N 414.531 2.235 10 20 HECD C[C@@H](NC(=O)COCCNC(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 783932881 GUFNQFUDSGAHCK-GOSISDBHSA-N 411.502 2.147 10 20 HECD CC1([C@H]2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)OCCO1 784217556 BRTRNWUGMNJLML-KRWDZBQOSA-N 407.486 2.347 10 20 HECD NS(=O)(=O)C1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 784408480 TYAFGALZZFGIGN-UHFFFAOYSA-N 415.475 2.320 10 20 HECD COc1cc(O)c(CNC[C@@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc1OC 786002927 OYGOSMGIGYTQNE-CQSZACIVSA-N 402.495 2.096 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(-n4cccn4)c3)cc2)CC1 786661083 OIAQKOLSNPCDAL-UHFFFAOYSA-N 403.486 2.471 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C2CC2)cc1 787460617 CQDSXDCYDKFMDD-UHFFFAOYSA-N 418.501 2.141 10 20 HECD Cc1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 788186948 HXECJXXKDPHLNR-MRXNPFEDSA-N 418.444 2.393 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc1 789723836 TXLFTXNCMUELOU-UHFFFAOYSA-N 416.547 2.271 10 20 HECD O=C(NCC[C@H]1C[C@H]2CC[C@H]1C2)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801419 SZKJPITYSQFSTH-SZMVWBNQSA-N 403.498 2.221 10 20 HECD CSC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823050 YDRIOKVPXOLNCJ-UXLLHSPISA-N 423.554 2.410 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@H]1c1ccccc1 789832596 BCDFUZWAUXMXSE-FQEVSTJZSA-N 411.477 2.377 10 20 HECD CC(C)n1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 796971617 KVCGRYAPUNFELQ-UHFFFAOYSA-N 424.549 2.251 10 20 HECD CCc1cnc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 804318931 VVYBRENNCLJREY-UHFFFAOYSA-N 402.520 2.116 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCC(=O)Nc2ccccc2)C2CC2)cc1 806251822 KFUPSVLGXKFTCD-UHFFFAOYSA-N 408.502 2.389 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(Cc2cccc(F)c2)CC1 806276619 SHWRFSSMTSLODT-UHFFFAOYSA-N 422.551 2.225 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)C1CCOCC1 807548677 BEVWKNRPJZZFCN-GFCCVEGCSA-N 413.312 2.435 10 20 HECD COc1ccc(O)c(CNc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c1 809683024 MHBUMTCKQPSXJF-UHFFFAOYSA-N 405.520 2.339 10 20 HECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1[C@H]1CCCO1 810024845 TWIVFYPQMSJHQJ-TZIWHRDSSA-N 405.514 2.168 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc4c3OCC(=O)N4)cc2)C1 810257073 GYVKGLJVZCYPRR-OAHLLOKOSA-N 423.473 2.041 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](CO)Cc1ccccc1 918209175 SRRSZOORSAJCQH-LJQANCHMSA-N 401.482 2.313 10 20 HECD CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918776863 BPTLIQCXLRPPCL-UHFFFAOYSA-N 401.488 2.446 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCCO3)cc2F)C[C@@H](C)O1 919155387 UNAQUTNDIWHWMZ-HLLBOEOZSA-N 408.470 2.168 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 920865409 AWYYXFOMFZIQKC-CQSZACIVSA-N 423.560 2.260 10 20 HECD COc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OCCO 920888864 BKQPBJJNVLDONW-MRXNPFEDSA-N 400.475 2.394 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 1320023405 GHEDSNYFMRUREL-OAHLLOKOSA-N 423.560 2.162 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cl)c2c(c1)OCCO2 1320514637 XNMFJMBHPOCKFR-AWEZNQCLSA-N 421.833 2.427 10 20 HECD CN(C)c1ccc(CN2CCN(C(=O)N3CCOCC3)CC2)c(C(F)(F)F)c1 1321496499 OFIWOXNXOCTLAZ-UHFFFAOYSA-N 400.445 2.341 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cccc2c1OCO2 1342917333 WDSXNRYUMXGODW-HNNXBMFYSA-N 401.415 2.050 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)NC=O)cc1 1800094369 GYPJCRIBSXEIJI-CMCXCUNFSA-N 422.529 2.480 10 20 HECD CN(C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816855408 CWLDEVWRQCLFAM-CQSZACIVSA-N 421.885 2.342 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Cl)cc3)C2=O)cc1 7229995 ZGIYVDNZHINNQO-NRFANRHFSA-N 414.893 2.489 10 20 HECD CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 728022025 KSQBAYCGRQWLJO-VDGBGEPSSA-N 403.548 2.397 10 20 HECD CN(C)C(=O)CCN1CCC(NC(=O)NCc2ccc(N3CCCC3)cc2)CC1 731498467 OXELVYMCDXMUBL-UHFFFAOYSA-N 401.555 2.029 10 20 HECD CNC(=O)[C@H]1CCCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C1 732049752 CKIUQWWDPYXILS-QMMMGPOBSA-N 417.216 2.237 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 734702319 WOVIHSQSFXJPSN-FQEVSTJZSA-N 424.501 2.433 10 20 HECD CC(=O)c1ccc(S(=O)(=O)CC(=O)NCc2ccc(N(C)C)cc2C)cc1F 734814205 CUDJNDZPQMGXPK-UHFFFAOYSA-N 406.479 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3nc(=O)c4cc(F)c(F)cc4[nH]3)CC2)cc1 742464140 HZTCLGPIOYSOEO-UHFFFAOYSA-N 414.412 2.101 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCOc3ccccc3F)CC2)cc1 742948273 PODNLADEHUCVOK-UHFFFAOYSA-N 416.497 2.335 10 20 HECD COC[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccco1 746757932 SBSJNASVUMTONO-SJLPKXTDSA-N 400.479 2.168 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(CC(C)C)cn2)cc1OC 749864165 IQPVINAUDRHTJS-UHFFFAOYSA-N 416.525 2.110 10 20 HECD COCCOC[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067489 MDHUQQWRNFTXIJ-LBPRGKRZSA-N 414.505 2.036 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCc2ccc3c(c2)CCCN3C)cn1 753447663 XZXBHIMLBVHCNY-OLILMLBXSA-N 415.563 2.301 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)CC2)cc1 753602779 VCJUZIXFYLVJQO-UHFFFAOYSA-N 421.519 2.246 10 20 HECD COc1cc(N2CCN(C(=O)c3cnn(C)c3C(F)F)CC2)cc(OC)c1OC 759238687 OQYLUNJPAOMQJW-UHFFFAOYSA-N 410.421 2.346 10 20 HECD COc1cc(N2CCN(C(=S)NCC3CCN(C)CC3)CC2)cc(OC)c1OC 760508291 BKFNKSSSWDIJDZ-UHFFFAOYSA-N 422.595 2.051 10 20 HECD O=C(Cn1cnc(-c2ccccc2)n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 761814908 YOJYJVBDTBTXMI-UHFFFAOYSA-N 409.465 2.362 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2 761998892 AKNPHXDTIUDVRN-UHFFFAOYSA-N 409.416 2.450 10 20 HECD CCOC(=O)C1(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 768613651 JOXDSZFMNDWNJK-UHFFFAOYSA-N 421.405 2.287 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1F 770243310 NFKPPBVUFCVHNV-UHFFFAOYSA-N 408.499 2.247 10 20 HECD C[C@H](NC(=O)N1CCN(C(=O)NC(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 773248503 ZXGMQOSABBITII-KRWDZBQOSA-N 417.554 2.420 10 20 HECD COCc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 774746683 UBYUIYIUKLUQOO-SFHVURJKSA-N 417.531 2.013 10 20 HECD Cc1nc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nn1-c1n[nH]c(C(F)(F)F)n1 775404742 NOAFVRGQCTXCBL-SECBINFHSA-N 408.388 2.270 10 20 HECD Cc1ncc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c(C)n1 776841090 GETXZIKPCSPULE-UHFFFAOYSA-N 421.480 2.279 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CCN(c2cnccn2)CC1 777828674 NWYYKHKCNLNLBK-UHFFFAOYSA-N 418.881 2.254 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3OCCO4)CC2)cc1 778246104 PZNMXVYZGWENLL-MDZDMXLPSA-N 423.469 2.310 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 778248808 ZACCXTGPTMWYFA-KHPPLWFESA-N 424.457 2.125 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCc3ccc(O)c(O)c3)C2)cc1 778925889 PRVSBEXJODOHMJ-MRXNPFEDSA-N 404.488 2.123 10 20 HECD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(O)c(O)c1 778930363 UUKIFFBXHXDJFG-HNNXBMFYSA-N 419.459 2.174 10 20 HECD CC(=O)c1cc(F)cc(CN2CCOC[C@H]2c2noc(-c3cnn(C)c3)n2)c1O 779844703 QOCYOAMVHYIYKS-INIZCTEOSA-N 401.398 2.091 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 781444196 UBUPXDJOPIFKAH-UHFFFAOYSA-N 405.401 2.415 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(Cc3ccccc3)CC2)cc1 784553949 IUWUXRTVUUCUIK-UHFFFAOYSA-N 411.502 2.019 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 785422376 KHEYTPMTCSYCPX-HXUWFJFHSA-N 411.502 2.282 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(C)ccn3)CC2)cc1 788954321 KWBSYWPVTVNGOJ-UHFFFAOYSA-N 409.534 2.201 10 20 HECD CCN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819167 MHGTXIVQWQLVHA-SOLBZPMBSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C(C)(C)C3CCOCC3)CC2)cc1 796439375 RULDGENYGWQPAZ-UHFFFAOYSA-N 404.507 2.340 10 20 HECD CN1CCN(Cc2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)CC1 799124798 RGABFQUBGBFRCW-UHFFFAOYSA-N 403.533 2.240 10 20 HECD COc1ccc(N2CCN(c3cc4c(cc3[N+](=O)[O-])n(C)c(=O)n4C)CC2)cc1F 804540033 PLKBKZATBDDWAR-UHFFFAOYSA-N 415.425 2.260 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)CCC3CC3)cc2F)CC1 805009031 DTSQGLQKXUUKOM-UHFFFAOYSA-N 404.530 2.232 10 20 HECD C[C@]1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 805758481 MKTPXGPDYSZRTN-JLTOFOAXSA-N 411.449 2.058 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N=c2ccnc3n(C)[nH]cc2-3)cc1)C1CCCCC1 806869417 STWICOQQXOIYJW-UHFFFAOYSA-N 420.517 2.366 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1nc(O)c2sccc2n1)c1ccc(N(C)C)cc1 807671870 UGGJFDGTZGQTFR-LBPRGKRZSA-N 413.503 2.299 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 807689785 KHYMMPHSUJCBIH-GOSISDBHSA-N 410.518 2.115 10 20 HECD COc1cccc(-n2c(=O)c3ccccc3n3c(SCC(=O)C(C)=O)nnc23)c1 808011325 SKDXIJIOQXLMJF-UHFFFAOYSA-N 408.439 2.292 10 20 HECD CCOCCC1(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 809436842 LNZLBJUMRNLKIY-UHFFFAOYSA-N 403.523 2.057 10 20 HECD COc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)cc1 809734085 VFDWAVLRBZTOSB-UHFFFAOYSA-N 401.419 2.276 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 810630192 GVWVGNMYJNUSAN-BBRMVZONSA-N 403.914 2.060 10 20 HECD CN1CCN(S(=O)(=O)c2ccc(NCc3c(O)ccc4c3CCCC4)nc2)CC1 811808482 KKHOIPJHJRMPPW-UHFFFAOYSA-N 416.547 2.214 10 20 HECD C[C@@H](NC(=O)N1CCC[C@@H](CS(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 920872139 OUSZVPKWMAYBSE-IAGOWNOFSA-N 409.552 2.050 10 20 HECD O=C(C1=CCCC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004426 DAYYUDGXNAJLJY-FQEVSTJZSA-N 406.866 2.305 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccnc1 1796305046 BIZQHSSVILEMFC-DTUWPTEXSA-N 423.469 2.093 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)O1 1797785902 WYCVAHIZLYJDCS-CESFCVHUSA-N 416.474 2.022 10 20 HECD C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1812574364 CGKYJATULJZODL-MMDDYWAUSA-N 408.458 2.340 10 20 HECD CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1835202828 CVHPNWQTTHCQPA-HSZRJFAPSA-N 411.502 2.184 10 20 HECD Cc1cc(C)n(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1842067310 DCDJDNLJNUMBIE-UHFFFAOYSA-N 418.881 2.082 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccnc(Cl)n2)C1 1844451916 AOUZSWSWRSQNKP-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 7201576 FXHXSKSSHZRXOA-IAGOWNOFSA-N 418.515 2.251 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCN(CC(F)(F)F)C1 142358079 DREVNENEISXYAJ-AWEZNQCLSA-N 418.435 2.223 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 147124024 PNDQDSNYKWPXNM-UHFFFAOYSA-N 410.474 2.045 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 738500199 KWOWMIDHTFQLPT-KSSFIOAISA-N 413.522 2.424 10 20 HECD COC[C@@H]1CN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CCO1 742413643 WEMWQUZFORQCTD-QMMMGPOBSA-N 406.189 2.126 10 20 HECD CC(C)n1cc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)cn1 743046142 BNBGIVKXRKWLDT-UHFFFAOYSA-N 416.492 2.364 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(CCO)CCCCC3)CC2)cc1 753346580 YZTQAZUTAHVGQV-UHFFFAOYSA-N 418.582 2.449 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3c3cc(C)on3)CC2)cc1 754001181 YZVUWKZLIYTXCE-SIKLNZKXSA-N 400.523 2.312 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2Cc2ccc(N3CCOCC3)c(F)c2)cn1 754153951 KYJFLYWHUQEEKZ-PIIWDFAUSA-N 406.527 2.184 10 20 HECD Cc1cc(C(=O)Oc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 755336313 VLQYLORTYUETED-SFHVURJKSA-N 404.426 2.459 10 20 HECD COC[C@@H](CCO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 755994856 YIABLIJAUZBVCV-XTCQQWIJSA-N 414.574 2.243 10 20 HECD CN(c1ccc(CN2C(=O)NC3(CCS(=O)(=O)CC3)C2=O)cc1)C1CCCCC1 761182061 WHFGUYCODZKKHT-UHFFFAOYSA-N 419.547 2.455 10 20 HECD COCc1nc(SCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n[nH]1 761868176 UZRNETBSGMDZAV-CHWSQXEVSA-N 423.514 2.112 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1CC(F)(F)F 762553431 SOSNKKDYUIYTQQ-CQSZACIVSA-N 418.435 2.440 10 20 HECD O=C(CN(CCO)Cc1cccnc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 763566617 UGROHRFKDMIYHX-UHFFFAOYSA-N 415.449 2.290 10 20 HECD O=C([C@H](Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1)N1CCOCC1 764982832 YRROTXRFWPUEKZ-QHCPKHFHSA-N 409.530 2.083 10 20 HECD CC(C)c1ccnc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)n1 767306502 UUSBNXZOXLFVCP-UHFFFAOYSA-N 424.549 2.468 10 20 HECD C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NCc2ccccc2O)C1=O 771419165 WJHVHFGDWRLQSI-IBGZPJMESA-N 405.813 2.268 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccc(Br)cc1 773750916 XXPBZTWERIYBRD-LLVKDONJSA-N 407.264 2.338 10 20 HECD CCN(CC)c1ccc(CNC(=O)N(CCCOC)[C@H]2CCS(=O)(=O)C2)cc1 774179514 PFBXBQRNAWVDPK-IBGZPJMESA-N 411.568 2.268 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCC[C@@H]3C)CC2)cc1 774760249 GQLNIQIHLCUSNS-GHTZIAJQSA-N 416.566 2.018 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccco3)cc2F)C[C@@H](C)O1 775117218 WTBHYKWRMKUWGI-HUUCEWRRSA-N 403.454 2.007 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCC(=O)N[C@H](C)c2ccc(F)cc2)c1 775373190 OTUISUOZBIRFSQ-ZIAGYGMSSA-N 403.454 2.184 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOc4ccccc4C3)CC2)cc1 778243997 BETLTNUXEBRIRB-ZHACJKMWSA-N 421.497 2.321 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCN(C)c4ccccc43)CC2)cc1 778270459 SMJWRCUFIFTFGE-QXMHVHEDSA-N 420.513 2.383 10 20 HECD CC[C@]1(CO)CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 779546507 XJGCGFGOFSIKRK-QFIPXVFZSA-N 404.555 2.011 10 20 HECD COC(=O)[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[C@@H]1C 787325977 GWFUMAJCSYTLRI-KGLIPLIRSA-N 406.438 2.284 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCC3(CC2)OCCO3)cc1 787402504 YOZSLAYJGPNNLY-UHFFFAOYSA-N 403.523 2.293 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4cnc(O)nc4N)CC3)c2C)cc1 787914405 YTEDNWKQSFMBLL-UHFFFAOYSA-N 422.489 2.143 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc(CN(C)C)c3)CC2)cc1 788461537 UPFJKOXEXSKAFH-UHFFFAOYSA-N 424.545 2.158 10 20 HECD CC(C)N(C)CC1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788930657 UPLGEVPOWIZFKU-UHFFFAOYSA-N 400.567 2.482 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(N2CCOC2=O)c1 788937849 NGNFZZAOMZHGLB-UHFFFAOYSA-N 422.485 2.176 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC(C)(C)C3)cc2F)C[C@@H](C)O1 789822081 VNPWKXGPBZHIEJ-HUUCEWRRSA-N 423.554 2.410 10 20 HECD CN1CC[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 793929744 MJSMELPGETVLKX-SLQMCABGSA-N 423.585 2.467 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1 794381825 OUTKWSBIENNFSQ-UHFFFAOYSA-N 418.393 2.014 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(CC(F)(F)F)C2)cc1F 803381262 VSLWKIVHTALQAO-AWEZNQCLSA-N 418.435 2.041 10 20 HECD CCc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 805192243 CIEDWUMGJILWRZ-MRXNPFEDSA-N 403.504 2.235 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1[C@H]2CC[C@H]1CC(c1ccnn1C)C2 807098911 FVXVIEIBVHXTNV-PMACEKPBSA-N 409.534 2.348 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 808956833 XJOYASDWDCPWBC-INIZCTEOSA-N 416.472 2.384 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCC1([S@](C)=O)CCC1 809897319 YMYQHKDRBXGRGT-NDEPHWFRSA-N 405.564 2.053 10 20 HECD CNC(=O)c1cccc(NC(=O)[C@@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)c1 857758755 QSVHEFSKPIVDFO-QGZVFWFLSA-N 410.518 2.342 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)O)c2)cc1OC 917758391 URLXWTSTKXTDGV-UHFFFAOYSA-N 420.490 2.017 10 20 HECD C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917833562 BAEHIONGVKDOIL-XPIZARPCSA-N 409.486 2.233 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cn3ccc4cc(OC)ccc43)nc12 919168588 XCYJOAAVCDRLFX-UHFFFAOYSA-N 424.413 2.318 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H](CS(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 920872143 OUSZVPKWMAYBSE-SJORKVTESA-N 409.552 2.050 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc21)c1cc(O)nc(O)c1 1802527682 YUQCIVKCIWGTGD-SFNKJDCFSA-N 407.470 2.475 10 20 HECD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(C)n1 1802745475 DJOUIIKGCXZWKR-REPLKXPHSA-N 424.501 2.389 10 20 HECD Cn1cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283562 DEAVGKJAFDLPJF-BEVBHUTCSA-N 411.458 2.107 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CCCC1 1806179510 GEOBCRHDWHJDBB-JXFKEZNVSA-N 410.474 2.398 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(C)n1 1844609468 UDEFPKBRBAHEMP-RMKNXTFCSA-N 423.469 2.346 10 20 HECD CCc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033735 ASDGUWJVYQTDAV-VQHVLOKHSA-N 423.469 2.291 10 20 HECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)ccc1O 1847038653 XYOHGYYSEWWIOM-VMPITWQZSA-N 424.453 2.348 10 20 HECD CN(C)S(=O)(=O)c1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1 237120537 GJXJIIQZZQVLHD-UHFFFAOYSA-N 407.511 2.202 10 20 HECD COc1cc(CNCc2ccc3c(c2)CCO3)ccc1OCC(=O)N1CCOCC1 725852522 DCKODFNQZIKYDV-UHFFFAOYSA-N 412.486 2.158 10 20 HECD COc1cccc([C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 732242276 WVKGAIDFELICPI-FQEVSTJZSA-N 403.454 2.204 10 20 HECD O=C1N[C@H](C(F)(F)F)CC[C@@H]1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735520115 WCBKDTMRCFMOQP-YCPHGPKFSA-N 400.397 2.357 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 741096736 FERXKHRRNWOCMV-UHFFFAOYSA-N 404.470 2.210 10 20 HECD CN(CC[C@H]1CCCCN1C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 743855247 IEVXFIOETZMZJS-LJQANCHMSA-N 406.546 2.085 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745799856 LISDZZKRVLQDAQ-LSDHHAIUSA-N 420.464 2.471 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(CC(F)(F)F)n3)cc2)C1 746140482 PVQUTYUWFDFXRM-CQSZACIVSA-N 424.427 2.469 10 20 HECD Cc1ncoc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 750928155 JJEWSEZDXCLBFQ-BETUJISGSA-N 405.426 2.209 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 753154070 LBKNAQVGQGGWIX-OLILMLBXSA-N 413.547 2.294 10 20 HECD Cn1c(=O)oc2c(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cccc21 753347794 GPAPZRMIDMNGFD-HNNXBMFYSA-N 423.473 2.155 10 20 HECD COCC(C)(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755629529 WSJHNVPKCYCQBV-UHFFFAOYSA-N 401.486 2.231 10 20 HECD Cc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 757256865 UUBVAWROWHSROE-UHFFFAOYSA-N 406.483 2.115 10 20 HECD COc1cc(N2CCN(CN3C(=O)C[C@](C)(C(C)C)C3=O)CC2)cc(OC)c1OC 758963923 JTJSGYKZBRFMNE-JOCHJYFZSA-N 419.522 2.213 10 20 HECD COc1cc(N2CCN(C(=O)NCCCC(C)(C)CO)CC2)cc(OC)c1OC 760123936 VEALREMTJKNGNA-UHFFFAOYSA-N 409.527 2.343 10 20 HECD Cc1cn2c(CN(C)C(=O)c3cc(NS(C)(=O)=O)ccc3O)c(C)nc2s1 760367446 AJUSXCMRMMXTKD-UHFFFAOYSA-N 408.505 2.362 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)ccc1OC 766047410 HKPBZOOJDBNZEI-UHFFFAOYSA-N 406.460 2.430 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)cc1 768033119 CSIJCUSKQFETQO-UHFFFAOYSA-N 406.490 2.428 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 769290905 LFEVDKCLDPZPOZ-UHFFFAOYSA-N 421.475 2.408 10 20 HECD CCOC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C)c1C 771658360 RRNBFIIDVGASMW-SFHVURJKSA-N 420.487 2.415 10 20 HECD CCCc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n(C)n1 772208525 GYWCRKQCWOLONK-QGZVFWFLSA-N 400.479 2.225 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(C(=O)Nc2ccccc2)CC1 774754595 VICVFVLFWCHAGT-UHFFFAOYSA-N 423.517 2.328 10 20 HECD O=C(NCCc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 775126442 JXQGQERNUHZCAI-UHFFFAOYSA-N 419.884 2.291 10 20 HECD Cc1cnn(-c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2F)c1 785295360 UBEODRXBKRUGLO-CYBMUJFWSA-N 412.421 2.417 10 20 HECD Cc1nc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 785670331 ORZDWLYRHVTMCU-CYBMUJFWSA-N 424.473 2.454 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1)c1ccc(N(C)C)cc1 787979739 PMRYUTPUMTWDKA-PGRDOPGGSA-N 424.545 2.120 10 20 HECD C[C@H](NC(=O)C(=O)NCCSC(F)(F)F)c1ccc(N2CCOCC2)cc1 788543623 YBXXXEIKYSEZMH-LBPRGKRZSA-N 405.442 2.070 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCS1 789825508 MMGFCIJABVITME-UXLLHSPISA-N 423.554 2.410 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN2CCCC[C@@H]12 790277579 KEYCMEIJDPCDOR-HOTGVXAUSA-N 424.339 2.246 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)c(O)c1 792847924 FTOLOKIVHQYFJW-UHFFFAOYSA-N 421.519 2.228 10 20 HECD CCN(C)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248949 NEECFRUCAUSRLP-MRXNPFEDSA-N 400.545 2.105 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797390825 UTNXKNTUVWXHOQ-ZDUSSCGKSA-N 400.431 2.007 10 20 HECD COCCn1c(-c2cccnc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802455002 DKGCRQYLEHPVIX-UHFFFAOYSA-N 412.469 2.461 10 20 HECD C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803300343 RHUZZOYAKYNKRU-JKSUJKDBSA-N 416.547 2.419 10 20 HECD C[C@H](NC(=O)C(=O)NCC[C@@H](C)N1CCCCC1)c1ccc(N2CCOCC2)cc1 803309150 QDMVIIKCELLZOO-MOPGFXCFSA-N 416.566 2.081 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nn(C)c3ccccc23)cc1F 804853070 SIFCUVWSMGKOBD-UHFFFAOYSA-N 411.481 2.491 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCO[C@@H](COC(C)C)C3)cc2)CC1 805026001 YPOWFECPMYJRCY-OAQYLSRUSA-N 417.550 2.192 10 20 HECD CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808016940 HFEYCHCKOCHJAO-UHFFFAOYSA-N 405.455 2.472 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCCN4c5ccccc5C[C@@H]4C3)CC2)cc1 810051283 YGOVDUFKMVGKBD-JOCHJYFZSA-N 420.557 2.481 10 20 HECD CN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CN(C(=O)OC(C)(C)C)C1 812010094 UTPJLBTWITVRAQ-UHFFFAOYSA-N 422.501 2.423 10 20 HECD CCc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(=O)O 871821852 PEVBGMOYMDGKNV-UHFFFAOYSA-N 422.478 2.401 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3F)CCC2)cc1 1792314152 YZKHIVVIGPRBBE-KGLIPLIRSA-N 421.519 2.339 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1cc(O)nc(O)c1 1817848590 ROIRQMJBQMFPCN-KBPBESRZSA-N 417.491 2.417 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)C3CN(C)C3)C2)cc1 1846716186 XWAOFGHSZUIBDB-UHFFFAOYSA-N 406.530 2.473 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)S(C)(=O)=O)cc1 731885826 XESGZPDBLARCKE-UHFFFAOYSA-N 405.520 2.186 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 734214748 AVXYCDNPTIFYRW-VQTJNVASSA-N 416.566 2.342 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H](c1ccccc1F)N1CCOCC1 742246916 HTNJUILFUKFALC-JOCHJYFZSA-N 413.493 2.352 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 744407093 KYWNTOBTYPORIV-KRWDZBQOSA-N 412.494 2.201 10 20 HECD CCCN1CC[C@@H](CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759280817 CSWFYAUALGTMDP-KRWDZBQOSA-N 420.554 2.276 10 20 HECD CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCNC1=O 760116775 NKIVQOVQWHPFDP-CVCOIXHCSA-N 409.558 2.076 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)NCCCSc2nccs2)cc1F 760576534 YIQFJDQKCUOXJV-UHFFFAOYSA-N 410.539 2.146 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl 760804190 FCWKBCGOUQNPTF-UHFFFAOYSA-N 409.895 2.387 10 20 HECD COc1ncnc(OC)c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761982554 NFMXSEHZUZWIFJ-CQSZACIVSA-N 406.870 2.247 10 20 HECD CC(C)Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 762415887 LMZZLZBWOLHNQP-UHFFFAOYSA-N 401.536 2.347 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccncc1Br 763279857 HXFGZCUCPHNFJD-UHFFFAOYSA-N 424.320 2.009 10 20 HECD C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769937640 SMKVRJCTLIWJCT-GWQKEKGPSA-N 410.517 2.334 10 20 HECD CCOC(=O)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C)c1C 771658357 RRNBFIIDVGASMW-GOSISDBHSA-N 420.487 2.415 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)CCNC(=O)OCc3ccccc3)ccc21 771745087 YLPZHSSDDYZBIZ-UHFFFAOYSA-N 417.531 2.415 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 775258099 QHMJHGJBISXRFV-WSTZPKSXSA-N 417.550 2.364 10 20 HECD CCOc1ccc2c(c1)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)CCO2 775346515 CCDGTCHABXGRQQ-INIZCTEOSA-N 406.460 2.416 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc(C(F)(F)F)n1 777576974 PYIGXSJAHCWIKH-CQSZACIVSA-N 421.423 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC(C)(C)[C@@H](O)C(C)C)CC2)cc1 778393680 HXYSJTDKDUNTDU-YRBAHSOBSA-N 417.550 2.059 10 20 HECD CCN(C[C@@H](O)C(F)(F)F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 779529684 ORTXFLHHQUJZNH-MRXNPFEDSA-N 407.408 2.242 10 20 HECD CN(C)S(=O)(=O)c1cccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)c1 782538046 QPEGQVIOOBKZOV-UHFFFAOYSA-N 414.531 2.313 10 20 HECD Cn1ccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 785596996 CGQQGHATQIAYCX-OAQYLSRUSA-N 415.497 2.318 10 20 HECD O=C1CC[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 785896775 KBESSPZIFXVNQQ-FQEVSTJZSA-N 412.511 2.298 10 20 HECD CN(C)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 786896326 CHMZRTRJRXSXIM-UHFFFAOYSA-N 412.559 2.238 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cc(F)ccc1F)c1ccc(N2CCOCC2)cc1 787037198 JGSSEYUGUIBLKH-CQSZACIVSA-N 403.429 2.295 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C)[C@@H]3C)cc2F)C[C@@H](C)O1 789826674 QCCGVHDNPNQBPY-XUWVNRHRSA-N 423.554 2.408 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCOCC(F)(F)C(F)F)cc2)C1 790379764 QAJFJLFKWUNWFB-AWEZNQCLSA-N 419.419 2.312 10 20 HECD C[C@@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccccc1 803665068 WFBDVUVXTICBDM-QAPCUYQASA-N 401.482 2.179 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCC[C@@H]3c3ncc[nH]3)CC2)cc1 804317319 ZRHRIZBXZDNPLF-LJQANCHMSA-N 411.506 2.257 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(C(=O)N(C)C)CCCC1 806264839 ICCFKCFOYNRIOZ-UHFFFAOYSA-N 403.523 2.286 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(N(C)C)cc1 807669979 AYVZYEVPGBMBCR-GDBMZVCRSA-N 415.925 2.373 10 20 HECD COC1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768195 FEHJSZCDHAYTHW-AWEZNQCLSA-N 411.449 2.010 10 20 HECD COc1ccncc1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 814417088 KNHVLZCRAXWBGT-UHFFFAOYSA-N 416.478 2.148 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC(=O)NC1CC1 914442728 INKCRSPOXGTGBK-LCYFTJDESA-N 409.558 2.124 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3ccccc3F)cc2)C1 918116919 CIJQOLNOKNIFKR-JXFKEZNVSA-N 414.481 2.060 10 20 HECD CCCC(=O)NC1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224700 UNMQAAHPUJVXEE-UHFFFAOYSA-N 406.502 2.253 10 20 HECD CCOCCCNC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918443948 HWFAUKSMQVSKMM-UHFFFAOYSA-N 413.474 2.146 10 20 HECD O=C(CCNC(=O)c1ccsc1)NCc1ccc(N2CCC(CO)CC2)cc1 919968299 ATFOUZBRGSPDNY-UHFFFAOYSA-N 401.532 2.393 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 1320386948 PZHQFEFESQGJML-QFBILLFUSA-N 416.405 2.021 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)[C@H]3CCCC[C@@H]3C(=O)OC)CC2)cc1 1338267177 GODODJMNNRVGJM-OALUTQOASA-N 410.536 2.269 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3cc(C(C)(C)C)n[nH]3)CC2)cc1 1339275314 HUDYJPQGTPCYAG-HXUWFJFHSA-N 415.582 2.331 10 20 HECD CN1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793877264 PHSXNCARFDUJLS-FQLMCAECSA-N 407.898 2.097 10 20 HECD Cc1ccc2[nH]cc(CC(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c2c1 1843249098 WDPSQTZALJCYLH-UHFFFAOYSA-N 420.469 2.342 10 20 HECD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)ccn1 1845501751 YRWAGWMYVNHHGG-UHFFFAOYSA-N 417.849 2.286 10 20 HECD OC[C@@H]1CCCN(c2cc(NCc3ccc(N4CCOCC4)c(F)c3)ncn2)C1 301220983 ADZOLGJPLDPJGF-QGZVFWFLSA-N 401.486 2.273 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C(=O)N4CCCC4)CC3)CC2)cc1 726713202 KZUAQGJIBNVMPJ-UHFFFAOYSA-N 415.538 2.207 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)nc(O)n4C)cc2F)CC1 730235060 LIIIZGZIRDSKBM-UHFFFAOYSA-N 411.481 2.490 10 20 HECD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NCCCSc1nccs1 733972376 QLJUAEQUZPKOCS-DYEKYZERSA-N 400.595 2.467 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c1 734017038 YECBDJHNSPZLPS-UHFFFAOYSA-N 419.231 2.076 10 20 HECD COc1cccc(CNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1O 745680117 GGUPVUKTCHDAQV-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 749639907 NSAXQWVYAFEBBZ-UHFFFAOYSA-N 421.494 2.329 10 20 HECD O=C(CCn1nc(O)c2ccccc2c1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751295292 YCODYYFQZNVNQI-KRWDZBQOSA-N 423.469 2.406 10 20 HECD COCCOc1ccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cn1 753847005 UPHSZLIYUHJEKA-UHFFFAOYSA-N 418.469 2.286 10 20 HECD COc1ccc(Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1OC 758283298 LYQCYEUTKJDYAZ-UHFFFAOYSA-N 405.432 2.422 10 20 HECD COc1cc(N2CCN(C[C@@H](O)COCc3cccs3)CC2)cc(OC)c1OC 759885759 GUYWBMHCTVSTSJ-QGZVFWFLSA-N 422.547 2.474 10 20 HECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 761055969 CGMHQVZDMIIJEP-UHFFFAOYSA-N 421.494 2.249 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)c([N+](=O)[O-])cc1OC 766924514 FYXZPLVVJVZLPZ-HZPDHXFCSA-N 420.510 2.239 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2n(c1=O)CCS2 768913424 ZUFHFZGMTFSOTQ-AWEZNQCLSA-N 420.922 2.102 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H]3COCCN3CC(F)F)cc2F)C[C@@H](C)O1 771623878 QYNUCRXLSYDGDA-QWQRMKEZSA-N 415.456 2.021 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 772701038 NJQBYEWWFGCQTA-ZHALLVOQSA-N 411.520 2.435 10 20 HECD CNC(=O)c1cc(C)ccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772910113 NEHKYSYTCTWBGU-UHFFFAOYSA-N 414.481 2.059 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccc(Br)cc1 773750919 XXPBZTWERIYBRD-NSHDSACASA-N 407.264 2.338 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCC(=O)N2CCN(c3ccccc3)CC2)c1O 774992388 QPAWJTNJBZGYRZ-UHFFFAOYSA-N 414.462 2.138 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CCN(C(=O)C(C)C)CC1 777827975 FXFWKXQGUTXUMJ-UHFFFAOYSA-N 410.898 2.442 10 20 HECD NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C\c3ccc(O)c(O)c3)c2)C1 779516038 WIOCMJSRGBAXLU-GXVATQTDSA-N 409.486 2.125 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O 784027982 PXMBSZQDESMXHM-UHFFFAOYSA-N 422.478 2.453 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCOCC3(CCOCC3)C2)c1 784042953 IIRLLSMFYSGZLE-UHFFFAOYSA-N 418.534 2.056 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCc2cccc(C(N)=O)c2)cc1)C1CCCCC1 787856634 QZAYOULUWHDYBR-UHFFFAOYSA-N 422.529 2.487 10 20 HECD C[C@H]1CCC[C@H](C)N1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789845043 JCDYPBFQSPEWGP-ROUUACIJSA-N 418.607 2.235 10 20 HECD C[C@@H]1CC(=O)C[C@H](C(=O)NCc2ccccc2O)[C@@H]1C(=O)NCc1ccccc1O 791138791 HCACSOHCXAQTTQ-YMTYPPQLSA-N 410.470 2.262 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1 792334897 DVIDCFWPYDBARH-UHFFFAOYSA-N 422.485 2.393 10 20 HECD COC1(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCOCC1 792722924 WPQJFRQIDWQGKA-UHFFFAOYSA-N 423.421 2.139 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@@H]3C[C@@H](C)O)CC2)cc1 796382870 JIJHIIFBRHRCET-FCEUIQTBSA-N 405.583 2.194 10 20 HECD CC(C)n1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 796680168 ZCMPGSSZTKBYRN-GASCZTMLSA-N 417.485 2.472 10 20 HECD CN1CCN(CCNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1(C)C 799365387 YZHBGIBWTAJEHV-UHFFFAOYSA-N 405.612 2.065 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCOc2ccccc2C1)c1ccc(N2CCOCC2)cc1 803297785 GTGBSVLDAZRDEW-QGZVFWFLSA-N 409.486 2.122 10 20 HECD C[C@H](NC(=O)N1C[C@H](N2CCOCC2)C[C@H]1C)c1ccc(N2CCOCC2)cc1 804988329 ATZJNSDAUQVGJF-LVCYWYKZSA-N 402.539 2.089 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1ccc(N(C)C)cc1 807671468 PMLAELNXABQNHP-HOTGVXAUSA-N 418.538 2.398 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCO1 807972067 HPTPMOBSCZEEGG-AOIWGVFYSA-N 404.507 2.221 10 20 HECD Cc1cc(Br)c(O)c(CN2CCC(C(=O)N3CCN(C)CC3)CC2)c1 809732624 HJCALTGRHXTVAV-UHFFFAOYSA-N 410.356 2.449 10 20 HECD CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)Cc2ccc(N(CC)CC)cc2)C1 914791058 GWQOYLFKOWKATA-GOSISDBHSA-N 411.568 2.485 10 20 HECD CC(=O)Nc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1C 919839357 IFPYDKZWGSRKHE-UHFFFAOYSA-N 401.488 2.441 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)[C@H](C)CO)CC2)cc1 1320090032 PZXUCPRIVUMIQC-NFBKMPQASA-N 413.562 2.061 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)Oc1ccc(C=O)cc1 1320394142 OPPDFSZWAJIPEG-HNNXBMFYSA-N 423.368 2.173 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1csnn1 1800712898 ZETIHKWNSMYNRE-JGPRNRPPSA-N 408.867 2.168 10 20 HECD CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1806328396 AYFTVAKLHNJVRS-VGSWGCGISA-N 419.485 2.290 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccon2)CC1 1826146031 RCERVTIYEZRBJI-INIZCTEOSA-N 400.435 2.028 10 20 HECD CCc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n[nH]1 1845501139 FBZIPNNGVCBCCP-UHFFFAOYSA-N 404.854 2.168 10 20 HECD COCCS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 109874321 YPXGTUCHHIDDFL-UHFFFAOYSA-N 418.515 2.078 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n(C)c2ccccc12 550398177 ATPKFBPFSGSMHU-LJQANCHMSA-N 404.514 2.494 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2F)CC1 730194005 HZSJCOYAXNFPOU-UHFFFAOYSA-N 418.473 2.087 10 20 HECD CCC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730194947 ZIVRWGUGBQRTJS-GOSISDBHSA-N 404.530 2.232 10 20 HECD COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@H](C)N(C)Cc1ccccc1O 732203391 RXGDALXVJKXDEN-AWEZNQCLSA-N 421.519 2.110 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@H]1CCCO1 734151460 ITLCMJPCNUZRRR-GOSISDBHSA-N 419.547 2.425 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)c1O 737285670 LIOMCJCMPRIAQG-UHFFFAOYSA-N 411.458 2.167 10 20 HECD CN(C)C(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 741069974 NZIGRWOOXDTABX-UHFFFAOYSA-N 401.442 2.081 10 20 HECD C[C@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N(C)Cc1ccc(N2CCCCC2)cc1 741710165 YPRPZLXRNHKTKR-XLIONFOSSA-N 407.580 2.143 10 20 HECD Cc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 743559893 PKZGIZYCGVDAHX-OAQYLSRUSA-N 408.502 2.436 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C2CC2)[C@@H](C)O)c1C 745742583 AJYJVSRCRPPHLB-IERDGZPVSA-N 412.486 2.404 10 20 HECD COC(=O)c1sccc1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 751065186 UTRJXQMPGQIWEH-UHFFFAOYSA-N 410.517 2.491 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCCS3)CC2)cc1 752797103 LSTYUOAKUCEBPW-VJIACCKLSA-N 403.548 2.302 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3cc(OC)ccc3O)CC2)cc1 754139098 BJKXRDKQTLGRKU-HKUYNNGSSA-N 415.534 2.243 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@@H](C)c3nccs3)CC2)cc1 754269182 HNEUGIXHPBZESN-IEBWSBKVSA-N 404.580 2.370 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cn(-c2ccccc2)nn1 755222836 QDCZVWMJNNVPCG-UHFFFAOYSA-N 420.517 2.475 10 20 HECD COCc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N3CCC(C)CC3)cc1)CC2 757689555 ROBHJIMHLJHHAY-GOSISDBHSA-N 412.538 2.475 10 20 HECD COc1cc(N2CCN(CN3C(=O)[C@H]4[C@H]5CC[C@@H](C5)[C@@H]43)CC2)cc(OC)c1OC 758965677 SSXQMOIZPICBCK-SLUIBLPYSA-N 401.507 2.049 10 20 HECD COCCC1(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 759288669 UXVHEXLCRKAYJA-UHFFFAOYSA-N 407.511 2.361 10 20 HECD CN(C)CCOc1cccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 762059260 WABVPEMOOQZRGY-UHFFFAOYSA-N 418.475 2.421 10 20 HECD C[C@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762090564 ADOQWQOOBYGAQQ-ZIAGYGMSSA-N 419.494 2.379 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CN(C)CCO1 770124730 ROQSDQBGQUZCEB-DAYGRLMNSA-N 412.481 2.275 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cnc4c(c3)NC(=O)CO4)cc2F)C[C@@H](C)O1 770676236 NJDNLEBAAZNBCN-CHWSQXEVSA-N 414.437 2.095 10 20 HECD COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1F 770724079 KLJJUQOQDGDMTQ-UHFFFAOYSA-N 419.428 2.189 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(OCCN3CCOCC3)c2)c1O 774981702 JPXNHRZXZQRZIL-UHFFFAOYSA-N 417.462 2.310 10 20 HECD CS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1Br 778920020 SZNCNRSKCPZGTN-UHFFFAOYSA-N 400.250 2.194 10 20 HECD Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781365525 TTWYWTUCIDADQZ-IBGZPJMESA-N 417.485 2.285 10 20 HECD Cc1cc(Br)ncc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296859 JUQDOGVGSYBSMA-SNVBAGLBSA-N 408.252 2.250 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(Cc2ccccc2)CC1 788333177 PNIPBBNFABSRCM-UHFFFAOYSA-N 407.514 2.279 10 20 HECD COC[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)[C@@H]1CCCO1 791042139 QNCQCEUXDOEECV-IRXDYDNUSA-N 424.409 2.294 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c(O)c1 794380676 GRWXQYVPDZIKJE-LRTDBIEQSA-N 403.479 2.154 10 20 HECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 797639536 FADNPUAFBCNCFD-XHDPSFHLSA-N 422.507 2.023 10 20 HECD O=C(NCCN1CCCc2ccccc21)C(=O)NCc1ccc(N2CC=CC2)cc1 804001314 VKNQEEWMLIUIMD-UHFFFAOYSA-N 404.514 2.248 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3cccc(OC)c3)CC2)cc1 804315009 ACEBNCAGXMXWNO-UHFFFAOYSA-N 411.502 2.447 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCc2ccccc2C1 807116631 NRHGPBNNNGYQRZ-HXUWFJFHSA-N 421.541 2.403 10 20 HECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385716 PVLUYPHRSBNHAJ-UHFFFAOYSA-N 424.207 2.326 10 20 HECD O=C(NC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768975 CKSNQXXCXANCHR-UONOGXRCSA-N 413.490 2.242 10 20 HECD Cc1nsc(NC2CC2)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 814330963 UJCOAQWWAUQFMF-UHFFFAOYSA-N 420.560 2.191 10 20 HECD COc1ccc(N2CCN(CCCNCc3ccc4c(c3)NC(=O)CO4)CC2)cc1 816530529 LLBXKVDCJLKGFJ-UHFFFAOYSA-N 410.518 2.328 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1 918434287 KYZODSLYNXNIEM-UHFFFAOYSA-N 407.478 2.072 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(NC(C)=O)c3)CC2)cc1 918460827 HSRUQBYZUJHVKR-UHFFFAOYSA-N 410.474 2.331 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)CC2)cc1 918706776 ZKSZGCRMBWEANQ-UHFFFAOYSA-N 417.531 2.312 10 20 HECD C[C@@H](c1ccc(F)cc1)N(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 920636195 QFQQZGPEGBWIAQ-LBPRGKRZSA-N 424.450 2.279 10 20 HECD Cc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1799595460 GIDNDLXMHRVQCD-QDMKHBRRSA-N 417.556 2.107 10 20 HECD Cn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1825724648 ANZUEPQDOQIRCB-GOSISDBHSA-N 412.490 2.378 10 20 HECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)/C=C/c1cnn(C)c1 105159730 GLXBBVBMDXVHCM-DHZHZOJOSA-N 402.520 2.443 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 109606760 PJSLLWXVTOTYJV-UHFFFAOYSA-N 418.515 2.439 10 20 HECD C[C@@H](NC(=O)N1CCC(N2CCCC2=O)CC1)c1ccc(N2CCOCC2)cc1 729602560 NIMHNRCLLCPLDJ-QGZVFWFLSA-N 400.523 2.381 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cn(-c4ccccc4)nn3)cc2F)CC1 730194008 IAGSMOPGGGFRRQ-UHFFFAOYSA-N 408.481 2.478 10 20 HECD C[C@@H](NC(=O)N1CCC[C@@H](N2CCCC2=O)C1)c1ccc(N2CCOCC2)cc1 732243940 WIQCDEJOGFFDCQ-YLJYHZDGSA-N 400.523 2.381 10 20 HECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 734074213 LMNQKTAGLKKYKC-UHFFFAOYSA-N 401.419 2.248 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1 734664681 HPJUPQVTSIUJIS-UHFFFAOYSA-N 419.570 2.413 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccco1 744280642 SNGZWEBNFOOATH-HNNXBMFYSA-N 402.520 2.337 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCc3c(cccc3N3CCOC3=O)C2)cc1 744414225 KBJLAPQAJAQPPI-UHFFFAOYSA-N 408.502 2.384 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@](C)(O)c3ccco3)CC2)cc1 745349466 IHLHFJBNQKCZCA-QFIPXVFZSA-N 416.522 2.007 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cc(C(N)=O)ccc3C)CC2)cc1 746674502 SIZMSJWGENCGBX-UHFFFAOYSA-N 411.506 2.046 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2=O)c1 747958370 ZYJWFNPKPLUITC-SFHVURJKSA-N 415.446 2.023 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4cc(F)ccc43)CC2)cc1 754043387 RKQRTAOWONHQPG-IBGZPJMESA-N 401.482 2.216 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1c(C)nn(CCOC)c1C 754481704 GVIXUGGFHKNSLD-UHFFFAOYSA-N 401.511 2.200 10 20 HECD CCNC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758230099 GJNGXFMRKWZXFI-HXUWFJFHSA-N 413.518 2.007 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cn1C 760540258 HCHDUNOCWIZPGN-UHFFFAOYSA-N 423.560 2.234 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNc3cc(N4CCCC[C@H]4CO)ncn3)cc2)C1 764782716 HZJHAROFGGEXFU-ICSRJNTNSA-N 424.549 2.142 10 20 HECD CCOC(=O)N1CCC(NC(=O)C(=O)N(C)Cc2ccc(N(CC)CC)cc2)CC1 775006452 ZDNSTFLIIJMFMD-UHFFFAOYSA-N 418.538 2.228 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@H](O)c3ccccc3)CC2)cc1 778296120 WZIIBUKAIUQCLL-GJCOWUBNSA-N 423.513 2.140 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(C(F)F)CC3)CC2)cc1 778379315 HSEDWXYYAAQTPU-VOTSOKGWSA-N 407.461 2.404 10 20 HECD COc1ccc(Cn2ccc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)n2)cc1 778606556 YPRWYCUQZZVMAH-AWEZNQCLSA-N 424.457 2.470 10 20 HECD COc1ccc(N2CCN(CCCNc3ncccc3S(C)(=O)=O)CC2)cc1 779707466 IARARQPYEGCZDC-UHFFFAOYSA-N 404.536 2.118 10 20 HECD CN(CC1(O)CCOCC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 780386833 JIMXBULCLSUQDF-UHFFFAOYSA-N 413.465 2.440 10 20 HECD Cc1nc(Cn2cc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)nn2)no1 783280218 QKYRVAJQNHETGN-UHFFFAOYSA-N 423.399 2.289 10 20 HECD O=C(OCC[C@H]1CCOC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785408702 XBEOASLMGSVRTD-LLVKDONJSA-N 411.457 2.365 10 20 HECD Cc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 786481779 GRQHVGCPXLDTST-KRWDZBQOSA-N 403.504 2.024 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSCC[C@H]3C)cc2F)C[C@@H](C)O1 789822411 WNRZXEYOZUDHRJ-BZUAXINKSA-N 423.554 2.410 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O 790408992 JHOHZZWNPQZXKO-UHFFFAOYSA-N 400.840 2.109 10 20 HECD O=S(=O)(CCO)c1ccc(CNCc2cccc(Br)c2O)cc1 791006549 MMEJVWLSRUXDMN-UHFFFAOYSA-N 400.294 2.211 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 792329960 GXPQXUOHJTWONI-INIZCTEOSA-N 411.506 2.328 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc4ccn(C)c(=O)c4c3)ccc21 792974665 UNJWDDAHNXUINQ-UHFFFAOYSA-N 404.470 2.176 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C\c1ncc(I)s1 794696199 CWXMJBWDMMCFMA-ALCCZGGFSA-N 407.258 2.050 10 20 HECD CNC(=O)[C@@]1(C)CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 797525802 SENRZQDAAKHPRR-BSEYFRJRSA-N 419.481 2.247 10 20 HECD CCOCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 799558547 LAWKGFIRPIEEEI-HOTGVXAUSA-N 422.497 2.415 10 20 HECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)no1 803305910 OCHZNBWWZNLSHM-UZLBHIALSA-N 412.490 2.361 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1F 803664272 IWXGZOZLPASELS-LJQANCHMSA-N 421.419 2.386 10 20 HECD CC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 804317006 QBACFPZWFYVSKZ-HXUWFJFHSA-N 403.523 2.102 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O 807289890 MBFDGPGXDZGBEH-OAQYLSRUSA-N 424.545 2.119 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCO[C@]3(CCSC3)C2)C2CC2)cc1 809495366 MIZXVPSKKYMDJG-HTAPYJJXSA-N 417.575 2.415 10 20 HECD COCCNC(=O)CN1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809541840 YZBPZPXLCIWIEW-UHFFFAOYSA-N 422.573 2.130 10 20 HECD COc1cc(Br)cc(CN2CCC[C@H]2C[C@@]2(C)NC(=O)NC2=O)c1O 809705793 ZUTCAJHPYKLWTR-YVEFUNNKSA-N 412.284 2.116 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2F)cc1F 810370687 KTEXBVGPDNONIT-UHFFFAOYSA-N 411.474 2.406 10 20 HECD CC[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H](C)S1(=O)=O 813058712 MEDYQHJHKBELMK-HNAYVOBHSA-N 409.552 2.271 10 20 HECD COC(=O)Cc1csc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 915313505 CAFTXCPLAKFMGV-UHFFFAOYSA-N 404.492 2.359 10 20 HECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 919980052 JXIGTAKAWVLMLY-KRWDZBQOSA-N 403.866 2.251 10 20 HECD COc1ccc(N2CCN(CCCNc3ccc(S(C)(=O)=O)cn3)CC2)cc1 1156260710 JBIFCCSZNZZEES-UHFFFAOYSA-N 404.536 2.118 10 20 HECD CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCN(c2ccc(OCC)cc2)CC1 1319846924 HCTLHADSOFTIEX-FQEVSTJZSA-N 403.523 2.152 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(CC)n(-c2ccccc2)n1 1321359798 HRTDMCJRJXDIQE-INIZCTEOSA-N 424.457 2.145 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccns1 1796932652 NKUIXGBXIICGQP-RBVVOMGSSA-N 423.498 2.188 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799169388 OCKGJBOJKBFFQP-IHBSRNJCSA-N 408.882 2.001 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799945555 HYCVTDNQDUCWGO-OTRUCEAGSA-N 408.502 2.464 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)COc1ccc2ccc(=O)oc2c1 18469728 SJGUTAXNFRSMJD-UHFFFAOYSA-N 424.453 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccccc3N3CCC(O)CC3)CC2)cc1 59806774 SSDDJHDTJOKGDQ-UHFFFAOYSA-N 424.545 2.417 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)n(C)c2ccccc12 673314451 QLSXMRGAVWJNAI-FQEVSTJZSA-N 418.497 2.367 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)cc2F)C[C@@H](C)O1 729497577 VERGULQEHGXEEW-UKBAYJJMSA-N 420.529 2.102 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCc3ccccc3C2)cc1Cl 732746739 FQTYVUSOTGECAN-UHFFFAOYSA-N 415.924 2.427 10 20 HECD Cc1ccccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732886519 GLKZIWWVPTZIEZ-NQIIRXRSSA-N 410.518 2.230 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)c(F)c3)CC2)cc1 732923300 UUSJZTNYQMKSEA-UHFFFAOYSA-N 407.511 2.243 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@H]1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 733464133 FSKYPCRNXWRZCZ-ZDUSSCGKSA-N 414.480 2.320 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 734404568 LFFRBBXRAKQLIQ-QFIPXVFZSA-N 412.465 2.284 10 20 HECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 734943454 YTUKPJCNIWEESR-UTKZUKDTSA-N 422.533 2.364 10 20 HECD CSC[C@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 736375744 MDRKJWGTDNKPGZ-HNNXBMFYSA-N 418.542 2.493 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@@]1(N2CCOCC2)CCSC1 740909871 RUHJELKNPVLXQJ-NRFANRHFSA-N 402.564 2.070 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1O 743915377 IRPJIGPDFAZERK-UHFFFAOYSA-N 420.425 2.303 10 20 HECD CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NCc3ccccc3O)c2)c1C 748481747 MPNAMNJDGGYXFH-UHFFFAOYSA-N 422.441 2.318 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2cccc(I)c2)c1 751414720 CPLAGUYRLRIAMF-UHFFFAOYSA-N 419.240 2.484 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(C)n1 760092524 PKBWSCKUIONHSC-UHFFFAOYSA-N 400.504 2.207 10 20 HECD O=C(O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1Cl 761258294 BATPIJRSOMCIMS-UHFFFAOYSA-N 410.879 2.353 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc2c(c1)S(=O)(=O)CC2 764233877 BIRGZESDDZXRFC-UHFFFAOYSA-N 419.478 2.314 10 20 HECD C[C@@H](CC(=O)N1CCCCCC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765980899 UULQCOOUFNDVNM-SFHVURJKSA-N 407.580 2.192 10 20 HECD CN(C)C(=O)c1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 766199760 HUGDTUORYCQNPF-UHFFFAOYSA-N 413.293 2.335 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)CC2 768012243 UPCRYOLDWRVBLW-UHFFFAOYSA-N 410.474 2.243 10 20 HECD O=S(=O)(Cc1ccon1)N1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 769506138 MKNRTHGNJIZBJN-UHFFFAOYSA-N 404.536 2.313 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(c3cccc(C)c3)CC2)cc1 784554402 ADMKNFYBYGGHTP-UHFFFAOYSA-N 411.502 2.332 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1 785428843 TVQSHPJEFKCWGT-IBGZPJMESA-N 409.465 2.147 10 20 HECD COc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788931661 JDSBPHLQNBHPLY-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2COc3c(cccc3OC)C2)cc1 788977462 LFONEMIOKHZXMQ-SFHVURJKSA-N 411.502 2.278 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)c1 803686749 HLUGGXKJBSDAQZ-UHFFFAOYSA-N 422.529 2.043 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3csc(N(C)C)n3)cc2)CC1 805026098 CCNDPVABHVEVRJ-UHFFFAOYSA-N 415.563 2.378 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NCc2cc(OC)ccc2O)s1 806809945 FAOYEPKFZRPHGG-GHMZBOCLSA-N 407.496 2.277 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807102096 CVAXNTUTFQLMBL-KRWDZBQOSA-N 403.523 2.115 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c2ccccc21 807292149 MMNVOHMEWIIOBY-NRFANRHFSA-N 418.497 2.293 10 20 HECD CC[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1O 810225698 KJZFTRWWVDLQTM-DOTOQJQBSA-N 415.456 2.385 10 20 HECD C[C@H](c1ccccc1)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 813589547 CFNFIYFALCAYAB-FOIQADDNSA-N 414.481 2.119 10 20 HECD CCOC(=O)[C@H]1CCCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 917658132 QKMLQZBGWFXSHD-SFHVURJKSA-N 411.568 2.483 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@H](C)O[C@H](C)C1 921203186 DAPTUJCEALVTCU-LLGFUMIMSA-N 407.530 2.412 10 20 HECD O=C(Cc1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602400 FINCUMKHFPOPGN-MUJYYYPQSA-N 417.412 2.266 10 20 HECD COc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1801846985 RZJAVRWFVQZIMB-KXXXJKOBSA-N 423.469 2.467 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)ccn1 1804286363 RRJGSOMCWDQYPT-ZXRXUGKRSA-N 423.469 2.472 10 20 HECD Cc1c[nH]cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818217375 YOJVLUCTZGGZGO-HNNXBMFYSA-N 410.434 2.472 10 20 HECD COC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423892 AHMBZAPOEQDALZ-MRXNPFEDSA-N 405.495 2.151 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@]2(F)Cl)C1 1846443310 ARSSOXBJWHLRTM-QGHHPUGFSA-N 403.237 2.493 10 20 HECD NC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2cccc3nsnc23)c1 19103162 ZNDHRUNKBOQYHT-UHFFFAOYSA-N 403.489 2.191 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 141686905 KXEVQHDKOGETRY-OAHLLOKOSA-N 411.458 2.126 10 20 HECD Nc1c(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)ncnc1-n1cccn1 480840668 HVDUWOQOSLYJFH-UHFFFAOYSA-N 415.457 2.067 10 20 HECD Cc1csc([C@H]2CN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CCO2)n1 673315619 MJAQYTDWAPTPJD-GOSISDBHSA-N 412.515 2.468 10 20 HECD CN(Cc1ccccc1O)C(=O)c1cc(S(N)(=O)=O)c(Br)s1 729521803 BZMPSEMCPAMYMK-UHFFFAOYSA-N 405.295 2.136 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)c3cccc(-n4cnnn4)c3)cc2)CC1 731038547 KEUZRGSDRCLSSP-UHFFFAOYSA-N 412.519 2.377 10 20 HECD CCOCCN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 732451480 WKYLTZVBIHUODU-ROUUACIJSA-N 422.545 2.303 10 20 HECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 732892853 KTRXNIXEJBRXQB-UHFFFAOYSA-N 417.531 2.331 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)N3CCc4ccccc4C3)nc12 740987702 UFKUZLJWDKDSRB-AWEZNQCLSA-N 424.457 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)CC2)cc1F 753740828 WAVRQAKXSFTFLX-UHFFFAOYSA-N 405.430 2.295 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C\c3ccccc3)n3nnnc3C)CC2)cc1F 753742116 PGEUGHLEVPTEEE-XSFVSMFZSA-N 422.464 2.476 10 20 HECD COc1ccc(N2CCN(CC(=O)NCc3ccc4c(c3)OCO4)CC2)cc1F 753858875 XJWUBYPAPJZGNI-UHFFFAOYSA-N 401.438 2.001 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 754000564 WXHLTGAQCXJDRT-HNNXBMFYSA-N 406.552 2.421 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCc3nc(COC)nn3C2)cc1 757778890 YYDBEPQJTKKDIY-KRWDZBQOSA-N 400.527 2.427 10 20 HECD O=S(=O)(NCc1cccc(Br)c1O)c1ccc2c(c1)OCCO2 766201311 QWCFGBVYTLTJNW-UHFFFAOYSA-N 400.250 2.404 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4c(cc3F)NC(=O)CC4)cc2)C1 767888797 SSJMFYWFSKZBST-INIZCTEOSA-N 424.476 2.342 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCCCN1S(C)(=O)=O 769291925 PGNBELUQIFLYSU-AWEZNQCLSA-N 419.341 2.317 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2ccnc2)nn1 771058907 OPRBFELIPHAVPO-MRXNPFEDSA-N 412.881 2.416 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)cn1C 774126950 PJNCMCRMPDPUPS-UHFFFAOYSA-N 400.479 2.255 10 20 HECD Cc1c(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 775403153 GYNLLCDIJRWGAQ-LBPRGKRZSA-N 406.464 2.108 10 20 HECD Cc1cc(C(=O)NCC(=O)N2CCOCC2)c(C)n1-c1cccc(Br)c1 776500305 WWZMOENVKQJSOT-UHFFFAOYSA-N 420.307 2.445 10 20 HECD COCCC1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 778327860 HJSSOGCDRXEBIC-HJWRWDBZSA-N 415.534 2.223 10 20 HECD O=S(=O)(c1cccc2nsnc12)N1CCN(Cc2cc(F)ccc2O)CC1 778996171 WNRWWVGFDQXMAZ-UHFFFAOYSA-N 408.480 2.043 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@@H]3CCO)CC2)cc(OC)c1OC 779710228 AAUKHGYCSZCNFV-NVXWUHKLSA-N 407.511 2.095 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](CO)c3ccccc3)cc2F)C[C@@H](C)O1 782053641 TZHQNEWOOKRSPA-CBGDNZLLSA-N 415.509 2.379 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cncnc2N(C)C)cc1 782423997 UROXIGBIDLNUJN-UHFFFAOYSA-N 422.489 2.369 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(C)(C)S(=O)(=O)C3CC3)cc2F)C[C@@H](C)O1 785885260 AUXYLNPDKMLMPP-OKILXGFUSA-N 412.527 2.411 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](C)[C@H]1OC 788321327 UVNWJBDECDOHNP-NSISKUIASA-N 417.550 2.095 10 20 HECD O=C(CSc1nccn2ccnc12)NCc1ccc(N2CCOCC2)c(F)c1 788508220 BPBBDTFWDWDVKC-UHFFFAOYSA-N 401.467 2.114 10 20 HECD Cc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 788938384 RFWAKUAJFAGXQU-OAQYLSRUSA-N 420.513 2.133 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](C)[C@@H](C)C(=O)NCc2cc(OC)ccc2O)c1 790788372 VHDPFUMTPFZACT-OKILXGFUSA-N 416.474 2.320 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 803317069 QPOXRPFBFWPHEF-OAHLLOKOSA-N 417.456 2.338 10 20 HECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 806519031 IJEZUCNFRFBMIN-HUUCEWRRSA-N 406.527 2.349 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COCCN1CC(F)F 806951037 ZHFCRMXIBSDSBC-XJKSGUPXSA-N 419.419 2.339 10 20 HECD Cc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807289027 GYLKSGLZQZMAJA-UHFFFAOYSA-N 404.514 2.336 10 20 HECD COc1cnc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 815525740 SJYHUVNOHHMLHD-UHFFFAOYSA-N 417.377 2.056 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 917929239 ASPAUDZZQVOXFA-HNNXBMFYSA-N 421.494 2.015 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@@H]3C(=O)NCc3ccco3)cc2F)CC1 1324717202 XAQBNEHADHLWQT-OAQYLSRUSA-N 400.498 2.451 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243740 HBWZKCHZJGMAAD-FECCGZLWSA-N 422.909 2.391 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793623759 NNUWBIYAXBNUOM-OBSCOMINSA-N 410.898 2.410 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)C(F)(F)Cl)sc2C1)c1cc(O)nc(O)c1 1826392821 CNSGVJKSMZMAOH-SSDOTTSWSA-N 418.809 2.007 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 141680850 SCIRDDDFKYBULR-HNNXBMFYSA-N 413.474 2.356 10 20 HECD NC(=O)C1CCN(c2ccccc2NS(=O)(=O)c2cccc3nsnc23)CC1 523321395 CULLNXBAOAFMIP-UHFFFAOYSA-N 417.516 2.194 10 20 HECD O=C(NCCCN1CCCCC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 730119662 NXFNAHOGYFBQPM-UHFFFAOYSA-N 402.539 2.097 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCCO)[C@H]3CCc4ccccc43)nc12 733895122 QXDPXJZQLRLQHZ-IBGZPJMESA-N 410.474 2.484 10 20 HECD Cc1cc(C(=O)CN2CCSC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 738339894 JDOUOYYYXCOLJQ-CQSZACIVSA-N 407.561 2.362 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1Cn1cncn1 743314893 QUOTXVJDGQPTTI-UHFFFAOYSA-N 409.465 2.357 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 743566888 KSOGCZUJHNFOCL-NJYVYQBISA-N 416.566 2.320 10 20 HECD COc1cccc(CNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c1O 745780625 KRTLXMXLWJGXML-UHFFFAOYSA-N 415.490 2.111 10 20 HECD COc1ccc(N2CCN(C(=O)CSCc3nc([C@@H](C)OC)no3)CC2)cc1 747847667 SMKLJGAOHJQCSX-CQSZACIVSA-N 406.508 2.368 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccn(CC(F)F)n3)CC2)cc1 748952030 XNPPUQWVXPPDMH-UHFFFAOYSA-N 408.453 2.101 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(CO)CCOCC3)cc2F)C[C@H](C)O1 749176283 RQIQPHIYNZNAHY-HOTGVXAUSA-N 409.502 2.028 10 20 HECD CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749345059 UDLAIWIUQFMRDR-UHFFFAOYSA-N 410.490 2.111 10 20 HECD Cc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 752383167 XFZOIZUKCJNZEN-TXEJJXNPSA-N 406.483 2.459 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1F 752725100 FVLDTBANNDBZJS-UHFFFAOYSA-N 410.449 2.159 10 20 HECD COc1ccc(N2CCCN(C(=O)NCc3ccc4c(c3)C(=O)NCC4)CC2)cc1 758683369 BSCCAINHNVVVHO-UHFFFAOYSA-N 408.502 2.403 10 20 HECD COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)/C=C\c1ccc(O)c(O)c1 759593268 MQHGIYNIXDMREL-XQRVVYSFSA-N 407.400 2.071 10 20 HECD CN1C(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)[C@@H]1Cc1ccccc1 761128921 ZTNFDLQTPQMSGO-FPOVZHCZSA-N 420.513 2.394 10 20 HECD O=S(=O)(Nc1cc(-n2nnnc2C2CC2)ccc1F)c1cccc2nonc12 765089099 FECUCWGEKYDVOB-UHFFFAOYSA-N 401.383 2.016 10 20 HECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2ccc(N3CCCC3)cc2)c1 767033164 QHBOUISOWYKUMZ-UHFFFAOYSA-N 403.504 2.173 10 20 HECD NC(=O)COc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 768913015 URFPPUQRMSMBTD-KRWDZBQOSA-N 417.893 2.304 10 20 HECD N=C(Cc1ccccc1)NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772885519 RRSBWRXBQLGGPM-UHFFFAOYSA-N 400.454 2.020 10 20 HECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1(C)C 775772660 VPZIICLKFLVTSM-YCEFEEMOSA-N 402.539 2.247 10 20 HECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1ccccc1S(=O)(=O)NC1CC1 780398317 XTCNHSHRSLBRGK-UHFFFAOYSA-N 402.881 2.287 10 20 HECD COC(C)(C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 782767069 PWBVQNUCKYZNTH-UHFFFAOYSA-N 401.486 2.374 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCSCc2ccnc(Cl)c2)cc1 785445297 VVWYCBDWWYHRHK-UHFFFAOYSA-N 406.939 2.467 10 20 HECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1OC 787922450 BPQJMTCTCJKYJX-UHFFFAOYSA-N 411.502 2.279 10 20 HECD C[C@H](Cc1ccccc1F)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787974389 LSANNJNXVABYLN-OAHLLOKOSA-N 417.456 2.165 10 20 HECD COc1ccc(C)cc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789372198 MFECKKLRNLXLAH-UHFFFAOYSA-N 413.543 2.489 10 20 HECD CCC(O)(CC)CCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789820132 PMENLIOPGHXPIP-HOTGVXAUSA-N 423.529 2.113 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(F)c(S(C)(=O)=O)c3)c2)CC1 790970280 CEIYQMADIOVINS-UHFFFAOYSA-N 419.478 2.150 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2F)C[C@@H](C)O1 791204251 GVTIGRMCZAVLIK-TXEJJXNPSA-N 403.414 2.255 10 20 HECD COc1cccc(CNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1O 800519700 UKNLFVDQURDREN-UHFFFAOYSA-N 400.410 2.449 10 20 HECD COCc1csc(NC(=O)C(=O)NCc2cccc(Br)c2O)n1 807058911 UQMNDCAHCVGJJI-UHFFFAOYSA-N 400.254 2.013 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287715 MJZDHDMZNOSYKH-YCZSINBZSA-N 411.546 2.467 10 20 HECD CN(Cc1ccccc1O)C(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 916697353 IUXXTOHYYVVRKO-UHFFFAOYSA-N 423.466 2.216 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1 918305815 LXOXCQLXZATRFG-UHFFFAOYSA-N 424.545 2.224 10 20 HECD CC(=O)Nc1ccc(C)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918309608 CKTPBILPXVMEIK-UHFFFAOYSA-N 424.501 2.387 10 20 HECD C[S@](=O)Cc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919840599 SHIOINDXRMCKRY-SANMLTNESA-N 406.529 2.052 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3cc(Cl)ccn3)CC2)cc1 1318171455 LITFVKIILRKFSS-UHFFFAOYSA-N 402.882 2.259 10 20 HECD COc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603833 ZEPQOPQXUIQNQQ-QDMKHBRRSA-N 415.421 2.206 10 20 HECD O=C(c1ccc(O)cc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546394 FYFJPXXGXUHYII-UHFFFAOYSA-N 411.458 2.357 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845783 WBICBXKLNCIRBQ-JQWIXIFHSA-N 407.377 2.177 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429202 QODJMBNWBBKTSP-RDTXWAMCSA-N 417.506 2.341 10 20 HECD COc1cccc(NC(=O)CN(C)C(=O)CN(C)c2ccc(OC)c(OC)c2)c1 63616952 XHXZQMPDSKFRTL-UHFFFAOYSA-N 401.463 2.246 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 108433474 UJILPEVNMUENSL-HXUWFJFHSA-N 423.579 2.328 10 20 HECD COC(=O)/C=C1/SCC(=O)N1CCCN1CCCN(c2ccc(OC)cc2)CC1 139877441 FEXBIVANXIBVLI-HMMYKYKNSA-N 419.547 2.187 10 20 HECD COc1ccc([C@@H](CNC(=O)NCc2cc(OC)ccc2O)N2CCOCC2)cc1 734065115 PWWRHRCRYOQFPO-HXUWFJFHSA-N 415.490 2.282 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)cc(N)c3F)CC2)cc1 738719555 UTVGVDSNYLZHPS-UHFFFAOYSA-N 405.401 2.061 10 20 HECD CN1CC[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751700 VVNVDLUILOXVHO-SJLPKXTDSA-N 418.538 2.303 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)CN1C(=O)C[C@H](Cc2cnn(C)c2)C1=O 746374144 JCWDTBYISQXFSK-FQEVSTJZSA-N 409.534 2.418 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]([C@@H](C)O)C3)CC2)cc1 747393281 AYKYLMUCXZDSJB-RTBURBONSA-N 404.555 2.010 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCN(c2ccccn2)C1 753124333 PDIMRZGSZXPBGC-KRWDZBQOSA-N 413.497 2.260 10 20 HECD O=C([C@@H]1CN(C(=O)/C=C\c2ccc(Cl)nc2)c2ccccc2O1)N1CCOCC1 759778310 AVTWDCTVUCBSHC-POZKEBTKSA-N 413.861 2.401 10 20 HECD C[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@]1=O 759855664 CQNOYZGDAZYQCV-ONSXPEOJSA-N 410.495 2.243 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C3CCOCC3)CC2)cc1 762061674 IYXVIZHHFHEYQR-GOSISDBHSA-N 404.555 2.322 10 20 HECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1cccc(Br)c1O 765754962 YUAZCAHXFYXXHI-UHFFFAOYSA-N 410.268 2.026 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)c1 767794354 RMOZLSRGRHQIRF-CYBMUJFWSA-N 418.471 2.068 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 767939046 QBGVYSZNSNDYSV-FGZHOGPDSA-N 416.566 2.090 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C)nn2-c2ncccn2)cc1 768030449 LRUBDYBAGKAVEW-UHFFFAOYSA-N 407.478 2.072 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3nccn4cnnc34)[C@H](C)C2)cc1 771205350 QUTUGMWJGTVCND-QGZVFWFLSA-N 422.537 2.391 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773860029 YAACRGKNTAJWCR-CQSZACIVSA-N 403.504 2.280 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@]2(C1)C(=O)Nc1ccccc12 777458368 DNUPXQQDLJNUQL-HSZRJFAPSA-N 424.476 2.468 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](F)Cc3ccccc3)CC2)cc1 778203458 VXBKZUWUUZQPBL-HXUWFJFHSA-N 400.450 2.468 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cn1 778968301 OPBNQZWJLPBAPM-UHFFFAOYSA-N 412.469 2.414 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3CCN(C)C)CC2)cc1 782409733 MSRSMEKVDJLWOF-UHFFFAOYSA-N 424.545 2.477 10 20 HECD CC[C@@H]1CO[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819193 MKPSYERGIXFHMK-LISAXSMJSA-N 421.513 2.081 10 20 HECD Cc1ccccc1CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845931 XBAGLMUSAKJZLY-UHFFFAOYSA-N 413.493 2.370 10 20 HECD C[C@@H](O)C[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855664 VOWVWXHKIXDYGY-VQIMIIECSA-N 405.564 2.008 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1COCCN1C1CCCC1 789986784 OFGGSAAUTNQUGJ-OAQYLSRUSA-N 405.514 2.046 10 20 HECD COc1ccc(N2CCN(CCNCc3c(Br)c(C)nn3C)CC2)cc1 790469110 MOGOOCJSYAKRBS-UHFFFAOYSA-N 422.371 2.411 10 20 HECD COc1cc(CN2CC[C@H](NC(=O)NCc3ccc(OC)cc3O)C2)cc(OC)c1 793096591 ANHWHLYZZLEDGA-KRWDZBQOSA-N 415.490 2.492 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(n1)CCCC2)c1ccc(N2CCOCC2)cc1 803307690 KNGIRVYEIIJOEN-KRWDZBQOSA-N 422.529 2.291 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315852 UABGXYJORSOFJR-LJQANCHMSA-N 416.566 2.161 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CC[C@@H]3CCCCN3C)CC2)cc1 804320233 YOAKZTXHHDBAQF-IBGZPJMESA-N 416.566 2.113 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1 807511283 KBNRCNQUTBYIQQ-UHFFFAOYSA-N 414.245 2.374 10 20 HECD C[C@H](CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCCCC1 807701761 KXSOSYGPCUPXTA-UYAOXDASSA-N 417.550 2.281 10 20 HECD Cc1ccc(C(=O)N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c(O)c1O 813838793 OTQIXUGCXQTROK-HNNXBMFYSA-N 405.495 2.173 10 20 HECD CC(C)CN(C(=O)/C=C\c1cnn(C)c1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 917109374 LVAJJCDVIFJTJM-KTKRTIGZSA-N 422.489 2.015 10 20 HECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 918079955 NMFZUTKCUUXCGA-QGZVFWFLSA-N 403.866 2.251 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CN3CCCC3=O)cc2F)C[C@H](C)O1 918099014 HSPBHYPUAPCIEQ-PMPSAXMXSA-N 406.502 2.249 10 20 HECD Cc1cccc2c1N(C(=O)C(=O)NCc1ccc(N3CCC(CO)CC3)cc1)CC2 918443662 XQHVFBKALWLYOY-UHFFFAOYSA-N 407.514 2.409 10 20 HECD Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805006937 FEZTVFUDCSQTQV-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(c1cc(-c2ccccc2)[nH]n1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250387 SFLJFAMBJAKSJE-UHFFFAOYSA-N 419.441 2.014 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1 1844478252 QKGFZFXVZCOIEA-UHFFFAOYSA-N 420.425 2.279 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(-n3cnnn3)cc2)cc1 109701721 XHFZHLNXEHAQCB-JOCHJYFZSA-N 420.517 2.479 10 20 HECD Cc1ccc(C(=O)OCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c(O)c1O 727005083 FRZPPHLJGYWSDI-UHFFFAOYSA-N 412.442 2.115 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NCC(C)(C)CN(C)C)CC2)cc1 727069869 LQSIZSYHSBJFHB-UHFFFAOYSA-N 421.655 2.259 10 20 HECD O=C1N[C@H](c2ccc(N3CCOCC3)c(F)c2)Nc2ccc(N3CCOCC3)cc21 727463712 LFWHZVNFCAWXKH-OAQYLSRUSA-N 412.465 2.353 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)c(F)cc1[N+](=O)[O-] 727710503 OCHJJRSECSONAZ-UHFFFAOYSA-N 411.386 2.360 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(CC2CCOCC2)CC1 737037576 PKQDHXTYSDFQDK-UHFFFAOYSA-N 418.607 2.494 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(OCCN2CCCC2)CC1 745948859 XXBIWUHKOXZMEX-UHFFFAOYSA-N 402.583 2.288 10 20 HECD CNC(=O)[C@H](C)CN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 747967791 YKMPGZLVVXEGBI-ZIAGYGMSSA-N 407.470 2.103 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCN(C2CCCCC2)C1 748846538 QYLSNKNXMUDFOD-IBGZPJMESA-N 419.591 2.192 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc(S(N)(=O)=O)c1C 751294901 SIEIVQJLOOHGJT-GOSISDBHSA-N 418.515 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(F)(F)[C@H](C)C3)CC2)cc1 753027065 YYFYYRGRFUGITF-KXPUMZMLSA-N 407.461 2.404 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@]3(C)CCO[C@H]3C3CC3)CC2)cc1 753132753 NVRAOOJSCZKJBB-RBBKRZOGSA-N 402.539 2.074 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 753871265 IEANEGIUUROTMS-OALUTQOASA-N 410.536 2.017 10 20 HECD NC(=O)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 753941179 QBXJQMDAVVYNNZ-AWEZNQCLSA-N 419.432 2.250 10 20 HECD CCn1nc(C)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 754480990 CSKPNYVJYPIJPN-KRWDZBQOSA-N 400.479 2.372 10 20 HECD COc1ccc(O)c([C@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1 756593408 YXONWCTYQXIQMD-INIZCTEOSA-N 419.547 2.188 10 20 HECD COC(=O)[C@@H]1CCCC[C@]1(C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 759841612 AUNGYENPAIHJBO-UGKGYDQZSA-N 403.523 2.055 10 20 HECD CCN1CCN(CCCCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 761053437 XOFIQXTUHPFVCR-UHFFFAOYSA-N 408.930 2.228 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCSC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 762024026 JGWSXCANMGXSMJ-CQSZACIVSA-N 422.528 2.221 10 20 HECD Cc1noc(C2CN(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C2)n1 765468762 YCXVRGDJAHKSDH-BETUJISGSA-N 403.458 2.440 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1 765879330 FAYLEBVBFRSWPK-QFIPXVFZSA-N 424.545 2.330 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)Nc3ccc(O)cc3C(C)=O)ccc2O1 766047809 LCNSKYNAWXSLKX-SFHVURJKSA-N 405.428 2.262 10 20 HECD NC(=O)[C@H]1CCCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769958448 QMUQIKCHRYOLEU-GXTWGEPZSA-N 423.516 2.028 10 20 HECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 771233542 IOZUSOCRMZDJSK-FUHWJXTLSA-N 418.538 2.308 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)Cc3ccccc3Cl)cc2)C1 772319708 RNYYRCSTQACBIF-XLIONFOSSA-N 415.921 2.262 10 20 HECD O=C(Nc1ccc(F)cn1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 773670281 RDYGCVJRFMOJPQ-OAHLLOKOSA-N 406.845 2.299 10 20 HECD CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 774619586 GOEKBDWPYDQVDF-UHFFFAOYSA-N 419.864 2.089 10 20 HECD C[C@H](CNCc1cc(Br)cc(Br)c1O)S(C)(=O)=O 776253248 UGBAVKICQOQBMO-SSDOTTSWSA-N 401.120 2.440 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4C(=O)CCC4=O)cc3)c2)CC1 781048441 WMPHOOXLNDOIGR-UHFFFAOYSA-N 420.469 2.261 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 785439808 VTJNHPBBWDBQBI-UHFFFAOYSA-N 408.546 2.322 10 20 HECD CCNC(=O)Nc1ccc(C)c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 787703135 SMYRNWZBJNPFTC-UHFFFAOYSA-N 406.464 2.466 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1C(N)=O 789370596 QQSQRAWARBKJIN-UHFFFAOYSA-N 412.490 2.236 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789846791 QNASIFPCRBFXHU-AWEZNQCLSA-N 416.547 2.381 10 20 HECD C[C@@H]1CN(c2ccccc2F)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 789870388 OHSNFCVAOPWINV-CYBMUJFWSA-N 407.467 2.254 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1 792702392 RZJWCNIHJGJGLM-UHFFFAOYSA-N 414.530 2.356 10 20 HECD C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N(C)C)c(F)c1 801798242 SGTSIBOQUVKRJG-OAHLLOKOSA-N 422.526 2.448 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 802553630 QBHDPWKMTIVKQM-UHFFFAOYSA-N 409.364 2.211 10 20 HECD COC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309650 BTLPUKCNLUKOJE-VQIMIIECSA-N 415.490 2.106 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCCO[C@@H]2CCOC2)cc1)C1CCCCC1 803680168 ZHVHQFZUAYOKPX-OAQYLSRUSA-N 417.550 2.384 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(N(C)C)cc1 807670012 AYVZYEVPGBMBCR-HOCLYGCPSA-N 415.925 2.373 10 20 HECD COCC(=O)N1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 918409484 MNXVBURCDNNVAO-UHFFFAOYSA-N 409.446 2.358 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C(C)(C)C)CC3)cc2F)C[C@H](C)O1 1317929413 KZMHJCCAZQOVOW-ROUUACIJSA-N 420.573 2.472 10 20 HECD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CC1 1823497389 YHBLRVVISOOUJP-GFCCVEGCSA-N 421.548 2.062 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)C2CCC(CO)CC2)C1 1841906240 JVXAFCDTGZYVFG-UHFFFAOYSA-N 422.909 2.367 10 20 HECD COc1ccccc1-c1nnc(SCC(=O)NCc2ccc(N(C)C)cc2)n1N 18410413 KGLGNZBSQWOFJB-UHFFFAOYSA-N 412.519 2.142 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCOc3ccc(F)cc3)CC2)cc1 29150666 ZPEXFCVTLWRHMG-UHFFFAOYSA-N 401.482 2.494 10 20 HECD CC(C)CCC[C@H](C)NC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 138501419 VYJIUBWWMHEJJL-ZDUSSCGKSA-N 400.497 2.252 10 20 HECD O=[N+]([O-])c1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCCC3)cc1)OCCO2 728292273 ADRFRXHEEXHLLZ-UHFFFAOYSA-N 419.459 2.445 10 20 HECD CN(CCN1CCN(C(=O)OC(C)(C)C)CC1)C(=O)NCc1ccc(N(C)C)cc1 729493380 XCKOHMWHQABEAK-UHFFFAOYSA-N 419.570 2.447 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 734017034 XWIBCJWEBGNRRK-KURKYZTESA-N 400.475 2.383 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCCC4)cc3)ccc21 735650807 SOWJXTYAAQTHDM-UHFFFAOYSA-N 420.513 2.242 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3cc4c(cc3F)NC(=O)CC4)n2)cn1 743049512 HXHWUXKHRLXSGR-UHFFFAOYSA-N 407.452 2.368 10 20 HECD C[C@H](O)C[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 752147599 PPQBAYDDKOSSPQ-IMBTUZDBSA-N 407.530 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1F 753740050 LXWFDFBADAYCIF-UHFFFAOYSA-N 407.467 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC2)cc1F 753841398 SUIJHTPIYCRPOR-UHFFFAOYSA-N 421.494 2.270 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)[C@@H](C)c3ccccc3)nc12 759553580 DVGYNXDTUUQSIQ-ZSEKCTLFSA-N 413.430 2.210 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccccc3C)CC2)cc(OC)c1OC 759877341 GNQVBUGLSFBALP-UHFFFAOYSA-N 413.518 2.459 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)CC3)cc2F)C[C@@H](C)O1 760158228 GKXOOFIYFHYVAV-CALCHBBNSA-N 422.545 2.037 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CSc3ccccc3OC)nc12 763791102 NWRXIAQCNJHJHW-UHFFFAOYSA-N 417.443 2.456 10 20 HECD CN(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)cc1 765002420 IFFCGURXHLBTND-OAQYLSRUSA-N 410.518 2.022 10 20 HECD COC[C@H]1CCCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 768255768 IYMNNAHXZBXFLV-RBUKOAKNSA-N 402.539 2.346 10 20 HECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c1 768549607 TXNOEMGRXJKYAK-UHFFFAOYSA-N 411.568 2.418 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(OC)cn3)cc2F)CC1 770531925 CPQFZAONHVJTTL-UHFFFAOYSA-N 401.486 2.371 10 20 HECD COc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1F 770721069 PCYFVPVSHNYJIM-UHFFFAOYSA-N 401.438 2.268 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2 774362683 CZLQMWPQPBHWKM-UHFFFAOYSA-N 406.442 2.070 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3cnc(C)s3)CC2)cc1 778388992 BHYWUPHBYAZLSC-FPLPWBNLSA-N 414.531 2.024 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(F)c3)cc2)CC1 786122252 OUPOQCOKALEBBO-UHFFFAOYSA-N 409.458 2.112 10 20 HECD COCCc1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 786285358 FNQGMIVKUANVHS-UHFFFAOYSA-N 411.502 2.309 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@H]1CCCc2occc21 788629961 YCGQFLJWTJXXCN-SFHVURJKSA-N 415.465 2.190 10 20 HECD CCO[C@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 788744714 ZNOUIMVCQHOERN-SIKLNZKXSA-N 423.529 2.152 10 20 HECD C[C@H]1C[C@@H](C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789835086 NYTUIJQUWLVGEQ-QLPKVWCKSA-N 405.514 2.344 10 20 HECD COc1ccc(CCC(=O)N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)cc1 790069772 SKYWQEOLACAZFX-UHFFFAOYSA-N 402.422 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)CC2)cc1 794184893 KCSAJPAXYKFIDL-BWTSREIZSA-N 401.507 2.457 10 20 HECD Cc1ccc(-n2cnnc2)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 797836317 JYTFNKMEHJYYMS-GOSISDBHSA-N 418.501 2.207 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(C(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 799764996 AFLFVPZZMIWPSH-INIZCTEOSA-N 417.531 2.265 10 20 HECD COCCn1c(C(C)C)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802377793 PLQGKRQRAHYIPR-UHFFFAOYSA-N 419.526 2.400 10 20 HECD CC(C)C[C@@]1(CO)CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306216 RRHFHGRGMAJKNI-WZONZLPQSA-N 417.550 2.100 10 20 HECD O=C(NC[C@H]1CCCS1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450234 FKLUSADKYTULOX-MRXNPFEDSA-N 413.490 2.385 10 20 HECD C[C@@H](OC(=O)[C@@](C)(O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 805581644 ZLYKKLGBZVEGJZ-SPSFWMDKSA-N 407.422 2.493 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 806457404 LIULXKZNCQOZRA-LSDHHAIUSA-N 419.419 2.365 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N=c3ccnc4n(C)[nH]cc3-4)cc2F)C[C@H](C)O1 806480482 NJBOECDTODECQQ-KBPBESRZSA-N 412.469 2.416 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCO1 807972071 HPTPMOBSCZEEGG-ZIFCJYIRSA-N 404.507 2.221 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O 808185710 COOKBZRCGMGVBR-FQEVSTJZSA-N 414.550 2.151 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](O)c3ccc(Cl)cc3F)CC2)cc1 813426562 ISJUUFQJMKGKSU-FQEVSTJZSA-N 421.900 2.460 10 20 HECD CCOCC(C)(C)CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 813881469 YIEKVWWMVWPNBH-KHPPLWFESA-N 403.523 2.079 10 20 HECD CCNC(=O)[C@@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 814363041 GCJACEWEDYGXPN-KHYOSLBOSA-N 408.518 2.399 10 20 HECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 819427205 JFMWVZKRMAVOOJ-AWEZNQCLSA-N 403.460 2.344 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)CCc1ccccc1 1116927308 XQICJPJVDMBTJV-JTSKRJEESA-N 401.459 2.072 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 1320416977 JZKWSHNDQIUBEW-KRWDZBQOSA-N 403.508 2.165 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 1324765329 YIOAZISSDOIJEY-UHFFFAOYSA-N 419.503 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(C)nc3C3CC3)CC2)cc1 1344536197 VWAXFFLVDYJHAN-UHFFFAOYSA-N 410.474 2.177 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H]3CCN(C)C[C@@H]3c3cnn(C)c3)CC2)cc1 1355457609 OSFDBNBCEPPDHZ-FCHUYYIVSA-N 411.550 2.203 10 20 HECD CCO/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848297 CGMYPWKCMWOVTQ-IZPAUZPXSA-N 401.423 2.072 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848464 LHLUVTVWWKQZBI-SNVBAGLBSA-N 415.784 2.353 10 20 HECD O=C([C@H]1CC=CCC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442464 LSSLEURUMWADFP-KRWDZBQOSA-N 406.486 2.339 10 20 HECD COCCOCc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729062773 DRFXPQBFVHWXSH-CQSZACIVSA-N 402.447 2.380 10 20 HECD Cc1cc(C(=O)N2CCN(C(=O)c3ccc(O)nc3)CC2)c(C)n1-c1ccccn1 729363917 UNISVQQCFVHIFK-UHFFFAOYSA-N 405.458 2.188 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(CCOC)CC(F)F)cc2F)CC1 730133522 XCECFPCFBGKNCB-UHFFFAOYSA-N 402.461 2.391 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@@H]2[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730261358 IGXLDLGGISUFHS-OXJNMPFZSA-N 419.547 2.160 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3[nH]cc4c(=O)ncnc3-4)c2C)cc1 730655695 ASQYQTDTAZXCKU-UHFFFAOYSA-N 419.441 2.213 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1F 731404323 AMIYYLBIAIASLF-UHFFFAOYSA-N 414.547 2.143 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c1 734017595 PWCIGARTJNIWTA-INIZCTEOSA-N 418.515 2.426 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1 734533846 XMALPTXOCQSETC-UHFFFAOYSA-N 404.536 2.456 10 20 HECD COc1cc(Br)cc(CN[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1O 742390980 XYHNUULNAMPKOS-QMTHXVAHSA-N 409.284 2.180 10 20 HECD COC(=O)Cn1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 743165108 BZDPERQIBDIBIP-KBPBESRZSA-N 419.457 2.131 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)cc3)cc2)C1 746371975 CTIWJNFPZYDEMM-FQEVSTJZSA-N 422.529 2.155 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3c3cc(C)no3)CC2)cc1 754009177 ZJUIDIWENUEMCR-FPOVZHCZSA-N 400.523 2.312 10 20 HECD CN1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C(C)(C)C1=O 755596171 JZQUWNDNDYHLGS-UHFFFAOYSA-N 421.409 2.063 10 20 HECD C[C@@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756440390 COOJRRUXFJFUBH-PKOBYXMFSA-N 415.559 2.340 10 20 HECD C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)cc(F)c1O 756564309 SFVZJDCSWVGHLA-NSHDSACASA-N 423.348 2.453 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(-c4ccccc4)n3)CC2)cc1 758164351 WGYGLUWSMQOGPD-UHFFFAOYSA-N 420.517 2.218 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccnn1-c1ccccc1 768021629 TUHBJUCKPPFJQT-UHFFFAOYSA-N 423.448 2.103 10 20 HECD O=C(Nc1cccc(-n2ccnn2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 768713303 JNPKGMLQRGFHKE-IBGZPJMESA-N 421.457 2.119 10 20 HECD C[C@@H](CCN1CCN(C)CC1)NC(=O)NCc1ccc(N2CCSCC2)cc1 770344445 KSYBLDPJMAJACG-SFHVURJKSA-N 405.612 2.065 10 20 HECD C[C@H](NC(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1)c1ccccc1 770959984 NBUVDEJUJXPVLU-LBPRGKRZSA-N 416.459 2.234 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N(C)C)c(F)c2)s1 772606360 VYTDZFHEABZQTC-UHFFFAOYSA-N 414.528 2.039 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnn(CC(F)(F)F)c3)CC2)cc1F 772832369 WYFUQFYWUANARB-UHFFFAOYSA-N 422.404 2.104 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1C 773823965 NBVBMDLUNJKZEG-UHFFFAOYSA-N 409.408 2.479 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1)O[C@H](C)C2 774362897 HDAYTVAXRJSXIL-GFCCVEGCSA-N 400.431 2.117 10 20 HECD CCCN(C(=O)NCc1ccc(N2CCSCC2)cc1)[C@H]1CCS(=O)(=O)C1 776038424 XTLMJPQPSQEFKT-SFHVURJKSA-N 411.593 2.349 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3F)cc2)CC1 786660806 KJFQEMYRQAGZIU-UHFFFAOYSA-N 400.410 2.332 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](C)[C@H]1OC 788321329 UVNWJBDECDOHNP-PWIZWCRZSA-N 417.550 2.095 10 20 HECD Cc1csc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 788604380 IMICPUIDHSMFAW-INIZCTEOSA-N 403.504 2.024 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N(C)C)Cc3ccccc3C2)cc1 788950269 GEXMHBFZJMYXKP-UHFFFAOYSA-N 422.573 2.364 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C 790911855 SMUPILFQBBWMKY-KRWDZBQOSA-N 413.522 2.367 10 20 HECD Cn1[nH]c(C2CCN(C(=O)OC(C)(C)C)CC2)nc1=NC(=O)c1cccc(O)c1O 792671631 VCGABXWMXCIFSE-UHFFFAOYSA-N 417.466 2.015 10 20 HECD COc1ccc(CNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c(O)c1 794376141 CNAIAPIOLNEHEL-UHFFFAOYSA-N 406.504 2.311 10 20 HECD CC(C)(C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCOCC1 796430248 KDDYVJLHUKOPRH-UHFFFAOYSA-N 422.497 2.275 10 20 HECD CC[C@@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(F)cc1O 796693799 JHVNPQCBDZGVCJ-GOSISDBHSA-N 422.526 2.119 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](OCC2CC2)C1)c1ccc(N2CCOCC2)cc1 803299600 MBMLCNWNSGXYCF-UTKZUKDTSA-N 415.534 2.118 10 20 HECD COCCN(CCOC)C1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 806635037 NFPNRXIZLNSSKI-UHFFFAOYSA-N 418.582 2.338 10 20 HECD CC(C)c1ccnc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 807673338 QYXFNVGBDVPIPY-KRWDZBQOSA-N 424.549 2.192 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 814994689 WGLCZEMLGJEYKW-BZUAXINKSA-N 400.516 2.285 10 20 HECD O=C1c2ccccc2C(=O)N1CCOCCS(=O)(=O)Nc1ccc(O)c(Cl)c1 821191229 KGJHAPIZCITCPD-UHFFFAOYSA-N 424.862 2.100 10 20 HECD O=C(COC(=O)c1c(O)cccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 920732913 FUTQQNQHUFZYBZ-UHFFFAOYSA-N 422.840 2.495 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@@H](C)N2CCN(c3ccc(OCC)cc3)CC2)CC1 1319612694 NQFCGYLOGSNLNE-GOSISDBHSA-N 417.550 2.398 10 20 HECD C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319684594 YKZNLAMFXVCGDA-INIZCTEOSA-N 420.554 2.418 10 20 HECD O=C(CNC(=O)c1cc(Cl)ccn1)NCc1ccc(N2CCSCC2)cc1 1337554105 FXRVGFTVMPKPBZ-UHFFFAOYSA-N 404.923 2.334 10 20 HECD Cc1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)[nH]1 1800712673 PWTUZISJWFZWSC-CLLJXQQHSA-N 404.854 2.348 10 20 HECD CC(C)O[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546400 DPIRUMIAPMWECV-OAHLLOKOSA-N 405.495 2.151 10 20 HECD CCc1oncc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842549342 WRAAKIFNJJYFSD-UHFFFAOYSA-N 405.838 2.432 10 20 HECD Cc1cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c2[nH]1 1843249540 WCWZZGDBNOSRFW-UHFFFAOYSA-N 406.442 2.413 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc(C)c3)CC2)cc1 12069004 NZNAGFVQBCUZBW-UHFFFAOYSA-N 403.548 2.494 10 20 HECD C[C@@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ncccn1 14076806 VZAJYGQCCJYCAO-GFCCVEGCSA-N 401.378 2.436 10 20 HECD CN(C)C(=O)COc1ccccc1/C=C1\SC(=S)N(CCCC(=O)O)C1=O 63454109 BXKZLDVZFMPZMI-UVTDQMKNSA-N 408.501 2.220 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 115733305 SEBFPQLDQUHNMB-KRWDZBQOSA-N 403.504 2.158 10 20 HECD COc1ccc(N2CCN(c3cc(N4CCC[C@@H](CO)C4)ncn3)CC2)cc1F 301535378 ACWVUASWPIIGQR-MRXNPFEDSA-N 401.486 2.160 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CC[C@H](C(=O)N(C)C)O3)ccc21 537128009 PUIUEVUAKFLKMK-FXAWDEMLSA-N 401.507 2.270 10 20 HECD COC(=O)CCNC(=O)c1ccc(NC(=O)NCc2cccc(OC)c2O)cc1 729552066 AWYODUFXBXMDOS-UHFFFAOYSA-N 401.419 2.015 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N(C)C 730279216 LNCPZWVZYLOZRU-FQEVSTJZSA-N 414.529 2.145 10 20 HECD CC1CCN(c2ccc(CNC(=O)Cc3ccc(S(N)(=O)=O)cc3)cc2)CC1 731053451 POPWAHBJJIVISI-UHFFFAOYSA-N 401.532 2.429 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1 734072470 BHLNATVLTFXONM-UHFFFAOYSA-N 419.865 2.146 10 20 HECD Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740610223 UIZMYVKLSDKQKE-UHFFFAOYSA-N 418.475 2.406 10 20 HECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NCc2cc(OC)ccc2O)cc1 743220587 HYNZUMRSUGACMB-CYBMUJFWSA-N 415.446 2.404 10 20 HECD COCCN(C)CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594330 UBWJVNJSCFNYHK-HNNXBMFYSA-N 400.470 2.134 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)CC(C)(C)C)CC2)cc1 746313134 YWLQIPVZBHAPCT-GOSISDBHSA-N 406.571 2.304 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2 749629941 VPKHJWCDBJTEOO-UHFFFAOYSA-N 422.485 2.005 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 750823912 ABUREFPPQKXYRN-UHFFFAOYSA-N 422.445 2.211 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)C[C@H](O)C(F)(F)F)cc2F)CC1 758468237 OEURNUMBYBISKM-INIZCTEOSA-N 406.424 2.032 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)[C@H]3CCCOC3)CC2)cc(OC)c1OC 759295967 CDAYFBUBCSXJRK-HOTGVXAUSA-N 407.511 2.359 10 20 HECD CCCS(=O)(=O)NC1CCN(C(=O)NCCCSc2nccs2)CC1 759589619 BOMQQIDPWREDRL-UHFFFAOYSA-N 406.599 2.129 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@H](Cc4ccncc4)C3=O)cc2F)C[C@@H](C)O1 761097526 JCMMCGFBWPRIJM-SPYBWZPUSA-N 412.465 2.497 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)o1 766205876 AKUYKDAZMNBSSP-UHFFFAOYSA-N 404.238 2.403 10 20 HECD CCCCn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)n1 771235142 QZORUCUNJZSPMW-UHFFFAOYSA-N 404.536 2.156 10 20 HECD Cc1cc(C(=O)CN2CCCN(C(N)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 772722547 LGHGNBQVHIKSHK-UHFFFAOYSA-N 412.490 2.134 10 20 HECD COC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)c(F)c1 774025332 QOFSMHMCXGFKKP-HNNXBMFYSA-N 400.403 2.159 10 20 HECD CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775255442 QMJPFTBPZUPOBF-JPYJTQIMSA-N 409.530 2.490 10 20 HECD C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 775836544 NADVBDYDWKNGAN-PMPSAXMXSA-N 418.563 2.317 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CC3(Cl)Cl)CC2)cc1 778238859 QNEOJSXYMGREEX-AFNCTOJWSA-N 412.317 2.210 10 20 HECD CN(CC1(N(C)C)CCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 782946159 JUMZJLDMZDFKHZ-GOSISDBHSA-N 401.555 2.014 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(Br)cn1 785423292 VQNNIEVJARFBRT-LBPRGKRZSA-N 405.296 2.404 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCC(C)(C)CO 787041601 SUZQAQCVJJALMT-UHFFFAOYSA-N 415.328 2.418 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 788324882 ZEHRTCKDDMJHRE-VXKWHMMOSA-N 423.513 2.176 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccnc2-n2ccnc2C)cc1 788967124 VXQYKNWCFDVNTJ-UHFFFAOYSA-N 420.517 2.355 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061048 JLWFFXFTDYDNNB-QGZVFWFLSA-N 415.456 2.386 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cncc(-n4ccnn4)c3)cc2F)C[C@@H](C)O1 801663299 MWHYJUUKJLQPGB-GASCZTMLSA-N 410.453 2.345 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(N(C)C)nc3)cc2F)C[C@H](C)O1 804958020 GPTMNXUUUIIMKP-GJZGRUSLSA-N 422.526 2.379 10 20 HECD CCCN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806496604 ZYQWKHGWCGNXMW-ICSRJNTNSA-N 401.555 2.062 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)c3ccc(Cl)cc3F)nc12 811368766 FIRFOWCNCOJLTC-OAHLLOKOSA-N 423.784 2.181 10 20 HECD C[C@]1(C2CC2)NC(=O)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1=O 916592284 WAZVJBLPPCBUPB-HSZRJFAPSA-N 417.421 2.121 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 918324825 ZGLSTVKPWMSESJ-AWEZNQCLSA-N 424.469 2.280 10 20 HECD O=C(CCC(=O)c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918337556 ADKFZPQHHMVTEC-UHFFFAOYSA-N 400.500 2.201 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Cn2ccnc2)c1 918338146 VGPIAIYMSMZSEP-UHFFFAOYSA-N 424.526 2.096 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C 920927415 XLDRVMBVEUMHBF-INIZCTEOSA-N 424.501 2.007 10 20 HECD CNC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 1334421300 VPIJLHXJXNZYHE-UHFFFAOYSA-N 414.481 2.059 10 20 HECD CC[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1805375963 MLZNDHGLMPLPPS-OAHLLOKOSA-N 410.898 2.367 10 20 HECD C/C=C/C(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814165395 FLTKNDZJGCDBRT-UFHXMZQXSA-N 423.469 2.494 10 20 HECD Cc1[nH]ccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817726709 UMTJOKVIGDXTBT-LLVKDONJSA-N 413.459 2.125 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)[C@]1(F)CCCCC1(F)F)C2 1843249513 RZLKQUVPYZBYNX-GOSISDBHSA-N 413.396 2.227 10 20 HECD O=S(=O)(c1ccc(Cl)s1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 23843294 LYAQAUZCWSYMDX-UHFFFAOYSA-N 416.908 2.342 10 20 HECD Cc1ccc(CC(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cc1 725811397 FJOHKTOYLHZFPH-UHFFFAOYSA-N 422.573 2.406 10 20 HECD CNC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 732207010 KANKKKRSNAJIIF-LSDHHAIUSA-N 419.481 2.247 10 20 HECD CNC(=O)C1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCCC1 734000490 YPDKMWHZWSASRV-UHFFFAOYSA-N 405.454 2.049 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n(C)n1 737117041 HHFOHIUILOMOSV-UHFFFAOYSA-N 413.522 2.052 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 740904399 BFYLIDHYGJTMCT-UHFFFAOYSA-N 414.531 2.149 10 20 HECD CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1 741211181 AMRRRUAUTIVJAL-IBGZPJMESA-N 402.539 2.217 10 20 HECD CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743955908 MZABPHSAOPSOGV-UHFFFAOYSA-N 416.499 2.071 10 20 HECD CCOc1ccc(N(CC)CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 746159145 PCQXEGZLAJYRIX-UHFFFAOYSA-N 402.495 2.444 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCNC(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 749420815 NSCILUSXTSCPCK-HUUCEWRRSA-N 408.518 2.401 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)s1 753643292 HMQWDCRHOUXIGP-WFASDCNBSA-N 424.544 2.368 10 20 HECD CCN1CCN(CCCCNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753849658 IBIKGLDRMLPXFK-UHFFFAOYSA-N 421.561 2.084 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(Cl)cc3C(N)=O)CC2)cc1 758222042 DGSBJKZGVMUQNJ-KRWDZBQOSA-N 419.909 2.009 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc(Cl)nc3)cc2)C1 760819017 ZVSWHSMGLLFJES-QGZVFWFLSA-N 415.925 2.479 10 20 HECD Cc1cc(C(=O)CN2CCOC(C)(C)[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 763627506 KGKXMVDPJCDTBT-INIZCTEOSA-N 419.547 2.424 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1c[nH]nc1-c1ccccn1 765902897 FTJFPPXFQUJEGP-UHFFFAOYSA-N 416.235 2.195 10 20 HECD O=C(COc1c(F)cccc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 766394117 XXPXSLRZLJFJKE-UHFFFAOYSA-N 407.373 2.405 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cc(Cl)ccc2OCC(N)=O)cc1 766759958 WNQMLSWCKVCRQZ-UHFFFAOYSA-N 411.911 2.091 10 20 HECD COc1cc(CN2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc(OC)c1 768463734 LRUQRROXIIXWAV-NRFANRHFSA-N 400.475 2.153 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc([N+](=O)[O-])c2)cc1Cl 768866435 QYKHGICXBJRIBR-UHFFFAOYSA-N 411.870 2.482 10 20 HECD C[C@H](NC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1)c1ccc(N2CCOCC2)cc1 771462571 USDGCMYRADOSOP-INIZCTEOSA-N 422.489 2.290 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773020577 PLPZVWRLZWEMHF-IPJUCJBFSA-N 405.539 2.268 10 20 HECD C[C@H](NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccc(N(C)C)cc1 773023851 KSWJBLDYBZEZOT-WNSKOXEYSA-N 406.486 2.323 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c1O 774819759 RGNBKHUUCONXIH-UHFFFAOYSA-N 418.425 2.204 10 20 HECD COC(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 775665433 BCAYLRYBSKFECB-SFHVURJKSA-N 409.486 2.034 10 20 HECD C[C@H](NC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 776127049 KLTLBSPULYCGNZ-SFHVURJKSA-N 424.549 2.247 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](O)CCc1ccccc1 784222159 LQOUKFUUMXSSSV-IBGZPJMESA-N 401.482 2.455 10 20 HECD COC[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)O1 784370229 JRTGVMDTGDSULH-GDBMZVCRSA-N 408.454 2.136 10 20 HECD COc1ccc(COCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786257149 NLZKQAHFQOJNKJ-UHFFFAOYSA-N 411.502 2.197 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1N1CCNC1=O 787499305 DMZHDEFHGADGCF-UHFFFAOYSA-N 422.485 2.364 10 20 HECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N(C)c1ccccc1 787635739 GAAUJILHRJTQFD-RBUKOAKNSA-N 424.545 2.342 10 20 HECD COc1cccc(/C=C(/C(=O)N2CCOc3cc(N(C)C)ccc32)n2nnnc2C)c1 789653112 XRLCVOLAIVJSGD-MOSHPQCFSA-N 420.473 2.480 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(N2CCSCC2)CCCC1 789705687 MTXZIJAXNANSJO-UHFFFAOYSA-N 418.607 2.189 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789860469 LTHQPBIZXPJLAJ-MJGOQNOKSA-N 405.564 2.176 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(N4CCC4=O)c3)cc2)C1 790576648 NJQGPSJFEZTIME-KRWDZBQOSA-N 421.501 2.447 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C 790958179 LFKORQVJBSEMQS-INIZCTEOSA-N 400.479 2.397 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(-n4ccnc4)c(F)c3)ccc21 793916038 VOKNBJAZONBUQA-UHFFFAOYSA-N 421.476 2.326 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 801549465 PECYYDXPXFLHQD-NRFANRHFSA-N 417.550 2.234 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)NC1CCN(CCS(C)(=O)=O)CC1 802139467 CLGMSCQNLZKSDD-UHFFFAOYSA-N 411.568 2.213 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOCC4(CCCC4)C3)CC2)cc1 804315260 JALJUNGXSLTTAM-UHFFFAOYSA-N 415.534 2.199 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)cc1F 804853447 YDGHWYPMORHXMD-PONJGIIJSA-N 421.513 2.083 10 20 HECD C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806495576 IAYPCKSQKFIMNV-QFUCXCTJSA-N 413.566 2.157 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287713 MJZDHDMZNOSYKH-GFRNBQLOSA-N 411.546 2.467 10 20 HECD COCCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290750 NHDAYLXBKRFEBA-UHFFFAOYSA-N 423.513 2.329 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 810183484 YFTWPSNUTXKHQQ-IBGZPJMESA-N 409.486 2.495 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(OC)c(S(N)(=O)=O)c1 812429246 ICQPLUUAAUSHJV-UHFFFAOYSA-N 420.535 2.140 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)c3cccc(F)c3)CC2)cc1 913203915 QVTCJKYOPIYELI-UHFFFAOYSA-N 412.509 2.356 10 20 HECD CC(C)n1nnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917200955 VWFKKKNGGQAGMW-KBPBESRZSA-N 422.530 2.415 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)OC[C@H]3CCCCO3)CC2)cc1 921166906 SDXVQTLAWIWMGP-DENIHFKCSA-N 419.566 2.298 10 20 HECD CC(=O)c1ccc(OC[C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 922480957 RCAKYLWTRHGHJD-OAQYLSRUSA-N 412.486 2.376 10 20 HECD Cc1nsc(N2CCCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1320510262 ULOYXMCBSZLYON-UHFFFAOYSA-N 404.559 2.450 10 20 HECD Cc1nocc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932544 IFVDRZVEGKYLNZ-ACHSLPGTSA-N 421.457 2.028 10 20 HECD CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898649 UQTMNHMDCJCTRN-HNNXBMFYSA-N 411.593 2.267 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2 1843249084 UTKDSTMLDCTNPO-UHFFFAOYSA-N 411.380 2.042 10 20 HECD CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845399408 WTAAOBBJZMXUFP-SFHVURJKSA-N 422.529 2.436 10 20 HECD Cc1nccn1[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502300 JKFWESVSCGQFFG-LBPRGKRZSA-N 418.881 2.334 10 20 HECD CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=S)Nc1ccc(C(N)=O)cc1 726476446 YUOIHRCPAWUUTK-UHFFFAOYSA-N 421.548 2.176 10 20 HECD O=C(Cc1csc(-c2nc[nH]n2)n1)NCc1ccc(N2CCSCC2)cc1 727767827 NPALHEAZGNJXOX-UHFFFAOYSA-N 400.533 2.340 10 20 HECD COCCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CC(F)F 728928903 LGLCZFROWWEVDC-HUUCEWRRSA-N 417.472 2.269 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(NS(=O)(=O)CC)CC2)cc1F 731364963 VVBFYYBCVSAGLH-UHFFFAOYSA-N 414.547 2.285 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1 735201081 ZIJZJWURISZZFP-UHFFFAOYSA-N 413.474 2.413 10 20 HECD CCn1nc(C)c(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)c1C 741650425 ZWSXTODOQSTBQK-UHFFFAOYSA-N 416.525 2.091 10 20 HECD Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2=O)n1 741741460 CLTNGYBIICKOAT-UHFFFAOYSA-N 424.530 2.056 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cn(Cc2cccs2)nn1 742557639 VMTWJZWSEGYZNB-UHFFFAOYSA-N 401.467 2.294 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 742917533 ZLPVRZAUSUNHFW-UHFFFAOYSA-N 402.426 2.295 10 20 HECD Cc1nn(C)c(=O)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 744373182 UGRIJZXPOKRUSO-CQSZACIVSA-N 406.433 2.397 10 20 HECD O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCC(O)CC2)c(F)c1 746010522 KLKAMIWQZLOHKE-UHFFFAOYSA-N 402.426 2.423 10 20 HECD Cc1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746039734 WAXODKOGTPJDDP-INIZCTEOSA-N 412.465 2.091 10 20 HECD COc1csc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 747084051 PWZJANMPRSAAJV-UHFFFAOYSA-N 408.451 2.206 10 20 HECD C[C@H](NC(=O)N1CCC(N2CCCNC2=O)CC1)c1ccc(N2CCOCC2)cc1 747958596 ZPSPNNMAXDNJGT-KRWDZBQOSA-N 415.538 2.174 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(C)C 749645626 AROCQPXSGGQHOD-UHFFFAOYSA-N 417.531 2.498 10 20 HECD Cc1cc(C(=O)CN2CCS(=O)(=O)C[C@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 749846428 ZLYPVKGCDFPPNF-OAHLLOKOSA-N 418.515 2.167 10 20 HECD COc1ccc(N(C)CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1Cl 757857227 PNXDZMUZRPTTNT-UHFFFAOYSA-N 408.886 2.317 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@]12CCCO2 759318195 HMTXLGHMQYLPJD-KCZVDYSFSA-N 421.513 2.313 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(-c4ccncc4)noc3C)nc12 759573583 FUPPMFRTONRHLL-UHFFFAOYSA-N 423.385 2.327 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)CN(CCc4ccccc4)C3=O)CC2)cc1 761184357 LLQGHCCORKGNLG-UHFFFAOYSA-N 422.529 2.324 10 20 HECD COc1ccc2c(c1)[C@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)CC2 761591755 AZQBBVPYXXLORE-HXUWFJFHSA-N 414.527 2.276 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@H]2CCNS(C)(=O)=O)c1O 768437713 DQGUGKYTPQXEBA-AWEZNQCLSA-N 421.357 2.457 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c(O)cc1C 768443129 PDAAIVPANMFPTG-UHFFFAOYSA-N 416.503 2.092 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1 776040629 JJAFPUMZCCANAZ-UHFFFAOYSA-N 401.316 2.321 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC(C)(C)c3nc(C)cs3)CC2)cc1 779222364 LGIFHEIYGWFGKS-GOSISDBHSA-N 404.580 2.468 10 20 HECD COCCCOc1ccccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295301 SSRGYNBEYLZAIP-CQSZACIVSA-N 402.447 2.199 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3F)cc2)CC1 786120611 PGTVKDYYGWSZSM-UHFFFAOYSA-N 405.495 2.114 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccnc(-n3cccn3)c2)C2CC2)cc1 787246242 TUTJHYFGDDAFFE-UHFFFAOYSA-N 418.501 2.141 10 20 HECD CCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 788718597 MYISQDQXRFKKMZ-UHFFFAOYSA-N 419.522 2.343 10 20 HECD Cc1nsc(C)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 795945328 VPHDKMCQBRRGPV-UHFFFAOYSA-N 407.467 2.209 10 20 HECD COc1ccc(CNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c(O)c1 797617936 XHKCKEVYSZWLQX-UHFFFAOYSA-N 409.439 2.402 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803301532 SOAVFYCSQXHYQV-LSDHHAIUSA-N 414.506 2.225 10 20 HECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 804083361 NWRRJEPDBMNYBL-IBGZPJMESA-N 424.545 2.362 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCCC34CCOCC4)CC2)cc1 804317220 WTHWHXDOVWODHC-FQEVSTJZSA-N 415.534 2.246 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3C3CCC3)cc2F)CC1 805006667 APMVQVSJPMTUBF-HXUWFJFHSA-N 416.541 2.375 10 20 HECD CN(Cc1nncn1C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 806443499 OYLHJQJIELIRIE-UHFFFAOYSA-N 412.416 2.012 10 20 HECD CN(C)CCN1CCC(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 916382551 IZQZYIRRWIZLTR-FQEVSTJZSA-N 404.555 2.109 10 20 HECD CNC(=O)[C@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccccc1 919077061 RKODAAOQPRVAKB-OAQYLSRUSA-N 420.469 2.249 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccc2F)c1 1255148227 HXDLMOVMQJVISB-INIZCTEOSA-N 413.405 2.327 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 1320436401 KATSZPHDILWYLZ-DIEDAUMRSA-N 400.387 2.310 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(CNC(C)=O)s3)CC2)cc1 1323149758 FSHWDMVZZGMUNO-UHFFFAOYSA-N 423.560 2.294 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)no1)c1cc(O)c(O)c(Cl)c1 1798891115 CRMKGKGPMJCTEC-JGPRNRPPSA-N 407.810 2.010 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799169392 OCKGJBOJKBFFQP-ROBVNOKSSA-N 408.882 2.001 10 20 HECD O=C(c1ccc(Cl)cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248671 CIJCIKUHOPTZBT-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(F)cc(F)c2F)C1 1846832252 GJJDRDZGUQFMPK-UHFFFAOYSA-N 407.348 2.041 10 20 HECD Cc1cc(C(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 726168126 MHQIKALTQMARBI-HSZRJFAPSA-N 417.469 2.474 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1C(=O)O 728015522 RQEDAHCOOCZGJJ-UHFFFAOYSA-N 404.853 2.211 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCOc4ccccc43)CC2)cc1 728357040 QOSPTSNFKIANBV-FQEVSTJZSA-N 410.470 2.453 10 20 HECD CCCN1C(=O)C(=O)N(CN(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 728904745 RUVLGXHWVDNARG-UHFFFAOYSA-N 400.401 2.275 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(C)cc2)c1 728943686 BICYTFYWEAFOSF-AWEZNQCLSA-N 407.492 2.048 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCOCC(F)(F)F)cc2F)CC1 730115240 RNOATJSYGRZNCJ-UHFFFAOYSA-N 406.424 2.346 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN4CCCC[C@@H]34)cc2F)CC1 730118791 MIEJGKXINSJPLS-FPOVZHCZSA-N 403.546 2.394 10 20 HECD COC(=O)CSCc1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 734073705 VTEJKRKEINLSTI-UHFFFAOYSA-N 418.471 2.062 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3ccc(F)cc3)cc2)C1 734942765 QYDHESTWAGOIDO-XLIONFOSSA-N 414.481 2.060 10 20 HECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 736632046 ZZNFHISJEYMCEM-UHFFFAOYSA-N 407.467 2.099 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1 737182337 GGFVUFKGMRSNCU-ZDUSSCGKSA-N 410.430 2.416 10 20 HECD CCN(CC(=O)N1CCC2(CC1)OCCO2)Cc1cc(Br)ccc1O 744426636 SESAONOAJYGJNR-UHFFFAOYSA-N 413.312 2.342 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCOCC1 746413776 JKNFAMKMYNVJJF-AZUAARDMSA-N 402.539 2.393 10 20 HECD Cc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 746782874 GQBPZDORJABQMU-STQMWFEESA-N 406.483 2.459 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 755011371 GYZJWYAQGUWXPM-UHFFFAOYSA-N 407.492 2.491 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)co1 755789089 INHRUIOCWXUACH-SFHVURJKSA-N 421.519 2.075 10 20 HECD COc1cccc(Cn2nccc2NC(=O)C(=O)N(C)Cc2ccccc2O)c1OC 756770671 RNPKOWIORUTULX-UHFFFAOYSA-N 424.457 2.251 10 20 HECD COc1c(F)cc(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 761034557 QUUYCOXQFZSZJU-UHFFFAOYSA-N 419.428 2.407 10 20 HECD CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NCc2cccc(Br)c2O)CC1=O 765728338 HVLUZRNOXZNUBH-LSDHHAIUSA-N 424.339 2.104 10 20 HECD CC(C)C(=O)NCCN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767775191 LRUDMXLXDSVASK-HNNXBMFYSA-N 421.497 2.493 10 20 HECD COC[C@H]1CCCCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 768662627 CWWYPBRIVIRAIG-GDWUOILNSA-N 415.534 2.175 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(C)c(C(N)=O)c3)c2)CC1 769848786 PHVFTGVDPVPCII-UHFFFAOYSA-N 402.520 2.037 10 20 HECD CCOC(=O)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 771601845 LGULKYNCRCSIGM-UHFFFAOYSA-N 424.500 2.328 10 20 HECD COCCS(=O)(=O)c1ccc(CNCc2ccc([N+](=O)[O-])c(OC)c2O)cc1 775118746 OUSLFXUFVOMLMW-UHFFFAOYSA-N 410.448 2.019 10 20 HECD C[C@@H](NC(=O)CCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 775406305 WSQXPORQHXTBBT-GOSISDBHSA-N 409.534 2.454 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H](CS(C)(=O)=O)c1ccccc1 775548722 JGYRLCTTWYKKKM-FQEVSTJZSA-N 403.548 2.087 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@]34CCOC4=O)cc2F)C[C@@H](C)O1 779531052 WHISKZLMWAVFEQ-VTJXTGGHSA-N 405.470 2.430 10 20 HECD COC(=O)c1cnc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 779676126 RMHRBNMQHNRZDX-AWEZNQCLSA-N 404.854 2.017 10 20 HECD COCCO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 780311065 DITBVWQYVDJTDN-JFIYKMOQSA-N 409.502 2.386 10 20 HECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785421490 CWKKMVMGLVJTJF-QAPCUYQASA-N 418.538 2.131 10 20 HECD CCC[C@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786656768 RECRJTYNBDIYKT-FXAWDEMLSA-N 414.550 2.008 10 20 HECD COCc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 787518514 JPKPRIZICOGGJU-QGZVFWFLSA-N 411.502 2.163 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H]1CCCO1 788882361 CDNJLIHMZYLBDV-ZDUSMZPESA-N 409.502 2.433 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3C[C@@H](C)O[C@H](C)C3)cc2F)C[C@H](C)O1 789835555 PORHZDDRYZIMOJ-WCVJEAGWSA-N 421.513 2.128 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSCC[C@H]3C)CC2)cc1 791897537 QVLKRJNBGXRCHD-IWAYRVGRSA-N 403.548 2.254 10 20 HECD CC(=O)OC(C)(C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792351310 QFPDYWPZWKERGK-UHFFFAOYSA-N 409.394 2.285 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N(CCO)Cc1cccnc1Cl 792907136 FTDAZXKVPZNBND-UHFFFAOYSA-N 404.898 2.276 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c(O)c1 797389059 NDAJSYRIBSIPRI-GASCZTMLSA-N 413.474 2.269 10 20 HECD CC[C@@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCCO1 798353928 DHYWOSLXNKFPAB-HXUWFJFHSA-N 404.555 2.418 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)cc1 799748685 ZWEZCQVHAAVVJZ-UHFFFAOYSA-N 412.309 2.093 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=S)NCCNS(C)(=O)=O)cc2Cl)C1 799898917 YVAFWFDKITZKOB-ZDUSSCGKSA-N 419.016 2.090 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCCC34CCOCC4)CC2)cc1 800437514 NOCBMTMUITUOEA-IRLDBZIGSA-N 403.567 2.117 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H](C)CO1 803450999 BEVRCPUCFSJLFZ-ZIAGYGMSSA-N 411.449 2.009 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)cc1F 803660886 IACAHCJYRPOHBF-KRWDZBQOSA-N 416.472 2.432 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@]3(CO)CC(C)C)CC2)cc1 804317064 RWAREAKHPPRLGX-HSZRJFAPSA-N 417.550 2.180 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@@H]3c3ccccc3)CC2)cc1 804317645 KUTZLJXVPFKBSH-JOCHJYFZSA-N 423.513 2.380 10 20 HECD Cc1nc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(Br)n1C 805022552 WEJUWTAVBNHGSI-UHFFFAOYSA-N 415.313 2.145 10 20 HECD Cc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 807291902 PQDFLEBDWVUUDJ-UHFFFAOYSA-N 404.514 2.336 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cn(Cc4ccccc4)nn3)no2)c1 809231987 ZNKYZMYLHNKNOP-UHFFFAOYSA-N 412.431 2.121 10 20 HECD Cn1nncc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 809296050 FQTWKWSZSRDREN-JYRVWZFOSA-N 407.546 2.174 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@](C)(OC)C3CC3)CC2)cc(OC)c1OC 812924791 QAHYYOVTGFAVCK-NRFANRHFSA-N 407.511 2.359 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccccc3)cc2)C1 917833131 MBIHHWKVOUHUCC-FQEVSTJZSA-N 422.529 2.215 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H]1CCN(CC(F)(F)F)C1 918208617 DDWBVBFNPSQKLE-HNNXBMFYSA-N 418.435 2.346 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1 919815963 VGPGDGVHOCANPR-UHFFFAOYSA-N 403.460 2.138 10 20 HECD CC(C)(CF)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1320652758 DTTPJRZXEQCPMD-UHFFFAOYSA-N 404.465 2.490 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC1(F)F)C1=NN(c2ccccc2)C(=O)C1 1797733907 KUICRBCXRIVUGN-SLBVQIDZSA-N 416.428 2.073 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCC1)C2)c1cc(O)c(O)c(Cl)c1 1799770332 NICUQAYQAPLXOD-ZSBFGKGUSA-N 408.882 2.145 10 20 HECD O=C(Cc1ccncc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820717868 YSUHYRZEAJLOFB-MRXNPFEDSA-N 422.445 2.160 10 20 HECD COC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824604355 QHYJXQNGYISJOM-PBHICJAKSA-N 405.495 2.009 10 20 HECD Cc1cnoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829553585 KHTSZHCNNFRGOL-INIZCTEOSA-N 414.462 2.336 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cc2)C1 727941056 QUYCDFUBGIBZAV-QZTJIDSGSA-N 410.522 2.201 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1 734064301 BYMALZWZVZOCAQ-QGZVFWFLSA-N 404.536 2.250 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3ccc(F)cc3)cc2)C1 734942767 QYDHESTWAGOIDO-YLJYHZDGSA-N 414.481 2.060 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)ccc1OC 739950183 VRZWWDJYFZLQBZ-UHFFFAOYSA-N 404.488 2.343 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 740472863 FLZVMDVRAMYXKN-IIBYNOLFSA-N 416.547 2.157 10 20 HECD CCC[C@H](O)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 740982570 NFHBCOIPAPMCCM-ZOBUZTSGSA-N 410.486 2.150 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c(C(N)=O)c2)NC(=O)OC(C)(C)C)cc1 742755027 UNSUPUJKVBMDOJ-KRWDZBQOSA-N 415.494 2.175 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)ncn2C)c1ccc(N2CCOCC2)cc1 743898378 HBJUTNFPPCHYHD-OAHLLOKOSA-N 407.474 2.226 10 20 HECD CN(C)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 746693684 ICCPZTLMPGNFBZ-MRXNPFEDSA-N 411.911 2.450 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)oc1C 751141434 BRDKVBQAIGUOJK-UHFFFAOYSA-N 418.475 2.486 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2)cc1 751259730 DNWBLTTYNDAKID-UHFFFAOYSA-N 406.489 2.330 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4CCOC4)CC3)cc2)C1 753120210 AUESBNRUJYYOQC-VQTJNVASSA-N 414.550 2.346 10 20 HECD Cc1oc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1S(=O)(=O)N(C)C 754013905 JMBORKUEMKZMLH-INIZCTEOSA-N 422.503 2.365 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cs1 754039737 FGOYKRGPAOBINQ-UHFFFAOYSA-N 414.480 2.193 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)co1 756022082 VKHFGIFNICWWBQ-MRXNPFEDSA-N 408.476 2.057 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc(OC)c1OC 759887805 XILKPXSUGOXVIW-IAGOWNOFSA-N 405.539 2.339 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 764894362 GBAVCGFWQFIUSN-LJQANCHMSA-N 411.506 2.292 10 20 HECD O=C(COCCNC(=O)c1ccccc1)NCc1cccc(Br)c1O 765750515 HOUJLWAPRZJMCQ-UHFFFAOYSA-N 407.264 2.218 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)cn1C 766199816 JHROXMRNPNFDFL-UHFFFAOYSA-N 417.281 2.148 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nn1-c1ccccc1 772211727 KSTSSMLSPOFDLT-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)Nc1cccc(N2CCCC2)c1 780705400 BGPKZKSGSITMSK-UHFFFAOYSA-N 409.533 2.338 10 20 HECD CNS(=O)(=O)CCNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 784705571 ZCAXBGHETAOUFB-UHFFFAOYSA-N 414.325 2.136 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1 792238268 NJAJHBSEYUKKDI-ADLMAVQZSA-N 414.380 2.210 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1 793621537 XRTFKSNVYCLFPE-SFHVURJKSA-N 418.538 2.131 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc2c1OCCCO2 793742782 CTOGQWWYYQHCIC-UHFFFAOYSA-N 407.470 2.157 10 20 HECD CCOC(=O)[C@H](C)[C@H](C)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 801541679 UCTGTMIUEZGMLF-TWMKSMIVSA-N 423.529 2.233 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1F 803664200 HIZOGSLSGCFKFL-IBGZPJMESA-N 412.509 2.241 10 20 HECD CCc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1C 811274821 YPVZVBQAAOJVSF-UHFFFAOYSA-N 403.454 2.036 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)c4ccccc4)CC3)nc12 917079173 HGPPGLFPMXJQTK-UHFFFAOYSA-N 423.473 2.006 10 20 HECD COCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918438027 DIEZPVMHKODIDN-UHFFFAOYSA-N 415.465 2.188 10 20 HECD C[C@H](OC(=O)CO[C@@H]1CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1318976413 XFZKIVMQKFEWII-UONOGXRCSA-N 423.421 2.138 10 20 HECD COC(=O)[C@H]1CCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1323170472 XOMGIYIBRQNGJF-XJKSGUPXSA-N 422.393 2.442 10 20 HECD Cn1cnc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)c1 1788426903 ZRDRRSLFPNDAMF-UHFFFAOYSA-N 407.430 2.288 10 20 HECD CC(=O)NC1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 51278728 PMDRZODAJQELJG-HUUCEWRRSA-N 406.502 2.249 10 20 HECD CCN(CC(=O)NCc1ccc(F)cc1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 727198246 HOEUISUNMFTTEO-UHFFFAOYSA-N 414.525 2.488 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)CNCc2cc(Cl)cc(Cl)c2O)c1 729686207 GSYBUMFNBNENDO-UHFFFAOYSA-N 418.302 2.335 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 736321183 NMMUWWLHNUCTAQ-UHFFFAOYSA-N 404.488 2.134 10 20 HECD CC(C)(C)OC(=O)CCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745691572 LHUGKLDPQHFGNV-KRWDZBQOSA-N 418.538 2.309 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(-c3ccccn3)c2)SC1=S 747698106 HYPWFBQWPHTIEM-FOWTUZBSSA-N 419.553 2.499 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 748728880 UUQPYCYYTLWLRJ-UHFFFAOYSA-N 417.550 2.023 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 751313800 QMTOCWWXCNXRAP-NSHDSACASA-N 423.443 2.014 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 751842890 QKNDYQGVQFLAPJ-UHFFFAOYSA-N 417.531 2.358 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCc3ccccc3)[C@@H]3CCOC3)nc12 752347863 OSVJBMALASCMLU-GOSISDBHSA-N 410.474 2.445 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC[C@H]3c3ccc(C)o3)CC2)cc1 754044002 XGABCQMXXRXSCA-IRLDBZIGSA-N 415.534 2.153 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1F 754213181 OUBMUCIIMXMWDZ-UHFFFAOYSA-N 414.437 2.080 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c2C)cc1 758484687 OBSADYBKXOPJLT-CQSZACIVSA-N 422.503 2.156 10 20 HECD C[C@H](C[C@H](O)c1ccco1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 759568357 MSZUNQWRFZYZRT-SUMDDJOVSA-N 414.506 2.293 10 20 HECD COc1cc(N2CCN(C(=O)COc3cccc(C=O)c3)CC2)cc(OC)c1OC 760083110 BLWSRBBRUZFJEO-UHFFFAOYSA-N 414.458 2.253 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc(S(N)(=O)=O)ccc1C 766272712 RWMVZLMWAAGTEW-UHFFFAOYSA-N 403.504 2.432 10 20 HECD Cn1ccnc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(F)c1 769636807 KIDSNVIIHUHTCG-KRWDZBQOSA-N 418.450 2.156 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1 769653563 QFRJUPWOFDBEOH-UHFFFAOYSA-N 403.460 2.252 10 20 HECD O=C(NCc1nnnn1CC1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770501002 RVNWLPNNBMBCDB-AWEZNQCLSA-N 421.452 2.153 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccco2)N2CCCC2)cc1F 774866839 JQSLUSSKNWPOTO-SFHVURJKSA-N 402.470 2.054 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCOc3ccccc3C)CC2)cc1 779213522 BPPPTFMOWZAKMH-QFIPXVFZSA-N 413.562 2.497 10 20 HECD C[C@H]1C[C@H](C)CN(CCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 787708957 VMHSLZJYLVLINS-ROUUACIJSA-N 400.567 2.169 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)ccc2[nH]1 792348858 QHDBJUDQTMMFEV-UHFFFAOYSA-N 417.469 2.159 10 20 HECD Cc1nccnc1N1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 799364444 FYFBLMXFXQLLBZ-UHFFFAOYSA-N 412.563 2.370 10 20 HECD CSC[C@H](C)C(=O)N1CCC(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 799412309 UGGIYSQTWJNAQC-KRWDZBQOSA-N 419.591 2.377 10 20 HECD Cc1ccc(C2=NO[C@@H](CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1C 801396945 JAYUQARCUYZTBT-MRXNPFEDSA-N 417.487 2.304 10 20 HECD Cc1cc(-c2nnc(N3CCNC(=O)C3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 802757231 SNCGUOSTYBHAFR-SFHVURJKSA-N 420.517 2.325 10 20 HECD CCN(C)c1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803310130 HFPDJQIRGCSZJH-GOSISDBHSA-N 424.545 2.473 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@H](c4ccc(F)cc4)C3)ccc21 803686592 MZAUFTXBSXPNRZ-OAQYLSRUSA-N 411.477 2.424 10 20 HECD COCCCN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 804352472 UBNNNYZDLJOMPQ-UHFFFAOYSA-N 418.582 2.107 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@H]1O 806444014 XSBMSGVWNLPNEJ-CXAGYDPISA-N 401.429 2.454 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(N(C)C)cc1 807674995 SKMAAQXBUMPBNZ-DOTOQJQBSA-N 405.564 2.491 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2[nH]c(O)nc2c1 809727646 QDYABZKQQBWYIY-CQSZACIVSA-N 401.854 2.417 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCO2 814330433 QKRKNCZRBMNNRQ-HNNXBMFYSA-N 416.499 2.070 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)CN2CCN(S(=O)(=O)N(C)C)CC2)c1C 917099066 SSRHYHANOZXCMP-UHFFFAOYSA-N 418.563 2.009 10 20 HECD Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994037 MNZBEHSKCVZSLF-KXBFYZLASA-N 422.441 2.423 10 20 HECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCc2ccc3c(c2)CCCN3C)C1 726250189 TWBBSKSEVQCLHM-APWZRJJASA-N 402.539 2.142 10 20 HECD Cc1noc(C)c1/C=C1\SC(=S)N(Cc2ccc(S(N)(=O)=O)cc2)C1=O 726626913 MRWWRBFJQJKBMG-AUWJEWJLSA-N 409.514 2.340 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1 727945697 YPZGUIXWIAWWDD-UHFFFAOYSA-N 420.469 2.014 10 20 HECD CC(=O)NCCc1ccc(S(=O)(=O)NCCCSc2nccs2)s1 735315157 DLTYSJBGTNOGLH-UHFFFAOYSA-N 405.592 2.344 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccsc1 741080690 DMUBKFFLDOPJPK-HRAATJIYSA-N 416.547 2.157 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(C)c2)cc1 741647777 GFMCKKOSHYLGEY-UHFFFAOYSA-N 412.489 2.344 10 20 HECD CCC(=O)N[C@@H](C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742752988 IEYFPUBZBSTSCF-WMLDXEAASA-N 406.527 2.349 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](CCO)c1ccccc1 743856407 JNFARPCTMJITJQ-NRFANRHFSA-N 415.509 2.334 10 20 HECD Cc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 746037522 FTTSXBCJRMSHPD-KBPBESRZSA-N 400.454 2.398 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)cn1 747750515 BGESPZHBSRELCY-UHFFFAOYSA-N 422.488 2.225 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccccc3CO)CC2)cc1 749356617 SWRTZFSHCIOQRG-UHFFFAOYSA-N 412.534 2.199 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CSc3ncc(CO)n3C)cc2F)C[C@@H](C)O1 750004717 CSFDZZXCXVOFKI-ZIAGYGMSSA-N 422.526 2.074 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c(OC)c1 752109523 ANINDSHTAQEISE-UHFFFAOYSA-N 407.492 2.029 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCc4c(cccc4OC)C3)CC2)cc1 754267998 CROAQFSMOXZCBS-NRFANRHFSA-N 411.546 2.245 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 766047025 BSNWSBZELNXXMH-UHFFFAOYSA-N 424.500 2.180 10 20 HECD CN(C)c1ccc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)cc1 768199142 BSOCJPREWUAUPN-UHFFFAOYSA-N 418.519 2.387 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)[C@@H]4c5ccccc5CCN4C3=O)cc2)C1 777609248 BWCGRMHAMNETAA-NQIIRXRSSA-N 418.497 2.450 10 20 HECD COC(=O)Cc1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 778938042 OYPCCMNTPVBTKX-UHFFFAOYSA-N 400.450 2.432 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCC(=O)OC(C)(C)C)CC2)cc1 785891526 CPNXVPBMUXDEKF-UHFFFAOYSA-N 406.479 2.009 10 20 HECD CO[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 786652793 AZKKRCAODZIHRM-DYESRHJHSA-N 411.502 2.204 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 788324880 ZEHRTCKDDMJHRE-FCHUYYIVSA-N 423.513 2.176 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(C)o1 789864836 SLKBVVVIDGMYNE-SFHVURJKSA-N 417.531 2.261 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCS(=O)(=O)c2ccccc21 790292186 NBIVYMQAXPRLCH-QGZVFWFLSA-N 418.490 2.240 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 794020426 VXYBRUNLDVPDAP-UHFFFAOYSA-N 422.488 2.277 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1C(N)=O 797021488 POSDWGYFDIYNFF-AWEZNQCLSA-N 412.490 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC(F)F)nc3)CC2)cc1F 802559656 CKGHNXYIIPLATG-UHFFFAOYSA-N 424.379 2.118 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@H]([S@](=O)CC)C1 809234543 NCRFGOSUQPEUJB-JHUILQHCSA-N 407.580 2.297 10 20 HECD COc1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 810350183 ZXDKEKROARDSOI-UHFFFAOYSA-N 423.391 2.204 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccn3)cc2)CC1 811358586 UMVAZLPVXUYEHZ-UHFFFAOYSA-N 404.474 2.070 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCCCC(=O)C3)CC2)cc1 811387175 XKATYKSIRIYLEV-QGZVFWFLSA-N 402.491 2.427 10 20 HECD CO[C@H](C)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812348933 GKVDYZSDKSCFQL-VXGBXAGGSA-N 423.447 2.254 10 20 HECD COC(=O)C1(CS(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCCC1 813646509 LCZNSQBRWYJICW-UHFFFAOYSA-N 424.563 2.408 10 20 HECD CNc1nccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1[N+](=O)[O-] 816891629 YULLFQLTMHZNFE-UHFFFAOYSA-N 403.414 2.062 10 20 HECD CC(C)C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 916590510 IFRKPZGKPVFLLI-XHSDSOJGSA-N 415.442 2.190 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2cccn2)cc1 916676389 KNVCLHJAUHTSQT-UHFFFAOYSA-N 410.499 2.037 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3nc4ccccc4[nH]3)cc2)C1 918002814 LQFYANIDBAMQFO-QGZVFWFLSA-N 420.517 2.307 10 20 HECD COC[C@@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 920890163 LOBBANVLRLEGHP-LBPRGKRZSA-N 423.447 2.114 10 20 HECD COCCn1cc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1=O 1320275443 DYYPIAYOVJXNOD-SFHVURJKSA-N 401.463 2.413 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1OCC(F)F 1320398939 NUWCDHGREBWXNV-ZDUSSCGKSA-N 410.373 2.041 10 20 HECD O=C(CC(F)(F)F)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543596 KCDMXLUSAZUGLJ-UHFFFAOYSA-N 401.385 2.290 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](O)CC2)C1 1846467661 KNLWFGQMKUEKDR-MQMHXKEQSA-N 408.882 2.119 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3cnc4c(C)cccc4c3=O)CC2)cc1 726560886 UUYUJXKEGBRELT-UHFFFAOYSA-N 406.486 2.499 10 20 HECD COc1ccc(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)CC2)cc1 726563626 PIHOIGWHGVJGDE-MRXNPFEDSA-N 421.501 2.119 10 20 HECD CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 728022024 KSQBAYCGRQWLJO-OZLDOMPNSA-N 403.548 2.397 10 20 HECD CN(Cc1ccccc1O)C(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1 731119205 ZJEYSFYKVPWCTD-FQEVSTJZSA-N 410.518 2.431 10 20 HECD CN(CCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1)Cc1ccccc1 731213128 JQIYAXLHBITRQM-UHFFFAOYSA-N 423.605 2.118 10 20 HECD COC(=O)NCCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733542890 QIFVRWYSLHWNRN-UHFFFAOYSA-N 424.409 2.080 10 20 HECD O=C(COC1CCOCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735250470 ITPWPUZNNAOUDG-UHFFFAOYSA-N 402.413 2.354 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O 745994492 BQUFYGAVTREYHN-UHFFFAOYSA-N 417.531 2.481 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3cnn(CC(F)F)c3)CC2)cc1 746032197 NOPKCUSWWFNYDI-UHFFFAOYSA-N 422.480 2.491 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(C)nn2C2CCOCC2)c1 746396930 XNSBUSMNCXVQBH-CYBMUJFWSA-N 402.451 2.073 10 20 HECD Cc1ccccc1[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746759000 ZJCRJPTUWZVCGN-GHTZIAJQSA-N 410.518 2.230 10 20 HECD Cc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1-c1n[nH]c(C(F)(F)F)n1 747370823 KBHMDYKHEOMVFZ-UHFFFAOYSA-N 420.399 2.025 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)C1Cc2ccccc2C1 751237034 MBQNTRKWCGWFQM-UHFFFAOYSA-N 400.544 2.482 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCc1ccc(N2CCSCC2)cc1 753294429 HDAWCPZSTBJCCX-UHFFFAOYSA-N 423.560 2.322 10 20 HECD CCc1ccc([C@@H](COC)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 754345592 BOWAQOPVBFGWQQ-LJQANCHMSA-N 419.497 2.411 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@](C)(O)C3CC3)cc2F)C[C@@H](C)O1 756331794 YYZAIZYNMIPGJU-DOQJBMMISA-N 422.497 2.150 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC(OCCO)CC2)c([N+](=O)[O-])c1Br 756953654 OSOUSDFOMPNPDK-UHFFFAOYSA-N 420.216 2.252 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCCc3c(F)cccc3F)CC2)cc1 758208447 FVUBKMHKQYUZDZ-SFHVURJKSA-N 405.489 2.289 10 20 HECD COC(=O)CS(=O)(=O)Cc1ccc(CNCc2ccc(N(C)C)c(F)c2)cc1 759844113 XYQZTMUOEBIRJR-UHFFFAOYSA-N 408.495 2.269 10 20 HECD O=C([C@H]1CCCO1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768182239 XOXXDQDYMWGPKN-HXUWFJFHSA-N 402.495 2.408 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 769153434 IFRBNRBFBVXDAZ-YADHBBJMSA-N 416.566 2.042 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnc(Cl)n3C)cc2F)C[C@H](C)O1 769394214 CXPUPNKGUNULNV-RYUDHWBXSA-N 416.906 2.305 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc5c4OCO5)n3)CC2)cc1 771067035 MTOBMIFLEYZJEB-UHFFFAOYSA-N 422.441 2.365 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCC(=O)C[C@@H]4C)n3)CC2)cc1 771083860 TUPBGHNLQPVNPU-HNAYVOBHSA-N 412.490 2.442 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCCC4)O3)cc2F)CC1 773740217 JSTGKWRDKXWLLN-GOSISDBHSA-N 420.529 2.453 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1 773784746 HQJLBTVFVNQRIO-UHFFFAOYSA-N 420.535 2.311 10 20 HECD CS(=O)(=O)C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 774188144 PKVHUAWVWFUKFH-HXUWFJFHSA-N 417.531 2.108 10 20 HECD C[C@@H](NCC(=O)N(CCC(N)=O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 775257078 FSDFWIHNTPNAQK-LJQANCHMSA-N 424.545 2.078 10 20 HECD COc1ccc(N2CCN(C(=O)c3cnc4sc(C)c(C)n4c3=O)CC2)cc1F 775769446 CTDUTWVBBIGBJD-UHFFFAOYSA-N 416.478 2.483 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCn4cccc4[C@H]3C)CC2)cc1 778232260 GQNDWLUBXDPKKI-QZEKMECESA-N 408.502 2.305 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cn3c(n2)CCCC3)cc1 779806895 KLVGKIFDJYWBHQ-UHFFFAOYSA-N 400.508 2.331 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O 780608627 KRTNDXXOGHZSFD-IBGZPJMESA-N 415.465 2.282 10 20 HECD Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 786224497 JYHQDZLNUGXDFK-LEWJYISDSA-N 424.545 2.100 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cccc(F)c3)cc2F)CC1 786664478 AXUPZGFNBRCCLJ-UHFFFAOYSA-N 416.472 2.039 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)nc2Cl)cc1 797431269 KUBUMPFFPVDIHZ-UHFFFAOYSA-N 411.292 2.065 10 20 HECD CC1CCN(C[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)CC1 803660858 HEOJJYKXZNOIJI-LJQANCHMSA-N 418.557 2.478 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807545113 BZTYCAAIFPTRJE-XMSQKQJNSA-N 408.546 2.348 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nccn1CCc1ccccc1 808830230 UCOAWVPQGLYWPD-UHFFFAOYSA-N 419.529 2.467 10 20 HECD CC[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H](C)S1(=O)=O 813058711 MEDYQHJHKBELMK-DNVCBOLYSA-N 409.552 2.271 10 20 HECD CO[C@H]1CCC[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 814563519 YSUGUQBICFJGHD-SJORKVTESA-N 408.470 2.027 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)c1 818020103 UYELIGIRMGTNHK-UHFFFAOYSA-N 413.477 2.397 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C 920635006 AXZCSHPTQVOFMD-RSUWNVLCSA-N 412.508 2.250 10 20 HECD CCNc1ccc(C(=O)OCC)cc1N/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 920974098 AMZSUUCTFOLNSE-GXDHUFHOSA-N 418.519 2.490 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1 921087415 WPYNAXHEJLFLBC-UHFFFAOYSA-N 409.895 2.380 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(C)cc3C(F)(F)F)nc12 1116559937 VFRLDZVJYXXIKC-UHFFFAOYSA-N 412.324 2.326 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)N(C)C)c1 1321366905 QRRAHCHSANSYBI-INIZCTEOSA-N 415.446 2.096 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)CC2)cc1 1324626487 BZPFCHQOTQLBGV-UHFFFAOYSA-N 421.519 2.199 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cnsn3)CCC2)cc1)c1cc(O)nc(O)c1 1788424384 YOIQUSQEMUQKQC-UHFFFAOYSA-N 411.443 2.406 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2Cl)cc1 327719740 FTENEKBJQUQUAE-UHFFFAOYSA-N 404.853 2.211 10 20 HECD COc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)cc1 726527773 JPDKKUBOZQPXKY-FQEVSTJZSA-N 423.513 2.197 10 20 HECD C[C@@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 727137405 QALNFNQBEIWBJD-QGZVFWFLSA-N 401.482 2.166 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cnn(CCOC)c3)cc2F)CC1 730109992 GBXRPCFNWBTASC-UHFFFAOYSA-N 404.490 2.132 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCC(C)(C)NS(C)(=O)=O)cc1 731761272 BPHNALJKDVCELK-UHFFFAOYSA-N 422.551 2.385 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1 731979068 FLFHAGOYHZAHDH-ZIAGYGMSSA-N 408.499 2.355 10 20 HECD Cc1ccccc1[C@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732886525 GLKZIWWVPTZIEZ-WIYYLYMNSA-N 410.518 2.230 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)c1 734072922 VGRPOZUEGWKPGY-UHFFFAOYSA-N 404.444 2.149 10 20 HECD CCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739768625 UDJJNXQOFWWAMS-UHFFFAOYSA-N 415.515 2.434 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCSC(F)(F)F)CC2)cc1 742940830 ZHHYJHKHPPCMJN-UHFFFAOYSA-N 406.474 2.369 10 20 HECD CN1CCN(c2ccc(CNC(=O)NCc3c(O)ccc4c3CCCC4)cn2)CC1 743527866 AXAIWLUWPSZYMP-UHFFFAOYSA-N 409.534 2.417 10 20 HECD COCCN1CC[C@H](NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 743626815 NREPGVWNEDEOPR-CVEARBPZSA-N 412.481 2.277 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1 746990429 NQDRQQUVKIWXQU-UHFFFAOYSA-N 417.531 2.332 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Br)nc3)nc12 747001665 LWIFZTGIDYGGPT-UHFFFAOYSA-N 421.207 2.126 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1[C@H]2CC[C@H]1CC(=O)NC2 748826224 ACBDPYQDWFJYCU-KKUMJFAQSA-N 417.465 2.142 10 20 HECD COCCN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCC1 749554722 JBAYPXMHYZXCQI-SFHVURJKSA-N 402.539 2.489 10 20 HECD Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 752295064 FTCIPLXPQGNETN-MRXNPFEDSA-N 422.489 2.015 10 20 HECD COC(=O)[C@H]1c2ccccc2CCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 752301015 DRWOZRDIHUKUFC-HSZRJFAPSA-N 423.513 2.116 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1Br 753826521 UJCDLSCLXBSRGS-UHFFFAOYSA-N 407.312 2.321 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(-n4cccn4)cc3)CC2)cc1 758228814 CLZSBMDTUQWSOO-NRFANRHFSA-N 408.502 2.443 10 20 HECD CCS(=O)(=O)CCN(C)CC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 759367853 SSMJGIATQGRAQL-UHFFFAOYSA-N 420.531 2.430 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(-n3nnnc3C)ccc2F)cc1OC 760821042 CXFHLQFTUHTNQH-UHFFFAOYSA-N 400.414 2.202 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(S(C)(=O)=O)c3ccccc3C2)cc1 763488586 WMEWDRCPLHUUAC-UHFFFAOYSA-N 402.520 2.244 10 20 HECD Cc1ccc(-c2nnn(CC(=O)NCc3cccc(Br)c3O)n2)cc1 765725966 AZVLGDHJNSNNGD-UHFFFAOYSA-N 402.252 2.433 10 20 HECD NC(=O)CCC1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 767775298 NTMVKSSCHMLCEM-UHFFFAOYSA-N 419.481 2.378 10 20 HECD COc1cccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1[N+](=O)[O-] 769576579 IVFZEZVICDHOIA-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cn1 773860351 ZUMAVVQYRXKNHJ-CQSZACIVSA-N 415.494 2.063 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3CSC)CC2)cc1 778388130 AQOPZIIMPDNQAE-HJCTWCACSA-N 403.548 2.254 10 20 HECD CCC1(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCOCC1 778880792 JDDAJYJZFPAOFT-UHFFFAOYSA-N 408.470 2.029 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3CN3CCCCC3)CC2)cc1 779223682 POBMTDPJMICXMF-GOTSBHOMSA-N 416.610 2.128 10 20 HECD C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424565 PYBRBJLUOMDHEO-HBIPHATFSA-N 401.532 2.326 10 20 HECD COc1ccc(CNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c(O)c1 792919944 POUGSSADIGJMAV-LJQANCHMSA-N 413.474 2.309 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC3CCN(C(C)(C)C)CC3)CC2)cc1 793739056 XNYDOWBTLWMQNL-UHFFFAOYSA-N 416.566 2.113 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC=CCC3)cc2F)CC1 793819268 MXUKFMYXPKRGKY-QGZVFWFLSA-N 402.514 2.056 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c(O)c1 794389960 UGBNVAHUHVLPFG-KRWDZBQOSA-N 418.515 2.426 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1 796791152 RJHGYMWOCXPCEB-GFCCVEGCSA-N 415.446 2.103 10 20 HECD CN(CCCOC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 797862384 UVSCPPYMDYSGNW-UHFFFAOYSA-N 402.469 2.178 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 798255363 NBGKZQDMBWAQDS-UHFFFAOYSA-N 424.954 2.406 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@@H]2CCN(C3CC3)C2)cc1 803175276 BOBMANDFAPDYRI-GOSISDBHSA-N 410.518 2.227 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3CCCN(C(C)C)C3)CC2)cc1 803563802 DASIUYAWVPBUPC-GOSISDBHSA-N 416.566 2.017 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(CCCO)[C@@H]2CCc3ccccc32)cc1F 803662070 GQMVHSMBIQVDME-HXUWFJFHSA-N 413.493 2.406 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)cc1F 803662911 JBVXXCPKSFMXDK-SFHVURJKSA-N 415.509 2.426 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc2)CC1 805025635 RWBIZGZGYYRYQD-NQIIRXRSSA-N 400.567 2.480 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3COC(=O)N(C)CC)nc12 805761620 CLANLCMPDMFWGI-HNNXBMFYSA-N 419.482 2.054 10 20 HECD CCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCOC(C)(C)C1 810042678 FACHUJUKSLOEHJ-LEWJYISDSA-N 405.583 2.458 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H](C4CCC4)C3)cc2)C1 813593838 DDIMOGMUVPRINY-VQTJNVASSA-N 414.550 2.346 10 20 HECD COc1cc(N2CCN(C(=O)NCCC3CCOCC3)CC2)cc(OC)c1OC 1320443763 WJYXMFAHGCUBFO-UHFFFAOYSA-N 407.511 2.361 10 20 HECD CC(C)[C@]1(CO)CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 1324148647 XFWMKIPGIHZOEM-PMAPCBKXSA-N 421.557 2.396 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793623762 NNUWBIYAXBNUOM-RLDUGPAZSA-N 410.898 2.410 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(=O)N(C)C)cc1 1795902846 QFUXTMAZCGTCKJ-NUZGMZIFSA-N 422.529 2.434 10 20 HECD C/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1825048467 DBQCSSOKCDMNOJ-XGEGNJEQSA-N 415.471 2.461 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)CCC2CCCC2)C1 1842599720 BTNAXOGJNBTCJM-UHFFFAOYSA-N 409.577 2.021 10 20 HECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(Cl)c1 1843251375 YOBULAMTFVXOKD-UHFFFAOYSA-N 417.849 2.286 10 20 HECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847038643 XKQFZNIYQKUOJZ-UXBLZVDNSA-N 424.453 2.342 10 20 HECD C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 96955811 HQDXTYJFUQXMCH-MRXNPFEDSA-N 418.563 2.051 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)cc1 139802565 SQMWFNFRZJMLQD-UHFFFAOYSA-N 411.505 2.046 10 20 HECD Cc1cc(N(C)C)ccc1CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 301305378 UHLWAXSLFJGZNX-UHFFFAOYSA-N 403.552 2.004 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCN(C(C)C)C3)cc2F)CC1 730123861 WWZULKSTAJXMHX-IBGZPJMESA-N 405.562 2.497 10 20 HECD C[C@H]1CCCCN1C[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 733806466 DFTPVPOIEIJLFO-HOTGVXAUSA-N 409.552 2.490 10 20 HECD COc1ccc(OC)c(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740609029 AIFLUGKJRYOUTC-UHFFFAOYSA-N 419.503 2.206 10 20 HECD CC(=O)N(C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 742279889 YZMHBAXORRICSV-UHFFFAOYSA-N 421.494 2.124 10 20 HECD O=S(=O)(CC1CCOCC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 742301733 XUJPHOCPWZJQMR-KRWDZBQOSA-N 402.944 2.356 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1F 743900148 CNGVBEZAQKLEED-UHFFFAOYSA-N 413.453 2.066 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(CCO)CCCC3)CC2)cc1 745349821 JNIDHVCVLRRYCA-UHFFFAOYSA-N 418.582 2.449 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n(C2CCOCC2)n1 746419257 FBJJTDFNZWAGHO-UHFFFAOYSA-N 409.490 2.174 10 20 HECD COc1cccc(CNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1O 748848575 OKMTVRUSSVFVJK-UHFFFAOYSA-N 410.879 2.379 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)c(C)c1 749730230 LVOXXGCKCNLURH-UHFFFAOYSA-N 406.533 2.438 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2c(F)cccc2OC(F)F)c1 752807746 MNSFBONOKJGLOZ-UHFFFAOYSA-N 404.366 2.434 10 20 HECD COc1ccc(O)c([C@H](C)N[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756710845 FOZRYIIZXSNKHL-IRXDYDNUSA-N 413.522 2.347 10 20 HECD CCOC(=O)N1CCC(NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 756883724 VBMYLIGTWKPPSM-UHFFFAOYSA-N 404.555 2.418 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@@H](C)CC3)CC2)cc1 757662909 JIXDIOCEOBOVLY-QWPQOLDESA-N 403.548 2.254 10 20 HECD CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1CCOC 766764508 NVFCUBCVENFHNG-LJQANCHMSA-N 422.545 2.305 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N[C@@H]4CCCC[C@@H]43)cc2F)C[C@@H](C)O1 769033292 LQZALUJZEHEFKN-SLGAXEFGSA-N 418.513 2.392 10 20 HECD COC(=O)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cc(C)cc(C)c1 769631712 YMKIHWVDTFZMSA-QGZVFWFLSA-N 406.460 2.025 10 20 HECD C[C@@H]1OCC[C@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 771086724 MIGBRPAWQHETKW-PNBKFKSVSA-N 408.470 2.024 10 20 HECD C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NCc2ccccc2O)C1=O 771419170 WJHVHFGDWRLQSI-LJQANCHMSA-N 405.813 2.268 10 20 HECD O=C(NCCc1ccco1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 775116493 SAQQRFOZJFRNRN-UHFFFAOYSA-N 407.417 2.325 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 775501318 HDUARILGQCFJJO-OAHLLOKOSA-N 412.490 2.467 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@](O)(c4ccc(F)cc4)C3)CC2)cc1 777735250 XTSPXCHMNGGMHF-QHCPKHFHSA-N 413.493 2.076 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3ccccc3C)CC2)cc1 778350286 QLUGAHGADHXTEU-VDZCTEQFSA-N 423.513 2.058 10 20 HECD COc1ccc([C@H]2[C@@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)CCC(=O)N2C)cc1 783683478 FDLILPWODMNTCN-KKSFZXQISA-N 413.426 2.442 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 784713878 YGXKSRDUROQGJO-UHFFFAOYSA-N 413.474 2.258 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(-c4ccccc4)c3)cc2)CC1 786260518 YEPSGIJLPHCZCW-UHFFFAOYSA-N 403.486 2.471 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCC=CO3)cc2F)C[C@@H](C)O1 787054002 RNILPXRZQNENKW-KHYOSLBOSA-N 406.454 2.291 10 20 HECD CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCO1 802682531 MSTOQXJEMXOCIZ-KRWDZBQOSA-N 419.501 2.468 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cn(C)nc2-c2ccccc2)cc1F 803662742 MJMWXNAXPAWGNB-UHFFFAOYSA-N 409.465 2.225 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803685804 LNNZONPAUOZATB-HSZRJFAPSA-N 415.534 2.123 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccc2c(c1)CC(=O)N2C 804574531 NJEYRHZKRFYSBI-CABCVRRESA-N 408.502 2.326 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cccnn3)cc2Cl)C1 806463907 XVAIEPRABPKROU-AWEZNQCLSA-N 401.898 2.299 10 20 HECD COc1cc(N2CCN(C(=O)c3cn(C)nc3C3CC3)CC2)cc(OC)c1OC 813168459 PEPFMXQDZBLPOX-UHFFFAOYSA-N 400.479 2.286 10 20 HECD CC(=O)N[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(Cl)c3nonc23)C1 814388138 ZRVDSGKKLISLIF-GFCCVEGCSA-N 406.851 2.132 10 20 HECD O=C(Cn1nnc2c1CCCC2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857473497 ZENUYXWXSZPPRI-MRXNPFEDSA-N 403.914 2.297 10 20 HECD CC(=O)Nc1ccc(OC[C@@H](O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 917019920 MLGZONCZEPSXKF-QFIPXVFZSA-N 413.518 2.353 10 20 HECD O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccc(CS(=O)(=O)c2ccccc2)o1 917127160 UHPBGQKODOWORI-UHFFFAOYSA-N 414.468 2.250 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cn2cccn2)cc1 918340479 POVDVHQISIOWCW-UHFFFAOYSA-N 424.526 2.096 10 20 HECD O=C(CCS(=O)(=O)C1CCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 919970191 SUGUASCILGJXPK-UHFFFAOYSA-N 408.564 2.259 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@@H](NC(N)=O)c1ccccc1 928973502 ADETXZLLQBHFHO-LJQANCHMSA-N 412.490 2.054 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(N4CCNC4=O)c3)c2)CC1 1320833536 FZPSZBZPGIZJTQ-UHFFFAOYSA-N 407.474 2.137 10 20 HECD Cn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n1 1787415789 HTLOAXBGHXCYSV-UHFFFAOYSA-N 407.430 2.288 10 20 HECD C/C=C/C=C\C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799768437 ZFXXPQQADGBSDN-PTSXGIFVSA-N 406.866 2.087 10 20 HECD CCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816823876 NBBGXXLATWVRQU-GFCCVEGCSA-N 409.537 2.062 10 20 HECD COCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708645 LMFGPBDKENTVRO-SECBINFHSA-N 411.867 2.080 10 20 HECD O=S(=O)(NCC1CC1)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 31721403 OUCLCTXEOWGGQG-UHFFFAOYSA-N 424.529 2.180 10 20 HECD COC(=O)c1cc(NS(=O)(=O)c2cccc3nsnc23)c(OC)c(OC)c1 525018742 RHAGRUULYVVSBF-UHFFFAOYSA-N 409.445 2.296 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(-c4ncon4)cc3)CC2)cc1 727034997 ANGHVEIKQOGHBR-UHFFFAOYSA-N 421.457 2.469 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)C3CCCCC3)CC2)cc1 727938252 ISKMNNUZHBUMOQ-JOCHJYFZSA-N 418.582 2.448 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](N4[C@@H](C)CC[C@H]4C)C3)nc12 729265317 FWCRRKPXZQOFMQ-UXLLHSPISA-N 401.511 2.449 10 20 HECD CN(C)C(=O)CCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735850282 VFVGNPFBVDEJCE-UHFFFAOYSA-N 401.429 2.417 10 20 HECD CN(CC1CC1)S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 738354439 OLSIPMQDSROXEM-UHFFFAOYSA-N 407.458 2.218 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 741093170 NUVPGBYZZDMIGU-MJGOQNOKSA-N 409.552 2.020 10 20 HECD COC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CCO1 741795176 OEZQCXCWYHEANE-SFHVURJKSA-N 400.475 2.395 10 20 HECD O=S(=O)(CC1CCOCC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 742280884 YFHCGKAWQJFQOA-UHFFFAOYSA-N 422.469 2.388 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(F)c3C)CC2)cc1 746038227 NNOBBNKDRHIEBG-UHFFFAOYSA-N 414.481 2.020 10 20 HECD Cc1ccccc1[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746759008 ZJCRJPTUWZVCGN-WIYYLYMNSA-N 410.518 2.230 10 20 HECD CSC[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 746805292 PICWHNALTKQVMX-DAYGRLMNSA-N 421.538 2.415 10 20 HECD CCCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 749211861 BGHYVZJYAGJQOA-IBGZPJMESA-N 415.582 2.452 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c(C)nc4ccnn4c3C)CC2)cc1 760371445 NTDRJFNSDKAIHU-UHFFFAOYSA-N 422.533 2.297 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@H](c4ccc(O)cc4)C3=O)CC2)cc1 760953343 ZLEJSJWTPFIUSP-OAQYLSRUSA-N 424.501 2.206 10 20 HECD COC(=O)c1cn([C@H]2CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)C2)nn1 761226279 NUGWZENPPUWEDT-INIZCTEOSA-N 414.466 2.410 10 20 HECD COc1ncc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1C(N)=O 762223416 BJOUGYRFJZSFOI-UHFFFAOYSA-N 401.492 2.064 10 20 HECD COc1cc(Br)cc(CN2CCN(C(=O)c3cccn3C)CC2)c1O 768221053 YDOPSIBIJTZNDL-UHFFFAOYSA-N 408.296 2.460 10 20 HECD COc1ccc(N(Cc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)Cc2cccs2)cc1 772201629 RXSSNEBJVWHFQV-UHFFFAOYSA-N 411.487 2.237 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(C)c3F)CC2)cc1 776041381 KVFWNNPZUGMGPQ-UHFFFAOYSA-N 414.481 2.020 10 20 HECD COCCO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 780311071 DITBVWQYVDJTDN-XYJFISCASA-N 409.502 2.386 10 20 HECD COc1cc(N2CCN(C(=O)C3CCN(C4CC4)CC3)CC2)cc(OC)c1OC 784797175 FVGRVKSAHPODSI-UHFFFAOYSA-N 403.523 2.235 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2sccc2C1 789724324 DYTATTGMQZWRLE-QGZVFWFLSA-N 424.570 2.304 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c(O)c1 794380722 AZJAMQLAUASIKQ-HNNXBMFYSA-N 422.478 2.257 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2ccc(S(C)(=O)=O)nc2)cc1 795066704 XFELIFAUTAZMDF-UHFFFAOYSA-N 411.549 2.152 10 20 HECD CC[C@](C)(OC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 796397315 IWTPWZFSGASBAQ-ZSDSOXJFSA-N 410.486 2.414 10 20 HECD C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1c(F)cncc1F 796625646 JTUPSJFERIYTJN-CYBMUJFWSA-N 408.424 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)cc1F 803662203 UXQVYFVGTGRZEG-LJQANCHMSA-N 412.509 2.241 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)c1 804117513 CJDNRDIEQYCWPZ-SJLPKXTDSA-N 410.518 2.334 10 20 HECD Cc1ccc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)cc1 806281403 XIKWOQROGKYUAD-UHFFFAOYSA-N 404.561 2.399 10 20 HECD NC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c(F)c1 807513835 VRMYJZAFWGQLII-UHFFFAOYSA-N 400.193 2.192 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1 808341725 KXJGVAUPXIFSMC-FPOVZHCZSA-N 417.550 2.015 10 20 HECD CCN(CC(=O)N[C@H](C(=O)OC)C(C)C)Cc1cc(Br)ccc1O 809951126 YHUBTDJHEIXKON-INIZCTEOSA-N 401.301 2.290 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cnn(C)c2I)c1 815835041 IRKPLZDNBOOYLK-MRVPVSSYSA-N 401.204 2.230 10 20 HECD CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)cc1 913072450 ZKGGBSDATWYMLW-UHFFFAOYSA-N 419.488 2.007 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2ccccc2nc1O 918340243 OAGFSYFLIRYMFJ-UHFFFAOYSA-N 411.483 2.105 10 20 HECD CCC[C@H](C)N1C[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 919583619 JAZHBUMJNOEEFA-WMZOPIPTSA-N 403.523 2.291 10 20 HECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1804283930 PPUXBBUHRRGMSO-VYMNDLDVSA-N 423.469 2.472 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2(F)CCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997614 BMHORNCNMCJSRG-RDTXWAMCSA-N 414.437 2.100 10 20 HECD Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cs1 1808690404 VBCOLIFKZSQFSQ-UHFFFAOYSA-N 416.503 2.416 10 20 HECD Cc1cc(C(=O)CSc2cccc[n+]2[O-])c(C)n1-c1ccc(S(N)(=O)=O)cc1 6362027 VDTZRSHDEPDHMQ-UHFFFAOYSA-N 417.512 2.350 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCO[C@@H](c3cccc(O)c3)C2)n(C)c2ccccc12 557934945 HTZWEVZDSANAMD-OAQYLSRUSA-N 407.470 2.409 10 20 HECD NS(=O)(=O)c1ccc(CNC(=S)NCc2ccc(N3CCCC3)cc2)cc1 726456599 GJOMVMOVAJLGJZ-UHFFFAOYSA-N 404.561 2.099 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726725789 IAWMXWSOUYNJHD-UHFFFAOYSA-N 411.458 2.206 10 20 HECD CN(C)CCCOc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 730679855 KTKVQACGFYWCHO-UHFFFAOYSA-N 416.497 2.477 10 20 HECD CCN1CCN(C(=O)CC2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 731219205 UDLXBCQTUKJUJP-UHFFFAOYSA-N 415.582 2.228 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)CCN3CCOCC3)c2C)cc1 733995813 MWGQHAQHLIWVSN-UHFFFAOYSA-N 413.518 2.327 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 741093169 NUVPGBYZZDMIGU-IEBWSBKVSA-N 409.552 2.020 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@@]1(O)CCN(Cc2ccccc2)C1 741411370 LPLWYTINYBPJTE-DEOSSOPVSA-N 406.530 2.499 10 20 HECD CC[C@]1(C)NC(=O)N(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 744373408 XZUWUQKYFLRTNS-XCLFUZPHSA-N 424.448 2.094 10 20 HECD CSC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCOCC1 745649015 XBWGYMQCCOEUDW-UHFFFAOYSA-N 411.543 2.498 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCCS1(=O)=O 753497494 HRLAYBSUTACVBE-BBRMVZONSA-N 402.463 2.340 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)c1O 755246359 YMGJUENRVJHGQF-UHFFFAOYSA-N 409.446 2.495 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757272227 GOTGBFZTTDHAMW-UHFFFAOYSA-N 420.438 2.104 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(OC)cc3[N+](=O)[O-])CC2)cc1 758226617 YPXKHEBTBSQOLH-QGZVFWFLSA-N 417.462 2.174 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)CCNC(=O)OCc2ccccc2)cc1 771722468 ZEOWZICQASZRPS-UHFFFAOYSA-N 405.520 2.441 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(C)c1 775045496 UEYWHVCFOUCTFT-UHFFFAOYSA-N 424.545 2.091 10 20 HECD C[C@H](N[C@@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)c(F)c1 777116563 SNUVDASAIWAQNA-ZRGWGRIASA-N 401.486 2.240 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](C)NC(=O)CC(C)(C)C)CC2)cc1 778320824 RTZQWPJTQSNSFU-SFHVURJKSA-N 418.582 2.264 10 20 HECD CN1CCC[C@@H](OC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1=O 778742247 KPRJHZGYPVSKKB-OAHLLOKOSA-N 408.366 2.148 10 20 HECD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)/C=C\c1ccc(O)c(O)c1 779483365 YSUFEQXGJNFQHV-NTMALXAHSA-N 404.488 2.255 10 20 HECD C[C@H]1CN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCN1CC(C)(C)O 780339824 SOINAXBQGBHDCU-ZWKOTPCHSA-N 404.555 2.071 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCN(C)CC2)cc1)[C@@H](C)C(=O)OC(C)(C)C 781530130 UBZUGWWVLMZUNT-SFHVURJKSA-N 418.582 2.107 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc(C)c3F)cc2)CC1 786122614 VYHZEIQFYXWQFL-UHFFFAOYSA-N 405.495 2.281 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3nc(-c4ccco4)no3)cc2)CC1 786257116 XGVUXWYIRMCVNO-UHFFFAOYSA-N 423.473 2.247 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(Br)n3)cc2)CC1 786655771 IMEXOWKCTRKCIZ-UHFFFAOYSA-N 417.307 2.443 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc2c(c1)CCO2 788342023 HLWHRVFKJAPMGX-UHFFFAOYSA-N 411.527 2.107 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc2Cl)C1 800050176 OYKJSCPTIBTTMG-ZDUSSCGKSA-N 414.897 2.277 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)cc1F 804851131 ZMHXPTVEXWLVLE-AYHJJNSGSA-N 404.530 2.420 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)C[C@H](C)C3)cc2F)CC1 805006993 BYHUFFSVASBPPL-IRXDYDNUSA-N 404.530 2.088 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 806254597 OMMHMYJXLAKDMS-IBGZPJMESA-N 416.566 2.115 10 20 HECD COC[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807448612 UPQKYNALTGJHNU-YOEHRIQHSA-N 413.465 2.160 10 20 HECD COCC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccco1 807899488 STPWZOGYRTWGNF-ROUUACIJSA-N 416.474 2.387 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)C1=CCN(C)CC1 809710819 ZHDLIGNJUXJLEI-ZDUSSCGKSA-N 424.339 2.270 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnn(C)c1I 815729471 WCECGHVJXKJJDG-UHFFFAOYSA-N 412.231 2.130 10 20 HECD Cc1sc(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 871792968 VCZQAIUOJYQXFY-UHFFFAOYSA-N 410.517 2.412 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc2nc(O)nc(O)c2c1 906486382 BKPDSAAQNXQUGF-UHFFFAOYSA-N 402.476 2.318 10 20 HECD CC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)CC1 1783606264 ITCLSJWNMCQLOT-XCGNWRKASA-N 417.506 2.153 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C3)C4)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790245530 KPCQHZDCEJQSAQ-GRDLGNPVSA-N 420.893 2.145 10 20 HECD Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808752158 VSMAXDVMGBBWFZ-FOIQADDNSA-N 421.457 2.158 10 20 HECD CCN(C1CCN(C(=O)NCc2c(C)c3ccccc3n2C)CC1)S(C)(=O)=O 472281584 ULRHBSQPVSAWEO-UHFFFAOYSA-N 406.552 2.442 10 20 HECD CSCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 726194674 OLTXAUPANVZKBP-UHFFFAOYSA-N 411.461 2.194 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CN3CCC[C@H](C)C3)CC2)cc1 726239763 YHNGAZKZABSAJF-PMACEKPBSA-N 417.598 2.237 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1F 731356848 WWIHOQQAEAPBTJ-UHFFFAOYSA-N 419.478 2.376 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N(CCO)CCc1ccccc1 733037547 DUIINFHRXGFZKM-UHFFFAOYSA-N 401.482 2.409 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 733311316 IBAWSXCADGXDGZ-UHFFFAOYSA-N 423.560 2.016 10 20 HECD COc1cc(F)c([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 734015990 CVACGNPSESHPEM-SNVBAGLBSA-N 412.439 2.411 10 20 HECD C[C@@H]1CC(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 742096296 VUJZEHMYHVGPHG-SLQMCABGSA-N 423.585 2.467 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC3CC(C)(C)NC(C)(C)C3)CC2)cc1 742948016 LEEDYBOXFCDKNC-UHFFFAOYSA-N 417.598 2.426 10 20 HECD O=C1C[C@H](N2CCN3C(=O)NC[C@@H]3C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 751925736 SXMGBTKNCXGQIZ-MOPGFXCFSA-N 418.457 2.443 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)cc2)C1 754127477 JVKXVCMWMTYILE-VBSBHUPXSA-N 412.534 2.145 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)n1 756160995 UDBIJJMNSNSKIC-UHFFFAOYSA-N 400.454 2.054 10 20 HECD C[C@H]1CCCN(C(=O)C2CCN(C(=O)CN(C)c3ccc4c(c3)OCO4)CC2)C1 756646373 VMIKUICZAVLRTA-INIZCTEOSA-N 401.507 2.349 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NC[C@H]3CCCCO3)CC2)cc1 758183736 JUEXXQYFDGXJHD-HXUWFJFHSA-N 406.596 2.241 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CCS(C)(=O)=O)cc2F)C[C@H](C)O1 762014048 ZDRXQBJMSCUUHP-ILXRZTDVSA-N 415.531 2.062 10 20 HECD CCN(CC(=O)N(C)C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764190987 BZECEYXLGWRYSJ-CQSZACIVSA-N 407.470 2.199 10 20 HECD CNC(=O)COc1cccc(CNC(=O)NCc2cccc(Br)c2O)c1 764765519 VEKYZQUUBFDBRA-UHFFFAOYSA-N 422.279 2.279 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)[C@H]4CCCN4C)CC3)c2C)cc1 766333130 GPEAZLFNASTCPK-JOCHJYFZSA-N 424.545 2.481 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1OC 768439723 MXZXKDCKQKMPNN-UHFFFAOYSA-N 407.448 2.337 10 20 HECD COc1cc(CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C2CC2)ccc1O 770035553 PBYGOWKDVXDPQT-UHFFFAOYSA-N 406.460 2.283 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCCS1(=O)=O 773408102 QESUGKLQBBIDCB-NVXWUHKLSA-N 400.928 2.094 10 20 HECD Cc1ccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1Br 776415335 LKXDQROTHDMRRV-UHFFFAOYSA-N 410.293 2.218 10 20 HECD COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NCc1ccccc1O 781478926 XVIVVPYPESXMME-UHFFFAOYSA-N 407.220 2.196 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCCC3=O)cc2)cc1 785422316 JQZQEGAGXVMZFP-UHFFFAOYSA-N 408.502 2.202 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(-n2ccnc2)nc1 785989535 YNKBWQBVFCJVKI-UHFFFAOYSA-N 420.517 2.387 10 20 HECD CCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 787209189 NRNVXABNQYKGHK-UHFFFAOYSA-N 411.502 2.245 10 20 HECD CN(C)CCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788931388 FCYNASOPOSICNP-UHFFFAOYSA-N 408.546 2.324 10 20 HECD C[C@@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC[C@H]1CCCO1 789009130 GUPJUNDKGFMVJQ-ZIAGYGMSSA-N 407.422 2.303 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1cc([N+](=O)[O-])nc1C 791247140 VZLWDTTUOWZEFZ-UHFFFAOYSA-N 417.466 2.488 10 20 HECD C[C@@H]1c2nncn2CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792371480 LBUOYUVCKKDDGE-CYBMUJFWSA-N 401.426 2.069 10 20 HECD CNC(=O)CNC(=O)c1cccc(NC(=O)NCc2c(O)ccc3c2CCCC3)c1 800596553 NRFBMWODDWJBRF-UHFFFAOYSA-N 410.474 2.069 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC 803662615 YYSMDDBYGBNCFG-UHFFFAOYSA-N 403.454 2.184 10 20 HECD CCOc1cc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1OC 803686411 KIEHWFIHRHJKCD-UHFFFAOYSA-N 411.502 2.409 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)NCc1ccc(N(C)C)cc1C)C2 806820562 FUPSCCNPHIKHEH-UHFFFAOYSA-N 416.547 2.237 10 20 HECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)o1 807289182 LKFXUBWGCYZFPV-FQEVSTJZSA-N 409.486 2.435 10 20 HECD C[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)Cc2ccccc2C(=O)O1 917833450 NWCFSAVTEYKZCZ-MHECFPHRSA-N 421.497 2.176 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCCN(CC(F)(F)F)CC1 918223677 HIZPFECZXDXXSB-UHFFFAOYSA-N 418.435 2.442 10 20 HECD CCOC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 920086611 DTMNBGIKTUKOOJ-CALCHBBNSA-N 423.529 2.329 10 20 HECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)C1 920090793 ILAOXDIWHSCEHH-CABCVRRESA-N 417.510 2.128 10 20 HECD O=C1c2ccccc2C(=O)N1CC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 1116441065 GROOWTRWJUXYIM-HXUWFJFHSA-N 408.454 2.326 10 20 HECD Cc1cc2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2n(C)c1=O 1327888363 UXOHRROKEKRELA-UHFFFAOYSA-N 401.444 2.176 10 20 HECD O=C([C@H]1C[C@@H]1C1CC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441190 RBAGMIMXOLMXJD-MSOLQXFVSA-N 406.486 2.029 10 20 HECD COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 7079759 GKLDFNARVNVDRW-UHFFFAOYSA-N 401.419 2.485 10 20 HECD Cc1cc(C(=O)CN2CCOCC2(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 110985493 RTTRIPKELLRUEF-UHFFFAOYSA-N 405.520 2.035 10 20 HECD Cn1cnc(-c2ccc(NC(=O)C3=S=C(S(=O)(=O)c4ccccc4)C=C3)cc2)n1 545919275 PFKXDEWQRLBJSG-UHFFFAOYSA-N 424.507 2.500 10 20 HECD COc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])cc3S(N)(=O)=O)CC2)cc1 726594616 RYRFPFGIYXZMIM-UHFFFAOYSA-N 406.464 2.332 10 20 HECD COc1ccc(OCc2nc(/C=C3/SC(=S)N(CC(N)=O)C3=O)cs2)cc1 727176363 QASUALNXDWHIHI-AWNIVKPZSA-N 421.525 2.417 10 20 HECD COC(=O)Nc1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 733138722 IISAEOWWOGHALK-UHFFFAOYSA-N 403.460 2.352 10 20 HECD COCCOc1ccc(-n2nc(C)c(C(=O)NCc3cccc(OC)c3O)n2)cc1 735115600 IZSGQCGUAGOMEU-UHFFFAOYSA-N 412.446 2.245 10 20 HECD Cc1ccc(NCCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c([N+](=O)[O-])c1 740142841 YAUMVRBSCQFNFN-UHFFFAOYSA-N 422.463 2.212 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC3(O)CCCC3)cc2F)C[C@@H](C)O1 740984936 MJRHEJRUMOXZML-HZPDHXFCSA-N 422.497 2.294 10 20 HECD COC(=O)Cn1ccc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 743165818 RUKMBYULMPXEDB-ZDUSSCGKSA-N 423.420 2.448 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1F 746864880 ZYHUWUNOHKBOBB-PKOBYXMFSA-N 419.497 2.490 10 20 HECD CSc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 751213762 XZKRHNZYPGIHJS-UHFFFAOYSA-N 412.558 2.444 10 20 HECD COc1ccc(N(C)CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1Cl 757855468 BLQPFKPLQLVWQY-UHFFFAOYSA-N 409.895 2.022 10 20 HECD COc1cc(N2CCN(C(=O)CCc3c(C)nn(C)c3C)CC2)cc(OC)c1OC 759240868 BXXAYGSWVVSHEJ-UHFFFAOYSA-N 416.522 2.344 10 20 HECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 759570269 RXHDDXIPIPBMMP-GHTZIAJQSA-N 424.549 2.477 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)cc1F 761287338 WQLAMBDBBVJXGW-UHFFFAOYSA-N 416.858 2.487 10 20 HECD CC(C)[C@H](CNC(=O)NCc1cccc(Br)c1O)N1CCOCC1 764759609 APJRNEOMGSDIHT-HNNXBMFYSA-N 400.317 2.311 10 20 HECD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1cccc(Br)c1O)C2=O 765752505 WZRKGRIWAYGDBF-ZMZPIMSZSA-N 424.295 2.272 10 20 HECD Cc1noc(C2CC2)c1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 767902750 UBZITESDRGYKCZ-UHFFFAOYSA-N 404.492 2.417 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2c2noc(C3CC3)n2)c1 769896211 UOWXPKFZMGBUER-CQSZACIVSA-N 406.464 2.392 10 20 HECD COc1cc(Br)cc(CN(C)C2CCN(S(C)(=O)=O)CC2)c1O 770325853 SLSCKQYEZCSOAQ-UHFFFAOYSA-N 407.330 2.019 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3C[C@@H](C(C)=O)C3(C)C)nc12 772658111 GMUGPFVKDPRYDJ-DOMZBBRYSA-N 403.435 2.296 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1csc(N2CCOCC2)n1 773725233 DTBLOVOTUHCNML-UHFFFAOYSA-N 416.547 2.017 10 20 HECD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)O1 775459741 GPRIHMUAJPLUOQ-UXHICEINSA-N 402.539 2.454 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](OCC4CC4)C3)CC2)cc1 778174387 RWHIFGXHMAUKBO-JTHBVZDNSA-N 403.567 2.069 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](N(C)C(=O)/C=C\c3ccc(O)c(O)c3)C2=O)c1 779529561 DZECAWPOVXVJCB-LZCIBIBXSA-N 412.442 2.392 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1c[nH]nc1-c1ccccc1 782778794 UVCULCIZCUCWNL-UHFFFAOYSA-N 405.458 2.168 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)cc1 785428783 RNSHOVZSHNJVSE-UHFFFAOYSA-N 413.493 2.104 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cn3c(n2)CCCC3)cc1F 788846840 KPGCTOZGZWLDIR-UHFFFAOYSA-N 415.513 2.180 10 20 HECD C[C@H]1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789854803 DOPCZJRAKMMVFU-IRXDYDNUSA-N 405.564 2.177 10 20 HECD CO[C@]1(C)CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 791556092 KGAKFLDXYZFTBQ-OAQYLSRUSA-N 419.547 2.425 10 20 HECD COCCOc1ccccc1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 793800269 CSHVVQGKDAXTAX-UHFFFAOYSA-N 411.502 2.027 10 20 HECD COc1ccc(CNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)c(O)c1 794388286 VHULVFGMECAWFJ-UHFFFAOYSA-N 408.401 2.276 10 20 HECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 798927051 OKMYQLAMFZCTLQ-QFIPXVFZSA-N 423.513 2.453 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cncc(-n4ccnn4)c3)cc2F)C[C@H](C)O1 801663300 MWHYJUUKJLQPGB-GJZGRUSLSA-N 410.453 2.345 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C 804570028 AGAXVOQWKGOONT-MRXNPFEDSA-N 422.529 2.497 10 20 HECD CCOC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 804851570 HFXYJWZZYHLBIL-UHFFFAOYSA-N 407.486 2.090 10 20 HECD COC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(C)o1 806779621 QFFITLZAARMEJS-ZWKOTPCHSA-N 416.474 2.305 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1 807100777 QMSKQSOSILMIMC-UHFFFAOYSA-N 418.538 2.241 10 20 HECD O=C(NCCCN1CCCC1)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 809731673 MXCBDHODDZZMFV-UHFFFAOYSA-N 414.594 2.337 10 20 HECD Cc1cc(C(F)(F)F)nn1CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 811243386 WLFFGFAMUMZVAT-UHFFFAOYSA-N 412.412 2.478 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@](C)(O)C3CCC3)cc2F)C[C@@H](C)O1 812665446 SGZRTTPXGHYPSY-HLFMIMNKSA-N 422.497 2.150 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(C(=O)N(C)OC)CC3)CC2)cc1 813059036 SCXBRTZNQJLNKZ-UHFFFAOYSA-N 404.511 2.105 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(CS(C)(=O)=O)CC3)CC2)cc1 813621816 GJYVGMZXYKSHLE-UHFFFAOYSA-N 409.552 2.130 10 20 HECD Cc1ccsc1Cn1nccc1N/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 814316363 KYTIHOSZIPKYEF-MDWZMJQESA-N 403.533 2.496 10 20 HECD CN(CCO)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 864049576 KVRKNBGSOWZWIZ-XYOKQWHBSA-N 415.334 2.101 10 20 HECD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCc1ccc(N(C)C)cc1 919808084 QWCPUHHBAZDXJU-OAHLLOKOSA-N 420.491 2.422 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnc(Cl)s1 1796601511 RUBVEHRHINBUIJ-JGPRNRPPSA-N 408.867 2.168 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c[nH]1 1797145693 KGSZZSZPRAHXJE-ZURAMSNBSA-N 411.458 2.405 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC2(CCC2)C1 1803391108 AVOCIGQDQKZZTD-QDMKHBRRSA-N 421.588 2.065 10 20 HECD C[C@H](CN)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708877 SBPATEJRWCAQIU-SCZZXKLOSA-N 424.910 2.028 10 20 HECD O=C(C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccco1 1848123640 KHMMNMAAQIKDQM-STQMWFEESA-N 404.806 2.043 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CC[C@H](C(F)(F)F)NC1=O 195683683 LFCRQUZLFCUGGL-HUUCEWRRSA-N 401.454 2.313 10 20 HECD COc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)N(C)C 437022278 UDBMJRJLQOIEIB-UHFFFAOYSA-N 419.503 2.051 10 20 HECD CCOc1ccc(CNCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)c1 725841604 ITQSLSIFKUREKM-UHFFFAOYSA-N 406.504 2.102 10 20 HECD COc1cccc(O)c1CNCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 725849128 ILUXDAGHPANWMS-MRXNPFEDSA-N 406.504 2.148 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCNC(=O)C1CCCCC1 726045127 XCJXUTDRBOTTHX-UHFFFAOYSA-N 403.523 2.341 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1O 727761271 RQMPHDATGZXFSW-YEJXKQKISA-N 403.479 2.154 10 20 HECD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 729259674 SWLHTODYMRFEQZ-UHFFFAOYSA-N 423.517 2.328 10 20 HECD CN1CCCc2cc(CNC(=O)N[C@H]3CCN(c4ccccc4C(N)=O)C3)ccc21 732575603 FTSXFODICBSJEM-SFHVURJKSA-N 407.518 2.246 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c1 734018435 RDHPHTSHETXIOE-AWEZNQCLSA-N 421.519 2.090 10 20 HECD COc1ccc(C(=O)NCCN2CCN(Cc3ccc(N(C)C)c(F)c3)CC2)cc1 736647119 FKODBQOWTMRJFA-UHFFFAOYSA-N 414.525 2.448 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 741079648 MQKJDKQUGLNYJH-AZUAARDMSA-N 423.579 2.050 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCCN(C)C3)cc2F)C[C@@H](C)O1 741249157 CPQQKQPAPGORCA-QWFCFKBJSA-N 420.573 2.329 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc3c(c2)C(=O)NC3=O)cc1 741679112 KCECIKJAODKKGG-SFHVURJKSA-N 407.470 2.458 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742563115 FLPDAOICKJEYFA-QCFAMHMHSA-N 413.518 2.042 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCN([C@@H](C(N)=O)c4ccccc4)CC3)ccc21 746982985 KIXCJLPDPMTSQO-JOCHJYFZSA-N 421.545 2.123 10 20 HECD Cc1ccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)nc1 761784386 BVCPWEBIFMWQRR-OVCLIPMQSA-N 405.526 2.439 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 762275039 LVNQNZRMVDIEJI-INIZCTEOSA-N 408.458 2.185 10 20 HECD C[C@@H](N[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765422606 ANNPSGPFZRBLTE-HUUCEWRRSA-N 401.960 2.251 10 20 HECD CS(=O)(=O)c1nc(C(=O)NCc2cccc(Br)c2O)c2ccccn12 765727379 NEMFMPJSGHFCPM-UHFFFAOYSA-N 424.276 2.136 10 20 HECD CCOC1CC(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)(N2CCOCC2)C1 767888441 TZDQIMTYSBHUFR-FPPRHVDESA-N 407.511 2.031 10 20 HECD C[C@H](NC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(N2CCOCC2)cc1 767937858 ITAUBUZZSPPNKS-MTNREXPMSA-N 416.566 2.261 10 20 HECD C[C@@H](NC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1)c1ccc(N2CCOCC2)cc1 768977957 USQIVBIJOSJKDA-IQMFZBJNSA-N 422.485 2.069 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 773740195 OHOXRZYNXLSAPO-XJKSGUPXSA-N 412.442 2.179 10 20 HECD O=C(Cc1csc(N2CCOCC2)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 774067517 XBOGDCJDIAXLKI-SFHVURJKSA-N 417.531 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc4onc(C)c4c3)CC2)cc1 778253297 GCUYLTDKLPWCIV-FPLPWBNLSA-N 421.457 2.383 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@H](O)c3ccccc3)CC2)cc1 778296127 WZIIBUKAIUQCLL-VDZCTEQFSA-N 423.513 2.140 10 20 HECD NC(=O)c1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 778387995 TXZMAUYUZHPPGK-YRNVUSSQSA-N 421.529 2.190 10 20 HECD CC(C)[C@@H]1C[C@@H](CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCO1 781951821 QOSAKAZJAQYCEO-ICSRJNTNSA-N 408.564 2.379 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 785296039 AZESZZIHBWHXQL-ZDUSSCGKSA-N 413.474 2.312 10 20 HECD O=C(NCCn1cnc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786988708 ZSNOMZCJAXUFKZ-GOSISDBHSA-N 422.485 2.066 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1)c1ccc(N(C)C)cc1 787979736 PMRYUTPUMTWDKA-GCJKJVERSA-N 424.545 2.120 10 20 HECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788928678 BOOICBJIDGVUDY-CEXWTWQISA-N 400.567 2.386 10 20 HECD CN(C)c1ccc(CNCc2ccc(C(=O)NCC(N)=O)cc2)c(C(F)(F)F)c1 793042125 GPMJOBBCPSFLPE-UHFFFAOYSA-N 408.424 2.276 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCC(=O)NC2CCCCC2)cc1 793762102 QFUMSFWCIGBEMK-UHFFFAOYSA-N 416.566 2.446 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2OC)c(O)c1 794379291 OGHTXMVPDFROJJ-GOSISDBHSA-N 414.458 2.339 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CN(C)Cc2ccccc21)c1ccc(N2CCOCC2)cc1 803303163 YHXQFZMDTMKOAI-VGSWGCGISA-N 422.529 2.003 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc2c(c1)CC(=O)N2C 803688570 UVQBKBHTCRJCHI-HNNXBMFYSA-N 420.513 2.082 10 20 HECD Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NCc2ccccc2O)c1=O 806880351 QZTJUIOUWALGKM-UHFFFAOYSA-N 409.417 2.305 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(C2CC2)CC1 809866293 PYKXRJQJBQDMHL-UHFFFAOYSA-N 400.567 2.480 10 20 HECD O=C(NC1CC1)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 812012448 YOEMBBDSSOUXTE-FQEVSTJZSA-N 416.522 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H](C)n3nc(C)cc3C)CC2)cc1 919312441 XLIBQPOPMIUQNX-GOSISDBHSA-N 414.506 2.352 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O 1330104263 MNOYXJRCSMNFJZ-GOSISDBHSA-N 421.538 2.146 10 20 HECD C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602523 OECHAEGHOGOGPN-RUGDWHBFSA-N 410.474 2.018 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3CNC(=O)C3)C2)cc1 1845999412 CAAJKGCRMIGRFW-IBGZPJMESA-N 420.513 2.047 10 20 HECD C[C@]1(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)CC1(F)F 1847037199 HEIUXPUKUJECTJ-MJICGBHWSA-N 408.401 2.065 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2CC(F)(F)C2)=NN1c1ccccc1 1847330445 OKGLFLXWLHUIPE-IRXDYDNUSA-N 416.428 2.026 10 20 HECD CN(C)CCOc1ccccc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 726235816 GAXLXIMXYWLFDP-UHFFFAOYSA-N 412.534 2.463 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1nc(-c2ccccc2)n[nH]1 729814415 QAIRNHHBLDSFRK-UHFFFAOYSA-N 410.453 2.447 10 20 HECD CCC(=O)N1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730132914 IRCXURXBBDGPCM-UHFFFAOYSA-N 419.545 2.122 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 734065473 BWAJZSAJYRJWIY-MRXNPFEDSA-N 412.490 2.102 10 20 HECD Cc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1[N+](=O)[O-] 740609314 HNMCIPYFCWZBAV-UHFFFAOYSA-N 418.475 2.406 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc21 741099542 DSKJIKKKSCMLMJ-UHFFFAOYSA-N 419.485 2.314 10 20 HECD CC(=O)NC(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742751572 VGLKUULHXGBMSI-KRWDZBQOSA-N 406.527 2.349 10 20 HECD CN(c1ccc(CNC(=O)NCCOCCS(C)(=O)=O)cc1)C1CCCCC1 743566812 KHRNAEIURRMLOW-UHFFFAOYSA-N 411.568 2.316 10 20 HECD O=C(CN1CCC[C@@H]1C(=O)NC1CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386691 OPMBOMVMFBDZHB-HXUWFJFHSA-N 417.465 2.144 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(C[C@H]2CCOC2)CC1 749554265 POBLUOVPIMFIED-LJQANCHMSA-N 404.580 2.104 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)c1O 750817530 OTGCNPNBSWMEOB-UHFFFAOYSA-N 400.406 2.421 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 751715394 OSKUIHYGZUXEGA-ZACQAIPSSA-N 422.497 2.415 10 20 HECD C[C@@H](Sc1nnnn1C1CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752150978 DBXQETFREAWXJT-CJNGLKHVSA-N 403.508 2.402 10 20 HECD CCNC(=O)c1cccc(NC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753857903 QUMTUCHDXUTUMQ-UHFFFAOYSA-N 414.481 2.345 10 20 HECD COc1c(F)ccc(F)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 755198661 LXKFRDVGHJXVOL-UHFFFAOYSA-N 410.442 2.138 10 20 HECD CN(C)C1CCN(CCNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 759582912 AGGYENVKMCYMAC-HXUWFJFHSA-N 404.555 2.109 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](N2CC(=O)Nc3ccccc32)C1 759891942 DIZBLFNJYTXIBX-FQEVSTJZSA-N 421.545 2.244 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(OCCF)c1 760095853 CISMZCGKAFQLFL-UHFFFAOYSA-N 401.438 2.126 10 20 HECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)N(CC)Cc1ccc(N(C)C)cc1 764895209 PMPDHPFKCQDBLB-HXUWFJFHSA-N 407.522 2.389 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)s1 766207519 PBNPSUGPZLMSIY-UHFFFAOYSA-N 406.279 2.481 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)Cc2cccc(Br)c2O)C1 769304681 BGHRLINYVSWBJS-AWEZNQCLSA-N 413.312 2.388 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c1 772632585 ZNGLVLGETQRPJR-GFCCVEGCSA-N 413.521 2.109 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772714163 NFLVUKBPMISTGP-PMACEKPBSA-N 424.563 2.047 10 20 HECD COc1c(C)cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 773254753 GKBYGWDVYKUJBS-UHFFFAOYSA-N 402.516 2.477 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3CCCCCCC3)cc2)C1 774588777 XQHDHXVLOLEPAY-GOSISDBHSA-N 414.550 2.234 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)c1 775528565 ZLKSOKGPTIMQRT-CYBMUJFWSA-N 424.461 2.316 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O 779540633 BGVUIWRYAGLENB-XBXARRHUSA-N 404.444 2.240 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1 785296148 CBLYRBFFMATCBP-JTQLQIEISA-N 413.352 2.120 10 20 HECD CO[C@H](C)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 787412607 GKVDYZSDKSCFQL-NWDGAFQWSA-N 423.447 2.254 10 20 HECD CCO[C@@H]1C[C@@](O)(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 788756325 KECRQGJVMQFGRI-ZWDAVXSWSA-N 405.539 2.450 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H]([S@](=O)CC)C2)cc1 788928240 CIAJLLHYBVUDAX-CMHSWVJJSA-N 407.580 2.345 10 20 HECD CCCN(CC(C)(C)O)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789828927 ZENDTESXWLYDTN-HZPDHXFCSA-N 423.529 2.065 10 20 HECD C[C@H](COc1ccccc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793685790 KBAJVXIWCDNXEB-YLJYHZDGSA-N 412.486 2.484 10 20 HECD CNC(=O)[C@@]1(C)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 797432600 KGAJUVMEMVHKPO-ZSDSOXJFSA-N 406.502 2.107 10 20 HECD CCCN1CCC(N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 804317505 GFMKEVJPPWKYNI-UHFFFAOYSA-N 416.566 2.113 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2COC(=O)N[C@@H]2CCOC2)cc1F 806634288 JMCYPEFYIXVBRL-IAGOWNOFSA-N 422.501 2.471 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C 809404981 MCCWTFXZNSSJRF-LRDDRELGSA-N 424.339 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C3CC3)C(F)(F)F)CC2)cc1 813837980 CHVKUFJPJPFCHI-SGQUHAKNSA-N 411.424 2.357 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 916106968 MJMVOQYLSQUMRN-UHFFFAOYSA-N 412.489 2.410 10 20 HECD CC(C)[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCOCC1 916254153 IWHOPKKDZWGTRT-WOJBJXKFSA-N 405.539 2.440 10 20 HECD COC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)s1 917735807 WUPNBPUBUFPKRS-UHFFFAOYSA-N 424.909 2.360 10 20 HECD Cc1ccc(NCCCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1 918118293 YARSFEFWYBAQIZ-IBGZPJMESA-N 424.549 2.393 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3O)cc2F)C[C@H](C)O1 918138762 RRDKGAOGDWZJTN-RYUDHWBXSA-N 404.398 2.378 10 20 HECD COC(=O)c1ccc(CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918201071 CWOCZJMEYBXACM-UHFFFAOYSA-N 415.465 2.491 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCN1C(=O)COc2ccccc21 1340010587 FPMSDCJSHYWFBU-UHFFFAOYSA-N 415.833 2.235 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cc1F)c1cc(O)nc(O)c1 1799750617 YZUZGRKHORSTDN-BTTYYORXSA-N 403.385 2.337 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)sc2C)cc1 327311266 OGXFOFNYDMKJMY-UHFFFAOYSA-N 404.491 2.317 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729032965 FIMKPXMULLSWNZ-LBPRGKRZSA-N 401.419 2.186 10 20 HECD COc1ccc(-c2n[nH]c(CNC(=O)NCc3ccc(N4CCOCC4)cc3)n2)cc1 732453636 ZPUVAYINNSARAL-UHFFFAOYSA-N 422.489 2.316 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(C)ccc3F)CC2)cc1 732923104 OHJCOYHDOIDPBM-UHFFFAOYSA-N 407.511 2.243 10 20 HECD COC(=O)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(Cl)c1 733822530 HKXXCXBAPZQVBI-HNNXBMFYSA-N 413.835 2.488 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c1 734014949 NYYDCENLRFHTRP-AWEZNQCLSA-N 424.544 2.488 10 20 HECD Cc1cc(-n2cncn2)ccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 742049776 ATJXXNQRBMHABJ-SFHVURJKSA-N 418.501 2.207 10 20 HECD C[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)n1cncn1 742750825 QFGWDQFGOLNDEL-RHSMWYFYSA-N 402.499 2.287 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1C[C@]12CCc1ccccc12 743313042 JEMNBFCRDDIRAW-GGAORHGYSA-N 410.539 2.442 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)C2CC2)cc1 745830758 PYKPWOHMTFCNEY-GOSISDBHSA-N 401.555 2.014 10 20 HECD Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(N(C)C)n1 750216539 UPWJADRLMCZEKH-QGZVFWFLSA-N 412.490 2.308 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(N)cc1F 751626458 KRBJQGXYPFOJMI-UHFFFAOYSA-N 419.428 2.165 10 20 HECD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1F 752510966 BDURFOAXAWVOEJ-UHFFFAOYSA-N 423.535 2.217 10 20 HECD COc1ccc(N2CCN(CCOc3cccc(S(C)(=O)=O)c3)CC2)cc1F 753860605 KIFVEBIYVHIEJF-UHFFFAOYSA-N 408.495 2.439 10 20 HECD COc1ccc(N2CCN([C@H](C)C(=O)NC(=O)NCc3ccccc3)CC2)cc1F 753861333 QNZXMJDETXPBDH-MRXNPFEDSA-N 414.481 2.371 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3c(F)cccc3[N+](=O)[O-])CC2)cc1F 754040656 WRNUOBMDXZZOHE-UHFFFAOYSA-N 413.402 2.393 10 20 HECD COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)sc1S(N)(=O)=O 756078474 CITOPIIEPGMAAL-UHFFFAOYSA-N 409.533 2.275 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)CC1 756326320 GHXZJZMQMZBPAX-LJQANCHMSA-N 404.507 2.175 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](c3cccs3)N(C)C)CC2)cc1 758188093 YHLAOQRTZMCJOH-CTNGQTDRSA-N 418.607 2.132 10 20 HECD Cc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(O[C@@H]2CCOC2)c1 759095391 XNLYPUGJDSSRII-MRXNPFEDSA-N 420.487 2.170 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc(C(=O)O)c1F 761259276 MAFQXQQKUAOMAP-UHFFFAOYSA-N 408.451 2.147 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)c(F)c2)cc1OC 761948203 BYGSAQPAJVCJGF-UHFFFAOYSA-N 423.875 2.445 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccncc3Br)nc12 764148959 JBTYNHGFTPFMND-UHFFFAOYSA-N 421.207 2.126 10 20 HECD CSCC[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 767774138 KHFZOOPSKRBDCG-OWCLPIDISA-N 420.531 2.053 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3c(=O)oc4cccnc43)cc2F)C[C@@H](C)O1 768518105 NDFCYECBJUZNIE-ZIAGYGMSSA-N 414.437 2.059 10 20 HECD Cc1ccc(N([C@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2cccc3nonc23)cc1C 775150876 CCYQMZUULTUCGD-HNNXBMFYSA-N 419.484 2.346 10 20 HECD CS[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H]1N(C)C 776002082 RTQMVIRVSYDRSV-PMACEKPBSA-N 423.538 2.378 10 20 HECD C[C@@H](C1CC1)n1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 778544242 XQGJGMCGGKIHCB-INIZCTEOSA-N 411.506 2.288 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCOCC2)cc1)[C@@H](C)C(=O)OC(C)(C)C 781529450 OATIKLMVBYBCBZ-KRWDZBQOSA-N 405.539 2.192 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(N2CCOCC2)cc1 785432434 CFVLWWLQGVERIU-QGZVFWFLSA-N 410.518 2.083 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c(OC)c1 785466210 LJFFJSRPTUTVDM-UHFFFAOYSA-N 420.487 2.001 10 20 HECD CN(CC1(c2ccccc2)CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321529 WRESCQHBUMFKAG-UHFFFAOYSA-N 407.514 2.330 10 20 HECD CCC(O)(CC)CCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820134 PMENLIOPGHXPIP-HZPDHXFCSA-N 423.529 2.113 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)ccc1O 790406039 BEIMCBYHJGXFKF-UHFFFAOYSA-N 410.395 2.120 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c(O)c1 797389390 FISCESDTSJNZKK-UHFFFAOYSA-N 411.458 2.104 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)CC1 799184534 QAPMHRWSNNFCGG-UHFFFAOYSA-N 417.516 2.194 10 20 HECD CCCS(=O)(=O)c1ccccc1S(=O)(=O)CCN(C)Cc1ccccc1O 799308023 SPAGBMFCNJQRDN-UHFFFAOYSA-N 411.545 2.482 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4cccc(F)c4C3)CC2)cc1 801583857 QPMQJTDPHCEQCL-LJQANCHMSA-N 415.509 2.212 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 803390431 YEUKOIPZDXJFOF-UHFFFAOYSA-N 420.531 2.448 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OCC3CC3)nc2)cc1F 803571942 YAJWSHZLEZXZGB-UHFFFAOYSA-N 400.454 2.008 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)c(C)n1-c1ccccn1 804186081 DVGMEVTXDXHEAU-KRWDZBQOSA-N 404.536 2.233 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CC[C@H](C(=O)N2CCCC2)C1 804968763 JQIMESSXKKNJFT-SFHVURJKSA-N 402.564 2.394 10 20 HECD Cc1nc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c(Br)n1C 804975589 PYDURBZGCPXXLO-UHFFFAOYSA-N 405.293 2.175 10 20 HECD CC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 805006652 AIWIQUIWPRQKQY-KRWDZBQOSA-N 404.530 2.232 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C(=O)N1c1ccccc1 806279532 RHKCHFSGJSZOLF-DZGCQCFKSA-N 418.544 2.052 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 806282425 KRWGAJNZEMWIDB-KGLIPLIRSA-N 409.533 2.449 10 20 HECD COCc1cnc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 806882230 JDBKNHSIPOLHEZ-UHFFFAOYSA-N 404.492 2.022 10 20 HECD CN1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809866050 JFKGWDKQXJJPII-ICSRJNTNSA-N 417.550 2.136 10 20 HECD COc1ccc2c(c1)C1(CC1)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 812358407 ITQYZVFHVIOLKY-UHFFFAOYSA-N 402.472 2.460 10 20 HECD Cn1ncc(I)c1C(=O)NCCCSc1nccs1 815591087 VXWOOEKFZDCNMP-UHFFFAOYSA-N 408.290 2.393 10 20 HECD CC(C)c1noc(CCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 1318361124 KXMZOPUDFMDLDX-UHFFFAOYSA-N 401.511 2.444 10 20 HECD Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1795112115 GSFBVBLVFWBBRI-BTTYYORXSA-N 404.854 2.050 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(F)(F)F)C1=NN(c2ccccc2)C(=O)C1 1795840841 PQXVSAAUYQVCML-YOWGUQMCSA-N 422.407 2.370 10 20 HECD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845899199 AODAFLPPOVLYEK-AWEZNQCLSA-N 413.449 2.328 10 20 HECD O=C(CCC(=O)N1CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565571 CZRSDSCILZKYBC-UHFFFAOYSA-N 411.449 2.012 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc4c(c3)C(=O)OC4)CC2)cc1 726601586 NMKYBQKGNPNGFW-UHFFFAOYSA-N 402.472 2.313 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1 726855919 ZAAZTHFUJLIVGS-UHFFFAOYSA-N 400.454 2.368 10 20 HECD Cc1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 728937735 JJFVVTWOXWZGKG-GDBMZVCRSA-N 422.478 2.082 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)C[C@H]3CCCN(C)C3)cc2F)CC1 734669932 XLWVWCHDWOVTMW-IBGZPJMESA-N 405.562 2.451 10 20 HECD COc1ccc(N2CCN(CCNc3ccc4nnc(C(F)(F)F)n4n3)CC2)cc1 742928571 WJNFDBZRAMVRIZ-UHFFFAOYSA-N 421.427 2.386 10 20 HECD O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)N(Cc1ccco1)Cc1ccccc1O 743428960 SYOBHKGFVFCYIB-VURPSTOHSA-N 424.453 2.067 10 20 HECD O=C(COC(=O)c1ccc(CO)o1)Nc1cccc2c1C(=O)c1ccccc1C2=O 745381518 QVWMBKUAAINVOF-UHFFFAOYSA-N 405.362 2.343 10 20 HECD C[C@H](c1ccccc1)[C@](C)(O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 747364115 NAMWKEYFGNIDHY-VGSWGCGISA-N 416.543 2.092 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nc2nc(O)nc(O)c12 752147884 CRSUNLCUAIEMTK-CQSZACIVSA-N 410.430 2.271 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1nnnn1-c1ccc(OC(F)F)cc1 759587759 FCFSXWVGEFCEPE-KRXBUXKQSA-N 404.329 2.432 10 20 HECD Cn1cc([C@@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 766776886 MSVIPDXRXWTCMY-RTWAWAEBSA-N 413.522 2.054 10 20 HECD O=C(Cc1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768439356 GFZVREGFQRWJRK-LJQANCHMSA-N 402.878 2.358 10 20 HECD COc1cccc(OCCN2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c1 768462947 PFOKFXKWAIIDLM-NRFANRHFSA-N 400.475 2.023 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H]3CN(C)CC[C@@H]32)c1 768498397 JBECZRGVBAUHML-AVRDEDQJSA-N 401.551 2.343 10 20 HECD NC(=O)[C@@H]1CCCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769958451 QMUQIKCHRYOLEU-TZMCWYRMSA-N 423.516 2.028 10 20 HECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)c1c(F)cccc1F 770043607 YCRTXQRRGVNKGA-YOEHRIQHSA-N 414.430 2.284 10 20 HECD CCOC(=O)c1nn(C)cc1CNCc1ccc(N2CCN(CC)CC2)c(F)c1 770655523 YESCNTPUHHMVTF-UHFFFAOYSA-N 403.502 2.168 10 20 HECD O=C(COc1cc(F)cc([N+](=O)[O-])c1)NCc1ccc(N2CCOCC2)c(F)c1 771144143 OIONKBHLZCYLOQ-UHFFFAOYSA-N 407.373 2.405 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCn3ccnc3)cc2F)C[C@H](C)O1 774738249 OATBZRDEHAXFSI-ROUUACIJSA-N 417.529 2.274 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1C 774753168 IITNFCZLUIBAOF-SPYBWZPUSA-N 405.514 2.344 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3nnc4n3CCCCC4)cc2)CC1 775227299 XEDADKSVZQLREJ-UHFFFAOYSA-N 424.549 2.173 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)COc3ccccc3)CC2)cc1 778244047 BLCRWUQDWCAWFC-HSNDNRACSA-N 423.513 2.484 10 20 HECD CC(=O)N[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 779378315 NAGRSIGPZGADKW-FQEVSTJZSA-N 422.437 2.104 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](OCC4CC4)C3)cc2)C1 779536196 KRZFPZHFNMVTCQ-PZJWPPBQSA-N 414.550 2.489 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](O)CCc1ccccc1 784222165 LQOUKFUUMXSSSV-LJQANCHMSA-N 401.482 2.455 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 785432624 FVHIROUKONPOMJ-LJQANCHMSA-N 403.429 2.247 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)cc1 785439302 NMWRHEUEBVCBNR-UHFFFAOYSA-N 414.550 2.056 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C[C@H]2CCCO2)CC1 787107504 MSCIKDQPOWWKQQ-HXUWFJFHSA-N 417.550 2.281 10 20 HECD COc1ccc(CNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c(O)c1 792819177 HCTYLVRPNFWPKM-UHFFFAOYSA-N 413.474 2.100 10 20 HECD CN(C)c1ccc(CNCCS(=O)(=O)N2CCSCC2)c(C(F)(F)F)c1 792967564 ZVWZJPBWBBDPIM-UHFFFAOYSA-N 411.515 2.240 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(CCO)[C@H]3CCc4ccccc43)ccc21 803689226 MZCAKLDSPFPFSH-QFIPXVFZSA-N 407.514 2.194 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 807096402 CHHNMMSELTTZDZ-UHFFFAOYSA-N 423.492 2.361 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O 807098531 XMTFQAHGKMUCRU-HXUWFJFHSA-N 414.550 2.117 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NOC3CCOCC3)cc2Cl)C1 807953449 SKQKFEKVOWOVBG-CQSZACIVSA-N 409.914 2.419 10 20 HECD O=C(NCCC[C@H]1CCCCO1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807994834 VBWHGDRPMXDONO-MOPGFXCFSA-N 404.507 2.365 10 20 HECD CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@](C)(C(F)(F)F)O1 818189680 NWGHQTCRGDEKNU-HNNXBMFYSA-N 410.414 2.336 10 20 HECD Cc1cccc(C)c1OCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334478 GZHSMNJKGMRUAG-UHFFFAOYSA-N 402.516 2.233 10 20 HECD C[C@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971092 NRPLBZSCQMCFRJ-ZDUSSCGKSA-N 405.495 2.283 10 20 HECD Cn1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)c(-c2ccc([N+](=O)[O-])cc2)n1 920397541 OJUKHXNAMBKLRC-WUXMJOGZSA-N 404.429 2.281 10 20 HECD C[C@@H](NS(=O)(=O)c1cccs1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920887055 YRNUUWJMDWKZIS-HUUCEWRRSA-N 423.560 2.129 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCCS1 1823013798 MOEXAPMAQHPHFL-UONOGXRCSA-N 417.491 2.417 10 20 HECD Cc1cc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2[nH]1 1845715082 YEFBWNKDKHFHIN-UHFFFAOYSA-N 406.442 2.413 10 20 HECD C[C@@H](OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)NC1CC1 5452756 MZARZOMPOUQEJR-SNVBAGLBSA-N 408.366 2.194 10 20 HECD Cc1nc2ncnn2c(C)c1CCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 302924295 BLXXXYXFBFWNJU-UHFFFAOYSA-N 422.533 2.199 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc4nc(O)[nH]c4c3)CC2)cc1 726601914 VIYIUCYYTRGQDU-UHFFFAOYSA-N 402.476 2.224 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(CC4CC4)C3)cc2F)CC1 731120556 DCVCQOOZAMKKOI-LJQANCHMSA-N 403.546 2.251 10 20 HECD COC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 733196315 APTJWEHSSOQTIN-JENIJYKNSA-N 407.530 2.414 10 20 HECD CC(C)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)NC(=O)OC(C)(C)C 734558400 SMMNZFSORJQOLS-CQSZACIVSA-N 415.512 2.043 10 20 HECD CC(C)CONC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 749792313 PCSHFFSEWGWDDN-UHFFFAOYSA-N 402.474 2.329 10 20 HECD CCOCCO[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 750260651 BDMWJPDIIPCFSX-SFHVURJKSA-N 409.502 2.124 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cccc4cccnc34)c2)CC1 751213590 RQEHZBQVYQFBPZ-UHFFFAOYSA-N 417.512 2.270 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OCCO3)cc1Cl 751268903 IVRYSNIDZZZJFJ-UHFFFAOYSA-N 418.880 2.284 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCn2cc([N+](=O)[O-])cn2)cc1 751406473 PXAIDMDRUHDBLY-LJQANCHMSA-N 401.467 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@]3(C)CCCO)CC2)cc1 755732154 XFPMTZNVMQPTRB-ZUTVHTERSA-N 415.534 2.054 10 20 HECD COC(=O)CS(=O)(=O)Cc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)cc1 756757525 OKZSKLICKUSTFB-ZDUSSCGKSA-N 422.459 2.239 10 20 HECD CCN1CCN(c2ccc(CNC(=O)COc3c(C)nn(C)c3C)cc2F)CC1 758483238 AVNNKHPGVZGGBR-UHFFFAOYSA-N 403.502 2.013 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCC(=O)C[C@H]4C)n3)CC2)cc1 771083838 TUPBGHNLQPVNPU-BEFAXECRSA-N 412.490 2.442 10 20 HECD NC(=O)c1cc(OC2CCN(C(=O)NCCCSc3nccs3)CC2)ccn1 772518289 ZTPFXBPOKZTCLU-UHFFFAOYSA-N 421.548 2.372 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc(N(C)C)cc1 773084625 RCOUASVMARICCE-HNNXBMFYSA-N 423.560 2.332 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)nc3Cl)CC2)cc1 774208605 JICMBFZWGNNNKP-UHFFFAOYSA-N 418.881 2.476 10 20 HECD Cc1ccc(Cn2nccc2NC(=O)C(=O)NCCc2ccc(O)c(O)c2)s1 774362664 CGXLWFASRQAJBE-UHFFFAOYSA-N 400.460 2.010 10 20 HECD O=S(=O)(c1ccc(CNCc2cc(Cl)cc(F)c2O)cc1)N1CCOCC1 775839056 MOHYXUJMTABEAO-UHFFFAOYSA-N 414.886 2.495 10 20 HECD CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 779331450 FYTXVRCLJJWXBT-YLJYHZDGSA-N 404.530 2.413 10 20 HECD O=C(COC(=O)c1ccc(Br)cc1-n1cncn1)c1ccc(O)c(O)c1 784406532 NBDLIBWSIZSEKV-UHFFFAOYSA-N 418.203 2.481 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(-n2ccnc2)nc1 786003310 ORKPKNLZLGPEDG-UHFFFAOYSA-N 407.474 2.418 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)nc3-c3cccnc3)cc2)CC1 786661647 VIDFSGHTOBXFSA-UHFFFAOYSA-N 418.501 2.081 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)N3CCc4ccccc4C3)cc2)CC1 787321749 IXIDZUICNVSROB-IBGZPJMESA-N 420.557 2.418 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788909979 JLMSVDABLVXTIY-MRXNPFEDSA-N 418.538 2.275 10 20 HECD COC[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)[C@@H]1CCCO1 791042140 QNCQCEUXDOEECV-SJORKVTESA-N 424.409 2.294 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803685442 AEWHQIZZKRTOEW-LJQANCHMSA-N 422.529 2.089 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCC[C@@H]3CCCCO3)CC2)cc1 804317139 SSQXNYJZACNJOW-FQEVSTJZSA-N 403.523 2.246 10 20 HECD CN(CCc1nc(-c2ccccc2)no1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 804468083 MTFMFZDDZQNRTI-UHFFFAOYSA-N 416.459 2.128 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](C)CC3)cc2F)CC1 805009558 LZMMXPULOFNHTE-KRWDZBQOSA-N 404.530 2.232 10 20 HECD COCCOC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805026315 JMNSQNFFNYECJT-FQEVSTJZSA-N 417.550 2.051 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 807674526 MKRIMPAUVRNUJS-KGLIPLIRSA-N 403.483 2.069 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1)c1ccc(N(C)C)cc1 807676297 DTKUBZDKSVLEJZ-UHOSZYNNSA-N 414.550 2.227 10 20 HECD C[C@@H](CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCCCC1 807701755 KXSOSYGPCUPXTA-ICSRJNTNSA-N 417.550 2.281 10 20 HECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 808932466 OBPNKZIHZKOIKL-GOSISDBHSA-N 423.561 2.448 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 814180595 MDWGIPNIQOKBBM-MOPGFXCFSA-N 414.550 2.008 10 20 HECD C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccc(Cl)c2nonc12 814378844 VHRQXFFIOYQNJH-GXSJLCMTSA-N 406.851 2.433 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn2ccnc12 815397301 PUBHQJUIZAVGFF-UHFFFAOYSA-N 409.515 2.451 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(O)nc2ccccc12 916676301 GAKGQTWLUSPGLY-UHFFFAOYSA-N 411.483 2.105 10 20 HECD O=C(CCc1nc2ccccc2[nH]1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676970 XJHYGWRXWJSKRG-UHFFFAOYSA-N 412.515 2.047 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3cccc(C)c3)CC2)cc1 920252786 PFDJVRMACBUVNA-ZHACJKMWSA-N 423.513 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nc4ccccc4[nH]3)CC2)cc1 920253154 RVJHVMYDWZPLCI-ZHACJKMWSA-N 405.458 2.415 10 20 HECD C[C@@H]1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H](n2cncn2)C1 1261582495 VELQSRYJJJOLFD-UXPWSPDFSA-N 403.552 2.032 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ncoc3[C@@H]3CCCO3)CC2)cc1 1321869129 XCHPKWBQPPJQPR-SFHVURJKSA-N 400.479 2.087 10 20 HECD O=C(O)[C@@H](Cn1ccc(C(F)(F)F)n1)NCc1ccc(N2CCOCC2)c(F)c1 1321925550 RYSNGMFIPCOFEI-CQSZACIVSA-N 416.375 2.121 10 20 HECD COC(=O)CC(C)(C)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1340963287 UUOUUYKGQXKLCP-HZPDHXFCSA-N 423.529 2.329 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncoc2c1)c1cc(O)nc(O)c1 1797616590 ZEYRHLUWKYGYMB-QDMKHBRRSA-N 408.414 2.200 10 20 HECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1816528985 QTNWCTJGDLBHKQ-CQSZACIVSA-N 412.406 2.132 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1cc(O)nc(O)c1 1817843722 WSUGVTFXMOHVTF-LJLKPOLSSA-N 415.425 2.414 10 20 HECD Cc1ncoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844090 PPMSQNWIARYXNL-CYBMUJFWSA-N 412.406 2.132 10 20 HECD COc1cc(C)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(C)c1 1843250496 GOOZXZDSOLAGJL-UHFFFAOYSA-N 411.458 2.249 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 23748170 VODXYJAYOLSVIT-QFIPXVFZSA-N 412.465 2.317 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1c[nH]n2c1nc(=O)c1ccccc12 108047118 NTWKPLQVWRYUNW-UHFFFAOYSA-N 417.469 2.285 10 20 HECD O=C(COC(=O)c1ccc2ncoc2c1)NCc1ccc(N2CCOCC2)c(F)c1 727198575 MSOFBUSIJLYOGA-UHFFFAOYSA-N 413.405 2.277 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)s2)cc1 729352767 VHZZTQPPLPLNIY-MRXNPFEDSA-N 423.560 2.283 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCn2cc[nH]c(=O)c2=O)cc1 733155040 KDZRSTPKCBIRFG-UHFFFAOYSA-N 422.485 2.235 10 20 HECD CC1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)CC(N)=O)cc3)c2)CC1 742695504 RSLOBNBHSKYARK-UHFFFAOYSA-N 415.515 2.434 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCSc1nnnn1C 743809070 MJFGUFMRFHGVLZ-UHFFFAOYSA-N 400.302 2.209 10 20 HECD CCN(CC(=O)NC(=O)NCC(F)(F)F)Cc1cc(Br)ccc1O 743870923 HRWNTNVJRYPABA-UHFFFAOYSA-N 412.206 2.365 10 20 HECD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 746978606 WBKCMERMVJUYRQ-KRWDZBQOSA-N 419.545 2.120 10 20 HECD CCOC[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 747947858 HFXBZYHBIJYSKX-LJQANCHMSA-N 404.555 2.275 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3ncc(CO)n3C)cc2F)C[C@@H](C)O1 750004714 CSFDZZXCXVOFKI-OKILXGFUSA-N 422.526 2.074 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)oc1C 751113844 AOWXBNFGHZLMTJ-UHFFFAOYSA-N 410.517 2.406 10 20 HECD COC[C@@H](CCO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 755994853 YIABLIJAUZBVCV-HLVNSREUSA-N 414.574 2.243 10 20 HECD COc1cc(N2CCN(C(=O)Nc3cc(C)cn(C)c3=O)CC2)cc(OC)c1OC 759993539 ONGSGPPMUYTIDW-UHFFFAOYSA-N 416.478 2.074 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1C 760549191 GQFKVQSFDZYFQP-UHFFFAOYSA-N 421.519 2.158 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3C(C)(C)O)cc2F)C[C@@H](C)O1 764355782 JMVFCKDYDIMLDC-JXXFODFXSA-N 407.530 2.291 10 20 HECD O=C(NCCn1cc([N+](=O)[O-])cn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 768539291 YKLSZPYLEBERMC-UHFFFAOYSA-N 424.408 2.361 10 20 HECD C[C@@H](NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 775826145 CUAASFPMXAGJFK-OAHLLOKOSA-N 404.536 2.292 10 20 HECD O=S(=O)(c1ccc2c(c1)OCCO2)N1CCCN(Cc2cc(F)ccc2O)CC1 779001559 HCSBXSLWZDWHEV-UHFFFAOYSA-N 422.478 2.199 10 20 HECD CCN(Cc1ccccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C(C)=O 785293198 DEWDAEMQRBSOFU-AWEZNQCLSA-N 413.474 2.152 10 20 HECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)CC2 788939371 SZLDHVBYDLWPQY-LJQANCHMSA-N 409.534 2.354 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@H](C)c3cccnc3)CC2)cc1 788976828 HGVXGIXLQNVBMH-LJQANCHMSA-N 423.561 2.449 10 20 HECD CCN(Cc1ccoc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789846038 ZEEYCCSIMDINIL-UHFFFAOYSA-N 403.454 2.045 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCn4cnnc4[C@H]3C)cc2F)C[C@@H](C)O1 790220483 WFLLYGAJMJRARP-QLFBSQMISA-N 402.474 2.317 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(Br)n1 792992366 JUOZQNOZFYEVRN-UHFFFAOYSA-N 401.264 2.475 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1F 796791453 SSMPPKMGGSAWNM-SECBINFHSA-N 408.357 2.282 10 20 HECD CC(C)[C@@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)N(C)C 803497792 XNZUXQKICOSKRQ-MRUHUIDDSA-N 423.529 2.185 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(CCCO)CC(C)(C)C)CC2)cc1 804314839 BJXWRNWQNKDLHT-UHFFFAOYSA-N 405.539 2.037 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O 806216215 MXOBAHIJVLZPOX-QGZVFWFLSA-N 413.449 2.192 10 20 HECD CCc1cc(N2CCC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)ncn1 806270060 OSQOPWZCLICICV-APWZRJJASA-N 424.549 2.067 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](Oc2ncccc2F)C1 806281127 NURRMHAJFHMEKU-ZDUSSCGKSA-N 424.523 2.346 10 20 HECD CC(C)[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807272386 ZVUZRFSZWPPIOW-SFHVURJKSA-N 400.567 2.243 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 809697811 OVOJXDVPUBDPQW-SJLPKXTDSA-N 418.538 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccn3C)cc2F)C[C@@H](C)O1 918800842 NNPFDLOOFTZTMS-GASCZTMLSA-N 403.454 2.251 10 20 HECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)Nc1c(Cl)ccc2nonc12 1321102959 CJMXDGRLMAGKMJ-LJQANCHMSA-N 411.805 2.208 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1C1CC1 1802985422 CENMGNWZYJLPHG-CQSHLORDSA-N 422.485 2.254 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCC=CO1 1819373357 RIEXSQRQLHMNOQ-HUUCEWRRSA-N 413.434 2.215 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)CC2CC2)CC1 1826610036 GFBGFXVPAQJFHC-INIZCTEOSA-N 423.604 2.267 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c(F)c1F 1843251342 VOQMYEKKKVPJDL-UHFFFAOYSA-N 403.385 2.210 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843963996 KBWSFOSLXULLNI-SJLPKXTDSA-N 408.502 2.419 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(Cl)nc3)CC2)cc1 302812162 SCQXDWACEMUOMZ-UHFFFAOYSA-N 424.954 2.234 10 20 HECD CCN(C(=O)CN(Cc1ccco1)c1ccc(OC)c(F)c1)[C@H]1CCS(=O)(=O)C1 303867652 UQEPMJJRFUSUOH-INIZCTEOSA-N 424.494 2.470 10 20 HECD COc1cccc(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1O 727761176 MKJFFJDESDJCFC-UHFFFAOYSA-N 401.375 2.314 10 20 HECD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 728209025 CZAZPSTXPIZIBA-HZPDHXFCSA-N 421.501 2.395 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1 729062758 DLFPSOTXGWUXMH-ZDUSSCGKSA-N 422.441 2.181 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1 729064967 XDZYMPKNPUUKBY-SNVBAGLBSA-N 401.444 2.261 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1(N2CCCC2)CCOCC1 729624668 ZHRZRYQNHYRVLK-UHFFFAOYSA-N 416.566 2.310 10 20 HECD COC(=O)CN(Cc1ccc(S(=O)(=O)N(C)C)o1)Cc1cc(Cl)ccc1O 731846379 MFZMGHWZMPGENU-UHFFFAOYSA-N 416.883 2.064 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 743162036 VRSXARULEQKSDM-HNNXBMFYSA-N 418.519 2.314 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCCN1C(=O)CN(C)C1=O 743808219 OMHZWHJQTJOHSK-UHFFFAOYSA-N 412.284 2.177 10 20 HECD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 746724361 AGPPQEPXHYABNJ-CYBMUJFWSA-N 408.499 2.360 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(Cn2cncn2)c1 749730360 NCWAZRLAOCELOI-UHFFFAOYSA-N 402.505 2.020 10 20 HECD O=C(NCCOCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 752640769 HRKIIKJSLQOBPY-FQEVSTJZSA-N 412.486 2.346 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1F 754039718 DPCQZQZCSLBFKY-UHFFFAOYSA-N 410.467 2.362 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@H](CCO)c3ccccc3)CC2)cc1 754052806 ZRGWJQUSCCLQGR-LADGPHEKSA-N 413.562 2.234 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](C[C@@H]4CCOC4)C3)CC2)cc1 754115252 SQIUUQQGFZISAU-FUDKSRODSA-N 417.594 2.317 10 20 HECD CN(C)CC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCC1 760093955 BPVJAACCLZOLEB-LJQANCHMSA-N 415.582 2.310 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(C(=O)CCC(=O)O)cc2)cc1F 761286541 KUEGPIDODQDNPL-UHFFFAOYSA-N 408.451 2.418 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@H](C4CC4)C3)cc2)C1 765315077 ACSPTBDRBJMDAT-HBFSDRIKSA-N 400.523 2.145 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC4(CCCC4)C3)CC2)cc1 765716568 OIPSNAHNWXRXFY-UHFFFAOYSA-N 402.539 2.172 10 20 HECD CNS(=O)(=O)c1csc(C(=O)NCc2cccc(Br)c2O)c1 765750192 AOSSKWOMZCRUEI-UHFFFAOYSA-N 405.295 2.054 10 20 HECD CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765925803 KMNBEUIAAOVFRG-UHFFFAOYSA-N 420.263 2.392 10 20 HECD COc1cc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cnc1Cl 767692805 ZLOQBBPDIVJKAX-UHFFFAOYSA-N 424.910 2.246 10 20 HECD CS(=O)(=O)CC1(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 768913198 WITPBIGNRIACET-MRXNPFEDSA-N 414.955 2.341 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCN(C)C3=O)c2C)cc1 772505847 CNWKMGUOQKCUJM-QGZVFWFLSA-N 412.442 2.085 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773846788 OIXUKWGCLKNPFU-CQSZACIVSA-N 407.478 2.242 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCO[C@H](Cc4ccccc4)C3)CC2)cc1 776607855 KXEWGVNWNDYORC-HSZRJFAPSA-N 409.530 2.287 10 20 HECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2)c(OC)c1 776745242 HFWRMSGQQRHHKK-UHFFFAOYSA-N 400.478 2.353 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3c(C)noc3C)CC2)cc1 778278637 YYJCWGPRURCWEW-KVPUOBJLSA-N 412.490 2.382 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)c2)CC1 778681732 CEERUICNMYVYGP-UHFFFAOYSA-N 412.402 2.278 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)[C@@H]3CCCOC3)CC2)cc1 780044631 PPOMDPQSCYJDHA-RTBURBONSA-N 404.555 2.322 10 20 HECD COc1ccc([C@@H]2[C@@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)CCC(=O)N2C)cc1 783683475 FDLILPWODMNTCN-HRAATJIYSA-N 413.426 2.442 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC2(CCCC2)C1 789847473 RNVZUOJIQBCBHF-UHFFFAOYSA-N 403.548 2.028 10 20 HECD CC(C)(C)CN(CCCO)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855526 TYEHICDPLPEZER-UHFFFAOYSA-N 407.580 2.113 10 20 HECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 793899654 BKFDTZVENUYQEM-QZTJIDSGSA-N 400.567 2.480 10 20 HECD CNC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCO1 799994155 NSAFBLIQKQSTBF-KSSFIOAISA-N 408.930 2.233 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@H]3c3cc[nH]n3)CC2)cc1 804276125 HVHUNHOFKCENCQ-YUQDSPFASA-N 423.517 2.377 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C3Cc4ccccc4C3)CC2)cc1 804315787 SGKFCCBFKYGLRZ-UHFFFAOYSA-N 407.514 2.406 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](Cc3cnn(C)c3)C2)cc1F 804850994 WZJDOSTYEDBLEI-QGZVFWFLSA-N 415.513 2.113 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(NC(C)=O)s2)cc1 808082394 ZZBSIUMFBJKYHM-UHFFFAOYSA-N 418.522 2.054 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2c(nnn2-c2ccccc2)C1 814638165 LGZWVYVPMWHHEH-UHFFFAOYSA-N 404.518 2.350 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1OC(F)F 916676804 UDGDBLCWIZYCFN-UHFFFAOYSA-N 410.442 2.453 10 20 HECD Cc1cc(C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c(C)n1-c1ccccn1 917119623 PIEBXXYJZSXDOM-NRFANRHFSA-N 400.548 2.427 10 20 HECD CC(=O)c1cccc(OCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 917832048 HGFPGEVCDANEJL-LJQANCHMSA-N 409.486 2.286 10 20 HECD Cc1cc(C)n(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 918171220 UXIBQFMCPREBRA-UHFFFAOYSA-N 403.502 2.490 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc1 918369191 OGPWXIHBGMZFBG-UHFFFAOYSA-N 403.429 2.442 10 20 HECD C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 919821623 MWRMKWDZQMKRRV-WMLDXEAASA-N 403.504 2.329 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCCN4CCC[C@@H]4C3)cc2F)CC1 1252069570 SUAWIAMUDHWDQE-LJQANCHMSA-N 403.546 2.347 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 1317922574 GLGSBGIRWLEPRQ-UHFFFAOYSA-N 420.529 2.187 10 20 HECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 1323829677 LLCQWYMNAHBARS-RHSMWYFYSA-N 404.536 2.425 10 20 HECD CC(C)(C)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425844 AZFZHJHSWNTDBF-QGZVFWFLSA-N 418.538 2.114 10 20 HECD O=C(c1ncc(Cl)cn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500705 DICRMCWJOKLVKZ-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=C(C[C@@H]1OCCc2ccccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847759537 AMJDLTAGJRNESG-FHWLQOOXSA-N 423.469 2.012 10 20 HECD C[C@H](NC(=O)C1=NN(c2ccccc2)C(=O)[C@@H](C)N1)c1ccc(N2CCOCC2)cc1 109189886 FPWNULWKXAZSDN-DLBZAZTESA-N 421.501 2.039 10 20 HECD CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 729305513 MRSLVQPGXXPMAR-QHCPKHFHSA-N 407.514 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cccc(C[S@@](C)=O)c3)CC2)cc1 735919809 UTXNJIDBCXVFRA-MUUNZHRXSA-N 401.532 2.334 10 20 HECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)ccc21 741098105 HGJBIHHFITYAJB-UHFFFAOYSA-N 404.470 2.227 10 20 HECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCc1ccc(N2CCCCC2)cc1 742483010 BHDXQJHZQXLVEM-UHFFFAOYSA-N 422.441 2.498 10 20 HECD C[C@H]1COCCN1CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745802373 LKOQZBHFBIFLGG-HOTGVXAUSA-N 412.481 2.277 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 745861705 DTHJEJKXNSJIIJ-HXUWFJFHSA-N 417.598 2.191 10 20 HECD Fc1cc(CN=c2ccc3ncc[nH]c-3n2)ccc1N1CCN(c2ncccn2)CC1 748794721 IJBHBZUWZDBSSX-UHFFFAOYSA-N 416.464 2.266 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cn1 751136172 DPTCWKBBWHYUJJ-UHFFFAOYSA-N 407.492 2.285 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc2c(c1)CCCN2C 752660453 PGSSTIGBBJIVCN-NRFANRHFSA-N 424.545 2.242 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(S(=O)(=O)C2CC2)CC1 753966930 KIVVDSVMPODQPK-UHFFFAOYSA-N 408.568 2.241 10 20 HECD CCN1CCCC[C@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759265540 MVSAIXDWNFJUCP-KRWDZBQOSA-N 420.554 2.418 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCC(=O)[C@H](C)C4)n3)CC2)cc1 771055668 IVGIBPCYKWJWQH-CVEARBPZSA-N 412.490 2.442 10 20 HECD Cc1c[nH]cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1=O 772260756 YZJMUDKYSKHJGC-UHFFFAOYSA-N 416.389 2.254 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1 772529257 IPDJODAYCQKKQN-RISCZKNCSA-N 422.507 2.456 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2c(O)ccc3c2CCCC3)s1 772631808 SMFBHUHSQZCXRG-UHFFFAOYSA-N 423.560 2.419 10 20 HECD C[C@H](NC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(N(C)C)cc1 773275369 DFYLNSUBSWWVKJ-INIZCTEOSA-N 424.549 2.410 10 20 HECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nn1 773847165 PQOKTVQNOGHLIU-OAHLLOKOSA-N 407.478 2.161 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC(CO)CC3)cc2Cl)C1 774240721 BRGYZIAFSVKWMD-OAHLLOKOSA-N 407.942 2.423 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@H]1CC1(Cl)Cl 775152995 QDCHLRVKWAYDGE-CYBMUJFWSA-N 402.347 2.166 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1 776143316 CZEFHANPMNNNJI-UHFFFAOYSA-N 423.466 2.079 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CC[C@H](SC)C3)CC2)cc1 778287875 FLVFPOCXXSUWED-HBTVWZBFSA-N 403.548 2.300 10 20 HECD COc1ccccc1-n1c(C)nnc1SCC(=O)NCc1ccc(O)c(O)c1 778925098 HKOLONZHFPTBAU-UHFFFAOYSA-N 400.460 2.404 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1 785422067 GYGSHUUYRCBGCW-QGZVFWFLSA-N 400.910 2.417 10 20 HECD CCN1C[C@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)Oc2ccccc21 785424676 KXMIAGGSPLTKAZ-IBGZPJMESA-N 410.518 2.115 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc1 788928266 CWUZZNUILNTLKD-IRXDYDNUSA-N 402.539 2.055 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1 792959854 RFCFDCPDPOJZHT-INIZCTEOSA-N 414.462 2.116 10 20 HECD Cc1ccn2cc(CNC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)nc2c1 793750074 OYLYUTGBMQOLDE-IBGZPJMESA-N 422.485 2.172 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803306315 TZNDHJCDSPQCKV-QXATTWAWSA-N 403.523 2.020 10 20 HECD CCN(Cc1ccc2c(c1)OCO2)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661651 IQAGSHRMPLRSBV-UHFFFAOYSA-N 401.438 2.285 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C 804263121 ICPRDBQCYZQVSC-GOSISDBHSA-N 418.538 2.193 10 20 HECD COc1ccc(N2CCC(NC(=O)N3C[C@@H](N4CCOCC4)C[C@@H]3C)CC2)cc1 806683788 MSGOMNDIPRRYQR-PXNSSMCTSA-N 402.539 2.169 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC3(OC)CCC(C)CC3)CC2)cc1 807846325 CWUHJXZFQKWYBN-UHFFFAOYSA-N 417.550 2.445 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@@H](CO)c4ccccc43)CC2)cc1 817783139 RLDJBCZOBZAEAF-LENZSSGSSA-N 421.497 2.023 10 20 HECD COc1ccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1C(N)=O 917657896 GKFLZULRQDFQBR-UHFFFAOYSA-N 405.520 2.459 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 919841098 YIFXRZSYEVLPCL-UHFFFAOYSA-N 405.432 2.091 10 20 HECD Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808752160 VSMAXDVMGBBWFZ-QRWLVFNGSA-N 421.457 2.158 10 20 HECD O=C(CC(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722855 ZPKCMLFLKYLULN-QMMMGPOBSA-N 416.381 2.128 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(C)c3[N+](=O)[O-])CC2)cc1 4500249 CIIZXGUHZPQRCM-UHFFFAOYSA-N 413.430 2.417 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CC2 727226015 WUMNTJNPCMVLPV-GRDNDAEWSA-N 416.501 2.153 10 20 HECD CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729063951 MBDBQJJXDWSCJM-SNVBAGLBSA-N 405.838 2.230 10 20 HECD O=C(NCc1nnnn1-c1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 730673614 ZHFHJSCCNXLDCU-SFHVURJKSA-N 408.462 2.259 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)cc1F 731364385 ZFSYPSWJRINCCY-MRXNPFEDSA-N 419.545 2.166 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@H]3CCN(c4ccccc4)C3=O)nc12 731847392 HWTWEIMOVGHUEK-SFHVURJKSA-N 423.473 2.239 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(-n4cccn4)ccn3)CC2)cc1 735996652 ZCAUSBPKITZBJQ-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCN(c4ccccc4)CC3)CC2)cc1 742948475 UCSDJVJWJBBXIA-UHFFFAOYSA-N 423.561 2.349 10 20 HECD CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NCc2ccccc2O)ccn1 749639826 VYJCBVICSWWWIT-UHFFFAOYSA-N 420.425 2.194 10 20 HECD O=C(COc1ccc(N2CCCC2)cc1)NCc1ccc(C(=O)N2CCOCC2)cc1 749791498 PKWKUOAEADXOFU-UHFFFAOYSA-N 423.513 2.454 10 20 HECD O=C(NCCn1c(O)nc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 752889952 IMCMJXDUJLJDFZ-UHFFFAOYSA-N 423.517 2.450 10 20 HECD COc1ccc(N2CCN(C(=O)CCN3C(=O)COc4ccccc43)CC2)cc1F 753737200 BXSABCSEQIAZGS-UHFFFAOYSA-N 413.449 2.299 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1 760436365 LSUVGVNFLVUGGM-UHFFFAOYSA-N 421.588 2.491 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCCN(Cc3ccccc3)C2=O)c1 760505548 VWDLEJIQGKRHES-GOSISDBHSA-N 418.471 2.112 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 761061693 OFBRFGUWJQFXEZ-UHFFFAOYSA-N 409.442 2.028 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)NCc2cccc(Br)c2O)C1 765453875 PYGRGJZGEQJERH-CQSZACIVSA-N 400.317 2.311 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 770151605 ZDOXWQQAGVFWEI-UHFFFAOYSA-N 405.432 2.477 10 20 HECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1ccc(N2CCCC2)cc1 775213462 XIPZNZAOMIDRGG-UHFFFAOYSA-N 402.520 2.242 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c(C)c2)c(OC)c1 776747822 MTLFQEKSDYBTOL-UHFFFAOYSA-N 400.478 2.272 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3nc4ccccc4n3C)CC2)cc1 779225722 OYPACTXNQSYTDN-FQEVSTJZSA-N 423.561 2.197 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCCC(=O)OCc2ccccc2)c1 782100712 IVHCVYFDJYKFAJ-UHFFFAOYSA-N 420.487 2.407 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1noc(Cc2ccccc2)n1 785424556 PRPDHBGCTCCDKX-OAHLLOKOSA-N 407.474 2.220 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccccc1Cn1cccn1 785640061 INJZKIBILGAHDB-UHFFFAOYSA-N 415.544 2.303 10 20 HECD C[C@@H]1CCC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793722519 UBQCLURHLFCMQX-POAQFYNOSA-N 414.550 2.042 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCC(F)(F)C3)CC2)cc1 797768129 KTZGLZGLPNIGCN-MOEXGYKKSA-N 407.461 2.452 10 20 HECD CCN(CCOCCO)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 800427951 HZDOEZPRZVKCBS-HNNXBMFYSA-N 410.470 2.120 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)OC3(CCOCC3)C2)cc1F 804852645 CJRMEYSMCLASSW-INIZCTEOSA-N 421.513 2.085 10 20 HECD CCc1nc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cs1 806114391 DAFCGUADPKZTQN-OAHLLOKOSA-N 416.547 2.378 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOc4cc(O)ccc4C3)cc2)C1 806496161 QDBAPDSPOGNYKT-GOSISDBHSA-N 424.501 2.198 10 20 HECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807103547 RRWIYAJQYBYNQZ-MJGOQNOKSA-N 416.566 2.221 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@@H](CC(C)C)C3)CC2)cc1 808074175 PRXJBGVPGAONOT-RXVVDRJESA-N 417.550 2.444 10 20 HECD CNC(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 916677833 OLVVRYKFDXRZCO-UHFFFAOYSA-N 414.481 2.397 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 918618110 XRMOWQMSQFXFSI-LZQZEXGQSA-N 415.559 2.420 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 919617917 UEHYFVBRWUUDOK-LJQANCHMSA-N 403.523 2.435 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C(=O)NC(C)C)cc1 1320520161 ROMSGQNHCDVFND-KRWDZBQOSA-N 414.458 2.140 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(-c2ccccn2)noc1C 1321362119 XWNWQIRKDVVVSL-HNNXBMFYSA-N 411.414 2.360 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CC(C)C)N1CCCCC1=O 1325382359 LNGNBCVJXCJXOB-IRXDYDNUSA-N 420.506 2.115 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C3CCSCC3)CC2)C1 1810549813 CFHQPZBYDIUVJJ-UHFFFAOYSA-N 419.547 2.481 10 20 HECD COCCn1nnc2c1CCN(C(=O)c1ccc3c(c1)c(C)c(C)n3CCOC)C2 499148140 BOXGXNWEOZYQJP-UHFFFAOYSA-N 411.506 2.341 10 20 HECD NS(=O)(=O)c1ccc(OCCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 726374775 MBXDCEXEBKOALP-UHFFFAOYSA-N 403.504 2.020 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H](CS(C)(=O)=O)C3)CC2)cc1 726715642 UBDCHVXXLGIJNK-INIZCTEOSA-N 409.552 2.130 10 20 HECD COc1ccc(N2CCCN(C(=O)CCNC(=O)c3n[nH]c4ccccc34)CC2)cc1 728068160 BMGWULFRAXGPDE-UHFFFAOYSA-N 421.501 2.430 10 20 HECD C[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(=O)N(C)C 733164127 ZVDVBUNYSUNYIW-KBICQTFXSA-N 411.574 2.322 10 20 HECD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 734402072 GAKIFKGSJTYWCN-QHCPKHFHSA-N 424.501 2.153 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 745592478 IAYIWAMYBLJJRX-LJQANCHMSA-N 419.639 2.313 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H]1CCCc2c1cnn2C 749175457 IEZGBDHQSNNEMI-YLJYHZDGSA-N 424.549 2.341 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2c(c1)C(=O)CCC2 750253603 OHXBQQSGEIMWTD-UHFFFAOYSA-N 407.470 2.297 10 20 HECD O=C(NC[C@H](O)c1ccncc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 750538758 NCGVZCJETOEVGD-INIZCTEOSA-N 419.484 2.113 10 20 HECD Cc1cc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)ccc1-n1cncn1 762237549 HCTPGUZHJKMBKO-UHFFFAOYSA-N 412.431 2.370 10 20 HECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)CN1C 768769248 FWEYXHITBMUPRI-BSDSXHPESA-N 406.546 2.080 10 20 HECD COC(=O)c1csc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 770258131 SDGKATNPCWUWKZ-UHFFFAOYSA-N 418.519 2.487 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)c1 773780049 PUZJZPCDNKNUJZ-CYBMUJFWSA-N 423.491 2.212 10 20 HECD CCS(=O)(=O)c1c(Cl)cccc1/C=C1/SC(N2CCOCC2)=NC1=O 774117494 DJJKZWGJGSGRSE-JLHYYAGUSA-N 400.909 2.436 10 20 HECD C[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775254351 HLIRAFWBKNDRCO-HRAATJIYSA-N 404.532 2.311 10 20 HECD CCCCN(CCCC)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 776504972 IFDJSEBNWUWOLO-UHFFFAOYSA-N 421.541 2.315 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1Cc2ccccc2C(=O)O1 777825957 BXNWKHLWFUOAKM-QGZVFWFLSA-N 403.818 2.329 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c(OC)ccc(S(N)(=O)=O)c1OC 777853730 SHAXBENSTRWYRN-UHFFFAOYSA-N 421.519 2.080 10 20 HECD CC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780408913 OUQVZTAMCVQZRN-UHFFFAOYSA-N 401.488 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccc3)OC)CC2)cc1 781028677 JRPCAOGAPJFZAN-OUKQBFOZSA-N 409.486 2.490 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cccc(N2CCOC2=O)c1 785424420 PFJYNRCBXPWJHP-OAHLLOKOSA-N 410.474 2.203 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1 785427582 CTPKQBOVKBVANJ-PWRODBHTSA-N 411.502 2.110 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)c(C)cc3F)cc2)CC1 786121163 BPIACYFGVNRBEL-UHFFFAOYSA-N 423.485 2.420 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(OCCN(C)C)c1)c1ccc(N(C)C)cc1 787178442 WJCCUXRLPXKKMC-QGZVFWFLSA-N 412.534 2.187 10 20 HECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 787911282 ACWJLZAZMIWCRW-HZPDHXFCSA-N 417.481 2.316 10 20 HECD Cc1nc(C)c([C@@H](C)N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 788310620 KRFIWODVGARNCS-OAHLLOKOSA-N 416.547 2.432 10 20 HECD CN(C[C@H]1COc2ccccc2O1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910584 MKMCYBUANHGPDX-IBGZPJMESA-N 409.486 2.201 10 20 HECD CCCC[C@@H](COC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823015 CEUIHUOLCRQGEW-JZXOWHBKSA-N 423.529 2.377 10 20 HECD CCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789825610 NAJRHDDBQWRJJF-JFIYKMOQSA-N 421.513 2.083 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789827620 TXPZZBJFQJMYCI-ZIAGYGMSSA-N 409.527 2.067 10 20 HECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N(C)C)cc3)cc2CC1 790135990 XDNLWWPLVUVIRX-UHFFFAOYSA-N 401.532 2.178 10 20 HECD C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793916088 WQOGEVXNDMOREI-HOTGVXAUSA-N 406.546 2.381 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 795905911 CBLCEAXHRAJMMM-SOLBZPMBSA-N 422.497 2.415 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 802281165 RSFFKJUBRBJGRJ-XLIONFOSSA-N 410.536 2.440 10 20 HECD CC(C)N(C)CC1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803687896 QRVVQPMLJISZIT-UHFFFAOYSA-N 400.567 2.264 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](c3nncn3C)C(C)C)cc2F)CC1 805767613 YHMMZSOUHZVVCI-LJQANCHMSA-N 417.533 2.293 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(c2nnc3n2CCCC3)CC1 807097267 METCKFOBWNYLGT-UHFFFAOYSA-N 424.549 2.011 10 20 HECD CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NCc3ccccc3O)c2)ccn1 815450471 CMAAUPCVBRKGBB-UHFFFAOYSA-N 420.425 2.194 10 20 HECD CN1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916259171 WWSHZZLMVOHETQ-UHFFFAOYSA-N 405.612 2.065 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1 916565873 MLTZYSLRSYLYPZ-SFHVURJKSA-N 422.485 2.104 10 20 HECD Cc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1-n1cnnn1 918455602 DJJOKCWJYKNUCL-UHFFFAOYSA-N 419.489 2.166 10 20 HECD CCOC1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 918738423 CATZVMBYOFOREG-UHFFFAOYSA-N 419.547 2.425 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 919568759 KVEBIEGEFHEDKU-HUUCEWRRSA-N 424.544 2.346 10 20 HECD Cc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1317947302 UGMOFEPEARJSHW-ZIAGYGMSSA-N 416.453 2.011 10 20 HECD CCn1nc(C(C)C)cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1334556480 BGBSZOXXVTUBRT-UHFFFAOYSA-N 404.536 2.191 10 20 HECD O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NCc1ccccc1O 109677575 IYVWYDCUOIHVLQ-UHFFFAOYSA-N 413.293 2.140 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC(OCCCN(C)C)CC2)n(C)c2ccccc12 673315279 NZCSYXJDUFZVBE-UHFFFAOYSA-N 414.550 2.062 10 20 HECD C[C@@]1(c2ccc(CNCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 726189554 COOHJOWABUERLE-SFHVURJKSA-N 404.264 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(C(=O)OC(C)(C)C)CC3)CC2)cc1 727437739 PLIJRUXXMPCGFW-UHFFFAOYSA-N 417.550 2.398 10 20 HECD O=C(CN1CCC[C@@H]1CN1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 727833150 NXNNSMQKQRPGGD-HXUWFJFHSA-N 418.557 2.229 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(OC)c1OC 727948283 YUNSXGOSJYTXOV-UHFFFAOYSA-N 405.426 2.172 10 20 HECD CC1CCC(NC(=O)CN2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 728302468 PIYQYSZIVBLVDE-UHFFFAOYSA-N 415.582 2.275 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnnn1CC(F)(F)F 729967992 CUVFGKZSICIJRP-UHFFFAOYSA-N 402.446 2.442 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H]3CN3CCOCC3)CC2)cc1 745796701 TVOLZZQHVZTIMP-HXUWFJFHSA-N 402.539 2.170 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4nccnc4c3)CC2)cc1F 754212577 LUZCTRJJLVGAJJ-UHFFFAOYSA-N 409.421 2.065 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 756825635 ZWVQFMVMMUROQB-XMMPIXPASA-N 423.513 2.187 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccn(-c2ncccc2F)n1 759012101 KADPLQVTCBXFQW-UHFFFAOYSA-N 409.421 2.246 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)c1 761981728 HSIZQASJRCZJEG-NSHDSACASA-N 409.435 2.394 10 20 HECD COc1ncc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1C(N)=O 762221641 ILPWXPMIUNWZQI-OAHLLOKOSA-N 400.435 2.108 10 20 HECD CC(C)Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 762416213 QRLLTPSZERGXPM-UHFFFAOYSA-N 413.522 2.003 10 20 HECD CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 764254463 NCKYPBXFQSXSSK-AWEZNQCLSA-N 419.503 2.066 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)NCc2cccc(Br)c2O)c1 765283577 OUTCJHVBPHHUMM-UHFFFAOYSA-N 400.254 2.124 10 20 HECD O=C(Cn1cc(C(=O)NCc2cccc(Br)c2O)cn1)NC1CCCC1 765771308 ZVOAESJATIHGEO-UHFFFAOYSA-N 421.295 2.340 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](O)C(F)(F)F 766251332 NPBVYHBIRYPLFP-HOCLYGCPSA-N 407.408 2.288 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCn3cc([N+](=O)[O-])cn3)cc2F)C[C@@H](C)O1 768521606 AEGYDGYAHSVVJS-ZIAGYGMSSA-N 420.445 2.043 10 20 HECD CN(Cc1ccccc1O)C(=O)c1sccc1S(=O)(=O)N1CCSCC1 769282718 PUCHTNZJBVDSAG-UHFFFAOYSA-N 412.558 2.463 10 20 HECD COc1ccc(O)c(CNC(=O)CS(=O)(=O)c2cccc(Br)c2)c1 769530572 HOAUPIDPSQEALE-UHFFFAOYSA-N 414.277 2.253 10 20 HECD CC[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCO[C@H](CC)C1 774015062 WRWIWNYLUXQFER-QUCCMNQESA-N 407.530 2.292 10 20 HECD CC(C)(C)c1nnc2ccc(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)nn12 775464625 JHACOMNYNJGUIQ-UHFFFAOYSA-N 414.535 2.269 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](OCC4CC4)C3)CC2)cc1 778174360 RWHIFGXHMAUKBO-FYYLOGMGSA-N 403.567 2.069 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 784251591 INAXNWRKKSGEHN-RBUKOAKNSA-N 404.555 2.322 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)cc1 788879816 DYIAZQIOKUUAHN-IBGZPJMESA-N 408.568 2.242 10 20 HECD C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NCCCSc1nccs1 792164928 KPXAJAZINOGORF-OAHLLOKOSA-N 421.466 2.373 10 20 HECD COC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C 798045929 RACBPKJTNYQSHR-NSHDSACASA-N 401.419 2.270 10 20 HECD C[C@@H]1CCNC(=O)[C@H]1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 799428875 RFFGWHGPKUUCHL-HTPHJUJXSA-N 423.585 2.370 10 20 HECD COC(=O)c1cn(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1 800571082 FBTRDIAGHRNRTF-CYBMUJFWSA-N 405.886 2.271 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2ccccc2C1 803688214 MDXSPMMHDZJCDU-SFHVURJKSA-N 420.557 2.248 10 20 HECD COc1ccccc1O[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 804716970 ZLZAXXHBLRVSNW-OAHLLOKOSA-N 420.487 2.456 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 808095164 UEPCEERSJBQKNN-RDJZCZTQSA-N 423.506 2.476 10 20 HECD COc1nnccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 809376255 QPANJBQIESSGKG-UHFFFAOYSA-N 404.338 2.421 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4)CC3)cc2)C1 918116859 BPZUKXAVNTWWGQ-FQEVSTJZSA-N 421.545 2.420 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3C(=O)NC3CC3)cc2F)C[C@@H](C)O1 918220162 HJHKCGJHSWQPIY-MDOVXXIYSA-N 418.513 2.392 10 20 HECD O=C(CCc1nc2ccccc2o1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918336355 YJMVVJIBDULYFM-UHFFFAOYSA-N 413.499 2.312 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)cn1C 1116592574 XXKWCQNVLMXWRI-LBPRGKRZSA-N 411.252 2.103 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3c(C)cnn3CC3CC3)CC2)cc1 1325006083 GGYJHPUARGWLBU-MDZDMXLPSA-N 423.517 2.454 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1C[C@]1(F)Cl 1804291672 TVTKIMADEGMJEI-MGAJALESSA-N 424.856 2.379 10 20 HECD C/C=C/C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1812548134 GMUKUDFBEGHSNL-ZIRJPHQLSA-N 423.469 2.494 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)C1CC1 1813719123 XDHUYVRFAAKSRT-OEFDOCSMSA-N 423.469 2.328 10 20 HECD Cc1ccoc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725099 JZMKZRLSFJGEEP-LLVKDONJSA-N 414.443 2.390 10 20 HECD C/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2 1825048466 DBQCSSOKCDMNOJ-VPCUOIRZSA-N 415.471 2.461 10 20 HECD COc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)[nH]c2c1 1843692887 PNCDNNOQCSWKDF-UHFFFAOYSA-N 422.441 2.114 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(C)c3C)CC2)cc1 56966418 PSBZLZIHKFVUFA-UHFFFAOYSA-N 410.518 2.189 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1 435815409 FHWQBUMRMDZQDZ-UHFFFAOYSA-N 424.413 2.353 10 20 HECD CC(C)NC(=O)CNC(=S)NC1CCN(c2ccc(OC(F)F)cc2)CC1 727281254 CWYRKTYPKUWZLA-UHFFFAOYSA-N 400.495 2.246 10 20 HECD O=C(NCCn1c(=O)oc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 730119861 SMQMCELPZSLLSZ-UHFFFAOYSA-N 414.437 2.070 10 20 HECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N(C)C)cc1 731497043 SQEMLQMJTJHRGG-HXUWFJFHSA-N 406.490 2.091 10 20 HECD COc1cccc(C[C@@H](C(=O)NCc2ccc(N(C)C)cc2C)n2nnnc2C)c1 734402705 OYNNEHOJRWVODJ-NRFANRHFSA-N 408.506 2.465 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H]3c3ccco3)cc2)C1 735188495 ZSOJKAHJFHPZIX-IEBWSBKVSA-N 412.490 2.264 10 20 HECD O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NCc1ccc(N2CCOCC2)cc1 740742054 FWXUULAVOFXVKB-HSZRJFAPSA-N 409.530 2.431 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCNc2ccc3ccccc3n2)c1 743459608 GZRDQTUEKKXSLP-UHFFFAOYSA-N 400.460 2.154 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](Cc3cnn(C)c3)C2)c1 747462506 ZHJBSUBAIPWKPA-GOSISDBHSA-N 412.534 2.225 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1 749918108 LBDBBMCZMXLDCH-IBGZPJMESA-N 402.520 2.220 10 20 HECD CCc1cccc(S(=O)(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 751249370 SMLCKSUZFFPPJI-UHFFFAOYSA-N 403.548 2.358 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)Nc3ccc(O)c([N+](=O)[O-])c3)cccc12 753521295 LPXYSEHQYLPITO-UHFFFAOYSA-N 403.372 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)NCc3ccc(F)cc3)CC2)cc1F 753739256 BGOOLXGKGUXGHZ-UHFFFAOYSA-N 418.444 2.121 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759221494 RQDOBSZPYXGGSW-CAQIIQHBSA-N 409.502 2.433 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3C(C)(C)O)cc2F)C[C@@H](C)O1 764355786 JMVFCKDYDIMLDC-YRNRMSPPSA-N 407.530 2.291 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765903153 GMEAREZNOCBHOR-UHFFFAOYSA-N 407.220 2.196 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCCN(CC(F)F)CC1 766763777 JYVKCKQWXFWDCO-UHFFFAOYSA-N 400.445 2.145 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3ccccc3NC(C)=O)CC2)cc1 767757320 XRERQOQXDIQBSQ-UHFFFAOYSA-N 410.518 2.135 10 20 HECD C[C@H](NC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1)c1ccc(N2CCOCC2)cc1 768977958 USQIVBIJOSJKDA-NPMXOYFQSA-N 422.485 2.069 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(OC)c4O)n3)CC2)cc1 771065999 HQDFXGVPUSFOIR-UHFFFAOYSA-N 424.457 2.351 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(Cl)cn1 772951907 CVLVVIGADJAEQG-UHFFFAOYSA-N 406.845 2.090 10 20 HECD C[C@@H](NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccc(N(C)C)cc1 773023841 KSWJBLDYBZEZOT-IQMFZBJNSA-N 406.486 2.323 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H](CS(C)(=O)=O)c1ccccc1 775548723 JGYRLCTTWYKKKM-HXUWFJFHSA-N 403.548 2.087 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nc4c(s3)CCC4)CC2)cc1 778227519 LIPWGIWLRXMLHV-MDZDMXLPSA-N 412.515 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(Cl)nc3)CC2)cc1 778242869 YSRFLCJYSWBIHJ-CMDGGOBGSA-N 414.893 2.265 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCN3c3ccccc3)nc12 785130870 DPFTYGUQXFNIPS-QGZVFWFLSA-N 410.430 2.324 10 20 HECD C[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789836601 TVQGGMQKIZCOLF-RDJZCZTQSA-N 405.514 2.488 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)CC2)cc1 797799467 JAKVDHNVOSPXTF-WGSAOQKQSA-N 417.550 2.303 10 20 HECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)o1 803687447 MRIPMUWOVJPBEK-HXUWFJFHSA-N 411.502 2.441 10 20 HECD Cc1cc(C(=O)N2CCC[C@H](CN(C)S(C)(=O)=O)C2)c(C)n1-c1ccccn1 804186082 DVGMEVTXDXHEAU-QGZVFWFLSA-N 404.536 2.233 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCCCSc2nccs2)C(=O)N1c1ccccc1 806279535 RHKCHFSGJSZOLF-ZFWWWQNUSA-N 418.544 2.052 10 20 HECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(=O)NCCCSc1nccs1 806280590 RRZHXFXGNBASQT-AREMUKBSSA-N 411.574 2.138 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 807131569 PXFVBFJGBDDOBJ-AZUAARDMSA-N 404.507 2.364 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)[C@H]2C1 808353886 BBHZOZFOVVNAND-BVSLBCMMSA-N 414.550 2.312 10 20 HECD COc1cnc(N(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)nc1 808811320 UAAMCMZQKIWEFN-UHFFFAOYSA-N 418.365 2.445 10 20 HECD COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NCc1ccccc1O 810049765 YCURIBYGJRKGLX-UHFFFAOYSA-N 414.277 2.349 10 20 HECD CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917834944 VASJQOVUAOUZPF-IEBWSBKVSA-N 414.550 2.042 10 20 HECD CC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796603218 FAHWHGFHYVBYJH-BCDXTJNWSA-N 424.457 2.017 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)c[nH]1 1796934274 GXRWTWNFEYBPPA-GGPHIMKMSA-N 419.485 2.368 10 20 HECD Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)[nH]1 1824701606 IVPFNXMQWFJOLB-QGZVFWFLSA-N 413.478 2.071 10 20 HECD O=C(Cc1c(F)cccc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248737 JDHHOZZRRCUIML-UHFFFAOYSA-N 419.840 2.345 10 20 HECD C[C@@H](Cn1cccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500826 SRLCNHFJYHJKSN-ZDUSSCGKSA-N 418.881 2.101 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2CCc3ccccc3C2)C1 1846091841 UGOOPSHWEKINLT-KRWDZBQOSA-N 407.470 2.115 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)NCc2c(C)c3ccccc3n2C)CC1 471221439 UYLSYOOBBXPLEK-UHFFFAOYSA-N 415.534 2.441 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@](C)(OC)c3ccccc3)CC2)cc1 730354936 MBGLBZLLRFZXIU-QHCPKHFHSA-N 412.486 2.449 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(NC(=O)C4CC4)nc3)ccc21 731404609 ACDMNAXBBRVLJV-UHFFFAOYSA-N 407.474 2.067 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C4CCC4)CC3)cc2F)CC1 733648239 NOKZBUVKMRSIHJ-UHFFFAOYSA-N 403.546 2.347 10 20 HECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 737118671 YTYDGUZQOVCXGW-UHFFFAOYSA-N 424.501 2.103 10 20 HECD CN1CC[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 737727350 DIWSAHKRYCWAMX-YGYTWAPGSA-N 409.558 2.076 10 20 HECD COc1cc(N(C)CC(=O)NC[C@H]2COc3ccccc3O2)cc(OC)c1OC 741798681 JNORBOXNDCSFBU-HNNXBMFYSA-N 402.447 2.105 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2nccnc2N)NC(=O)OC(C)(C)C)cc1 742754593 RBRPGDRRBFCKJC-HNNXBMFYSA-N 400.483 2.121 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCC[C@H](O)C3)CC2)cc1 745348033 AQMWYKINHATLHG-QUCCMNQESA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCc3nnc(C(C)C)o3)CC2)cc1 746839321 UUMHNHYQKIVUIO-UHFFFAOYSA-N 401.511 2.073 10 20 HECD CN(c1ccc(CNC(=O)CCn2cc(S(N)(=O)=O)cn2)cc1)C1CCCCC1 749941214 DUKWZMGSZIGNIZ-UHFFFAOYSA-N 419.551 2.006 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)C(C)(C)NS(C)(=O)=O)c1C 751690405 KTTRAIAJXJHFBV-UHFFFAOYSA-N 406.504 2.456 10 20 HECD COc1ccc(N(C)CC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c(OC)c1 752122634 NGSVICNDUXNZID-UHFFFAOYSA-N 421.519 2.337 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc4nonc34)n2)o1 753918637 ODDMZVJIAPRZPW-UHFFFAOYSA-N 419.444 2.376 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC4(CCOCC4)C3)CC2)cc1 754049070 HBKSFKONZNSARS-NRFANRHFSA-N 403.567 2.071 10 20 HECD CCn1nc(C)c(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 754480994 CSKPNYVJYPIJPN-QGZVFWFLSA-N 400.479 2.372 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cccc(N(C)C)n3)cc2F)CC1 755066410 WUMYUVBGENLJCF-UHFFFAOYSA-N 414.529 2.428 10 20 HECD Cc1nnc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 759313492 ILGZTLNQYNZVBA-DOMZBBRYSA-N 402.524 2.109 10 20 HECD CC(C)CCNC(=O)C1CCN(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 759594159 LQGZKQUWJNEMPI-XQRVVYSFSA-N 418.490 2.055 10 20 HECD Cc1nn2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cnc2c1Cl 766781976 IIQXDJZZGWUNTM-UHFFFAOYSA-N 421.910 2.006 10 20 HECD CCOc1ccc(OCC)c(NC(=S)NNc2nc(O)c3cnn(C)c3n2)c1 769793318 KIAGDSIHACNXJI-UHFFFAOYSA-N 403.468 2.180 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@H](COC(C)C)C2)c1 769804474 JBXJXAZBSPMKNI-NRFANRHFSA-N 406.523 2.053 10 20 HECD C[C@H](c1ccccc1)[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 771423256 RKDUOMPNSXODSG-AGHHOFFYSA-N 424.545 2.352 10 20 HECD CCCCn1ncc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1C 772343412 UOSHEZSGAZEQOG-UHFFFAOYSA-N 401.423 2.274 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 772375761 QYZFIZIZLWGSIG-GOSISDBHSA-N 417.550 2.255 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c1 772632587 ZNGLVLGETQRPJR-LBPRGKRZSA-N 413.521 2.109 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(O)(C(F)(F)F)CC1 775416632 JHCHZABOYKJTEB-UHFFFAOYSA-N 419.419 2.386 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H]1OC 776118482 QBHAVOCVJVLGOK-DHHNYBAUSA-N 409.502 2.431 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(C)(C)[C@H](O)C(C)C)CC2)cc1 778393678 HXYSJTDKDUNTDU-NELJVSICSA-N 417.550 2.059 10 20 HECD O=C(CNC(=O)c1ccc(Br)s1)OCC(=O)c1ccc(O)c(O)c1 783059815 HHOFBGHDYPMJIC-UHFFFAOYSA-N 414.233 2.078 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1 785440324 YHYQZIKCHZENIV-OAQYLSRUSA-N 422.529 2.180 10 20 HECD CC[C@@H]1CCCCN1C(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785529144 LOQMEUAEATUANW-LJQANCHMSA-N 416.566 2.115 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCOC1CCCCC1 785539107 NRNSXMQNKRLQRG-UHFFFAOYSA-N 417.550 2.337 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(C[C@@H]1CCCO1)C1CCCC1 788321428 WHOCZADYOLAMTH-NRFANRHFSA-N 415.534 2.090 10 20 HECD CO[C@@H](C)CS(=O)(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2 800831004 OUMUXTMTUKGZDV-QWHCGFSZSA-N 416.565 2.312 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc1F 803661607 HKHRDNIOGPDUSQ-NRFANRHFSA-N 413.493 2.480 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c2ccccc21 803689129 LAROONFVABWQQU-FQEVSTJZSA-N 420.513 2.299 10 20 HECD O=C1N[C@@H](Cc2cnc[nH]2)C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 804148490 JUVCOVMDZQIKSN-INIZCTEOSA-N 405.405 2.143 10 20 HECD COc1cccc2c1OC[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C2 804674520 SIILFFCRZRAECP-GOSISDBHSA-N 423.513 2.372 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)C(C)(C)C)CC2)cc1F 804851468 CUSAASXKROMQLF-UHFFFAOYSA-N 420.529 2.005 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c(O)c1 807070563 VGSJQLOJNGMTCS-UHFFFAOYSA-N 418.421 2.353 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc2c1COC2=O 808940999 OZXMXOTUISQFHV-UHFFFAOYSA-N 405.204 2.080 10 20 HECD CO[C@@H](C)[C@@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 811865418 BOAWDVNOOVEWGY-CVEARBPZSA-N 416.501 2.165 10 20 HECD Cc1nnnn1-c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 857456675 DKFSFBJAESAHSB-UHFFFAOYSA-N 410.453 2.001 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC[C@@](O)(C2CC2)C1 1256166572 ACTKXQIXDDKGJP-SFHVURJKSA-N 408.501 2.242 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]c2c(c1C)C(=O)CCC2 1320394191 PNRPLFJXIQGKFC-AWEZNQCLSA-N 400.431 2.158 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC1CCC1)C2)c1cc(O)nc(O)c1 1777849720 ZBOGCJGIDQRJRM-VGOFRKELSA-N 417.506 2.201 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)n(C)c2ccccc12 472787116 JQAGQOAESKWHMN-CYBMUJFWSA-N 406.442 2.461 10 20 HECD COC(=O)C[C@@H]1CCCCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 726587042 RDUDOSFOKYZRME-FQEVSTJZSA-N 404.507 2.345 10 20 HECD C[C@@H](NC(=O)NCc1nnnn1-c1ccccc1)c1ccc(N2CCOCC2)cc1 730579698 DYSZLANCAPQMMN-MRXNPFEDSA-N 407.478 2.059 10 20 HECD CCOc1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl 732758891 RPBCSRRXSOHIJX-UHFFFAOYSA-N 423.922 2.299 10 20 HECD COc1ccc(C(=O)NCC(=O)NCc2ccc(N(C)C)cc2C)cc1[N+](=O)[O-] 734558085 ODMOMVBEFQUYQD-UHFFFAOYSA-N 400.435 2.024 10 20 HECD COc1cccc(CNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)c1O 745781458 PUZVAVLJXWXRPR-UHFFFAOYSA-N 421.519 2.477 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ccnc3[C@@H](O)c3ccccc3)CC2)cc1 763171059 BJMWYOCQGIEBQO-QFIPXVFZSA-N 406.486 2.322 10 20 HECD COC(=O)Cc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765903875 ORDZHQQWFZJGQR-UHFFFAOYSA-N 421.247 2.125 10 20 HECD COc1ccc(N2CCN(CC(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1F 771764266 XVARDVABEVGUIN-OAQYLSRUSA-N 414.525 2.375 10 20 HECD C[C@H]1C(=O)N(C)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 778127422 NRTCFKXDTNQNKR-PBBNAPBQSA-N 423.585 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCNc3ccccc3)CC2)cc1 778285372 HKJNKILJYWYEJD-VAWYXSNFSA-N 408.502 2.128 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccn2c(O)nnc12 780956397 UYAJVLJPPLOYER-LBPRGKRZSA-N 403.389 2.435 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1OC 784025683 GTUOVOVJHUPGTH-UHFFFAOYSA-N 413.474 2.480 10 20 HECD CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785294842 OGHLVAMDGPCMFE-AWEZNQCLSA-N 413.474 2.266 10 20 HECD CN(Cc1ccccc1Cl)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311545 WYTZMSOIEKBZQL-UHFFFAOYSA-N 401.894 2.451 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCN3Cc3ccccc3)ccc21 803688331 PBIAJDLPVJTCMA-QFIPXVFZSA-N 420.557 2.466 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCC(=O)N2CCCCCC2)cc1 804080581 MSXHJXCGRBHXQJ-UHFFFAOYSA-N 416.566 2.400 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)cc1 804317650 KVIAVIJEEVYDGJ-QFIPXVFZSA-N 422.529 2.083 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(C(C)C)no3)CC2)cc1 806431581 ZMSRIUUCNSZGGA-UHFFFAOYSA-N 400.479 2.162 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1OC 807386975 SVNNUGACUMNQPK-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CCc1cnc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 807770432 OHGKYYZPUYAHMV-MRXNPFEDSA-N 417.531 2.278 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)nnn1Cc1ccccc1F 815329120 UQCXTYIKPIAZFG-UHFFFAOYSA-N 410.453 2.095 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)Cc2ccccc2)CC1 915363811 FIWYDBJPTLQJBA-UHFFFAOYSA-N 408.546 2.098 10 20 HECD CCCC(=O)N1CCC[C@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 919615602 VMJUGNOEVYLENX-SFHVURJKSA-N 403.523 2.293 10 20 HECD C[C@@H](NC(=O)N1CCN(C(=O)N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 920870410 FEZVUYOZHSWQON-GOSISDBHSA-N 415.538 2.127 10 20 HECD C[C@@H](NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920889261 RACNHZJUEVVVIZ-CYBMUJFWSA-N 423.922 2.315 10 20 HECD O=C(/C=C/C1CCCCC1)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1781283556 FORWWSCAYPSNKD-WMWRJIBUSA-N 415.490 2.073 10 20 HECD Cc1cccnc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1794264157 ZDAWFZPXIVKIDE-BJWYYQGGSA-N 410.474 2.081 10 20 HECD COCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811803382 INAYTXQXCIJGKR-FZKQIMNGSA-N 419.865 2.112 10 20 HECD C[C@H](CN)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814749607 BIADTFSGYWXMDQ-PSASIEDQSA-N 424.910 2.028 10 20 HECD COC(=O)c1ccc(COc2ccc(C=C3C(=O)N(C)C(=O)N(C)C3=O)cc2)cc1 3311546 ZKMHSVSEJLEEJT-UHFFFAOYSA-N 408.410 2.486 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(C(F)(F)F)c2)SC1=S 727178078 RJTVXWBEYFKBQD-FLIBITNWSA-N 410.464 2.456 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 728981422 ZHGAQEQQEXQQND-ZIAGYGMSSA-N 412.442 2.402 10 20 HECD O=C(NCC[S@](=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1 735095520 VEJCIDIOXHZJEF-NDEPHWFRSA-N 401.532 2.271 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@H](C)NC(=O)c3ccccc3)CC2)cc1 742927131 JRRIESYXWUTMCY-IBGZPJMESA-N 424.545 2.142 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](NC3CCOCC3)C(C)C)cc2F)CC1 743338807 GMNUOKIDDXIFQX-QFIPXVFZSA-N 420.573 2.377 10 20 HECD Cn1cc(N2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)cn1 746414928 IOGXIMHQNFAYKN-UHFFFAOYSA-N 400.552 2.005 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 749658879 NORGXKUIPDOUNN-UHFFFAOYSA-N 420.473 2.199 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 751324798 IKQBBSJTRADUOO-JTQLQIEISA-N 410.404 2.120 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4nc(N)ns4)CC3)c2C)cc1 753981281 AAXUMXZWTLIEDL-UHFFFAOYSA-N 412.519 2.499 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC3(c4ccc(OC)cc4)CC3)CC2)cc1 754144414 QORRPTBNSOCSRR-OAQYLSRUSA-N 411.546 2.466 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 757675477 KHIKEINYVCQBAW-GFCCVEGCSA-N 408.432 2.212 10 20 HECD CCNC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758230098 GJNGXFMRKWZXFI-FQEVSTJZSA-N 413.518 2.007 10 20 HECD O=C(NCc1ccc(-n2cncn2)nc1)NCc1cccc(Br)c1O 764762552 HVFIKMINMDHXRV-UHFFFAOYSA-N 403.240 2.130 10 20 HECD COc1ccc(C(=O)NCCNC(=O)NCc2cccc(Br)c2O)cc1 765468808 YVLWCEFOYYPDKF-UHFFFAOYSA-N 422.279 2.393 10 20 HECD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NCc2ccccc2O)cc1 769363854 WTWDHYFYQQETPE-IBGZPJMESA-N 416.499 2.454 10 20 HECD CN(C)c1nc(N)nc(COc2cccc(NC(=O)/C=C\c3ccc(O)c(O)c3)c2)n1 779514285 NSOORIAPWQMHPG-CLFYSBASSA-N 422.445 2.162 10 20 HECD COc1ccc(N2CCCN(CN3C[C@H](NC(=O)OC(C)(C)C)CC3=O)CC2)cc1 782933961 OSZNJTLJVOGTSN-QGZVFWFLSA-N 418.538 2.290 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C[C@H](C)O)[C@@H](C)CO)c2C)cc1 785537517 QHZCUVMHLYHKKW-HOTGVXAUSA-N 402.491 2.127 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4ncccc4C)CC3)nc12 788003742 GFKDQCJWYXBNEC-UHFFFAOYSA-N 411.462 2.358 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1 788327193 BRJFGPRWFYLXOE-UHFFFAOYSA-N 400.822 2.495 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)cc1 793637310 DKYJXHSYNAPQNB-MRXNPFEDSA-N 411.502 2.150 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 793644658 IHORWEZDIDCMCP-KSSFIOAISA-N 418.538 2.349 10 20 HECD C[S@](=O)C1(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 799404107 SIYYDGNCCMPMKH-CEXHIMGSSA-N 401.479 2.467 10 20 HECD COC[C@@H]1CCCCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804318757 SLDMPWXYNQPSQI-QGZVFWFLSA-N 403.523 2.055 10 20 HECD CCOC(=O)[C@H]1CCCN(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)C1 805134484 APRGDNADSXDEBW-JTQLQIEISA-N 411.307 2.309 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C(=O)N1c1ccccc1 807654047 KRSQPVARHYUXTM-UZLBHIALSA-N 408.502 2.021 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 807841481 CAPFYRVAWIQCJD-IBGZPJMESA-N 414.550 2.008 10 20 HECD NC(=O)c1cccc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 809989779 GXTKYUOEJIDDLV-UHFFFAOYSA-N 403.479 2.170 10 20 HECD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)OCC(=O)c2ccc(O)c(O)c2)c1C 916591585 WWGQYRUFMLKATL-UHFFFAOYSA-N 421.471 2.036 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccnc1N1CCCCC1 920195537 UJWAEYFUUJDALU-UHFFFAOYSA-N 423.517 2.163 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C(C)=O)c(C)nc1C 1324200313 MAJQRNYPNQDVMQ-KRWDZBQOSA-N 400.431 2.216 10 20 HECD C[C@@H](OC(=O)[C@]1(F)CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1328754432 YKBMHIJSLXXECG-IPQOISQHSA-N 411.385 2.461 10 20 HECD Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)[nH]1 1824701602 IVPFNXMQWFJOLB-KRWDZBQOSA-N 413.478 2.071 10 20 HECD CC(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424640 LEBWFGLPMABPTJ-QGZVFWFLSA-N 405.495 2.151 10 20 HECD COc1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 8155198 MCZUCJOCBXUVFN-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(OC)c(OCC(N)=O)c(OC)c1 53661982 MBGVZYZILGMEQS-UHFFFAOYSA-N 415.490 2.296 10 20 HECD COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(N2CCOCC2)cc1 165503349 CQJBTFAFNZVFCH-LJQANCHMSA-N 402.491 2.070 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)n(C)c2ccccc12 472788855 LYGCJRQDHODPAY-UHFFFAOYSA-N 402.458 2.381 10 20 HECD O=C(COc1ccccc1CNCc1cc2c(cc1O)OCO2)NC[C@@H]1CCCO1 725848599 YMXBCIOZPSFAIZ-KRWDZBQOSA-N 414.458 2.085 10 20 HECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCc2ccc3c(c2)CCCN3C)C1 726250192 TWBBSKSEVQCLHM-LPHOPBHVSA-N 402.539 2.142 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(-c2nnnn2C)c1 742272675 KEQGGOBAZVBXGL-UHFFFAOYSA-N 400.508 2.154 10 20 HECD COc1ccc(N2CCC(NC(=O)N(CCO)CCOCC(F)(F)F)CC2)cc1 745799064 GDFMRSXPAMWDBL-UHFFFAOYSA-N 419.444 2.247 10 20 HECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 749627250 IHBCZYPHLOXWIG-UHFFFAOYSA-N 410.474 2.175 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3sc(C)nc3C)CC2)cc1 751240348 JWMRAUMWNFYLIB-UHFFFAOYSA-N 424.592 2.259 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 751661372 DYRHYEGRGNOIOC-UHFFFAOYSA-N 417.531 2.312 10 20 HECD COc1cc(N2CCN(C(=O)c3cn(C)nc3C(F)F)CC2)cc(OC)c1OC 759223018 OYIOBSORPQSCOA-UHFFFAOYSA-N 410.421 2.346 10 20 HECD CCCCN(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765032649 FMOPGGDHBHQLFD-UHFFFAOYSA-N 424.504 2.444 10 20 HECD O=C(CN1CCOC2(CCOCC2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767910892 CXHYLKWOAUMOIL-UHFFFAOYSA-N 420.465 2.282 10 20 HECD C[C@@H](O)C[C@H]1COCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 768328576 VZBJYHDXMUQETH-PBHICJAKSA-N 413.465 2.438 10 20 HECD COC(=O)CSCCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768917005 VKSSBZCGBMPINN-OAHLLOKOSA-N 400.928 2.423 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 768950569 AWJGPUFLACZXJI-CQSZACIVSA-N 424.517 2.499 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1NS(C)(=O)=O 773847093 NXAXNVSFSCYQKK-AWEZNQCLSA-N 418.519 2.248 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)NCC3CCCCC3)CC2)cc(OC)c1OC 774498892 OKPMYCGAMQTUJI-UHFFFAOYSA-N 419.522 2.058 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2cnn(CC(F)F)c2)cc1 777678186 PAEQTCIIARNNEK-UHFFFAOYSA-N 410.450 2.260 10 20 HECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 779337022 VIFXZTIAOHQSBA-BJLQDIEVSA-N 402.539 2.081 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 785298522 VPEWIBYNYBBREH-LBPRGKRZSA-N 421.457 2.446 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)cc1 785444281 RIMKMQXSIKIGOR-PMACEKPBSA-N 416.472 2.209 10 20 HECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(CC1CCCC1)c1ccc(N)cc1 786425785 ICSWIEFKDYUXTL-UHFFFAOYSA-N 413.478 2.341 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(Cc1ccccc1)[C@]1(CO)CCOC1 787674943 IGHOVMMESGJLAP-DEOSSOPVSA-N 411.546 2.365 10 20 HECD COc1ccc(N2CCN(CCCN[C@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 788505822 KSFWBPKSHRABJI-RXVVDRJESA-N 409.596 2.153 10 20 HECD COc1ccc(Cn2cc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)cn2)cc1 792978489 IAXUIBRHORRZHH-CQSZACIVSA-N 424.457 2.470 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c(O)c1 794376402 FAEZAVCTWCSTKG-OAHLLOKOSA-N 410.517 2.240 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3c3cc[nH]n3)CC2)cc1 804276124 HVHUNHOFKCENCQ-VFCOFNOGSA-N 423.517 2.377 10 20 HECD Cc1cc(Cl)nc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807560969 YJRMBHSWJFAHBQ-UHFFFAOYSA-N 416.909 2.155 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C(=O)N1c1ccccc1 807654045 KRSQPVARHYUXTM-OXJNMPFZSA-N 408.502 2.021 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1nc(O)c2ccccc2n1)c1ccc(N(C)C)cc1 807672576 DLGQJYKMSMTCPL-CQSZACIVSA-N 407.474 2.237 10 20 HECD Cc1cc(CC(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 915263996 DGYADBDEEOHKFN-UHFFFAOYSA-N 423.966 2.137 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C(F)(F)F)n1 918372103 LHEVCPXSSSYUKB-CYBMUJFWSA-N 409.412 2.071 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(-n3nccn3)cc2)C2CC2)cc1 918457007 QVJAGENXYJWDJP-UHFFFAOYSA-N 404.474 2.463 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(=O)n3c(nc2c1)CCC3 919859894 KCMDYSPOSOKHOY-UHFFFAOYSA-N 404.470 2.109 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 1319870800 NVXBXBZRKWGEOB-DEOSSOPVSA-N 409.530 2.371 10 20 HECD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCC3)c2)cc1 1335672918 FKXKGHSVCFCGMP-HNNXBMFYSA-N 403.504 2.198 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccs1)c1cc(O)nc(O)c1 1794471757 GFYGJRRLJWDDIZ-QDMKHBRRSA-N 401.488 2.439 10 20 HECD CC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816833242 XIQIPAJFWPJMMH-LBPRGKRZSA-N 423.564 2.308 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3cc(OC)c(OC)c(OC)c3)CC2)cc1 57547895 UFEHQXVQQNRNRT-UHFFFAOYSA-N 415.490 2.482 10 20 HECD O=C(CCNC(=O)c1ccc(Br)cc1)NCCc1ccc(O)c(O)c1 98074672 ZMCGNMKIEDDMES-UHFFFAOYSA-N 407.264 2.339 10 20 HECD CN(C)c1ccc(CNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1 115236865 YRHOTIBBAVQJJF-LJQANCHMSA-N 417.531 2.140 10 20 HECD Cc1cc(CN2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)on1 141039085 NHUZFNYGWNPKPZ-GOSISDBHSA-N 413.522 2.408 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 731526736 BSWWYQHMGHOTTK-UHFFFAOYSA-N 417.393 2.248 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3cccc(F)c3)cc2)C1 734660409 PTTURHSIQNPDST-PXNSSMCTSA-N 414.481 2.060 10 20 HECD O=C(NCC[S@](=O)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 735096142 VWSOGUDNHFLTFD-LJAQVGFWSA-N 419.522 2.410 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc([S@@](C)=O)c1)c1ccc(N2CCOCC2)cc1 737157163 HSHHOMDPUXXARA-MHTXLSKPSA-N 415.515 2.077 10 20 HECD C[C@@H]1[C@@H](C)[S@@](=O)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744408333 WMRQLCYQEJTRAH-SIJNZQJQSA-N 410.495 2.242 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4ncccc4c3)cc2)C1 747251439 TWNKENCJIZXPKH-GOSISDBHSA-N 424.526 2.415 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(=O)N1CCOCC1 752968283 PNSCJQPOQGZBDT-FQEVSTJZSA-N 402.539 2.360 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1 754596258 GFHTXXOHIUTDOK-HXUWFJFHSA-N 412.490 2.149 10 20 HECD Cc1cc(F)cc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 758042054 VSPVMLAXKGLJHY-UHFFFAOYSA-N 418.471 2.469 10 20 HECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 761650921 KSYPPPXWHSKSLB-CYBMUJFWSA-N 415.446 2.143 10 20 HECD COC(=O)N[C@@H](C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 761775209 DOPDNRZDEBXUDN-XJKSGUPXSA-N 408.499 2.179 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 761950726 SELQVSWKDJUTGO-AWEZNQCLSA-N 424.457 2.470 10 20 HECD COC(=O)c1ccccc1S(=O)(=O)NCc1cccc(Br)c1O 766201863 WISIMJLVTFMMFN-UHFFFAOYSA-N 400.250 2.420 10 20 HECD O=C(CN1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1)Nc1ccc(Cl)cc1 768465951 UIDJIIUMRMQEBN-IBGZPJMESA-N 417.893 2.228 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773844715 FNOAEXSWDKYJGH-CYBMUJFWSA-N 400.454 2.409 10 20 HECD C[C@H](NCC(=O)NC(=O)NCc1cccs1)c1ccc(N2CCOCC2)cc1 775259278 QSMDBUUQMRQKJM-HNNXBMFYSA-N 402.520 2.261 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@H](C)[C@H](OC)C3(C)C)CC2)cc1 778420581 XQJPASOJXRHWBG-VTYLLSBJSA-N 415.534 2.076 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O 779484166 ATDAHZUVLFEYIR-JXFKEZNVSA-N 420.531 2.167 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785292880 BVIOJWCBBUKUSI-CYBMUJFWSA-N 409.446 2.062 10 20 HECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785298150 WCAZWIMYCXUVRX-LLVKDONJSA-N 404.394 2.100 10 20 HECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785435471 ZWRDJEOEWHISOZ-GOSISDBHSA-N 410.518 2.020 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccnc3Br)cc2)CC1 786658640 CCLDFOOUQPIKLA-UHFFFAOYSA-N 417.307 2.443 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H](C)S(C)(=O)=O 788282777 LKGIFCANVBLXFW-CHWSQXEVSA-N 422.469 2.227 10 20 HECD CN(Cc1cc(F)c(F)c(F)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321565 XNGXZRCPRXSXJH-UHFFFAOYSA-N 421.419 2.215 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)/C=C\c2ccccc2Cl)ccc1O 790405512 KSNNJVBTTWKYTK-HJWRWDBZSA-N 402.881 2.366 10 20 HECD C[C@@H](NCCNS(=O)(=O)c1ccc(F)cc1F)c1cc([N+](=O)[O-])ccc1O 799724800 AHAZGLJQIMOSJC-SNVBAGLBSA-N 401.391 2.208 10 20 HECD CC1(C)CNC(=O)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 800322380 BWOMYJIXRWDDNA-LCYFTJDESA-N 423.585 2.467 10 20 HECD COc1cc(N2CCN(c3nnc(-c4cccn4C)n3C)CC2)cc(OC)c1OC 800761438 NXTVCUCAYPBOJN-UHFFFAOYSA-N 412.494 2.173 10 20 HECD CN(C)CCN(Cc1cccs1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686601 NLMRDCWWPWGCQF-UHFFFAOYSA-N 414.575 2.337 10 20 HECD CN(C)c1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 805011037 PVIJNNCSDKUEDE-MRXNPFEDSA-N 424.954 2.450 10 20 HECD O=C(NCCc1ccc(F)c(F)c1F)C(=O)NCc1ccc(N2CC=CC2)cc1 807292523 SFUJVAABHIAIPZ-UHFFFAOYSA-N 403.404 2.455 10 20 HECD CCC[C@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1=O 917836349 LTGMWAGLXZHKLJ-QXAKKESOSA-N 414.550 2.042 10 20 HECD NC(=O)COc1cccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 918293740 FMTRMZCKXLRFPC-UHFFFAOYSA-N 423.425 2.017 10 20 HECD O=C(CCNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 919969633 ASBUSIWPKRWKOK-UHFFFAOYSA-N 413.493 2.471 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc2c(cc1Cl)OCO2 920194803 HPTZZQYMJDOYDA-UHFFFAOYSA-N 417.849 2.160 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nc2c(s1)CCC2 920940025 QXWZUSFTJMRGKK-UHFFFAOYSA-N 406.533 2.188 10 20 HECD O=C(CSCCN1CCOCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1115821456 RJUWNNXQDLIAGR-UHFFFAOYSA-N 410.495 2.466 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 1116419913 UZEQQDPEFJHYFQ-HSZRJFAPSA-N 422.485 2.102 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)C2CCC2)[nH]n1 1823497465 ZGBQUYJGDJCTHZ-ZDUSSCGKSA-N 421.548 2.062 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 43175461 NZBOAZVDFPHETB-UHFFFAOYSA-N 418.519 2.095 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 726609788 FRXFFCXYJTXDDV-ROUUACIJSA-N 404.555 2.463 10 20 HECD CCN1CCN(c2ccc(CN/C=C3/C(=O)NC(=O)c4ccccc43)cc2F)CC1 730202828 AAKWZGRHHVITAQ-XDJHFCHBSA-N 408.477 2.368 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1OC 734701500 BEDKNJJFLTWHMM-UHFFFAOYSA-N 401.463 2.342 10 20 HECD C[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(S(N)(=O)=O)c1 743506027 JDSRHUBALMBALV-ZDUSSCGKSA-N 403.504 2.479 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 748707744 BUXXDUVWDPQIQI-UHFFFAOYSA-N 417.550 2.241 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(C)CCOCC3)CC2)cc1 753349203 KMYJZCKLTDHFNP-UHFFFAOYSA-N 404.555 2.323 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C)c2cc(F)cc(F)c2O)c1 756705592 KYUGXTCUOKWGRM-QWRGUYRKSA-N 413.446 2.256 10 20 HECD COc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(Br)c1O 761015594 OAZCOCRYNHSEED-YWEYNIOJSA-N 404.263 2.449 10 20 HECD O=C(NCc1cccc(Br)c1O)NCc1nnnn1-c1ccccc1 764777660 COTFMBMHKRLCJQ-UHFFFAOYSA-N 403.240 2.130 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)NCc1cccc(Br)c1O 766201958 YAZNJBDAYRVRBG-WCQYABFASA-N 406.298 2.306 10 20 HECD O=C(NCCSCCCO)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769228263 RZJUDBSDEWBWHD-UHFFFAOYSA-N 416.546 2.100 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCN(C)S(=O)(=O)c1cccs1 772016442 NLDARDRGMMWMHH-UHFFFAOYSA-N 410.565 2.242 10 20 HECD O=C(NCc1ccco1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774119451 RVVLLJJPWNIVFD-UHFFFAOYSA-N 411.380 2.068 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)CCC(C)C)CC2)cc(OC)c1OC 774662628 HEKHRIQONYDLTM-MRXNPFEDSA-N 421.538 2.302 10 20 HECD COc1ccccc1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 775052052 JQTPAESVVAFYQX-UHFFFAOYSA-N 413.543 2.224 10 20 HECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1(C)C 775772656 VPZIICLKFLVTSM-IWKCEXAMSA-N 402.539 2.247 10 20 HECD CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)C1=O 775837339 RKBIIENWUAXLDN-WAIKUNEKSA-N 423.517 2.292 10 20 HECD CC(C)CNS(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 779542887 UDYSYISUDQWOSC-UXBLZVDNSA-N 404.488 2.362 10 20 HECD C[C@@H](OC(=O)Cc1ccn(C)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782389749 SYFZLEJKYAQZBW-CYBMUJFWSA-N 417.421 2.308 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCO[C@]2(CCSC2)C1 788931107 FLKFENRNRPMPIS-LAUBAEHRSA-N 403.548 2.074 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nc3cc(OC)ccc3n2C)cc1 788953811 FEIVLGWHPQSFKO-UHFFFAOYSA-N 423.517 2.361 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@@H]1c1ccncc1 789801537 UQXVSLXXBJCDCZ-LJQANCHMSA-N 412.465 2.037 10 20 HECD O=C(NCCCc1cccs1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814106 XYPNUOXEALMSQM-UHFFFAOYSA-N 405.495 2.089 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@@H](C)CC3)cc2F)C[C@@H](C)O1 789822963 XJVSDYVYBPWOJL-XHSDSOJGSA-N 423.554 2.410 10 20 HECD O=C(CN1CCN(C(=O)c2c(F)ccc(O)c2O)CC1)Nc1ccccc1Cl 789943975 KWUQJYITCGJWKQ-UHFFFAOYSA-N 407.829 2.287 10 20 HECD CN(CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1CCCCC1 791129479 ZDTYPJVBQYGZHS-UHFFFAOYSA-N 407.580 2.192 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@](C)(OC)CC3)CC2)cc1 794186279 ZBNBBDVQELZZEK-AXKWSIDASA-N 415.534 2.318 10 20 HECD Oc1cc2c(cc1CN1CCN([C@@H]3CCN(Cc4ccccc4)C3)CC1)[C@H](O)CO2 795696789 DIMAELKYSIWROH-NFBKMPQASA-N 409.530 2.210 10 20 HECD CCc1ccnc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 798064760 FMZRKUGURLDESB-CMDGGOBGSA-N 408.502 2.174 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ncnn3C(C)(C)C)cc2F)CC1 800029432 KVDKXHCSIQIABD-UHFFFAOYSA-N 417.533 2.314 10 20 HECD CC(=O)NC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CCO1 800742565 UORZLBFOXLFLIX-IBGZPJMESA-N 408.506 2.231 10 20 HECD CC(C)n1cc2c(n1)[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)CCC2 803663463 ZUBAWYBMUUUFKZ-KRWDZBQOSA-N 401.486 2.479 10 20 HECD COc1ccccc1O[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 804716969 ZLZAXXHBLRVSNW-HNNXBMFYSA-N 420.487 2.456 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 807973775 YWDKADVBDFMLST-ZWKOTPCHSA-N 403.523 2.055 10 20 HECD O=C(CN1CCOCC(F)(F)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808784421 FKBBESKRSJBZQT-UHFFFAOYSA-N 400.381 2.368 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CC[S@](=O)C1 1116279714 ZELJYANLVJFANP-JXQATOHYSA-N 414.599 2.367 10 20 HECD CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 1317920954 KGACXDNYVQAPHR-YLJYHZDGSA-N 420.513 2.155 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 1341406038 CDCBABIFJNBDOT-UHFFFAOYSA-N 417.531 2.298 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(F)cc2F)C1 1841796180 NQPAFCGCSIRQGM-HWKANZROSA-N 415.396 2.301 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccccc2Cl)C1 1842702140 XVCXSKBQTROKPK-UHFFFAOYSA-N 401.850 2.206 10 20 HECD C[C@H](Cn1ccnc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502324 LDVSLUSKXFYLSU-CYBMUJFWSA-N 418.881 2.101 10 20 HECD O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc2nsnc12 14225235 IDKMUYHGQPIAAM-UHFFFAOYSA-N 424.529 2.277 10 20 HECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2NC1=O 138478549 ZNJHARCDJOIASQ-ZDUSSCGKSA-N 408.458 2.043 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3cccc(C#N)c3)cc2F)CC1 303301993 CXNYSCOJJNOYMR-UHFFFAOYSA-N 416.522 2.459 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)C[C@H](O)COCc2ccccc2)n(C)c2ccccc12 582082398 ITEDSOSPONFMPO-IBGZPJMESA-N 423.513 2.139 10 20 HECD NC(=O)CC[C@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 727158591 VKGUAVXVGGZUNR-OAHLLOKOSA-N 419.481 2.378 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)cs1 728566209 PDJLRWPIFPKNSQ-UHFFFAOYSA-N 404.517 2.212 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C(C)(C)C)C3)cc2F)CC1 730194232 BTWPESCZVSBLDS-QGZVFWFLSA-N 404.530 2.231 10 20 HECD CCN(CC)c1ccc(CNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)cc1 731447750 VPAJYWRPQKIBCK-UHFFFAOYSA-N 411.549 2.196 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1 734064346 FKSLGQZWAPKPLK-IBGZPJMESA-N 403.454 2.413 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccs1 740472864 FLZVMDVRAMYXKN-KKSFZXQISA-N 416.547 2.157 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(F)c1F 743389591 BALIZEVPQADBAM-UHFFFAOYSA-N 407.392 2.320 10 20 HECD CNC(=O)CC1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 746669589 GCFKVXKTGVSQJB-UHFFFAOYSA-N 419.481 2.249 10 20 HECD O=C(NC[C@@H]1CCN(C2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065206 NXYXNZRLZHDBKB-ZDUSSCGKSA-N 421.544 2.469 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1[N+](=O)[O-] 751098201 OUGVENGUVACEFI-MRXNPFEDSA-N 412.446 2.235 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-n4cccc4)nc3)nc12 753484246 HPVNJILTHRWZPW-UHFFFAOYSA-N 407.386 2.154 10 20 HECD COCCNS(=O)(=O)c1cccc(CN[C@H](C)c2cc(F)cc(F)c2O)c1 756587857 DGJADAGVKWFYKE-GFCCVEGCSA-N 400.447 2.446 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 758202249 HGMHLSAGSKPSRH-KIFXHHALSA-N 418.626 2.278 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cnn(C)c2N)NC(=O)OC(C)(C)C)cc1 758290747 RMQZIURFEPHCFF-MRXNPFEDSA-N 402.499 2.064 10 20 HECD C[C@@H]1CCCCN1C(=O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 768298674 DVQJYDPXOIBSNS-CQSZACIVSA-N 410.902 2.472 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(Br)s1 769282048 IFHICKBAGCPWGT-UHFFFAOYSA-N 419.322 2.153 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 773768519 IXWLMEWKJGECOY-CYBMUJFWSA-N 401.419 2.204 10 20 HECD O=C(NCCc1ccccn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774123382 MILXIWCVYDWLOE-INIZCTEOSA-N 418.444 2.127 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(O)(C(F)(F)F)CC1 775420630 YKLDCFAYBSKYDZ-UHFFFAOYSA-N 405.392 2.261 10 20 HECD COC1(C)CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 775558942 XEAWOOICNORJNE-UHFFFAOYSA-N 419.547 2.425 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Nc3nc(C)cs3)CC2)cc1 775906928 NWOMIEYOLJWZND-HNNXBMFYSA-N 418.519 2.153 10 20 HECD COCC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(N)=O 775978190 YWRRXNHUOXFZMN-MRXNPFEDSA-N 408.296 2.477 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCS(=O)(=O)C1CCCC1 777826062 GIOAAAUERBDHOK-UHFFFAOYSA-N 417.911 2.295 10 20 HECD Cc1cc(C)cc(OCC(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1 779534157 FHXAPULUWRFFQY-GQCTYLIASA-N 410.470 2.478 10 20 HECD Cc1cc(O)cc(=O)n1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 783567280 WNAQTMSVTWXFJI-IYBDPMFKSA-N 417.481 2.322 10 20 HECD COC(=O)[C@H](Cc1ccc(F)cc1)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 783569637 NLVKYMKDRCDIHO-RXVVDRJESA-N 413.493 2.401 10 20 HECD CN1CCC(N(Cc2ccccc2)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785439602 RXVWBCAXFMBTAZ-UHFFFAOYSA-N 408.546 2.492 10 20 HECD CCOC[C@H](C(=O)O)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 797710490 ZRYWOMCONRNRKW-SUNYJGFJSA-N 411.474 2.070 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 806276267 AQHVYLORMKHXGG-ZBFHGGJFSA-N 408.593 2.217 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(CCOc2ccccc2)CC1)c1ccc(N(C)C)cc1 807674218 IHQKUIRPCYOMTI-IBGZPJMESA-N 424.545 2.153 10 20 HECD Cc1cc(Cn2nnc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2C)on1 814102149 CYTUXEKMMBKMHV-UHFFFAOYSA-N 410.478 2.040 10 20 HECD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 916591082 ZMDPLAMNYROVIB-UHFFFAOYSA-N 413.835 2.041 10 20 HECD CC(C)(C)C(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918220282 AFUBUBYVWDIJPY-UHFFFAOYSA-N 420.529 2.187 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3cccc(F)c3)cc2)C1 921122484 JWULYMZKIKXQPR-XLIONFOSSA-N 414.481 2.060 10 20 HECD COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(Br)c1O 1320989994 WAAJTVXRQXMIQK-GXSJLCMTSA-N 409.074 2.025 10 20 HECD O=C(Cc1ncccn1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786952605 ORZXGQBQJOYUTH-UHFFFAOYSA-N 419.441 2.273 10 20 HECD Cc1[nH]ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934168 BCPHSIAPFIYKRG-VBUUOAMHSA-N 419.485 2.368 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 437003896 AOMFIGUBNGCZLC-UHFFFAOYSA-N 401.488 2.233 10 20 HECD COc1cc(C(=O)NCc2c(C)c3ccccc3n2C)cc(OC)c1OCC(N)=O 471225257 CPGAYYGCXPIPOF-UHFFFAOYSA-N 411.458 2.298 10 20 HECD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1cn(Cc2cccnc2)nn1 542187760 BWTBJSMEDUDLNS-ZSOIEALJSA-N 401.386 2.284 10 20 HECD O=[N+]([O-])c1cccc(F)c1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 557462412 IYLVSDBQVLWLIR-UHFFFAOYSA-N 423.451 2.250 10 20 HECD CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@@H](c3nn[nH]n3)C2)C1 579311867 SMOMYOZVIBVLJN-MRXNPFEDSA-N 407.522 2.327 10 20 HECD COc1cc(/C=C2/SC(=S)N(CC(N)=O)C2=O)ccc1OCC(F)(F)F 727176711 YIOCLIQTLKMDFN-VZUCSPMQSA-N 406.407 2.323 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1F 731408230 GMOZFMZEFCZYPD-UHFFFAOYSA-N 421.494 2.330 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1 734073042 BDBVWKIJISAVAE-UHFFFAOYSA-N 411.458 2.200 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1 739078130 BRDDZRDJFRKJKU-HNNXBMFYSA-N 415.490 2.466 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1-n1cncn1 742051068 WEKNLMZYYCMCNB-LJQANCHMSA-N 418.501 2.207 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)NC(=O)c3ccccc3)CC2)cc1 742927132 JRRIESYXWUTMCY-LJQANCHMSA-N 424.545 2.142 10 20 HECD CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 751302611 OEAZLVYZDZLLKY-OAHLLOKOSA-N 413.503 2.397 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCCN3C(=O)NC4(CCCC4)C3=O)cs2)cc1 751944139 CJCWNTQKBRQAHN-UHFFFAOYSA-N 414.487 2.338 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3CCCCCC3=O)CC2)cc1F 753795854 OHQGCSMPKBVPNJ-UHFFFAOYSA-N 406.502 2.459 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccccc4OC[C@H]3C)CC2)cc1 754272280 SDDASZFUAHQKKU-KNQAVFIVSA-N 411.546 2.461 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCC[C@@H]3O)cc2F)C[C@@H](C)O1 755062696 KXXJUHAXMIRVAX-HPNQWNLUSA-N 407.530 2.148 10 20 HECD C[C@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(F)cc1O 756712398 PRPBVWDBQUUMFD-DOTOQJQBSA-N 401.486 2.478 10 20 HECD COc1ccc(O)c([C@H](C)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)c1 757621393 OQYMKXUNKSZJFV-AWEZNQCLSA-N 406.508 2.051 10 20 HECD COC(=O)c1ccccc1CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758578847 XDLIMKUACLKSAW-IBGZPJMESA-N 423.513 2.424 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C[C@@H](O)c3ccco3)nc12 758828364 RWXLODKJIVSUFA-GDBMZVCRSA-N 400.435 2.293 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(c2ncc(F)cn2)CC1 759222718 WBUVTPXUVOIWTA-UHFFFAOYSA-N 416.526 2.201 10 20 HECD COCCC1(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 760740844 FFOIVMWZMYTWTF-UHFFFAOYSA-N 404.555 2.323 10 20 HECD Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 761591560 NQRIGLAYWIQOAW-UHFFFAOYSA-N 414.487 2.496 10 20 HECD COc1ccc(N2CCN(Cn3nc(-c4cnccn4)n(C)c3=S)CC2)cc1F 765079604 PHOYSROCWTUGMN-UHFFFAOYSA-N 415.498 2.335 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCN(C)C(=O)OC(C)(C)C)CC2)cc1 768744008 OEFYEXZOIAYUKA-UHFFFAOYSA-N 420.554 2.143 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(F)c(S(=O)(=O)NC)c3)c2)CC1 770287183 VLAOPHQINCDOFF-UHFFFAOYSA-N 420.510 2.128 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)CCS(=O)(=O)N(C)C)c1C 772277510 SQIZPNVXHQSNLR-UHFFFAOYSA-N 406.504 2.410 10 20 HECD NC(=O)c1c(Cl)cccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772912108 VEJBPXDNPJEGRG-UHFFFAOYSA-N 420.872 2.143 10 20 HECD COc1c(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cccc1C(N)=O 782780541 GNFNAYFERSFXRL-UHFFFAOYSA-N 423.425 2.260 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 784689858 RCMDNJXTLMDYGZ-ZDUSSCGKSA-N 417.487 2.187 10 20 HECD O=C(COC(=O)c1coc(C2CC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 786167870 PZKIWNHMDMFGSA-UHFFFAOYSA-N 403.410 2.001 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(Cl)c3c(c2)OCCO3)cc1F 787882138 XUIQGJRVYYAUSQ-UHFFFAOYSA-N 421.856 2.249 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(-n2ccnn2)cc1 788908880 CKXXOYLTJFVNEY-KRWDZBQOSA-N 418.501 2.361 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788940634 YAFRJPBNSDKNOS-LJQANCHMSA-N 414.550 2.058 10 20 HECD CC[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801848 WPISSXBLRZLKRU-LJQANCHMSA-N 414.481 2.283 10 20 HECD C[C@H]1CN(c2ccnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2)C[C@@H](C)O1 789967805 NYXFSNNBZNTPFY-HDICACEKSA-N 410.518 2.462 10 20 HECD CC[C@H](C)NC(=O)CCNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 793664448 GYQLPJOPQYMXNO-INIZCTEOSA-N 403.523 2.475 10 20 HECD Cc1cnc(CCN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803309797 COBJJJZLACQSKY-MRXNPFEDSA-N 416.547 2.166 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](OCC(F)(F)F)C3)ccc21 803686810 QSTPXTJDMXSHMI-MRXNPFEDSA-N 413.440 2.255 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(C)cc3OC)CC2)cc1 804317466 DNJBRFMSMVLHGC-UHFFFAOYSA-N 411.502 2.414 10 20 HECD CC[C@H]1C[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852466 UQQLFBOIWXUQDX-NQIIRXRSSA-N 412.578 2.482 10 20 HECD CN(C)C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c3nonc23)c2ccccc2O1 814385774 HSZBHTAEDMZKEZ-LLVKDONJSA-N 408.867 2.394 10 20 HECD Cn1c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc2ccccc21 918117835 KQBAAFKVGZIQNE-KRWDZBQOSA-N 420.517 2.274 10 20 HECD CCCC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 918370785 BNBMRUUYPKQYIB-RTBURBONSA-N 414.550 2.043 10 20 HECD COCCOc1ccc(C(F)(F)F)cc1NC=C1C(=O)N(C)C(=O)N(C)C1=O 920978024 QFYYLYANMVKWSJ-UHFFFAOYSA-N 401.341 2.077 10 20 HECD COCCN(CCOC)C1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1323780316 HSFJXTXEIXLZBW-UHFFFAOYSA-N 422.589 2.137 10 20 HECD O=C(Nc1c(Cl)ccc2nonc12)c1cccc(CN2CCS(=O)(=O)CC2)c1 1342950732 JEIRRSDDIVCBMG-UHFFFAOYSA-N 420.878 2.359 10 20 HECD Cc1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1794894451 UDFNCNXKKPRJHJ-QDMKHBRRSA-N 416.865 2.415 10 20 HECD Cn1cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794955690 RPJNTFIPYHTBBH-BEVBHUTCSA-N 411.458 2.107 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2c(c1)COC2 1796601190 CUELNXDMGMSXGK-BCDXTJNWSA-N 409.442 2.089 10 20 HECD Cc1ncoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826064235 NZEKFZLSYFYPMF-INIZCTEOSA-N 414.462 2.336 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1 6054362 STKXHLXETMLZBM-UHFFFAOYSA-N 405.432 2.171 10 20 HECD CCOCCN1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C[C@@H]1CC 522007927 KMTLEGCTNPVEGJ-SFHVURJKSA-N 414.550 2.062 10 20 HECD COC(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(CC(N)=O)C3=O)o2)cc1 727175947 JGCTVNVHLWMCHK-ZSOIEALJSA-N 402.453 2.420 10 20 HECD CCOc1cc(/C=C2\SC(=S)N(CC(N)=O)C2=O)cc(Br)c1O 727176395 QUBPIJVBIIGNCL-YHYXMXQVSA-N 417.306 2.240 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c1 728980976 RILDIXUDAJQZQM-FPTDNZKUSA-N 411.458 2.354 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 729535259 OIKSPSYPRDXJRV-FAYQHZLMSA-N 420.531 2.485 10 20 HECD CO[C@](C)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 730211120 KBYKWVJXURDGGM-NRFANRHFSA-N 402.516 2.099 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)N3CCc4ccccc4C3)nc12 740987703 UFKUZLJWDKDSRB-CQSZACIVSA-N 424.457 2.102 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@]3(C)Cc4ccccc4C(=O)O3)CC2)cc1 742921747 YVKWXKBZSIDAGS-DEOSSOPVSA-N 423.513 2.105 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(N(C)C)n1 750233800 UHWXZEOPTWJHAD-INIZCTEOSA-N 411.506 2.109 10 20 HECD COC(=O)[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 752332018 KXWKMVOOABBGPZ-GQIGUUNPSA-N 421.513 2.083 10 20 HECD CNS(=O)(=O)c1cc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1F 752414001 LGWOKWUEJPEKNF-UHFFFAOYSA-N 421.494 2.141 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)C[C@H](C)O)CC2)cc1 754043065 NXIXOKKNPZSKSF-NZQKXSOJSA-N 413.562 2.061 10 20 HECD COCCNS(=O)(=O)c1cccc(CN[C@@H](C)c2cc(F)cc(F)c2O)c1 756587860 DGJADAGVKWFYKE-LBPRGKRZSA-N 400.447 2.446 10 20 HECD CN(CCCNC(=O)C1CCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 758395838 CDXCCLBKBSJEQL-UHFFFAOYSA-N 420.529 2.235 10 20 HECD COC[C@@H]1CCCCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 768662629 CWWYPBRIVIRAIG-GNISGLHKSA-N 415.534 2.175 10 20 HECD COc1ccc(O)c(CNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1 769529446 AUJJEUHTDFFEQP-UHFFFAOYSA-N 410.386 2.093 10 20 HECD COC(=O)c1csc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 770255300 DLNMQICXQQBXLP-UHFFFAOYSA-N 423.516 2.091 10 20 HECD C[C@H](NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(S(N)(=O)=O)c1 774390750 DHSFFXWPGJYDHO-INIZCTEOSA-N 403.548 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccnn3CC3CC3)CC2)cc1 778377454 TYEVZYZWKSHSNH-CMDGGOBGSA-N 409.490 2.145 10 20 HECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cn2)n1 787487384 CPSGZEMTRGTSMZ-UHFFFAOYSA-N 424.480 2.022 10 20 HECD CS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834252 LHCCBSQQMYTKAM-DOTOQJQBSA-N 423.554 2.193 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccccc1C(N)=O 792302885 AITJOWWGTYCOFI-UHFFFAOYSA-N 404.850 2.279 10 20 HECD Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 797534098 VMSNVZVIKLQCIL-UHFFFAOYSA-N 420.513 2.463 10 20 HECD C[C@H](NC(=O)C(=O)N1CCOc2ccccc2C1)c1ccc(N2CCOCC2)cc1 803297784 GTGBSVLDAZRDEW-KRWDZBQOSA-N 409.486 2.122 10 20 HECD CN(C)Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803687949 SIDGJBKGNRCXQL-UHFFFAOYSA-N 408.546 2.405 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]4CCC[C@@H]43)cc2F)CC1 805007587 MOWRKCRHCGMPRB-QUCCMNQESA-N 416.541 2.375 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C 806334856 JCLAJIFNWNBDEW-GOSISDBHSA-N 420.554 2.343 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCc3c(C)noc3C)CC2)cc1 806479712 QSCNYKWDMARKHG-UHFFFAOYSA-N 414.506 2.088 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1C 810360887 AJICZFYEXIVXSL-NSHDSACASA-N 404.394 2.451 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)COC(=O)c2sc3nc(C)cc(C)c3c2N)C1 899147681 CBFDCKRSVHHVEG-ZDUSSCGKSA-N 419.503 2.454 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1ccc(-n2cncn2)nc1 916394699 GGGBAMIAPMDKHQ-UHFFFAOYSA-N 409.519 2.215 10 20 HECD Cc1nnnn1/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917706686 HPEIXEDCTLHRIV-STZFKDTASA-N 422.464 2.272 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc2nccnc2c1 918440839 VEJQGLLVNMMTEA-UHFFFAOYSA-N 407.499 2.438 10 20 HECD CN1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786567355 ZJHYAIMSCBAWRK-KRWDZBQOSA-N 410.474 2.335 10 20 HECD Cc1ccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)c2c1 1796600347 BSEZYLOIQUYFIM-MUJYYYPQSA-N 421.457 2.015 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2(F)CCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997608 BMHORNCNMCJSRG-KBXCAEBGSA-N 414.437 2.100 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CCc2ccc(F)c(F)c2)C1 1841201112 CRQDWLAQYMQRAC-UHFFFAOYSA-N 417.412 2.221 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)cc1C 6908845 ZRJGDHMERVUYCX-UHFFFAOYSA-N 419.485 2.341 10 20 HECD C[C@@H]1CCCC[C@H]1OCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 733567993 JLXAORZHBBYYMM-OXQOHEQNSA-N 422.497 2.417 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccnc(N4CCCCC4)n3)CC2)cc1 739711327 KMCSFHJXCCLAMO-UHFFFAOYSA-N 424.549 2.028 10 20 HECD CCO[C@@H]1C[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 740887210 QUHDUZXCFPRESF-VQTJNVASSA-N 407.530 2.414 10 20 HECD COc1cccc(CNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1O 745800785 OCLGRZKOKQAJEB-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nc(C)n(-c2n[nH]c(C(F)(F)F)n2)n1 747211856 OXJIGYIFVQAKSS-UHFFFAOYSA-N 422.415 2.441 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1[C@H]2CC[C@H]1CC(=O)NC2 748826223 ACBDPYQDWFJYCU-ILXRZTDVSA-N 417.465 2.142 10 20 HECD CC(=O)c1cc(Cl)cc(CN(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c1O 750045933 YULZUOBUUDSYMH-CVEARBPZSA-N 401.912 2.416 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC(=O)N2C)c(C)n1-c1ccc2c(c1)OCCO2 752027272 ACPYLAXEPBDYCL-KRWDZBQOSA-N 412.442 2.212 10 20 HECD CCOCCNC(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 753436979 JVBGBXWYFMNLMW-UHFFFAOYSA-N 415.829 2.425 10 20 HECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 760220592 ZBAHLOZLFRRICO-UHFFFAOYSA-N 404.474 2.213 10 20 HECD COc1cc(C)c(Br)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 765367439 XKOYGTYUCBDWBN-UHFFFAOYSA-N 423.263 2.475 10 20 HECD C[C@@H](NC(=O)N1CCCC[C@@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 767780696 IRCDNDFSJLLECK-VQIMIIECSA-N 409.552 2.193 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1-n1cnnn1 768913298 YQWGNUFPZDEROO-INIZCTEOSA-N 412.881 2.416 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCO[C@@H]3C)cc2F)C[C@@H](C)O1 771086723 MIGBRPAWQHETKW-KCYZZUKISA-N 408.470 2.024 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)C2CC2)cc1 776076145 JXCJTQGBPMQXRO-DYESRHJHSA-N 421.563 2.163 10 20 HECD Cc1cc(CC(=O)NCC2CN(S(C)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 778205673 FKKRZLVDPBASDB-UHFFFAOYSA-N 409.939 2.298 10 20 HECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2ccc(O)c(O)c2)c(OC)c1 778924696 DZLALFSQOGMWIK-INIZCTEOSA-N 400.431 2.036 10 20 HECD COc1ccc2ccc(O)c(CN3CCC[C@H](S(=O)(=O)N4CCOCC4)C3)c2c1 779869815 MIWMUABFENAYEC-SFHVURJKSA-N 420.531 2.180 10 20 HECD C[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H]1CO 785865070 VPKPDGDEVXIINN-CXAGYDPISA-N 401.429 2.454 10 20 HECD CCC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789819954 PICFJUXHDYATNT-SOLBZPMBSA-N 421.513 2.083 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@]3(C)CCCS3)cc2F)C[C@@H](C)O1 789837369 ZBJODIBESJBFTO-VTJXTGGHSA-N 423.554 2.457 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN2CCCC[C@H]12 790278173 KEYCMEIJDPCDOR-JKSUJKDBSA-N 424.339 2.246 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)c1ccccc1 792079238 HMGIHOWGWPWBJB-UHFFFAOYSA-N 419.460 2.441 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(Cc3cc4c(cc3O)OCO4)C2)CC1 795741941 GEUFDCQHJPOBAX-MRXNPFEDSA-N 405.495 2.248 10 20 HECD CC(C)C[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803297684 CXGRSAVAFANRSM-FBBABVLZSA-N 417.550 2.410 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCOC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803299336 JJFWANKDMRFCPX-MJGOQNOKSA-N 415.534 2.308 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 803385454 BLOIDBZHKPOREH-OAHLLOKOSA-N 401.429 2.274 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)CN3CCCCC3)CC2)cc1 804317751 OSQLKRZQHWIHTF-GOSISDBHSA-N 416.566 2.018 10 20 HECD Cc1cccn2cc(CCNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)nc12 806538420 HDEFNGKHPUOEEO-UHFFFAOYSA-N 405.502 2.000 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc4c3COC4=O)CC2)cc1 808923459 SWAXLHZLUFJQNE-UHFFFAOYSA-N 409.442 2.089 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cnccc3OC)CC2)cc1 814417454 VPBQBVAQMGGZSY-UHFFFAOYSA-N 413.522 2.110 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1 920019236 LURYFSFTMKFYOT-PBAKHKOTSA-N 420.513 2.172 10 20 HECD CS(=O)(=O)c1cc(C(=O)Nc2cccc(N3CCOCC3)c2)cc([N+](=O)[O-])c1 920292952 POMFHLLOFSQDGY-UHFFFAOYSA-N 405.432 2.087 10 20 HECD CCOC(=O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1320484265 VQBJKJLADFZKTB-PKOBYXMFSA-N 416.522 2.016 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817842557 FWRLQEPJYINYIG-LSDHHAIUSA-N 415.450 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 3555751 AHGRYPVKZFZDFT-UHFFFAOYSA-N 413.430 2.417 10 20 HECD Cc1cc(C)c(O)c(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1 216022276 CHFUAZRCFAZTRB-UHFFFAOYSA-N 405.476 2.424 10 20 HECD CCOC(=O)c1ccc2c(c1)N(S(=O)(=O)c1cccc3nsnc13)CCO2 573903487 HNHDEERVIJAAKS-UHFFFAOYSA-N 405.457 2.456 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4nccnc4c3)CC2)cc1 726726779 AKIFCXVQGHJFBO-UHFFFAOYSA-N 405.458 2.362 10 20 HECD CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 727755944 LFFUBTFDCUUBHB-SFHVURJKSA-N 405.564 2.477 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729280173 ONADMKQGHAAEMX-AWEZNQCLSA-N 422.503 2.125 10 20 HECD Cc1nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1-c1ccccc1 731577447 OFMGUOOLKCGFLL-GOSISDBHSA-N 418.501 2.207 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 734217247 UTQUXHYGQZDBSU-IAGOWNOFSA-N 406.502 2.109 10 20 HECD COc1ccccc1[C@@H](CO)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 734942724 QNBWCYCAABBYDS-GOSISDBHSA-N 403.454 2.204 10 20 HECD O=C1N[C@H](C(F)(F)F)CC[C@H]1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735520111 WCBKDTMRCFMOQP-FMKPAKJESA-N 400.397 2.357 10 20 HECD CCCN(C)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 745690315 ASPGZCWXAFGXIQ-PMACEKPBSA-N 415.582 2.262 10 20 HECD CCOC(=O)CCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748025504 YUWZGPVPQZBYJW-UHFFFAOYSA-N 412.489 2.328 10 20 HECD COc1ccccc1N1CC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 749960699 IKMXMLFCEBCQFN-CQSZACIVSA-N 419.503 2.029 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)c1 752126454 SKMCLNVXLSTFKV-UHFFFAOYSA-N 417.481 2.432 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(CN(C)C(C)C)CC3)CC2)cc1 754029466 IJQJDZHSAYCDIN-HSZRJFAPSA-N 418.626 2.230 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1F 754040655 WQEGBQCVVKBBNI-UHFFFAOYSA-N 413.402 2.393 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccn(-c4ccccc4)n3)cc2)C1 756916172 KBOLPRDJMQWQPM-IBGZPJMESA-N 417.513 2.433 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 759500765 WUZWXUAWALIFQO-CQSZACIVSA-N 419.494 2.333 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 761967767 OXRVCFDOBUVJHU-NSHDSACASA-N 408.451 2.472 10 20 HECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 762415822 JHOOJRIOVXLFAZ-OAHLLOKOSA-N 408.405 2.000 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnn1C1CCCC1 764939677 MXCAOKUVVGBWAN-UHFFFAOYSA-N 402.520 2.163 10 20 HECD O=C(Cn1cc(Br)ccc1=O)NCc1cccc(Br)c1O 765757582 RDZPFTBYJNBFMT-UHFFFAOYSA-N 416.069 2.395 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 767302295 QTLLZMNYFORCJO-OKILXGFUSA-N 400.516 2.269 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 767325757 YGSRGWYNIRVHFL-FYYLOGMGSA-N 416.566 2.322 10 20 HECD COc1cc(O)c(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)cc1OC 768440473 WYVOUBILFOTXOY-UHFFFAOYSA-N 424.494 2.491 10 20 HECD COc1cccc(OCCN2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c1 768462949 PFOKFXKWAIIDLM-OAQYLSRUSA-N 400.475 2.023 10 20 HECD C[C@]1(C2CC2)NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777616622 SKLWMUOSRWYRFH-JOCHJYFZSA-N 424.480 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@H]3CC(C)C)CC2)cc1 778277457 HPCGZSHCLOOJQW-NDDJGDGRSA-N 415.534 2.174 10 20 HECD CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 787085285 RWLXDRYMORBMHD-CYBMUJFWSA-N 400.454 2.344 10 20 HECD COCc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 787506433 UXPLSHFIBPCVHR-QGZVFWFLSA-N 411.502 2.163 10 20 HECD CC(C)C[C@@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788745368 GFFAWMKSWREJHB-AUSIDOKSSA-N 416.566 2.471 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCOC[C@@H]2CCOC2)cc1)C1CCCCC1 803677218 JRFWEFQVTPCHKB-LJQANCHMSA-N 417.550 2.241 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(Cc4ccccc4)CC3)ccc21 803686061 UQONLHUCCZLLLM-UHFFFAOYSA-N 406.530 2.030 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806254791 SUTIUHVKJNGMTB-UXHICEINSA-N 417.550 2.281 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1 806425696 LKFZMHMLWMRPCQ-JOCHJYFZSA-N 408.546 2.492 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1COC2(CCCC2)O1 806688764 XZCWXPUABDGDTK-LJQANCHMSA-N 403.523 2.292 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 807099388 UJEDTKRPHKYKOO-JOCHJYFZSA-N 408.546 2.410 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1 807611373 FCPFMROZFPAAFA-XUVXKRRUSA-N 415.534 2.054 10 20 HECD Cc1nc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c(C)o1 814312108 UUMVOUXZLPPRFW-UHFFFAOYSA-N 410.453 2.477 10 20 HECD CC(C)NC(=O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 914442346 CFVCYRVOOFRZIN-LCYFTJDESA-N 411.574 2.370 10 20 HECD COCCOc1ncccc1CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 916510475 MATXQNUHLVWMQR-UHFFFAOYSA-N 414.506 2.285 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4ccccc4)=NO3)cc2)C1 917834386 JVWIIQPTDKYWKG-WIYYLYMNSA-N 406.486 2.198 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccc(-n2ccnc2)nc1 918199596 JFRDMRIQLIEICW-UHFFFAOYSA-N 420.517 2.475 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2cccnc12 920195391 QWSJVVMZDNUMCW-UHFFFAOYSA-N 420.469 2.335 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccc(O)cc4C4(CC4)C3)CC2)cc1 1261214135 LHNRRENAWRFWAT-QFIPXVFZSA-N 423.557 2.431 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(C)ccc3S(N)(=O)=O)CC2)cc1 1319907618 GLSDTVULMUHVKE-UHFFFAOYSA-N 403.504 2.004 10 20 HECD CN(C)c1ccc(CNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1 733332678 LGFIXCAMEIKIHP-UHFFFAOYSA-N 415.582 2.276 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1 734702356 YNQNEHAFAUSWJH-UHFFFAOYSA-N 408.502 2.438 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(-n4cccn4)c3)nc12 735156106 RSJFNSMOGVXRNN-UHFFFAOYSA-N 407.386 2.154 10 20 HECD CCCCc1nnc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 738886169 ZSFSGWGPGDUSKA-UHFFFAOYSA-N 423.564 2.437 10 20 HECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)cs1 742288205 FQOXBWJYDUQGFE-UHFFFAOYSA-N 410.517 2.491 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3csc(C)n3)CC2)cc1 742940775 XMRTZZZJZGAPLM-UHFFFAOYSA-N 403.552 2.124 10 20 HECD CC(=O)Nc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 743641197 AAFUUQYBXJRFQY-LJQANCHMSA-N 423.517 2.346 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(C[S@](C)=O)c1 744530345 HXEDLIXINVPCCT-NDEPHWFRSA-N 402.516 2.447 10 20 HECD C[C@@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)n1nnc(-c2ccccc2)n1 745684937 RPBNXYJAKNSVPX-INIZCTEOSA-N 422.489 2.169 10 20 HECD C[C@H](NC(=O)N1CCC[C@H]1CN1CCOCC1)c1ccc(N2CCOCC2)cc1 745778332 APHBIQJTFPJDCN-RXVVDRJESA-N 402.539 2.090 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1 746989899 ISORWCFJOASVNN-UHFFFAOYSA-N 417.531 2.332 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 747240825 JCQFPCQIAXWXBT-UHFFFAOYSA-N 422.478 2.270 10 20 HECD COc1ccc2c(c1)OC[C@H](C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 747375933 UREGTCWUASOOSX-RBUKOAKNSA-N 423.513 2.264 10 20 HECD NC(=O)c1ccc(OCCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 748713571 PXDGDPYSSJSTSC-UHFFFAOYSA-N 411.502 2.080 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3Cc4cccc(O)c4C3)cc2)C1 758434541 BQPIAWZZXXMKBZ-MSOLQXFVSA-N 408.502 2.061 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCSC3)cc2F)C[C@@H](C)O1 762036455 OAYKFTKQSYAEGL-IJEWVQPXSA-N 410.511 2.352 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 765729590 PLIIYPICIMWIFE-LSDHHAIUSA-N 423.288 2.475 10 20 HECD C[C@@H](NC(=O)N1CCCC[C@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 767780689 IRCDNDFSJLLECK-APWZRJJASA-N 409.552 2.193 10 20 HECD O=C1c2ccccc2C(=O)N1C[C@@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 771173247 NOZTZRRHRFEKME-INIZCTEOSA-N 403.438 2.437 10 20 HECD CNC(=O)C(C)(C)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 772994344 AMWRBCUYEFYPKC-UHFFFAOYSA-N 416.444 2.113 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCN(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 774988897 RTEOPWGHFULFEJ-LJQANCHMSA-N 424.545 2.343 10 20 HECD Cc1cc(CNC(=O)NCc2ccc(N3CCCC3)cc2)ccc1S(N)(=O)=O 775221340 AVAPDUXMSRRDOJ-UHFFFAOYSA-N 402.520 2.242 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1Oc1ccccc1 776273240 YVPFLNCCFKVSJB-UHOSZYNNSA-N 420.487 2.119 10 20 HECD COc1ccc(O)c(CN2CCC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c1 777222914 QIZXPYRQPBOISC-KRWDZBQOSA-N 419.522 2.445 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1 785422066 GYGSHUUYRCBGCW-KRWDZBQOSA-N 400.910 2.417 10 20 HECD COc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)CC2)cc1 788871952 ZNYSJHPQQGPGCK-BJLQDIEVSA-N 418.563 2.070 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1Cl 791384513 HTSCPZHWZZEXFH-KRWDZBQOSA-N 417.893 2.458 10 20 HECD COc1cncc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 791701466 ZVCUTSUTTQCDQG-UHFFFAOYSA-N 417.377 2.056 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@H](C4CCOCC4)C3)CC2)cc1 804318015 WAGJCQJRAGIJAM-SFHVURJKSA-N 415.534 2.055 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CN(C(=O)OC(C)(C)C)C1 804753748 KZKJOJKMOKZTTP-UHFFFAOYSA-N 418.538 2.084 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3COC(C)(C)OC3)cc2Cl)C1 806655744 GTIBGDZHTVQYLS-CQSZACIVSA-N 423.941 2.460 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)CNC(=O)OC(C)(C)C 806766247 QITLUWZNKDIXEP-HNNXBMFYSA-N 406.527 2.131 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1nc(-c2cccc(F)c2)no1 807103930 XWUDSPRNKOGFTH-UHFFFAOYSA-N 411.437 2.183 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc2c1OCCO2 807386881 ODSCEOAWOLOASU-UHFFFAOYSA-N 407.220 2.181 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C 807514127 KQDFRZUWLLGAKH-YQQQUEKLSA-N 402.539 2.397 10 20 HECD O=C(N[C@H]1CCN(c2ccccn2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807693260 HKVGZXGBPDXSTO-SFHVURJKSA-N 420.469 2.304 10 20 HECD Cc1cc(N2CCC[C@H](N3CCN(Cc4ccc(N(C)C)c(C)c4)CC3)C2=O)n(C)n1 815086483 KMNDTJCEDJVZSK-QFIPXVFZSA-N 424.593 2.416 10 20 HECD CCn1nncc1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 815526214 KUKURYQTDMHUBJ-GFCCVEGCSA-N 418.409 2.257 10 20 HECD Cc1cc(C(=O)O[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c(C)n1-c1ccccn1 914903674 RLOFRWVREGNLMT-LBPRGKRZSA-N 412.368 2.423 10 20 HECD O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NCCc1ccc(O)c(O)c1 917356454 SNSNZJLHQQWFAL-UHFFFAOYSA-N 419.286 2.042 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccco4)no3)cc2)C1 917834666 MYNPAEQMEOIPLG-INIZCTEOSA-N 423.473 2.280 10 20 HECD O=C(CCn1c(S)nc2ccccc2c1=O)NCc1ccc(N2CCOCC2)cc1 919767216 OLTSBDGGFTWALW-UHFFFAOYSA-N 424.526 2.228 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@H](C)N2CCN(c3ccc(OCC)cc3)CC2)CC1 1319612696 NQFCGYLOGSNLNE-SFHVURJKSA-N 417.550 2.398 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCOC1)c1cc(O)c(O)c(Cl)c1 1804279745 WAXUOJWIEZWULN-MHEUCROKSA-N 408.882 2.430 10 20 HECD O=C(C[C@@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806591674 GBUZHNOLCOHPSI-KRWDZBQOSA-N 417.506 2.297 10 20 HECD C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)CC1(F)F 1828046815 IPKJOADHHGTPDM-VVVCHXIZSA-N 424.429 2.220 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc3ncccc3c2)C1 1841759161 UBOXYILCTMIJLT-UHFFFAOYSA-N 418.453 2.101 10 20 HECD Cc1ccoc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441490 CPZYRSUKUJSNLX-UHFFFAOYSA-N 406.442 2.198 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)CC2)cc1 726632059 QCRWMBZQVGCVPH-UHFFFAOYSA-N 417.531 2.358 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H](c1ccccc1)N1CCC(O)CC1 727767600 GGEKIJFFAPHQOE-HSZRJFAPSA-N 409.530 2.337 10 20 HECD COCCOc1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)ccc1OC 729064667 URKLGCXKAFZCFN-ZDUSSCGKSA-N 418.446 2.251 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1c(F)cccc1-n1cccn1 730386940 KQYVLPBCEYPHDU-UHFFFAOYSA-N 423.448 2.103 10 20 HECD COc1ccc(N2CCCN(C(=O)NCc3nnnn3-c3ccccc3)CC2)cc1 730582095 FZAATHIFUHSMDX-UHFFFAOYSA-N 407.478 2.093 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1C 735928790 SDOXBKJPUGYGPB-FQEVSTJZSA-N 424.545 2.065 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 737181814 DVKKXYUOHXKGHR-LBPRGKRZSA-N 400.435 2.358 10 20 HECD NS(=O)(=O)c1ccc(CNC(=S)NCc2c(O)ccc3c2CCCC3)cc1 741874954 KPWYYDSEUDUWPE-UHFFFAOYSA-N 405.545 2.083 10 20 HECD O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)N(Cc1ccco1)Cc1ccccc1O 743428959 SYOBHKGFVFCYIB-UKAVVXHISA-N 424.453 2.067 10 20 HECD O=C(CCNS(=O)(=O)c1ccccc1F)NCc1c(O)ccc2c1CCCC2 743718454 BPMYQWRZDLCTNC-UHFFFAOYSA-N 406.479 2.395 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N1CCN(C(C)=O)CC1 743870931 IAJCJIJLXQOWIY-ZDUSSCGKSA-N 412.328 2.056 10 20 HECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 745795718 JOTGNSZOIPGNNR-LJQANCHMSA-N 402.539 2.013 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCC[C@@H]1O 748619666 UNDUDAWBTWOZGY-LQBOVUBWSA-N 402.539 2.129 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 753640455 QBYGZJMGMNYNQZ-LBPRGKRZSA-N 412.895 2.119 10 20 HECD COc1ccc(N2CCN(CC(=O)N[C@@H](Cc3ccccc3)C(C)=O)CC2)cc1F 753856626 IVPMMUJJTULRLM-NRFANRHFSA-N 413.493 2.273 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1F 753858191 VHICZDMEPYWOQX-UHFFFAOYSA-N 401.438 2.366 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4cccs4)CC3)CC2)cc1 754061631 MCENYLWKJONUNO-FQEVSTJZSA-N 416.591 2.062 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1Cc1ccc(N2CCOCC2)nc1 760979830 WQSWMYGVJHHUPX-UHFFFAOYSA-N 416.865 2.242 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 768817441 OXTCIYKQVOUPTQ-GOSISDBHSA-N 419.522 2.455 10 20 HECD CC[C@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccc(N(C)C)cc1 773015438 MPZZUTXWFQMUIM-FQEVSTJZSA-N 405.568 2.380 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(N2CCOCC2)CCCCC1 774841369 HOZMPDKZVTZLIC-UHFFFAOYSA-N 417.550 2.282 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)nn(C)c2C)cc1 775280673 KEVYUJMQMSYNJE-UHFFFAOYSA-N 400.526 2.380 10 20 HECD CCN(C)C(=O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 775951815 PQMJOGTVTWPEEH-RAXLEYEMSA-N 411.574 2.324 10 20 HECD CC[C@@H]1C[C@@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 781776163 FOUBAOFGFBMCFW-FUHWJXTLSA-N 422.497 2.417 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1OC(F)F 786103158 QPPJOOGSYTWRFA-UHFFFAOYSA-N 419.428 2.057 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 789812152 JFLZPHGJVWSFSW-NUJGCVRESA-N 421.513 2.083 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 789812153 JFLZPHGJVWSFSW-SOLBZPMBSA-N 421.513 2.083 10 20 HECD CCc1nn(C)c(CC)c1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 790951383 MSZIYHPQMFVMLO-UHFFFAOYSA-N 411.550 2.072 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3[nH]nnc3-c3ccccc3)cc2)CC1 797758580 REKRLRVMUJGRIY-UHFFFAOYSA-N 404.474 2.070 10 20 HECD CC(C)O[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803307123 WEHOKVKKTWODOX-FFZOFVMBSA-N 417.550 2.409 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc2c(c1)CC(=O)N2C 803688571 UVQBKBHTCRJCHI-OAHLLOKOSA-N 420.513 2.082 10 20 HECD O=C(NCCC1(O)CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805772620 LXBVDMJZEJATFN-HNNXBMFYSA-N 413.465 2.488 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cnn4ccccc34)cc2)C1 805783095 SGOODPGQLWQHMI-KRWDZBQOSA-N 406.490 2.035 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 807099376 UDEMVZKNUCTTMQ-OAQYLSRUSA-N 417.550 2.254 10 20 HECD Cc1ccnc(OC2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)c1 807289873 LNRSPMMHTHLXLN-UHFFFAOYSA-N 420.513 2.452 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)CC1(C)OCCO1 807420984 QKANEWVTWWJYIB-INIZCTEOSA-N 403.523 2.149 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC([C@](C)(O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673551 VORGMLUZWXKMLR-DJJJIMSYSA-N 415.456 2.482 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807674413 KNOOGVKBBKCHTA-DOTOQJQBSA-N 403.523 2.368 10 20 HECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 807831226 RIJGGPABDMYPLU-INIZCTEOSA-N 418.538 2.084 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc(Br)cc1 810156580 MFUFRTNQIACUEG-UHFFFAOYSA-N 413.293 2.092 10 20 HECD C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccc(Cl)c2nonc12 814378845 VHRQXFFIOYQNJH-KOLCDFICSA-N 406.851 2.433 10 20 HECD CCCn1c(SCC(=O)c2ccc(O)c(O)c2)nc2cc(S(N)(=O)=O)ccc21 916532843 KNEXGRRFOFUWFM-UHFFFAOYSA-N 421.500 2.480 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccc2c(c1)OCCO2 918184500 GDCHPCSGNMUUTH-UHFFFAOYSA-N 401.438 2.433 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc(C)c1O 1796603782 WVZMTATVKAOXBR-BJWYYQGGSA-N 411.458 2.381 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2o1)c1cc(O)nc(O)c1 1800903060 ZNIZPHQWVLNCRN-BTTYYORXSA-N 408.414 2.200 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 1844829352 KJCZENXGZSNLQI-UHFFFAOYSA-N 420.809 2.118 10 20 HECD NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(Cl)cc2)c([N+](=O)[O-])c1 16218215 CZERUERXIDEAHF-UHFFFAOYSA-N 401.857 2.209 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 23855276 PDHJNXLIXGUIAH-UHFFFAOYSA-N 410.430 2.117 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(-c2cnco2)c1 147103244 QLQLNNTXDDEUDA-UHFFFAOYSA-N 406.442 2.433 10 20 HECD O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1 726236635 PCCZYTIVAKPHEY-UHFFFAOYSA-N 417.531 2.186 10 20 HECD CCNC(=O)c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726725428 CYFOHAQMLMSSSK-UHFFFAOYSA-N 424.501 2.169 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CCO)CC3)cc2F)C[C@H](C)O1 730261221 VQCWANIPWUSPHL-IRXDYDNUSA-N 407.530 2.150 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(S(N)(=O)=O)c(C)c3)CC2)cc1 730843102 ZBSWYHKQVDQQRY-UHFFFAOYSA-N 403.504 2.050 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 732576046 WYMXDRLXCBWTEJ-UHFFFAOYSA-N 423.878 2.413 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C(C)C)N3CCCCC3)nc12 741010664 JZCJZLHKBFCELS-QGZVFWFLSA-N 404.467 2.165 10 20 HECD COc1cc(N(C)Cc2nnc3n(C)c(=O)c4ccccc4n23)cc(OC)c1OC 741795959 WTCDONPHCZJEQF-UHFFFAOYSA-N 409.446 2.243 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C\c1cc2ccccc2nc1N1CCOCC1 747148324 VFOQQLMLZJMZNV-JXAWBTAJSA-N 410.499 2.374 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H](O)Cc1ccccc1 747390636 UBTJJFPFIUFAIV-IIBYNOLFSA-N 401.482 2.454 10 20 HECD COC(=O)c1c(C)cccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 747457654 ZBWQIKNDVPRWSI-UHFFFAOYSA-N 418.515 2.439 10 20 HECD Cn1c(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnc1Cl 751359972 MIBQTZMZCPWMTM-ZDUSSCGKSA-N 419.334 2.375 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](N2CC(=O)Nc3ccccc32)C1 759891946 DIZBLFNJYTXIBX-HXUWFJFHSA-N 421.545 2.244 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)CC3)cc2F)C[C@@H](C)O1 760158233 GKXOOFIYFHYVAV-IAGOWNOFSA-N 422.545 2.037 10 20 HECD O=C1CC[C@@]2(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)SCCN12 761983392 RELDXXKSULOSOE-BEFAXECRSA-N 409.939 2.192 10 20 HECD C[C@H](c1ccsc1)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 765830350 SXCZLLRLBNRVGY-CYBMUJFWSA-N 409.533 2.344 10 20 HECD COc1ccc(N2C[C@@H](C(=O)NCc3cccc(OC)c3O)CC2=O)c(OC)c1 769507371 IGJCFMYFBUHRPT-AWEZNQCLSA-N 400.431 2.087 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 770340179 ZZNNADOYYCIXIM-ZDUSSCGKSA-N 405.505 2.198 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)c2)CC1 771636990 MEESTBUBLRTORY-QHCPKHFHSA-N 421.501 2.135 10 20 HECD Cc1csc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 774125165 ARROZZZTHQBOGT-CYBMUJFWSA-N 424.473 2.454 10 20 HECD Cc1csc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 774146886 MDOIHZPULCKQRW-KBPBESRZSA-N 420.510 2.137 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)Cc1ccccc1 774918455 JMJMIAGDGUJUEN-JOCHJYFZSA-N 408.546 2.192 10 20 HECD COC(=O)c1cc(NC(=O)CN[C@H](C)c2cc(OC)ccc2O)cc(C(=O)OC)c1 775374774 FRTVWOJUDBZEDH-GFCCVEGCSA-N 416.430 2.263 10 20 HECD COCCCN(CCO)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 782972750 TUFRNOCKTJKARK-HNNXBMFYSA-N 401.454 2.297 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785296483 FTGCUCPEHVVQML-ZDUSSCGKSA-N 409.446 2.062 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccc(N2CCOCC2)cc1 785432433 CFVLWWLQGVERIU-KRWDZBQOSA-N 410.518 2.083 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(N(C)C)cc1 786374143 HKTXGNFBCRUMRN-QGZVFWFLSA-N 422.529 2.482 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC[C@H]2c2cnn(C)c2)cc1 788950473 BFVHFUTXZGMKJH-IBGZPJMESA-N 415.563 2.199 10 20 HECD CCN(C)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248946 NEECFRUCAUSRLP-INIZCTEOSA-N 400.545 2.105 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCc2ccc(F)cc2C1)c1ccc(N2CCOCC2)cc1 803302951 VSYPREMNWCPNCF-MRXNPFEDSA-N 411.477 2.424 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN(C2CCC2)C1 803686232 DGQPZJJAMSVLSI-PXNSSMCTSA-N 412.578 2.454 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 806457403 LIULXKZNCQOZRA-HUUCEWRRSA-N 419.419 2.365 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC1CCC2(CC1)NC(=O)NC2=O 807546632 PNGHKQQJTUNLCX-UHFFFAOYSA-N 401.511 2.193 10 20 HECD COCC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccco1 807899486 STPWZOGYRTWGNF-QZTJIDSGSA-N 416.474 2.387 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O 808094903 JMMXWJXHNDCEAG-QFIPXVFZSA-N 416.474 2.270 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 809697809 OVOJXDVPUBDPQW-AEFFLSMTSA-N 418.538 2.493 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccc4nc(C)nn4c3)CC2)cc1 809894361 BMNXBYZIOJZGBV-UHFFFAOYSA-N 423.521 2.380 10 20 HECD CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCc1cccc(Br)c1O 811459273 BQXNHENJOKNXSB-HNNXBMFYSA-N 423.311 2.268 10 20 HECD COCCN1C[C@@H](C(=O)OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)CC1=O 914661824 CJIDAGDPASXBAX-INIZCTEOSA-N 416.449 2.454 10 20 HECD Cc1cc(C(=O)N2CCN([C@@H](C(N)=O)c3ccccc3)CC2)c(C)n1-c1ccccn1 916159573 VANGEPSQOZBGFP-JOCHJYFZSA-N 417.513 2.474 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)Cc1ccccc1 919790046 IXPVBCDQTNMSLL-OAQYLSRUSA-N 423.561 2.320 10 20 HECD Cc1cc(OCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)no1 921158926 BRXHJTGZNBLKNH-UHFFFAOYSA-N 420.377 2.319 10 20 HECD COc1cc(N2CCN(C(=O)c3c[nH]cc(Cl)c3=O)CC2)cc(OC)c1OC 1116941788 XBSNBLKYSOXRPK-UHFFFAOYSA-N 407.854 2.017 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(O[C@H]2CCOC2)cc1 1322313868 XQWPHUKPEYIHMM-ROUUACIJSA-N 415.442 2.170 10 20 HECD CCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799768004 KMCQMEBIFFKYRR-YWVIFJGQSA-N 410.898 2.391 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H]3CCC(=O)N3)C2)cc1 1842797911 MLMINYRHUBDZGV-HXUWFJFHSA-N 420.513 2.190 10 20 HECD C[C@@H](OC(=O)C1=COCCO1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 5895304 FOYAPUUSCBKVRT-GFCCVEGCSA-N 407.378 2.220 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCn3c(C)csc3=O)cc2F)CC1 303305394 NPZFBNUNYYVWBA-UHFFFAOYSA-N 406.527 2.206 10 20 HECD Cc1cccc(CS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 725826098 ZEFGLQIOEZFDMB-LJQANCHMSA-N 401.532 2.316 10 20 HECD COc1ccc([C@@H](CNCc2cc([N+](=O)[O-])ccc2O)N2CCOCC2)cc1OC 725842033 XYKLPBUXJGEACP-GOSISDBHSA-N 417.462 2.481 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3C(=O)c4ccccc4C3=O)CC2)cc1 726561982 BQCMMSGMQSMQIH-UHFFFAOYSA-N 407.470 2.467 10 20 HECD Cc1noc2ncc(S(=O)(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc12 726793692 NEQPNPQRSLRGKO-ZDUSSCGKSA-N 402.476 2.407 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc([C@H](C)O)cc3)CC2)cc1 727226575 MMTJSKQTZQXUCO-SFHVURJKSA-N 412.534 2.370 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)c1 727250172 JEYXRIZAYUMMHF-UHFFFAOYSA-N 413.477 2.397 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1 729032997 GBUPTZFRADALMC-GFCCVEGCSA-N 409.464 2.465 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 733300494 UGIPVISAXWOKAG-UHFFFAOYSA-N 423.542 2.424 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c1 734072899 TXMCWGGTEJLZIO-GASCZTMLSA-N 413.474 2.269 10 20 HECD Cc1ccc(CNC(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 736196614 RKETVATWASUKRU-UHFFFAOYSA-N 424.545 2.319 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(c3ncnc4c3cnn4C)CC2)c1O 750034970 ARFKGFFHYGENNP-UHFFFAOYSA-N 400.870 2.247 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 751236546 LGEPYYFHYNMZIZ-UHFFFAOYSA-N 424.544 2.222 10 20 HECD O=S(=O)(C[C@@H]1CCCCO1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751358709 GCYFPQMZUUMXCT-SJORKVTESA-N 402.944 2.499 10 20 HECD CC[C@@H](C)OCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 751682937 FENWBELHYJJVKA-MRXNPFEDSA-N 401.486 2.374 10 20 HECD CC(C)N1CCC(NC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)CC1 751938322 YHKKBHUMOWIUFR-UHFFFAOYSA-N 416.547 2.462 10 20 HECD OC1CCN(c2ccc(CNc3ncnc4c3cnn4-c3ncccn3)cc2F)CC1 752632769 QQMQGBLINXSKHR-UHFFFAOYSA-N 420.452 2.318 10 20 HECD COCCNS(=O)(=O)c1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)cc1 756483496 ORADJBIREZRUGD-CYBMUJFWSA-N 409.464 2.076 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cccc(=O)n2C)NC(=O)OC(C)(C)C)cc1 757035326 NKUVJJVNNOBZSK-QGZVFWFLSA-N 414.506 2.447 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3ccc([N+](=O)[O-])cn3)CC2)cc1 758223201 NQIUVDWIYBICGN-QGZVFWFLSA-N 404.492 2.274 10 20 HECD CC(C)N1CCC(O)(CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 761629502 KWQZHCDFEINKIJ-UHFFFAOYSA-N 406.596 2.274 10 20 HECD CN(c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)nc2)cc1)C1CCCCC1 764019921 RXUOFDAZPMGCGI-UHFFFAOYSA-N 402.520 2.428 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)CCc3cccs3)CC2)cc1 767469618 OUFTZJMCHDOEBN-UHFFFAOYSA-N 423.604 2.431 10 20 HECD COc1ccc(/C=C/C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1O 772320571 TVAXYLXCAMHLFO-JGZYNSJSSA-N 409.486 2.432 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CC(=O)N(C2CCCCC2)C1 772443104 IDYIVDAOGKTOFY-SFHVURJKSA-N 400.523 2.256 10 20 HECD Cc1ccc(Oc2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)nn1 774361864 JOVOBRVTRPMHFX-UHFFFAOYSA-N 408.414 2.286 10 20 HECD COC(=O)CCCN1CCC(NCc2ccc(N3CCC(CO)CC3)cc2)CC1 775621262 JGKMOPNRVNHGPS-UHFFFAOYSA-N 403.567 2.403 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3Cc4ccccc43)CC2)cc1 778242724 XLRSOEUBDJHQSR-GDWUOILNSA-N 405.498 2.356 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c(C)c1 780408290 YUJORRNQJVJVCY-UHFFFAOYSA-N 403.504 2.473 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1 782534061 CMOSFZIOQFYPJQ-UHFFFAOYSA-N 404.536 2.311 10 20 HECD COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296555 GHIQYTBPQHYFME-SNVBAGLBSA-N 406.822 2.224 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C 785596981 CGHPCVKVPWQARW-FQEVSTJZSA-N 423.492 2.456 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCCC4)nc3)cc2)CC1 786261307 AIGYGOISZIFKAW-UHFFFAOYSA-N 407.518 2.280 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccncc3Br)cc2)CC1 786655527 FIVBPKHTGLMPNR-UHFFFAOYSA-N 417.307 2.443 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(Cc2ccncc2)CC1 787434639 SEJYLHPZEQSKBY-UHFFFAOYSA-N 423.561 2.277 10 20 HECD COc1cccc2c1OC[C@H](NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)C2 788935175 BMBKBVFFLSIQJB-GOSISDBHSA-N 409.486 2.032 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCCN(c3ncccn3)C2)cc1 790249837 SSJYATIXKMIPFU-IBGZPJMESA-N 424.549 2.066 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cn3ccc4ccccc4c3=O)cc2)C1 790542170 OPABKHWONDAXID-LJQANCHMSA-N 418.497 2.020 10 20 HECD O=C(NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cccc(O)c1O 790910720 ABPIEJFTKHLZRN-UHFFFAOYSA-N 405.350 2.200 10 20 HECD Cc1n[nH]cc1C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 792927713 RXYBCZACTYERLC-UHFFFAOYSA-N 415.513 2.190 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccccc4O[C@H](C)C3)CC2)cc1 795411088 AGZNXNGNINADED-KNQAVFIVSA-N 411.546 2.461 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2F)c(Br)c1 802721874 KJZCRBDYXOGYSA-UHFFFAOYSA-N 424.269 2.498 10 20 HECD CSc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccn1 803303133 XXJJYSSLYJVYIB-OAHLLOKOSA-N 414.531 2.134 10 20 HECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)on1 803309500 YOIJCSXJEQYEMC-APWZRJJASA-N 412.490 2.361 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc(F)c(F)c1 803556015 WCCNIRRGWQRYOP-UHFFFAOYSA-N 417.456 2.119 10 20 HECD COC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803678559 DJXSYDNRVUSDBD-HSZRJFAPSA-N 415.534 2.483 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccnc1OCC(F)F 807100271 HSEQFEMJSORWPU-UHFFFAOYSA-N 406.433 2.033 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(Cc3cccc(F)c3)CCOCC2)c1 818360598 XMLGHYWMIYJEHV-UHFFFAOYSA-N 422.478 2.425 10 20 HECD CCOC(=O)N1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918142678 KXJGSZXENOEBTF-UHFFFAOYSA-N 422.501 2.207 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(Cn2ccnc2)c1 919839073 AILFCZMHNZNTFP-UHFFFAOYSA-N 410.499 2.419 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797296152 HSWRXTRKXAPFLM-BWOYXGKQSA-N 422.909 2.391 10 20 HECD COCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806493399 FXZOPNFHTDFGCY-ACJLOTCBSA-N 419.865 2.112 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824546140 KNDKUDCUIDPLAV-GZRFBZBPSA-N 419.522 2.133 10 20 HECD Cc1cc2nc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)[nH]c2cc1C 1843250026 CHFAFPZCQFNIMC-UHFFFAOYSA-N 421.457 2.117 10 20 HECD O=C([C@@H]1CCCSC1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037091 DWVSRYXGRLWFRD-KEDPEKRHSA-N 418.515 2.163 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 141694399 DVKDQWQAKXXNOR-HNNXBMFYSA-N 410.474 2.298 10 20 HECD Cc1ccnc(N2CCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CC2)c1 517725260 OPMVUSVHYBDUMQ-UHFFFAOYSA-N 405.502 2.155 10 20 HECD CCN(CC)C(=O)N1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 726715652 UTNJYKLOYSMABI-UHFFFAOYSA-N 417.554 2.453 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc([C@@H](C)O)cc3)CC2)cc1 727226574 MMTJSKQTZQXUCO-GOSISDBHSA-N 412.534 2.370 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729280174 ONADMKQGHAAEMX-CQSZACIVSA-N 422.503 2.125 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC(C)(C)c3noc(C)n3)cc2F)CC1 730125070 DONOINJNCAQMEJ-UHFFFAOYSA-N 404.490 2.394 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN(CC)S(C)(=O)=O)cc1F 731363838 CCBKPYQNNOQCIX-UHFFFAOYSA-N 402.536 2.143 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)Nc1ccccc1 732591348 BZFHRRMHKNSPRL-SJLPKXTDSA-N 423.517 2.215 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C)C[C@@H]3C(C)C)CC2)cc1 738970516 QVMGCLHGIYPBRC-JOCHJYFZSA-N 417.598 2.189 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H]3CCCN(C)C3)cc2F)C[C@@H](C)O1 741249156 CPQQKQPAPGORCA-NSHGMRRFSA-N 420.573 2.329 10 20 HECD O=C(NCCCN1CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745251306 SNMNLMHNRVDSQD-MRXNPFEDSA-N 412.481 2.278 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Br)c(OC)c2)c1 746796468 MTLHQIUDVJLJJL-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COCCOC[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067488 MDHUQQWRNFTXIJ-GFCCVEGCSA-N 414.505 2.036 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCCC2)[C@H]2CCS(=O)(=O)C2)c(OC)c1 752108939 DLPOAJZYNADRFS-KRWDZBQOSA-N 424.563 2.488 10 20 HECD Cc1cc(C(=O)NC[C@H](O)CS(=O)(=O)c2cccs2)c(C)n1-c1ccccn1 752340332 NFXNULZSUAJUMZ-HNNXBMFYSA-N 419.528 2.115 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](CCc4ccccc4)C3)nc12 755271758 OHOQKAOFWQZPHT-SFHVURJKSA-N 410.474 2.445 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@H]([C@H]4CCCO4)C3)cc2F)CC1 757200005 KWWJFZAGOSJXSJ-RTWAWAEBSA-N 420.529 2.057 10 20 HECD CN(C)c1ccc(OCCOc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 757705776 XXOXWBVRRORHSX-UHFFFAOYSA-N 406.504 2.231 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c(Br)o1 760521516 XUVVFWMSZQQRER-UHFFFAOYSA-N 417.281 2.373 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 763654194 AKBYLFMTUXCZPK-UHFFFAOYSA-N 408.499 2.189 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@H]2C1 766270674 KRYSXSGKAXTQFG-GJZGRUSLSA-N 417.465 2.096 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1 768718493 ITFAHSUVPQKYHM-SNVBAGLBSA-N 401.448 2.074 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3O)CC2)cc1 770509578 PCRZVTLVRFCCDA-UHFFFAOYSA-N 404.488 2.075 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CC=CC2)cc1)S(=O)(=O)c1cccs1 771985341 IYGQBADUBNRQFZ-UHFFFAOYSA-N 420.560 2.244 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1ccc(N(C)C)cc1 773857597 MPYFPDYHIWGFQU-AWEZNQCLSA-N 419.485 2.225 10 20 HECD CCOC(=O)C[C@](C)(NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 775891546 LSFORUUPDSBTIU-QFIPXVFZSA-N 405.539 2.301 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(C(C)(C)C)c3)CC2)cc1 778250554 CGLAUTFNMYOTGP-MDZDMXLPSA-N 411.506 2.490 10 20 HECD CN(CC1(O)CCOCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 780507206 NSKKUXVEQZNYMO-HNNXBMFYSA-N 413.465 2.440 10 20 HECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cn1 786342178 IPGCGGICJVAGIV-UHFFFAOYSA-N 405.458 2.321 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2ccc(NC(C)=O)cc2)cc1 788953061 YMUUNRICLNPWJG-UHFFFAOYSA-N 410.518 2.466 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cn(C)c3c(cnn3C)c2=O)cc1 791338943 CPSAOWDIJBXDQV-SFHVURJKSA-N 423.517 2.159 10 20 HECD Cc1ccc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c[n+]1[O-] 794719873 IXNVYLRBUUMVFS-HZPDHXFCSA-N 403.454 2.076 10 20 HECD C[C@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccc(N3CCCCC3)cc2)n1C 800770500 KZJBMBHJRJCBAN-HNNXBMFYSA-N 406.556 2.052 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664039 FLJDCSAXRUOZHF-OXQOHEQNSA-N 412.509 2.145 10 20 HECD CS[C@@H]1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 807204872 JCXGIKHEXLNDLR-PKOBYXMFSA-N 405.564 2.272 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@H](C)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807677167 MDWIPSSKKSJWPM-UONOGXRCSA-N 400.445 2.025 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 809659380 NNHIYWNZLRAFAD-UHFFFAOYSA-N 415.538 2.111 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2sc3nc(C)cc(C)c3c2N)C1 899147595 CBFDCKRSVHHVEG-CYBMUJFWSA-N 419.503 2.454 10 20 HECD O=C(CSc1ccc(F)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676263 FAWRIPVAPNUDOV-UHFFFAOYSA-N 408.520 2.469 10 20 HECD CC(C)Oc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 918337280 IMHHAKVWWLFIOT-UHFFFAOYSA-N 403.504 2.034 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H]3NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 1004721199 KYNPWSZQAQBYHT-LIEHMFRQSA-N 423.473 2.134 10 20 HECD O=S(=O)(c1ccc(NCCCSc2nccs2)nc1)N1CCOCC1 1319360537 YBVZVYGYPJXUKZ-UHFFFAOYSA-N 400.551 2.153 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(=O)CC(C)(C)C 1320143153 SZKJCUFPSIUYKT-JKSUJKDBSA-N 420.506 2.115 10 20 HECD COc1cc(F)cc(F)c1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 1323024292 WUOPDIBPFDFQMN-UHFFFAOYSA-N 416.421 2.428 10 20 HECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(O)cc1 1796604454 IRJCZFCZKDGPDZ-SJWGOKEGSA-N 411.458 2.254 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=COCCC1 1802407222 FYKPVUVMBDHVKT-BJKLQHCMSA-N 414.458 2.149 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CCC1)CC2)c1cc(O)nc(O)c1 1816727924 CBMIRABMFVRSJQ-JTQLQIEISA-N 406.439 2.067 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC2(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845784 WBICBXKLNCIRBQ-PWSUYJOCSA-N 407.377 2.177 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2Cl)C1 1844422249 YPRPDLGXIIUYJK-UHFFFAOYSA-N 423.256 2.325 10 20 HECD CN(C)CCNC(=O)c1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1 237176994 YNQBOOOTUUBZSS-UHFFFAOYSA-N 414.525 2.244 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cn(C)nc2C(F)(F)F)n(C)c2ccccc12 512540951 ZPYNLVWVGFMVLG-UHFFFAOYSA-N 407.396 2.172 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCO[C@H](COc3ccccc3)C2)n(C)c2ccccc12 579998674 KBQNXNFBLRTCBP-IBGZPJMESA-N 421.497 2.409 10 20 HECD CCN(CCCNC(=O)N(Cc1ccco1)Cc1ccccc1O)S(C)(=O)=O 726102167 IONRZGAWPGCJSE-UHFFFAOYSA-N 409.508 2.369 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 726630896 UVVRSRXSFNMIPX-FQEVSTJZSA-N 423.579 2.375 10 20 HECD COC(=O)CSCc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 728754069 MOEVNOVKZFACKV-UHFFFAOYSA-N 415.515 2.414 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1 728979632 JRVZWHOUHHZRPA-LLVKDONJSA-N 414.430 2.225 10 20 HECD CCCNC(=O)CCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 731910843 HXTXQOQTCDLRMM-UHFFFAOYSA-N 422.437 2.250 10 20 HECD CNC(=O)[C@@H]1CCCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C1 732049751 CKIUQWWDPYXILS-MRVPVSSYSA-N 417.216 2.237 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1 737208090 VAQQTBZMGCMKDM-OAHLLOKOSA-N 413.474 2.049 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@H](C(F)(F)F)C2)c1 739871759 FCAIFKOSFYAAQF-KRWDZBQOSA-N 402.413 2.190 10 20 HECD C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc(N2CC=CC2)cc1 740917913 VDSOIPHSQYJLSZ-FQEVSTJZSA-N 420.561 2.468 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2c(nnc2-c2ccccc2)C1 743876398 ZRMVZPNBSNSSKA-UHFFFAOYSA-N 404.518 2.485 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 751324805 IKQBBSJTRADUOO-SNVBAGLBSA-N 410.404 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1F 756171057 XEYOOOLMZOFESW-UHFFFAOYSA-N 422.460 2.357 10 20 HECD COC(=O)c1cccc(OCc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 758289091 GXCKWRHGWNRKTF-UHFFFAOYSA-N 419.415 2.179 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](NC(C)=O)C3CCCC3)CC2)cc(OC)c1OC 759239677 OJAKPIMXMFSZSZ-FQEVSTJZSA-N 419.522 2.056 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)nn(CC(F)F)c3C)nc12 760827980 PNNHJGCAKIMUBZ-UHFFFAOYSA-N 423.376 2.047 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2nnc(O)n2c1 762702375 MBBAWJYAKGPNNO-CYBMUJFWSA-N 403.389 2.435 10 20 HECD NC(=O)c1ccc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771051883 CKRMHAUQZWPHBB-QGZVFWFLSA-N 417.893 2.304 10 20 HECD CN1C(=O)COc2ccc(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc21 772011101 KYQNWBSWQRQSRQ-UHFFFAOYSA-N 401.806 2.370 10 20 HECD CCc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N(C)C)cc1 774952520 YGPAJYAUOVLEPW-NRFANRHFSA-N 414.525 2.489 10 20 HECD C[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O)c1ccc(N2CCOCC2)cc1 775255846 ROXXSBJOXCNLBH-OAHLLOKOSA-N 422.485 2.038 10 20 HECD CCOCCCNC(=O)C1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775652811 VBRNRYUCMMMFDN-UHFFFAOYSA-N 402.583 2.193 10 20 HECD CN(C)c1ccc([C@H](CN[C@@H]2CCCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 777302437 PPCLDQXUYBBQHW-AEFFLSMTSA-N 411.568 2.485 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(N)=O)ccc1F 783315079 SMXCQBMZRKFDCK-UHFFFAOYSA-N 400.454 2.366 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)cc(F)c3)cc2)CC1 786121526 GPTDWANQTVZTQA-UHFFFAOYSA-N 405.495 2.281 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3Oc4ccccc4O[C@@H]3C)cc2)CC1 786660525 ZDXPHVHEVMUVQK-OPAMFIHVSA-N 409.486 2.200 10 20 HECD CCc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(O)c1 787869983 NTILSPZOYTWPMQ-UHFFFAOYSA-N 416.449 2.404 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4ccncc4C)CC3)nc12 788003982 IIJANPRJPYADCK-UHFFFAOYSA-N 411.462 2.358 10 20 HECD CCN(CC)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccco1 793843977 MAXNWHIJHJSILQ-FQEVSTJZSA-N 410.518 2.471 10 20 HECD COC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccc(OC)cc2O)c([N+](=O)[O-])c1 795284965 OJFGXKCMCZNRDO-NSHDSACASA-N 403.391 2.212 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(F)F)cc2)cc1 797431492 QIZNDZUFEQWURE-UHFFFAOYSA-N 421.447 2.007 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCC(=O)NC)cc1 802609599 FKYPUNDKJSMRNI-UHFFFAOYSA-N 413.474 2.284 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(F)c(F)c3)CC2)cc1 803554881 DOTJDDNNTPSQSR-UHFFFAOYSA-N 417.456 2.417 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1F 803686109 WGOBXZFAVQKNAC-UHFFFAOYSA-N 412.509 2.202 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cnc(C4CCCC4)nc3N)CC2)cc1 806847240 LQVHRURWRKOPTK-UHFFFAOYSA-N 424.549 2.277 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1 806885900 JMIYMKLLWPXHTK-VIFPVBQESA-N 400.357 2.277 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387427 JZMKZOJETYNXRM-UHFFFAOYSA-N 420.263 2.159 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCN(C)C3)cc2Cl)C1 807955180 PYXUYKJOWYSQMC-NVXWUHKLSA-N 406.958 2.403 10 20 HECD CCc1ccc(S(=O)(=O)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 808051092 JKEQZEGOJNLERP-UHFFFAOYSA-N 420.506 2.315 10 20 HECD Cn1cc(/C=C/C(=O)N2CCN(C(=O)/C=C/c3cnn(C)c3)c3ccccc32)cn1 809239191 SUZVXQVOQZRSTF-FIFLTTCUSA-N 402.458 2.260 10 20 HECD CCc1nnc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 811968217 FDJVWYDANYJJEQ-UHFFFAOYSA-N 421.523 2.158 10 20 HECD COc1ccc(N2CCC(NC(=O)N(C)CCCN(C)CCN(C)C)CC2)cc1 812023921 GDFNJDHWJCPGGI-UHFFFAOYSA-N 405.587 2.189 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)NCc1ccccc1 916645126 FAWTUQHVTYSSTE-UHFFFAOYSA-N 418.563 2.404 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccc(-n4cccn4)cc3)cc2)C1 917836692 RIBVSYYJTVXMPB-FQEVSTJZSA-N 417.513 2.433 10 20 HECD O=C1CCCc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc2N1 919840636 UQBVUISBIKMFMU-UHFFFAOYSA-N 413.499 2.449 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc(CC(=O)OC)c3)CC2)cc1 1261200755 JGYYVRUEAVAAGQ-UHFFFAOYSA-N 418.515 2.312 10 20 HECD C[C@@H](CC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1327238122 KVRTXBVTTUCBJM-DOTOQJQBSA-N 418.538 2.308 10 20 HECD COc1ccc(COC[C@@H](O)CNCc2ccc(N3CCOCC3)c(F)c2)cc1 727467640 KKRODJWDVKUIBB-IBGZPJMESA-N 404.482 2.338 10 20 HECD CN(C)C(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 728179273 QHHOKPJIJOTUDX-IBGZPJMESA-N 408.502 2.020 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)NCC(=O)NC(C)(C)C)ccc21 728637266 CAVCRSLOTISUEX-UHFFFAOYSA-N 417.506 2.092 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](C(C)C)N3CCCCC3)CC2)cc1 729348388 WBJSGCYHTQGQMB-QFIPXVFZSA-N 402.583 2.444 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2)CC1 731120726 AQTFJYLLYRVJGS-NRFANRHFSA-N 414.550 2.456 10 20 HECD CC(=O)NCCNC(=O)CCC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 732280594 ZTXUDAQYSMKFJH-UHFFFAOYSA-N 402.539 2.104 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1-c1cccc(F)c1 733997976 XYOVPEBWIDVQMG-INIZCTEOSA-N 407.511 2.416 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3Cn3cncn3)c2)CC1 742696116 NVDXCTQVMVYVPT-UHFFFAOYSA-N 404.474 2.280 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1 743413124 RKORSHBFEJERKU-LLVKDONJSA-N 402.476 2.092 10 20 HECD Cn1cc(C[C@@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)cn1 746759809 VPYODEFDVWPPEM-KRWDZBQOSA-N 415.513 2.295 10 20 HECD COC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 749466008 PIHWWJROKXQTPY-NUJGCVRESA-N 421.513 2.083 10 20 HECD Cc1nc(CCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cs1 749916537 UBRZYWPJTKGQMT-UHFFFAOYSA-N 407.561 2.325 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1cc(OC)c(OCC(N)=O)c(OC)c1 750862180 WOIGHXCDPKYLDI-UHFFFAOYSA-N 402.447 2.326 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@H](OC)C3(C)C)CC2)cc1 753349074 IUOQYDHXOYSABC-UXHICEINSA-N 404.555 2.320 10 20 HECD COC(=O)c1ccc(-n2cc(C)cn2)c(NS(=O)(=O)c2cccc3nonc23)c1 753960217 CWXJWFVZCDTCQJ-UHFFFAOYSA-N 413.415 2.304 10 20 HECD COCC1(O)CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 759313265 HZHZSAKYCYJQAE-HNNXBMFYSA-N 422.481 2.262 10 20 HECD Cc1ccc([C@H](C)[C@H](O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764859548 QBOKNFVHSMEVMK-WEYGHZABSA-N 409.530 2.478 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)nc3)cc2F)C[C@H](C)O1 766326289 BYWXACWZWUCTLT-STQMWFEESA-N 404.417 2.228 10 20 HECD CC(C)(CCC(=O)OC(C)(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769932552 WOMXPIGIMZABTD-UHFFFAOYSA-N 400.497 2.394 10 20 HECD C[C@@H]1CN(Cc2cccc(Br)c2O)CCN1c1nccn2cnnc12 770279875 IDDHILNBIICOBQ-GFCCVEGCSA-N 403.284 2.303 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773084284 NQNQLRPMAAJMPT-GFCCVEGCSA-N 400.497 2.335 10 20 HECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(O)cc2C)s1 773229553 BSUBEWXWBGHKGW-UHFFFAOYSA-N 404.535 2.045 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCO[C@H](C)C3)cc2F)C[C@H](C)O1 776403417 GFOJWBMMMGZEQY-MUQADHOPSA-N 422.497 2.414 10 20 HECD Cc1ccc(C(=O)N2CCN([C@H](C(N)=O)c3ccc(Cl)cc3)CC2)c(O)c1O 780863113 QRLSFQZHCDVJTJ-INIZCTEOSA-N 403.866 2.044 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 787013971 KBFGLQGYLCVKEV-UHFFFAOYSA-N 405.495 2.089 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1 788949869 AYXOYDHIKLCVBT-UTKZUKDTSA-N 422.529 2.459 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnnn1-c1cccc(F)c1 789105449 JMNXCSMWIGJFPX-UHFFFAOYSA-N 411.437 2.288 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 789800722 NYDKFHYMJCNACH-IERDGZPVSA-N 411.477 2.498 10 20 HECD Cc1cc(C)cc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 789813856 WKULOFNOAKLRML-UHFFFAOYSA-N 413.493 2.254 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc(Cn2cccn2)c1 793814139 RQVJSKKHMFJADH-UHFFFAOYSA-N 415.497 2.240 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803301530 SOAVFYCSQXHYQV-GJZGRUSLSA-N 414.506 2.225 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)ccc21 803686064 UUMGXEUPMUCYSW-SFHVURJKSA-N 422.533 2.087 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CN1CCOCC1 804022556 VXASLKCWJRETAT-GOSISDBHSA-N 417.550 2.138 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 804317328 ZVGARVJRYXGUCM-GCJKJVERSA-N 403.523 2.100 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)[C@H](C)C1 804852384 ABYJMZYRLXKEND-VQIMIIECSA-N 406.546 2.477 10 20 HECD CN(C)c1ncc(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)n1C 805568869 DMUUVUJPZMQPPR-UHFFFAOYSA-N 413.522 2.169 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCOC[C@@H]3C)CC2)cc(OC)c1OC 805820910 AGNLRZHOCGHGLB-JKSUJKDBSA-N 407.511 2.217 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](Cn1cccn1)c1ccccc1 806163449 FQSXXYOUEAOMGG-OAQYLSRUSA-N 405.502 2.465 10 20 HECD Cc1cccn2cc(CCNC(=O)C(=O)NCCCSc3nccs3)nc12 806538129 WURVOFQMTCLNLL-UHFFFAOYSA-N 403.533 2.057 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC12CCCCC2 807099744 DXOJTHKNLYUUFN-UHFFFAOYSA-N 414.550 2.071 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(N(C)C)n1 807385208 FKUVSEHNSGOUPB-UHFFFAOYSA-N 407.268 2.179 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(OCCN2CCCC2)CC1)c1ccc(N(C)C)cc1 807672351 XYOZVLDUWVPNQB-GOSISDBHSA-N 416.566 2.033 10 20 HECD C[C@H](NC(=O)N1CCC(CS(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 813606794 XFJXQEFLHFRCJV-INIZCTEOSA-N 409.552 2.050 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2cn3ccccc3n2)CC1 821985719 SAYUOQUAUFWRHF-UHFFFAOYSA-N 420.561 2.177 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCNS(=O)(=O)c2ccccc2)C2CC2)cc1 918065236 QQFWVWYVHKUHGL-UHFFFAOYSA-N 416.547 2.405 10 20 HECD CCCC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 919971046 HGEXXJHHGHXARJ-KRWDZBQOSA-N 405.514 2.442 10 20 HECD CCN1CCOC[C@H]1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1337093403 HIMMKBAVUFFMMS-MOPGFXCFSA-N 420.554 2.155 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cnccn3)cc2)CCC1)c1cc(O)nc(O)c1 1787289006 KACALYBWHSLTAJ-UHFFFAOYSA-N 405.414 2.344 10 20 HECD Cn1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)cn1 1787379206 VVMWFSVGRGEHNL-UHFFFAOYSA-N 407.430 2.288 10 20 HECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1803780559 IPZJDQVHAQPMSB-QRWLVFNGSA-N 422.441 2.423 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1=NN(c2ccccc2)C(=O)CC1 27331646 DXNATYZJYUKHAY-UHFFFAOYSA-N 422.485 2.437 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CNC(=O)CCC3CCCC3)CC2)cc1 726529002 NKXDUBJNACUUFU-UHFFFAOYSA-N 416.566 2.020 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](c3ccccc3)N3CCN(C)CC3)CC2)cc1 727747767 QUFJOYNWNKXLEH-HSZRJFAPSA-N 408.546 2.333 10 20 HECD COc1ccc(-n2cnnc2SCC(=O)N(C)Cc2ccc(N(C)C)cc2)cn1 728789016 XNPOLOJYCBVKGQ-UHFFFAOYSA-N 412.519 2.488 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 729526824 HNHNWMUJIAYBPM-AWEZNQCLSA-N 409.490 2.308 10 20 HECD COc1ncnc(OC)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 731975633 KZONQZJGSWZXFU-CHWSQXEVSA-N 404.442 2.177 10 20 HECD CCN(CC(=O)NC)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 733161924 QJKUIGGFWVMIKW-RAXLEYEMSA-N 411.574 2.324 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3CCC(=O)NC3=O)c2C)cc1C 733560999 ZRXNNXSRRLTIAZ-UHFFFAOYSA-N 411.458 2.379 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)CC2)cc1 754100523 PBIWHDGYXRCKNC-HBMCJLEFSA-N 414.550 2.074 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc4c(c3)COC4)CC2)cc1 755119620 JPVDZPCCJMLCAC-UHFFFAOYSA-N 410.470 2.160 10 20 HECD C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(Br)cc1O 756418093 OYJNRQSGRPKFIP-LLVKDONJSA-N 406.280 2.221 10 20 HECD CCN1CCC[C@@H]1CNC(=S)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 758918125 BLZNMLKTRSMWLW-MRXNPFEDSA-N 422.595 2.193 10 20 HECD Cc1cc(O)cc(=O)n1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 759776255 XHNKZMOVIXKVQN-UHFFFAOYSA-N 407.417 2.249 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nnc(-c3ccccc3)s2)c1 760140857 NJIPJUJRUCSSLP-UHFFFAOYSA-N 404.473 2.212 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 767048436 XZWXCGXZISVSNV-UHFFFAOYSA-N 412.508 2.182 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(C)c(Cl)n2)cc1 769830888 AFCVCYLZFHTLJD-UHFFFAOYSA-N 406.917 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 770200119 TXERTTQGAPTXQI-UHFFFAOYSA-N 404.511 2.490 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NC(=O)c1ccc(OC(F)F)cc1 772770790 SRLYQTVFNBVLQE-WAPJZHGLSA-N 407.325 2.212 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(Br)n1 775602748 SZWQNXJGJWDZFP-UHFFFAOYSA-N 424.320 2.009 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](O)COc1ccccc1Br 779533272 HZTWRADNRLIZKS-FWPCIQOSSA-N 408.248 2.430 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1 786981944 RWXFHIRSFPFQOW-AWEZNQCLSA-N 403.429 2.295 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccsc1 787636456 IBLHQDFXJZASJF-IBGZPJMESA-N 400.548 2.384 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)O[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 789821015 RSCZQQNWTSDNHH-DMRKSPOLSA-N 421.513 2.080 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC2(CCOCC2)O1 790500406 DSDUCEVDAXCYON-INIZCTEOSA-N 407.486 2.142 10 20 HECD C[C@@H](Nc1cccc(C(=O)N(C)CC(N)=O)c1)c1ccc(N2CCOCC2)c(F)c1 793566208 SBIAOFWSSAPEKD-OAHLLOKOSA-N 414.481 2.393 10 20 HECD CNC(=O)C1CCC(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 803147269 LAUYWOBRMSPIHH-UHFFFAOYSA-N 414.550 2.056 10 20 HECD COc1ccc(N2CCC(Nc3nc(NCCO)nc(NC(C)C)n3)CC2)cc1 804414855 HIPYXBMYNXCXFB-UHFFFAOYSA-N 401.515 2.186 10 20 HECD COCCN(CCOC)C1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 806635679 VEEARFNTIPBAAS-UHFFFAOYSA-N 410.534 2.161 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CCCCS1(=O)=O 807929890 FJVNHFZPCPQFCT-LJQANCHMSA-N 410.536 2.342 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2cc(Cl)c(NC(C)=O)cc2OC)c1 808296324 OAJIUJNBGRLQCP-UHFFFAOYSA-N 414.867 2.500 10 20 HECD C[C@H]1CC[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808853906 KEGVNSVPSZTJLY-MOPGFXCFSA-N 412.578 2.482 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc3c(c2)CCCN3C)cc1C 810266563 PXJBSBLCJOLWEU-UHFFFAOYSA-N 401.532 2.281 10 20 HECD CCC[C@]1(CO)CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 811995697 VKRTWTJLHUUPRP-QHCPKHFHSA-N 418.582 2.401 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cn2)C[C@H](C)O1 918246516 QIMQLTUAGHWZNH-HOTGVXAUSA-N 411.506 2.016 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1 918305452 IGSKZPFTIBGFIT-UHFFFAOYSA-N 419.485 2.314 10 20 HECD Cc1cc(C(=O)COC(=O)CCN2CCCS2(=O)=O)c(C)n1-c1ccccc1 919442527 ZTBOUEMEKLKTRI-UHFFFAOYSA-N 404.488 2.246 10 20 HECD CN1CCN(c2ccccc2CNC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 1115986067 RNXDQEMSCQCILD-UHFFFAOYSA-N 423.561 2.274 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1ccnnc1 1787313878 IKCPLPDTLHTAAG-UHFFFAOYSA-N 405.414 2.344 10 20 HECD Cc1ncoc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795228479 QABVNJGXVSVNTL-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Nc1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)s1 1796140388 OHCJVPCXTGAMGC-JGPRNRPPSA-N 422.894 2.356 10 20 HECD Cc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804285804 FGORCPHYQVMIKP-ZURAMSNBSA-N 423.469 2.472 10 20 HECD CC(C)O[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286032 KZIJHZMTPPLIPH-MAOAGRFFSA-N 418.490 2.268 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccns3)CC2)C1 1810542874 CSKICZFFYRWCFG-UHFFFAOYSA-N 402.476 2.108 10 20 HECD C/C=C(\C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821894477 IHLIJQUTAVMPPH-TWXILYBASA-N 421.548 2.228 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(c3cccc(F)c3)CC2)C1 1841861285 QGNCCJSREYAXKN-UHFFFAOYSA-N 411.433 2.181 10 20 HECD O=C(COc1ccc(-c2nnco2)cc1)NCc1ccc(N2CCOCC2)c(F)c1 97493633 NRJBEFHRGOKNQM-UHFFFAOYSA-N 412.421 2.408 10 20 HECD Cc1c(CNC(=O)N2CCCC[C@H]2CCNS(C)(=O)=O)n(C)c2ccccc12 472242396 SGHRAVZYUBSUPY-INIZCTEOSA-N 406.552 2.490 10 20 HECD Cc1ccc(C(=O)OCC(=O)NCC(=O)Nc2cccc(Cl)c2C)c(O)c1O 727005159 IMZLDASAWHNWQG-UHFFFAOYSA-N 406.822 2.280 10 20 HECD CSc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 727227979 PTOZIDJDOQDFOB-UHFFFAOYSA-N 418.494 2.159 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c1O 729859212 MKTIWTCNZUEFAR-QFIPXVFZSA-N 409.442 2.016 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)cc2F)CC1 730194247 CRQPQYGIOKBWGR-GOSISDBHSA-N 416.541 2.375 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](N4CCCCC4)C3)CC2)cc1 730826095 YRMJJGVQNSJUGN-NRFANRHFSA-N 415.582 2.087 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1 734701575 GEVIJKVWDTWXPQ-UHFFFAOYSA-N 409.534 2.068 10 20 HECD CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194773 CZZHDLGODWJTAF-LJQANCHMSA-N 419.591 2.459 10 20 HECD CN1CC[C@H](N(C)C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 737676895 CBEIIJRFKQTSDE-UQRISPGASA-N 423.585 2.419 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@H]4CCO[C@H]4C3(C)C)CC2)cc1 741284654 XUKSRRDHHVEKDZ-NJDAHSKKSA-N 416.566 2.320 10 20 HECD CC[C@](C)(CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1OCCO1 748365751 BGQOUNAKNVKMIN-GOSISDBHSA-N 400.497 2.063 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1 751212845 GJECPFANMVMRFX-UHFFFAOYSA-N 410.517 2.039 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 753642355 BBINUGMJMMQBDF-AWEZNQCLSA-N 406.504 2.489 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnn(C)c3C(F)F)CC2)cc1 758979183 KZLBLSXUZGRWBJ-UHFFFAOYSA-N 407.421 2.044 10 20 HECD Cc1nn(CC(F)(F)F)cc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 763279968 GQHXNBGYZDDCBG-OAHLLOKOSA-N 423.439 2.386 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccc(Br)s1 763282542 YMTXJMPQPMKPMO-SECBINFHSA-N 413.293 2.399 10 20 HECD C[C@H](NCCCN1CCC[C@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765798536 UZLOWROBIASUFE-IRXDYDNUSA-N 408.974 2.415 10 20 HECD CCS[C@H](C)c1noc(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 768292750 MOVIAHJTRGENLH-SNVBAGLBSA-N 414.509 2.233 10 20 HECD COC(=O)c1[nH]c(C)c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1C 768680417 NSXGNYILMLKGNK-UHFFFAOYSA-N 401.463 2.300 10 20 HECD CCNc1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 770070352 WDRRZOVYMDEPKB-UHFFFAOYSA-N 418.519 2.398 10 20 HECD CC[C@H]1CN([C@H](CC)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCO1 773979985 RDGDWVXNDQAQHV-FCHUYYIVSA-N 403.567 2.401 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)N(C)C)c1 774945532 AINMZHMCGICCMI-QFIPXVFZSA-N 424.545 2.331 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCN2CCCCCC2=O)cc1 775098099 TWESGACNMRUJRG-UHFFFAOYSA-N 402.539 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C[S@](C)=O)c3ccccc3)CC2)cc1 775616459 BRZOBXCWFVHKEA-PBBNMVCDSA-N 415.559 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)(C)OCC3(C)C)CC2)cc1 778280798 XHDYKUJHFOWNOZ-ZHACJKMWSA-N 415.534 2.316 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCOc3ccccc3F)CC2)cc1 779219209 RRGAUMHVPPJJRR-FQEVSTJZSA-N 417.525 2.328 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCN1C(=O)OC(C)(C)C 781334170 GARWWFFVEQVQMV-QGZVFWFLSA-N 405.495 2.264 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc1 785440322 YHYQZIKCHZENIV-NRFANRHFSA-N 422.529 2.180 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)ccc3C)cc2)CC1 786121519 GONNSLKOVPUFBP-UHFFFAOYSA-N 401.532 2.450 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCc2cn3ccccc3n2)C2CC2)cc1 786158664 FEQZIUBRURHWCR-UHFFFAOYSA-N 405.502 2.250 10 20 HECD C[C@@H]1c2ccc(F)cc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331244 IDTLKULQRJSZFL-MRXNPFEDSA-N 411.477 2.424 10 20 HECD CC[C@@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801847 WPISSXBLRZLKRU-IBGZPJMESA-N 414.481 2.283 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](C)O[C@H](C4CC4)C3)CC2)cc1 792010580 ZFQYOGXOIABTJG-GCJKJVERSA-N 416.566 2.416 10 20 HECD C[C@@H]1CCC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793727029 VHSLHNJMUQJDBF-LMMKCTJWSA-N 414.550 2.042 10 20 HECD CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 795136163 GGQAZWFLLMBINP-UHFFFAOYSA-N 405.455 2.472 10 20 HECD NC(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1N1CCCCC1 800933187 JIQCMTQRXNXNHL-UHFFFAOYSA-N 401.448 2.113 10 20 HECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100143 KWVVARGMNJYZFT-FUHWJXTLSA-N 418.538 2.050 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H]1C 807770537 MAPHBMIOERPSBN-KKUMJFAQSA-N 411.449 2.009 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCO[C@H](C(C)(C)C)C1 808080912 KIHQNIVOYRYCSR-ICSRJNTNSA-N 417.550 2.192 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 809363131 PKXGYSOHTPVRDS-IUODEOHRSA-N 424.339 2.245 10 20 HECD CON(C)C(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 813046420 HNRCZHJGDSXSDQ-INIZCTEOSA-N 404.511 2.026 10 20 HECD CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917391065 JXWBIOFXUSDCLK-HNNXBMFYSA-N 411.462 2.268 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(CC(=O)NC)cc2)cc1 918309378 GLVOVSAUOCGVLM-UHFFFAOYSA-N 410.518 2.418 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H](c1ccccc1)N1CCOCC1 919790804 QVCGQYZHJXJVOK-QHCPKHFHSA-N 424.545 2.396 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCNC(=O)OCC(F)(F)F 919976055 FYYNYCXDBODVLJ-UHFFFAOYSA-N 403.401 2.160 10 20 HECD C[C@@H](O)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788673683 BXECTFVVMXXDLJ-OAHLLOKOSA-N 420.469 2.294 10 20 HECD CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc(C)n1 1796601288 PVBKSCPWETVNOT-BCDXTJNWSA-N 410.474 2.324 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC=CO1 1798411196 HVYQAYMTTXIYLS-ALDGSTNNSA-N 414.458 2.148 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1798776233 BCTPEGZXJRNALB-ZXRXUGKRSA-N 423.469 2.472 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cccnc1 1804283906 ORIWBIVQWNKSON-BJKLQHCMSA-N 409.442 2.164 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1CCCC1 1806179511 GEOBCRHDWHJDBB-OXJNMPFZSA-N 410.474 2.398 10 20 HECD CC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815076715 AGBZWGDOGPUUKI-CQSZACIVSA-N 415.450 2.137 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845095 YPPSRAVWBSSILF-NSHDSACASA-N 413.356 2.474 10 20 HECD COc1cccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843250975 KGHVJZOALDULHF-VOTSOKGWSA-N 409.442 2.032 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCC(F)(F)C1 1847224782 STSORBPDLWMLSM-PMUKSUFRSA-N 422.428 2.454 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 726102801 YNHHBXGWPGNXHS-CALCHBBNSA-N 422.545 2.349 10 20 HECD CN(C)C(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 728467652 PVSZECHDIQOIKO-LJQANCHMSA-N 408.502 2.020 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)c1 729062341 QMUKOWMAZGXRNX-OLZOCXBDSA-N 415.446 2.190 10 20 HECD CC1CCN(c2ccc(CNC(=O)CN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)cc2)CC1 731016880 SLGVPQFDSZFFKG-MOXQZVSFSA-N 407.514 2.346 10 20 HECD C[S@](=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 735574963 SFSVJLYHCPXCTG-BCOMRZATSA-N 414.531 2.447 10 20 HECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 739081052 OPGDFUFSTJHGRQ-CYBMUJFWSA-N 400.431 2.322 10 20 HECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1 741211183 AMRRRUAUTIVJAL-LJQANCHMSA-N 402.539 2.217 10 20 HECD COc1ccc(CNC(=O)CN(C)c2cc(OC)c(OC)c(OC)c2)cc1OC 741795384 KIFBDYFXQSOYQB-UHFFFAOYSA-N 404.463 2.482 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cccnc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 742277833 GDEVCHNONXBNPK-BETUJISGSA-N 424.454 2.221 10 20 HECD CN(C)c1ccc(CNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1F 746592957 JYARXGRGGFQDRB-UHFFFAOYSA-N 401.486 2.467 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccco1 746757937 SBSJNASVUMTONO-WMZOPIPTSA-N 400.479 2.168 10 20 HECD CCC[C@H](O)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 750242501 PQFOLMDZKGTGNU-KRWDZBQOSA-N 401.486 2.110 10 20 HECD O=C(CN1CC(=O)N[C@@H]2CCCC[C@@H]21)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 758780903 UWNVQMSRHRCNEM-UXHICEINSA-N 417.465 2.144 10 20 HECD CNc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 759616448 SHYXVZXRZRMYDY-UHFFFAOYSA-N 401.438 2.177 10 20 HECD C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 760204514 MOSNYAFKSZPJGE-AWEZNQCLSA-N 415.469 2.085 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c(C(=O)OC)s1 766048310 RKPBMBRWSMBJQP-UHFFFAOYSA-N 413.429 2.030 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CCO)c3ccco3)CC2)cc1 769497354 WTFMYTMZJKXBKR-FQEVSTJZSA-N 416.522 2.223 10 20 HECD CC(C)(C)[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(N)=O 775419953 DWCLOTDFRAJHIM-OAHLLOKOSA-N 416.444 2.241 10 20 HECD Cc1cc(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 775467749 RBZACRKYWYIJBI-RHSMWYFYSA-N 405.524 2.500 10 20 HECD COc1ccc(S(=O)(=O)N2CCCN(Cc3cc(OC)ccc3O)CC2)cc1 775742353 UNOIARBYCNKLRA-UHFFFAOYSA-N 406.504 2.306 10 20 HECD C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)CN[C@H](C)c1ccc(N(C)C)cc1 775835563 UYAWOXJXCINDJI-LSDHHAIUSA-N 416.547 2.028 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1-n1cnnn1 781720059 YDCQPWJXZCLLTN-UHFFFAOYSA-N 421.505 2.454 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2nccn2)nc1 783325744 AKSBNNMNEHBEST-UHFFFAOYSA-N 407.478 2.104 10 20 HECD O=C(Nc1ccc(F)nc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766627 IWLVKTGWVQABIR-HNNXBMFYSA-N 406.845 2.299 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(CC3CC3)CC2)cc1 788462210 WMJJCIZANCOAAS-UHFFFAOYSA-N 400.567 2.482 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 788824743 VKPCUXWYPGVLSF-FQEVSTJZSA-N 404.514 2.322 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@H]21 788920969 SUKGUNGCHFEHJG-YFYQMDMQSA-N 415.509 2.219 10 20 HECD CCc1csc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789377916 MKIYNOPTWCSSDM-UHFFFAOYSA-N 406.483 2.061 10 20 HECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789854890 GLPICHRPPWHCJX-UHFFFAOYSA-N 405.564 2.179 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789860464 LTHQPBIZXPJLAJ-HKUYNNGSSA-N 405.564 2.176 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 793644659 IHORWEZDIDCMCP-RDTXWAMCSA-N 418.538 2.349 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c(O)c1 794384305 YXYGFJJVZNGIID-SFHVURJKSA-N 418.515 2.259 10 20 HECD CC(C)[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 794829790 GXOVREHONKLYHS-DJJJIMSYSA-N 416.482 2.172 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC)c(OCCO)c1 798337164 CNWQKYQDHGZBRB-UHFFFAOYSA-N 423.849 2.241 10 20 HECD CN(C)CCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665191 YNLNNSQEHIJGLQ-UHFFFAOYSA-N 414.525 2.141 10 20 HECD CO[C@@H](C)c1nc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cs1 803686334 HVGKLCBCZHJMAF-ZDUSSCGKSA-N 402.520 2.166 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1nnc2ccccn12 804100984 KLJVCDFEFOKUJJ-CQSZACIVSA-N 418.548 2.298 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@@H](C)c3nccs3)CC2)cc1 804315813 SOJDBSSJTVNDQD-OAHLLOKOSA-N 416.547 2.499 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2c(C)nn(CC)c2C)cc1F 804465986 WCGDOFNWOOFMAO-UHFFFAOYSA-N 403.502 2.438 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCN(c4ccccn4)C3)cc2)CC1 805023658 ZGGVFQJKGNJTGM-FQEVSTJZSA-N 421.545 2.329 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@H](Oc2cccc(F)c2)C1 807292119 VJZNPJHKIDNSLR-NRFANRHFSA-N 409.461 2.498 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCO[C@H](C2CC2)C1 807769076 DBKPQVDZTNHJNI-YJBOKZPZSA-N 423.460 2.010 10 20 HECD CC(C)(C)OC(=O)NC1(c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)CC1 904990462 MMMLMZAADVTSMX-UHFFFAOYSA-N 410.452 2.328 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 917759069 BBKFNXDYQAXBKA-UHFFFAOYSA-N 415.515 2.115 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(OC)c1C 918337655 FAGPAXAKNTYMQC-UHFFFAOYSA-N 418.515 2.177 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C1CC1)C1=NN(c2ccccc2)C(=O)C1 1793155124 RRBHIWWVHRRKKK-DAAAGXSWSA-N 406.486 2.384 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccccc1)c1cc(O)nc(O)c1 1795497000 CVMFSOMMLGOIEN-BJWYYQGGSA-N 411.458 2.214 10 20 HECD CSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799012280 HDESFETUJFETRF-BTTYYORXSA-N 414.487 2.175 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)N3CCCC[C@H]3C(N)=O)c2C)cc1 7082708 LOLQVTCXASQBFN-IBGZPJMESA-N 413.474 2.126 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c(C)n1-c1cccc(F)c1 18361049 MGRDWYWRKREANL-SFHVURJKSA-N 422.478 2.383 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnn(CC(=O)NC2CCCCC2)c1 472105077 ZGCHMPVSCQENBN-UHFFFAOYSA-N 411.506 2.437 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCN(CC(=O)N(C)C)CC3)ccc21 520266934 KNCPWVKUQFXOPE-UHFFFAOYSA-N 414.550 2.187 10 20 HECD CN1CCN(CCCCNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 728948335 JWEFERQXIGSBED-UHFFFAOYSA-N 405.612 2.067 10 20 HECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c1O 729858832 DBURPJAUDHXSFP-UHFFFAOYSA-N 422.478 2.257 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCc2ccccc2C1 732274059 BTDZJZNQGGFDHD-PGRDOPGGSA-N 420.557 2.451 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)CC2)cc1 754100534 PBIWHDGYXRCKNC-PWRODBHTSA-N 414.550 2.074 10 20 HECD COc1cc(N2CCN(C(=O)NCCCOCC3CC3)CC2)cc(OC)c1OC 760105005 UCNIYVBJDIJWRE-UHFFFAOYSA-N 407.511 2.361 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)c1 764262704 XDVGDRNCIOWNGF-GFCCVEGCSA-N 409.446 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnc(Cl)c3F)CC2)cc1 766936368 HLAPFSMWXWHGPK-UHFFFAOYSA-N 407.829 2.388 10 20 HECD CCOC(=O)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)cc1 769732085 FXIJAOMTNOCUJT-MRXNPFEDSA-N 424.450 2.327 10 20 HECD CCS(=O)(=O)C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 770492392 FWWJMOAUVKQVDQ-UHFFFAOYSA-N 409.552 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnn5ccccc45)n3)CC2)cc1 771064367 ASZMQEBJRHWEER-UHFFFAOYSA-N 418.457 2.284 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 772115666 WZWHDORAGGEYIW-NSHGMRRFSA-N 402.539 2.391 10 20 HECD Cc1cc(C)c(NC(=O)CNC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c(C)c1 772773927 GITBVLRCJBADNK-FNORWQNLSA-N 412.442 2.334 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)ccc1OC 775286799 OCXNSBZTCVIJEQ-UHFFFAOYSA-N 422.459 2.014 10 20 HECD O=C(O)c1cc(N2CCSCC2)ccc1NS(=O)(=O)c1cccc2nonc12 776505284 YOBXTFOYBHPUGW-UHFFFAOYSA-N 420.472 2.275 10 20 HECD O=S(=O)(NCC(F)(F)F)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 776745929 QWEYMFCLEVEVOX-UHFFFAOYSA-N 410.395 2.034 10 20 HECD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782371454 ZAOMDSNKRRJLMD-UHFFFAOYSA-N 407.444 2.214 10 20 HECD COc1nn(C)c2nc(C)c(CCC(=O)OCC(=O)c3ccc(O)c(O)c3)c(C)c12 782730174 ZVWJUXYGPJQHCK-UHFFFAOYSA-N 413.430 2.364 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)NCC(=O)Nc2c(C)cccc2C)c(O)c1O 785274308 QSGRPYILPROAER-CQSZACIVSA-N 400.431 2.323 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)cc1 785424738 TYCNAGPGTHOJIX-QGZVFWFLSA-N 418.538 2.275 10 20 HECD CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 787324395 BYXBMTRJALOXBZ-UHFFFAOYSA-N 424.501 2.165 10 20 HECD CC(C)c1nc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788319463 KDLXUSBHJGXYOG-UHFFFAOYSA-N 416.547 2.078 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(-n2cccn2)cc1 788380430 QTRQNVUSSLNUKP-UHFFFAOYSA-N 401.517 2.244 10 20 HECD C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788928683 BOOICBJIDGVUDY-GUDVDZBRSA-N 400.567 2.386 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCN1CC(F)F 788933275 UHKNYTPIAKZCQX-QGZVFWFLSA-N 408.493 2.091 10 20 HECD O=C(NCCOC1CCCCCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798984 HBRFRQSXWDBXIM-UHFFFAOYSA-N 421.513 2.134 10 20 HECD Cc1cnn(C)c1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 795865415 YNRZLWFSMIRLFG-CYBMUJFWSA-N 400.451 2.277 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 797466273 HVEWUZMFNFPVCV-VBKZILBWSA-N 410.465 2.424 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(N2CCCS2(=O)=O)c1 797614778 ZJUHWAJLPIFNMN-CYBMUJFWSA-N 405.476 2.390 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCSC[C@@H]3C(=O)O)cc2F)C[C@@H](C)O1 797710459 YYOZVXGBWLWMDC-PBFPGSCMSA-N 411.499 2.151 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ccnc3C(=O)c3ccccc3)CC2)cc1 798220005 RVACCWMFYIWCNY-UHFFFAOYSA-N 404.470 2.472 10 20 HECD C[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803308370 DQAGAMRUDJEJHB-GJZGRUSLSA-N 402.520 2.077 10 20 HECD COC1(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CCOCC1 803676260 CKOZQRRLWBHELQ-UHFFFAOYSA-N 417.550 2.384 10 20 HECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)CC2 803687317 ZTUSAZXHUFWVES-LJQANCHMSA-N 409.534 2.136 10 20 HECD CCc1nc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cs1 804315688 PZUVXTMNXNVEGN-UHFFFAOYSA-N 402.520 2.116 10 20 HECD CCc1cc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)on1 805745733 FYAMOFCYIHBGTI-CQSZACIVSA-N 422.432 2.240 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)cc1 806179661 UIOQPMGNSPAKFV-RBUKOAKNSA-N 416.566 2.254 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 807288711 ZRNURKBTPHBFOW-SIKLNZKXSA-N 408.546 2.154 10 20 HECD C[C@@H](OCc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918337835 PDBOXIXTOKTAIA-QGZVFWFLSA-N 402.516 2.143 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3)cc2)C1 918463154 HNEUSDGEJJZRPS-HNNXBMFYSA-N 414.893 2.297 10 20 HECD O=C(CCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919970358 XGIRQTLYPHDGTN-UHFFFAOYSA-N 421.497 2.198 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ncoc3[C@@H]3CCCO3)CC2)cc1 1116070341 JDXWMPJNHUQIKT-IBGZPJMESA-N 414.506 2.477 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(OC)c(C)c(OC)c1 1116592635 YNODSYCHNMTWHJ-HNNXBMFYSA-N 403.431 2.328 10 20 HECD COc1ccc(CN(Cc2ccccc2O)C[C@H]2CCCO2)cc1OCC(N)=O 1319683687 MQRUEATXJKEZRQ-GOSISDBHSA-N 400.475 2.446 10 20 HECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2(F)CCC2)C3)=NN1c1ccccc1 1796935661 XFZOEHOORNUHRZ-ACHSLPGTSA-N 412.465 2.310 10 20 HECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)on1 1827427440 YOEWSXHJGWKXFY-INIZCTEOSA-N 414.462 2.336 10 20 HECD O=C(Cc1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249714 PILTTXHHWLYETN-UHFFFAOYSA-N 401.850 2.206 10 20 HECD C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)C1(O)CCC1 1847257929 LTOHPKPOIYEKHU-CQDKDKBSSA-N 408.882 2.118 10 20 HECD Cc1c(CNC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)n(C)c2ccccc12 472272645 AJIIWMPOPZJCHL-INIZCTEOSA-N 404.536 2.196 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c1 725898397 WSVHOYDYIDDEFG-UHFFFAOYSA-N 423.535 2.019 10 20 HECD CCN(CC)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 727057406 FOMDPUARZKXEFO-YBEGLDIGSA-N 421.544 2.075 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1 734067261 MQYATQCMAMZNBO-IBGZPJMESA-N 413.474 2.309 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4cc[nH]n4)C3)cc2)C1 734272125 DHMWOOPTSJFUNT-ROUUACIJSA-N 410.522 2.201 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)N(CC(N)=O)C(C)(C)C2=O)c1C 735793355 WENIPMQKZMCYBO-UHFFFAOYSA-N 410.474 2.113 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cnc(C(C)(C)C)nc1 737117617 JKVVIHPSSONACR-UHFFFAOYSA-N 411.506 2.208 10 20 HECD CCS(=O)(=O)NCc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 741680507 VLRIJNRHMPXAGJ-UHFFFAOYSA-N 401.532 2.438 10 20 HECD CC(=O)N1CCC(N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 742204683 PKEQTOSFUKLIFN-AWEZNQCLSA-N 419.481 2.390 10 20 HECD C[C@H]1CC[C@@H](CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)O1 745708368 KTFZTZWQUSQKKI-RDJZCZTQSA-N 408.470 2.169 10 20 HECD CCN(CC(=O)NN1C(=O)N[C@](CC)(c2ccccc2)C1=O)c1ccc(OC)cc1 746109058 IOGDBUQGMRCDQK-JOCHJYFZSA-N 410.474 2.410 10 20 HECD C[C@H](NC(=O)NCC(=O)NCCc1ccccc1)c1ccc(N2CCOCC2)cc1 746724571 PFTHULBHMRFDTE-SFHVURJKSA-N 410.518 2.242 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](O)Cc1ccccc1 747390635 UBTJJFPFIUFAIV-IERDGZPVSA-N 401.482 2.454 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 753902455 FLCFTGFHSTUEGE-UHFFFAOYSA-N 423.469 2.086 10 20 HECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)cc1 758170770 NBYBBXBGGUBXHD-UHFFFAOYSA-N 403.453 2.146 10 20 HECD COc1cc(N2CCN(C(=O)NOCc3cccnc3)CC2)cc(OC)c1OC 759293403 LONMWPORKXFWQH-UHFFFAOYSA-N 402.451 2.071 10 20 HECD Cc1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1C 760881872 YGNRAQLWWBHTQB-UHFFFAOYSA-N 403.504 2.343 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)CN(C4CCCC4)C3=O)CC2)cc1 760950775 MCPZZTZZOJWYLO-UHFFFAOYSA-N 400.523 2.414 10 20 HECD O=C(COc1cccc(NS(=O)(=O)c2cccc3nonc23)c1)N1CCCC1 765046367 CTRARBTYBMPSEQ-UHFFFAOYSA-N 402.432 2.025 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc21 765928183 VYTMAFRTHYYVDD-UHFFFAOYSA-N 403.236 2.296 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1 768165342 LXMHHJOKJHQVOH-UHFFFAOYSA-N 414.643 2.467 10 20 HECD CCCS(=O)(=O)NC1CCN(Cc2cc(Br)cc(OC)c2O)CC1 768263382 DDHXQYNSJXABCT-UHFFFAOYSA-N 421.357 2.457 10 20 HECD Cc1cnoc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 768613187 NPFMGYBHYXEPIR-ZIAGYGMSSA-N 405.426 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C)cnc3OC)CC2)cc1 778302480 IDYZFETZWHFANY-CMDGGOBGSA-N 410.474 2.251 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1 783318096 TYEXJJZJPLGFQQ-UHFFFAOYSA-N 400.454 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnn3-c3ccccc3)CC2)cc1 795764374 DSLRLILIPVUONW-UHFFFAOYSA-N 420.469 2.387 10 20 HECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803305898 NYGTXGIKZIKAQG-KGLIPLIRSA-N 400.479 2.183 10 20 HECD C[C@H](NC(=O)C(=O)NCC[C@H](C)N1CCCCC1)c1ccc(N2CCOCC2)cc1 803309151 QDMVIIKCELLZOO-OALUTQOASA-N 416.566 2.081 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)cc1 804966611 CIAJVHORZCJIDW-VCSGRIEYSA-N 415.582 2.416 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](Cc4cnn(C)c4)C3)cc2)CC1 805020164 PKSZXQCEJGCZFT-FQEVSTJZSA-N 423.561 2.364 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H](Oc2ncccc2F)C1 806281126 NURRMHAJFHMEKU-CYBMUJFWSA-N 424.523 2.346 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1[N+](=O)[O-] 807386805 KCBWWKWGISHSSI-UHFFFAOYSA-N 424.207 2.326 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2OC(C)C)cn1C 808112275 QEJDWEXLCHVJLQ-UHFFFAOYSA-N 410.448 2.065 10 20 HECD C[C@@H]1[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1Cc1ccccc1 813824629 QDRQWTKUVSTQOL-KDOFPFPSSA-N 403.504 2.157 10 20 HECD CCOC(=O)[C@H](Cc1ccccc1)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920638388 YMQFLCHLAFIJLM-KRWDZBQOSA-N 407.444 2.095 10 20 HECD COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1 920866198 XGLUHGHZGQFMHF-CQSZACIVSA-N 421.475 2.480 10 20 HECD C[C@H](NC(=O)N1CCN(C(=O)N2CCCC2)CC1)c1ccc(N2CCOCC2)cc1 920870411 FEZVUYOZHSWQON-SFHVURJKSA-N 415.538 2.127 10 20 HECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3cnc4c(cnn4C)c3)c2)CC1 1320445903 LGGIAILNTBIKTF-UHFFFAOYSA-N 414.535 2.300 10 20 HECD C[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)CCCN1 1800718114 GYPPIZYTVKPOBS-MWBIGIAMSA-N 407.898 2.145 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991022 MQRWCKNPXMDZTN-OXJNMPFZSA-N 408.458 2.318 10 20 HECD C/C=C/C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1812548124 GMUKUDFBEGHSNL-UFHXMZQXSA-N 423.469 2.494 10 20 HECD Cc1ccoc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725101 JZMKZRLSFJGEEP-NSHDSACASA-N 414.443 2.390 10 20 HECD O=C(CCc1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248732 IIQABGMKALTMDT-UHFFFAOYSA-N 417.412 2.221 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CN(C)C3=O)c2C)cc1C 7095668 XSZYDVIDNLQPAI-UHFFFAOYSA-N 411.458 2.331 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccccc4OC)CC3)CC2)cc1 69130750 LBIZEHMBOKWZDU-UHFFFAOYSA-N 424.545 2.175 10 20 HECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)N1CCOc2cc(N(C)C)ccc21 569092585 RLTJQSVEEVCMHB-UHFFFAOYSA-N 414.853 2.430 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)NCc3ccc(N4CCSCC4)cc3)cc12 725824416 SKCPVSMPBDTOAX-UHFFFAOYSA-N 417.560 2.308 10 20 HECD C[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 730216093 QRYBXFCOWXMAAW-MRXNPFEDSA-N 417.531 2.315 10 20 HECD CCN1CCN(c2ccc(CNc3ccc(C(=O)NCCOC)cn3)cc2F)CC1 732923222 YAJHLQILTSTDMK-UHFFFAOYSA-N 415.513 2.351 10 20 HECD C[C@H](CN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1)NC(=O)/C=C/c1cnn(C)c1 733955234 CVMIUZJANSBYLK-ACYHVXKWSA-N 418.501 2.418 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1 734067733 QPKGKRPNPWZIBW-LJQANCHMSA-N 403.454 2.413 10 20 HECD O=C(NCCCOC[C@@H]1CCOC1)NCc1ccc(N2CCC(CO)CC2)cc1 740920011 FGTNFFWYOPVCHH-FQEVSTJZSA-N 405.539 2.138 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 741079649 MQKJDKQUGLNYJH-ICSRJNTNSA-N 423.579 2.050 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743082805 WJMZIWNNYHQLET-UHFFFAOYSA-N 411.458 2.496 10 20 HECD CN1CCCc2cc(CNC(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)ccc21 752290535 DJCJHXVFWZUNGY-UHFFFAOYSA-N 411.886 2.439 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)CCc3ccccc3)cc2)C1 753122629 SSPQYVOGTDMXLH-IFMALSPDSA-N 424.545 2.181 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CCCN(C(=O)N4CCCC4)C3)CC2)cc1F 753739322 FCNNGIBTECRORU-KRWDZBQOSA-N 418.513 2.411 10 20 HECD CCO[C@@H]1C[C@H](N(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C12CCC2 754099695 XPLKNIXAYLENBP-AKIFATBCSA-N 417.594 2.458 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 754450153 IFDCYAIMWMGABG-AWEZNQCLSA-N 400.483 2.271 10 20 HECD Cc1nnc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1 755137698 AVQFNDSSPSVEIN-IHRRRGAJSA-N 405.474 2.098 10 20 HECD COC(=O)[C@@H](C)c1c(C)nn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 757342838 NXSYCKAVUDLCHY-HNNXBMFYSA-N 414.506 2.134 10 20 HECD O=C1CSc2ncc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2N1 767187687 NWOOSZDTPDIACU-UHFFFAOYSA-N 412.515 2.265 10 20 HECD CN(C)c1ccc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)cc1F 768804047 KZHLCXQPEMWXQR-UHFFFAOYSA-N 402.495 2.158 10 20 HECD CCOc1ccc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c(O)c1 768804902 RIABSVKRPNXEEH-UHFFFAOYSA-N 401.488 2.058 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)NCc1ccc(N2CCOCC2)cc1 770274075 FAOWOHQOCBAYQE-UHFFFAOYSA-N 411.506 2.385 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 772320782 WGRLFYAHKYXSHY-MRXNPFEDSA-N 413.449 2.244 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCCN2C(=O)NC3(CCCCC3)C2=O)c1O 774960626 CYFLWWZEHXYIHG-UHFFFAOYSA-N 406.439 2.043 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCCCC1=O 775093146 ATSOTZGZDJQQAY-UHFFFAOYSA-N 416.566 2.399 10 20 HECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(NCCCSc2nccs2)CC1 779349065 VJSYMZSBLWWCDP-UHFFFAOYSA-N 415.610 2.408 10 20 HECD C[C@H](C1CC1)n1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 779505061 SLDSHMLWTWAXSL-OAHLLOKOSA-N 417.535 2.411 10 20 HECD CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785296055 BFBDVGOVVJPCNR-UONOGXRCSA-N 413.474 2.312 10 20 HECD CC(C)NC(=O)c1cnn2c1C[C@@H](CNCc1ccc(N3CCOCC3)cc1)CC2 785563550 NFPUYFIHGIQUBW-IBGZPJMESA-N 411.550 2.210 10 20 HECD Cc1cnc(Cl)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 787874851 LXQYEBGOSOVHIJ-UHFFFAOYSA-N 402.882 2.477 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 788909256 FPMPGTDXYYUKAF-SFHVURJKSA-N 422.533 2.305 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3cccnc3)cc2F)C[C@H](C)O1 789827746 VKDDBMRISOFWKC-JYJNAYRXSA-N 414.481 2.328 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)Nc3ccc(O)cc3OCC)ccc2O1 790409363 OKECDONHARRSEW-GOSISDBHSA-N 407.444 2.458 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@@H](O)CCNC(=O)OC(C)(C)C)cc2)CC1 792986436 NIDGLRDWRKCEPR-SFHVURJKSA-N 407.511 2.010 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3[nH]nnc3-c3ccccc3)cc2)C1 797712426 KWVGYJZRRXVOEJ-QGZVFWFLSA-N 404.474 2.103 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OCCO 798327396 FZMWXDIQWPXRHR-UHFFFAOYSA-N 414.502 2.205 10 20 HECD COCC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC1 800727859 RDSYSVLBHPXTCU-UHFFFAOYSA-N 408.506 2.185 10 20 HECD CC(C)(C)OCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449109 OKQYYRYKLKRGBV-UHFFFAOYSA-N 413.465 2.304 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)c3ccco3)cc2F)CC1 805007031 DEGPTXDHNQEDTI-MRXNPFEDSA-N 416.497 2.396 10 20 HECD CCc1ccc([C@H]2COCCN2C(=O)C(=O)NCCCSc2nccs2)o1 806276011 DAHYJRPOPMWRCQ-CQSZACIVSA-N 409.533 2.497 10 20 HECD COc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccn1 806882852 NVKPWWPYOQWYJL-UHFFFAOYSA-N 420.416 2.415 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(Br)c(O)nc1=O 918657409 BYGRBACRCYMOSQ-UHFFFAOYSA-N 423.311 2.215 10 20 HECD CC(=O)Nc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1F 919840560 RBLYQAKCARKERB-UHFFFAOYSA-N 405.451 2.271 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784889694 RRTYEDXYUTUICY-WUUFJKRQSA-N 408.882 2.407 10 20 HECD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C(=O)O 13313655 KNOCDYIFGWJJQF-UHFFFAOYSA-N 404.488 2.351 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cc1 18215036 GFJLQZGVBPTSDL-GOSISDBHSA-N 407.470 2.458 10 20 HECD O=C(NCc1nnc2n1CCC2)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726700458 AHWJVYBVBDBLAD-UHFFFAOYSA-N 406.437 2.294 10 20 HECD Cc1cc(C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1cccc(Cl)c1 726939263 ROOGVMWACHMITD-UHFFFAOYSA-N 409.939 2.208 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN4CCCC[C@H]34)cc2F)CC1 730118792 MIEJGKXINSJPLS-PZJWPPBQSA-N 403.546 2.394 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 731403466 LJNPBEBCEHCSCB-UHFFFAOYSA-N 408.568 2.025 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1 734017447 IRIWYGCWNVVAFI-LRTDBIEQSA-N 403.479 2.154 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n(C)n1 737159305 WNZMCDZUINQRIX-MRXNPFEDSA-N 413.522 2.271 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](C)CN3CCOCC3)cc2F)C[C@H](C)O1 738978694 WMQVPVSHALNABM-SQNIBIBYSA-N 422.545 2.207 10 20 HECD Cc1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746037630 ILFRCVJKZIPQPX-UHFFFAOYSA-N 403.429 2.489 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1 747457294 RXGIGGLOIQVYLE-UHFFFAOYSA-N 400.508 2.329 10 20 HECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 749254660 GSCXKLYUXSNDOF-UHFFFAOYSA-N 422.478 2.318 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1 753640249 MSQBLKFGCBOZIK-OCCSQVGLSA-N 410.517 2.060 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(-c4ccccc4)n3)CC2)cc1 757825269 LSNTVOWBTAONAP-UHFFFAOYSA-N 421.505 2.220 10 20 HECD CCc1ncc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759994391 MVJQHKLVQIPKAM-UHFFFAOYSA-N 401.467 2.419 10 20 HECD CC(C)CCn1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 766328939 YVCCSNBLLOPNPJ-UHFFFAOYSA-N 417.485 2.160 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(Br)nc1 766490793 VUMGNLDFOSNKHM-UHFFFAOYSA-N 401.264 2.475 10 20 HECD COCCn1c(N)c(N(Cc2ccccc2)Cc2ccc(N(C)C)cc2)c(O)nc1=O 768140330 NLAKABOVWNOSTM-UHFFFAOYSA-N 423.517 2.450 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3(C(N)=O)CCC3)c2C)cc1 769097271 CXCPIINVFHHCRC-UHFFFAOYSA-N 412.442 2.262 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)OC)c2)c1 769540976 XGKZAPRWBMCVRT-UHFFFAOYSA-N 414.867 2.166 10 20 HECD NC(=O)C1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCCC1 769715577 TVVBWWQKGVSXCE-UHFFFAOYSA-N 423.516 2.173 10 20 HECD O=S(=O)(CCC1CC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770661043 FPUVLFSVHDGKNV-UHFFFAOYSA-N 419.526 2.162 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2c(c1)C(=O)NC2=O 771059439 RHXZBEVWKJRGHP-HNNXBMFYSA-N 413.861 2.324 10 20 HECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1=O 773020645 PWUWWGAOLPDYJR-IQMFZBJNSA-N 424.501 2.406 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3nccs3)cc2F)C[C@@H](C)O1 773491108 UNZDNNXSAILFQT-CHWSQXEVSA-N 407.467 2.369 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773849776 ZXQACQQIILKURN-OAHLLOKOSA-N 412.490 2.036 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1ccc(I)cc1 776281487 FJCPALFYWHCABW-UHFFFAOYSA-N 413.167 2.498 10 20 HECD CC[C@H](C)n1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 778245484 HAWYLDHBVLBGJA-HNNXBMFYSA-N 404.536 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CC(C)(C)OC)CC2)cc1 778287997 CHTUWYKNQIKDFH-QXPKXGMISA-N 403.523 2.220 10 20 HECD Nc1ccc(N(C(=O)C(=O)Nc2cnn(CC(=O)NC3CC3)c2)C2CCCCC2)cc1 784062690 RRRDMHRMSFRETA-UHFFFAOYSA-N 424.505 2.048 10 20 HECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)nn1 786550254 CXKFLUQRWWIJMK-UHFFFAOYSA-N 410.430 2.207 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)c(C)n1-c1ccccn1 790221161 FGHUNNIQXVQBIM-QGZVFWFLSA-N 402.520 2.129 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)Cc3ccccc3)cc2)C1 799557121 TUAMKHAYQDYGEB-NHCUHLMSSA-N 424.545 2.181 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 799775697 JKUDIQLQFLONLK-OAHLLOKOSA-N 411.911 2.392 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCN(c2ccncc2)CC1 807100076 HPXIMESHBCAMLF-UHFFFAOYSA-N 409.534 2.105 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccn(CC(F)(F)F)n1 807385810 RDYQJMXJXLUHPB-UHFFFAOYSA-N 421.173 2.168 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCO[C@@H](C(C)(C)C)C1 808081085 KIHQNIVOYRYCSR-UYAOXDASSA-N 417.550 2.192 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 808283438 IUIOQPBEIVFNKD-ZIAGYGMSSA-N 416.515 2.058 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@H](C2CC2)C1 808856522 VHABRLVNVLLCDT-NRFANRHFSA-N 410.562 2.093 10 20 HECD COc1cccc(CNC[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1O 816610741 WLMAKVKPOPPOFV-HNNXBMFYSA-N 407.511 2.254 10 20 HECD Cc1cc(CCNS(=O)(=O)c2cc(C(N)=O)n(C)c2)c(C)n1-c1ccccc1 913075418 ZWEWPIWUVJEBGG-UHFFFAOYSA-N 400.504 2.053 10 20 HECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N(C)Cc3ccc(N(C)C)cc3)cc2)[nH]1 915191633 KKHODBLADVBRBX-UHFFFAOYSA-N 422.485 2.219 10 20 HECD CCN(CC)c1ccc(CN(C)CCC(=O)N2CCN(c3ncccn3)CC2)cc1 917019335 AZLDDNHAWUDTHN-UHFFFAOYSA-N 410.566 2.494 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 917708169 ALPFKOHOMRMTRY-UHFFFAOYSA-N 417.393 2.272 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 918305169 GJJYWZCFQQRHLM-UHFFFAOYSA-N 412.490 2.060 10 20 HECD CNc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 919839120 BSFGAEGWNDZMBA-UHFFFAOYSA-N 404.448 2.124 10 20 HECD CN1CCN(c2ccc(CN3CCNC(=O)[C@H]3c3ccccc3F)cc2F)CC1 1320379279 RSMPDVMCNOBRDU-OAQYLSRUSA-N 400.473 2.390 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 1320772109 CHLCRUJMEJHGFA-WBMJQRKESA-N 402.403 2.400 10 20 HECD Cc1nc2ccccn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1797353692 ASJNXHYBEMWGDZ-MUJYYYPQSA-N 421.457 2.015 10 20 HECD CCO/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822606266 KMUZIUJAKPOQKG-OWNNVSBGSA-N 401.423 2.072 10 20 HECD CC(C)(C)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826861346 WYGCHKQHFNNYMC-KRWDZBQOSA-N 418.538 2.114 10 20 HECD COC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424223 UTSCIMPKNDPZTP-WMLDXEAASA-N 405.495 2.009 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc4c(c3)CCC(=O)N4)CC2)cc1 117792892 XNJNOKDMYJIIDX-IBGZPJMESA-N 411.502 2.142 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccccc3NS(C)(=O)=O)CC2)cc1 726563151 XJDGBSNAESWQGN-UHFFFAOYSA-N 403.504 2.466 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)CC2)cc1 726563375 IULLTSSHFWSUPG-QGZVFWFLSA-N 408.502 2.224 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H](C2OCCO2)C1 729597916 ULSQGNWJNKFHDT-MRXNPFEDSA-N 407.486 2.081 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCCS(=O)(=O)NC(C)(C)C)cc2)CC1 731047970 AKMMFPGHRCUEJT-UHFFFAOYSA-N 410.584 2.440 10 20 HECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(=O)N(C)C 733164124 ZVDVBUNYSUNYIW-BVRAVYJCSA-N 411.574 2.322 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 734406534 UIIGYHCIADVADP-QHCPKHFHSA-N 406.486 2.071 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)cc1F 735391560 JVKBFOSSDCXXBW-UHFFFAOYSA-N 412.465 2.213 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)C2CC2)cc1 745882530 HHHVOSRBRNLUBT-IBGZPJMESA-N 410.522 2.356 10 20 HECD CCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 747979302 GNULBNFPTUXURB-QGZVFWFLSA-N 420.529 2.235 10 20 HECD O=C(NCCCn1cccn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748023916 HOAGYKKQMTVLMM-UHFFFAOYSA-N 406.489 2.271 10 20 HECD Cc1nnc2n1C[C@@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 750795391 OTENBCTUVCVPGL-WMLDXEAASA-N 403.914 2.289 10 20 HECD Cc1cc(CCNC(=O)C(=O)Nc2cnc(N(C)C)nc2)c(C)n1-c1ccccc1 752379223 SLMFXOKSLRGESK-UHFFFAOYSA-N 406.490 2.248 10 20 HECD COC(=O)C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 754039466 XETSSRKKXBZNMS-CQSZACIVSA-N 424.500 2.326 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3c(CCCO)nc4ccccc43)CC2)cc1 758210791 RWHWIKQMAWSUIP-HXUWFJFHSA-N 424.545 2.153 10 20 HECD COc1cc(N2CCN(C(=O)Nc3nc4ccccn4n3)CC2)cc(OC)c1OC 760034044 ZZSXDUZELHSGIT-UHFFFAOYSA-N 412.450 2.109 10 20 HECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C(=O)[C@H]2C1 761088220 BSFDCGYBEKMCNZ-QRCPMIHRSA-N 405.470 2.381 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@H](O)C(F)(F)F 766248829 PRDYNNIQLYDVQZ-WBVHZDCISA-N 420.451 2.469 10 20 HECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)cccc21 769261308 PVFLYAZITLCZMK-UHFFFAOYSA-N 406.486 2.451 10 20 HECD C[C@H](CCN1CCN(C)CC1)NC(=O)NCc1ccc(N2CCSCC2)cc1 770344444 KSYBLDPJMAJACG-GOSISDBHSA-N 405.612 2.065 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](O)Cc3ccccc3Cl)cc2)C1 772319709 RNYYRCSTQACBIF-YLJYHZDGSA-N 415.921 2.262 10 20 HECD COc1ccc(N2CCN(C[C@](C)(O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1F 777598497 PFTRIORLGMIBQS-NRFANRHFSA-N 422.522 2.268 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4nccnc4c3)CC2)cc1 778241883 FUCMYAXPCAESCX-CMDGGOBGSA-N 417.469 2.482 10 20 HECD CN(CC(=O)NC[C@H](c1ccccc1)N(C)C)Cc1ccc(N2CCOCC2)cc1 781981483 VTBPJFXRJDBWRH-HSZRJFAPSA-N 410.562 2.374 10 20 HECD COc1cccc(C[C@@H](O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 785597642 JWRGMQTVIKLXIM-OAQYLSRUSA-N 402.466 2.015 10 20 HECD CCOC[C@@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 789816247 CKKGABFFJHSPDJ-JTDSTZFVSA-N 423.529 2.233 10 20 HECD C[C@H](c1cccnc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843012 HAQAUMGMJCXUJC-OAHLLOKOSA-N 414.481 2.018 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)NCc1ccc(OC)cc1O 794377739 VISWFCPGXPTEPU-UHFFFAOYSA-N 404.488 2.186 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3COC(=O)NC(C)C)nc12 796709793 NBFGHBDOTURJLW-HNNXBMFYSA-N 419.482 2.101 10 20 HECD C[C@H](NC(=O)C(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803296370 BNVMIZBIIOYBOV-PGRDOPGGSA-N 423.513 2.301 10 20 HECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@H]1CC[C@@H](C)C1 804316373 CKEKMINZKATASN-XLIONFOSSA-N 417.550 2.444 10 20 HECD Cc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807587487 HGBSTVHSGRZAFM-UZLBHIALSA-N 408.502 2.160 10 20 HECD CN1Cc2ccccc2[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 807677533 WCGCMXBXMOFBGA-CTNGQTDRSA-N 423.513 2.203 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1 808487027 RTXFCJDDWFKRJM-UHFFFAOYSA-N 421.858 2.406 10 20 HECD CCC[C@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 814433519 LBBIRAJQESAQFU-KRWDZBQOSA-N 421.561 2.319 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(-n3nccn3)nc2)cc1 918309837 KAIWFQIQCPKYMP-UHFFFAOYSA-N 407.478 2.106 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)NCc3ccco3)cc2F)C[C@@H](C)O1 918632961 GBEZLKAFSTYLIC-HUUCEWRRSA-N 418.469 2.148 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cn2cccn2)cc1 1320393317 HUEIRWGZRFMNDD-SFHVURJKSA-N 409.442 2.247 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 1343655860 IJLIADNMTYDRSR-DEOSSOPVSA-N 423.513 2.141 10 20 HECD C/C=C/C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1812548099 GMUKUDFBEGHSNL-IUOOSVRPSA-N 423.469 2.494 10 20 HECD NS(=O)(=O)c1cccnc1NCc1ccc(N2CCOCC2)cc1C(F)(F)F 301241911 GLZLBZQIVVFULX-UHFFFAOYSA-N 416.425 2.197 10 20 HECD Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 525212895 WZEYLFOKAPJCOY-UHFFFAOYSA-N 424.544 2.361 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC(OC[C@@H]3CCOC3)CC2)n(C)c2ccccc12 583163873 NQRQVBDNGPTHGS-QGZVFWFLSA-N 413.518 2.147 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(-c2ccncc2)n1 745861803 MVKHXUSQKZGFAA-SFHVURJKSA-N 418.501 2.114 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCCCSc2nccs2)cn1 753588566 NFRBRJGVZNBBED-IYJVBRSBSA-N 413.594 2.357 10 20 HECD CCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)COC1 756567092 IZFIMWVOYDUOLN-GJZGRUSLSA-N 408.470 2.025 10 20 HECD COc1cc(N2CCN(C(=O)CCc3c(C)n[nH]c3C)CC2)cc(OC)c1OC 760083575 FGXLWHVOZAFIJE-UHFFFAOYSA-N 402.495 2.334 10 20 HECD O=C1[C@H]2CSCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 761094689 GHFNNVGUNMNIAG-OAHLLOKOSA-N 415.437 2.422 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O 763283382 JMENLCYSBDYGES-QLEMLULZSA-N 417.506 2.282 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 775402461 BRLDSTFRHWTHCK-GJZGRUSLSA-N 405.520 2.305 10 20 HECD Cc1c(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 775403151 GYNLLCDIJRWGAQ-GFCCVEGCSA-N 406.464 2.108 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1 778914822 MSIAZESLPSLJPR-UHFFFAOYSA-N 403.394 2.433 10 20 HECD COc1ccc(N2CCN(CCCNCc3cc(Br)nn3C)CC2)cc1 785413562 OLUOBBBGTXHPOQ-UHFFFAOYSA-N 422.371 2.493 10 20 HECD CCOC(=O)NCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785667885 ILOBNVOHNTWPJO-LBPRGKRZSA-N 424.409 2.078 10 20 HECD Cc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 786727247 YXACXVRHJAABQA-PXNSSMCTSA-N 422.529 2.190 10 20 HECD COCCOc1cccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 787994580 QNZARPGLZDRPRP-UHFFFAOYSA-N 411.502 2.027 10 20 HECD CO[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789816631 DSQRWUBADDQKQU-PONJGIIJSA-N 421.513 2.083 10 20 HECD C[C@H]1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789841244 VOHGDCKAYFGBSF-JKSUJKDBSA-N 405.514 2.346 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C)CN3CCCC3)cc2)CC1 790190407 SHHNPEGNHFVRQQ-IBGZPJMESA-N 400.567 2.387 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1 799252113 JGGPSFZWOHDLSC-UHFFFAOYSA-N 410.474 2.143 10 20 HECD CN(c1ccc(CNC(=O)N2CCC[C@@H](S(N)(=O)=O)C2)cc1)C1CCCCC1 799898347 UBCAUKOBVOCFRU-LJQANCHMSA-N 408.568 2.418 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1 803644100 HGDJBWVMZFKGPO-OAQYLSRUSA-N 422.573 2.358 10 20 HECD O=C(NCCc1ccn(-c2ccccc2)n1)C(=O)NCc1ccc(N2CC=CC2)cc1 804106847 WPDXDJBKXIBHPU-UHFFFAOYSA-N 415.497 2.224 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C)O[C@@]3(CCCOC3)C2)cc1F 804852698 MDGXVTVWDIQHLH-ZHRRBRCNSA-N 421.513 2.085 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCCCSc2nccs2)c(N2CCCC2)n1 806281698 HABFYEXUZDIWOP-UHFFFAOYSA-N 419.576 2.362 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C 806516132 YOECFKQRUGFVGF-OAHLLOKOSA-N 406.527 2.097 10 20 HECD COc1ccc(OC)c(CCCNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 807099374 UCQQVZZBCPIBED-UHFFFAOYSA-N 413.518 2.443 10 20 HECD Cc1cnn([C@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 812010395 WPUIJMZPBMGUCF-KRWDZBQOSA-N 401.486 2.448 10 20 HECD CCN(CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 919750103 ORTXCMLGXJIWTJ-UHFFFAOYSA-N 401.532 2.064 10 20 HECD NC(=O)COC1CCN(Cc2cc(Br)cc(Br)c2O)CC1 1254165728 IWXFHRUNJCVBFV-UHFFFAOYSA-N 422.117 2.384 10 20 HECD Cc1c([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1C 1254665878 VBICSDDUABGBSU-OWCLPIDISA-N 417.529 2.448 10 20 HECD CC(=O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811799807 YYZQLRMVMAZTBL-GUYCJALGSA-N 417.849 2.055 10 20 HECD CC(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898189 FBZONXQVWJAYQO-HNNXBMFYSA-N 411.593 2.122 10 20 HECD O=C(Cc1cccc2ncccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847793766 CDZOICQJGPILCI-OALUTQOASA-N 418.453 2.099 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)cnc4ccccc43)cc2F)C[C@H](C)O1 108291580 GMKOZOOAISCOMN-HOTGVXAUSA-N 424.476 2.466 10 20 HECD O=C(Cc1occc1C(=O)N1CCOc2ncccc21)N1CCOc2ncccc21 498642249 BTXJVOZWTLJBMM-UHFFFAOYSA-N 406.398 2.077 10 20 HECD C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 726616894 VDLCGMQRXIMLMF-ZWKOTPCHSA-N 416.566 2.484 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC3)cc1C(=O)O 728015523 RQGTUJQLWQWNDX-UHFFFAOYSA-N 410.473 2.046 10 20 HECD CCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 730578464 SEPRJOVEHJLQGC-GOSISDBHSA-N 401.555 2.062 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)cc1 734686887 XVFMVWVPXXVBOR-NRFANRHFSA-N 417.598 2.081 10 20 HECD COC(=O)NCc1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 735304314 FNXZLYWJGZSLRE-UHFFFAOYSA-N 412.490 2.312 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(-n2cncn2)c1 735516434 OQSSHARUMUIFKC-UHFFFAOYSA-N 406.490 2.446 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n(C)n1 737111225 UGIRUZKDRAZAHC-SFHVURJKSA-N 414.506 2.471 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)CC2)cc1 741284653 XUKSRRDHHVEKDZ-HBMCJLEFSA-N 416.566 2.320 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 743362864 LBDWLNOZYQWFTD-UHFFFAOYSA-N 413.478 2.225 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C1CCN(S(C)(=O)=O)CC1 743808977 KNHDZHXPYVFLRH-UHFFFAOYSA-N 419.341 2.175 10 20 HECD COc1ccc(N(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)CC(C)C)cc1 746171162 RWYRUWXWUJEPNS-UHFFFAOYSA-N 419.547 2.164 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(C)o1 746757662 QJHSACTYFWFOLU-HKUYNNGSSA-N 414.506 2.477 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 748104451 DLVHQGWJRHPNIF-UHFFFAOYSA-N 418.563 2.314 10 20 HECD COc1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1NC(C)=O 749731489 QNRPSAJIDWJOLI-UHFFFAOYSA-N 408.505 2.347 10 20 HECD C[C@@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 750554710 VGZGSSQCWDKQSQ-CYBMUJFWSA-N 417.421 2.481 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1F 752725153 GAOAGTHMWZNEJK-UHFFFAOYSA-N 413.449 2.367 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C(F)(F)c3nccs3)CC2)cc1 755615367 SKJAPXXHIPTNDO-UHFFFAOYSA-N 411.430 2.136 10 20 HECD O=[N+]([O-])c1cnc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc1 760498117 WQQVGIAPKNKDNI-UHFFFAOYSA-N 410.413 2.253 10 20 HECD CS(=O)(=O)Nc1cccc(CC(=O)NCc2cccc(Br)c2O)c1 765747489 OSNIHQWFSSWJBE-UHFFFAOYSA-N 413.293 2.385 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)[C@@]2(O)CCSC2)NC(=O)OC(C)(C)C)cc1 765836498 NJUOIDSEEPKNGG-OXQOHEQNSA-N 409.552 2.303 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCCS1(=O)=O 767173471 WGPUCSRSBRTYRI-CYBMUJFWSA-N 405.314 2.263 10 20 HECD CCOC(=O)C1(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 768609260 HJLORDTZUQESIS-UHFFFAOYSA-N 421.405 2.287 10 20 HECD COc1cccc(CNC(=O)CS(=O)(=O)c2cccc(Br)c2)c1O 769502901 ADFSCZSOKIRNLE-UHFFFAOYSA-N 414.277 2.253 10 20 HECD COc1cc(O)c(CN2CCC(C(=O)NCC(C)(C)CN(C)C)CC2)cc1OC 775660574 GLLOVYWZSLEFLK-UHFFFAOYSA-N 407.555 2.325 10 20 HECD COc1cc(O)c(CNCCNS(=O)(=O)c2ccc(Cl)s2)cc1OC 776252863 IITOYHJHPJPCCM-UHFFFAOYSA-N 406.913 2.192 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2cnn(CC(F)F)c2)c(C)n1-c1ccccn1 778908832 KEXVAJLCENZWMI-UHFFFAOYSA-N 409.418 2.069 10 20 HECD CC(C)c1nc([C@H]2COCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)no1 779633819 WTZTVMDUKWOVPR-GOSISDBHSA-N 401.511 2.291 10 20 HECD COCCCN(CCO)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 782391122 IZMXOPGSDJAXKJ-UHFFFAOYSA-N 408.205 2.109 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C)(NC(=O)OC(C)(C)C)CC2)cc1 785441781 GHXCSIKYORIPQH-UHFFFAOYSA-N 418.538 2.275 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 796792470 XRXGIJZMGSMFCK-CYBMUJFWSA-N 414.462 2.382 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2 806846139 DONIAQITYWYJCH-UHFFFAOYSA-N 416.865 2.334 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12 807286990 GANJMMKSAQUNMT-KURKYZTESA-N 403.573 2.175 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 807288713 ZRNURKBTPHBFOW-UGKGYDQZSA-N 408.546 2.154 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)SCC(=O)N4)cc2)CC1 811358801 YSZSCOGNAHHYPF-UHFFFAOYSA-N 424.526 2.329 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCCC34CCOCC4)CC2)cc1 814182511 XNAZQRDPLQBPID-FQEVSTJZSA-N 415.534 2.199 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1nn(C)cc1Br 814600396 IKQKRQAKFZKZRM-UHFFFAOYSA-N 409.284 2.064 10 20 HECD CC(C)(C)c1n[nH]cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 815319979 ZFUFRJYZFUZECC-UHFFFAOYSA-N 418.469 2.156 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(C2OCCO2)c1 1116669311 NGGXTWWRCLYBAM-INIZCTEOSA-N 401.415 2.047 10 20 HECD CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCNS(C)(=O)=O 1321439109 JFGMJKKEYVUSHG-UHFFFAOYSA-N 416.551 2.358 10 20 HECD Cc1nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cs1 1847038982 HIXUDSAUIFFTCZ-GQCTYLIASA-N 415.471 2.099 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 147104756 HDEWAAWEQWBSQV-UHFFFAOYSA-N 401.438 2.316 10 20 HECD CCCN1CC[C@@H](CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 303288341 KJXIZUOPJYBFIZ-IBGZPJMESA-N 405.562 2.499 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC[S@@](=O)C(C)(C)C)CC2)cc1 303698950 WVXVOGUHQRDHBR-GDLZYMKVSA-N 424.611 2.054 10 20 HECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)ccc21 743958103 LDSMXSMDFUHICT-UHFFFAOYSA-N 407.470 2.435 10 20 HECD C[C@H]1CN(CCNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 745790574 BALZOEYHAZFPKQ-HOTGVXAUSA-N 412.481 2.277 10 20 HECD COC1(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCOCC1 746714934 PVTPKCGPFMMDHF-HZPDHXFCSA-N 409.502 2.434 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(C)(C)C(=O)Nc3ccccc3)CC2)cc1 754799749 NPLSVGYKXKRVRI-UHFFFAOYSA-N 410.518 2.351 10 20 HECD CCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)COC1 756567091 IZFIMWVOYDUOLN-GASCZTMLSA-N 408.470 2.025 10 20 HECD O=C(CN[C@H](CCO)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 760862923 DKNRVRMOWSQRRT-HXUWFJFHSA-N 407.530 2.199 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)N(C)C)c1 774947131 MUYXSIGFJHWMBA-IIBYNOLFSA-N 412.534 2.358 10 20 HECD CN1CCN(c2ccc(CN3CCN(Cc4noc(C(C)(C)C)n4)CC3)cc2)CC1 775710952 QSMBSSSYPNVSHF-UHFFFAOYSA-N 412.582 2.437 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@H]3c3ncc[nH]3)CC2)cc1 778252079 NHICRTXPGHAEEU-QJRAZLAKSA-N 423.517 2.377 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc4onc(C)c4c3)CC2)cc1 778253296 GCUYLTDKLPWCIV-BQYQJAHWSA-N 421.457 2.383 10 20 HECD C[C@@H](C1CC1)n1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 779505059 SLDSHMLWTWAXSL-HNNXBMFYSA-N 417.535 2.411 10 20 HECD NC(=O)COc1ccc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)cc1 784112742 OGEZXMCALXMKEZ-UHFFFAOYSA-N 410.474 2.295 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)cc1 785423677 FYBIZANKJXEFLV-UHFFFAOYSA-N 403.523 2.386 10 20 HECD CCC(CC)CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 786771106 UKLMFNGMNMNVHK-UHFFFAOYSA-N 400.567 2.387 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1c(F)cccc1Cl 786909766 TXQVEVBLAGHLLP-UHFFFAOYSA-N 405.857 2.248 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(F)cc3F)CC2)cc1 786980693 NANNJCCCLNBISG-UHFFFAOYSA-N 403.429 2.329 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(Cc2ccccn2)CC1 787144483 RLENHDNKGHHDOK-UHFFFAOYSA-N 410.518 2.307 10 20 HECD COc1cc(O)c(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc1OC 789466837 DDQCDIFNVKKDMM-UHFFFAOYSA-N 406.504 2.218 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]1c1ccc[nH]1 789842199 BFULBPGVIAHWCR-HXUWFJFHSA-N 414.481 2.095 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(N2CCC2=O)c1 790910941 AACUPVBIBBNWCK-UHFFFAOYSA-N 424.526 2.231 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3cccc(N(C)C)c3)nc12 801877064 XCGUVJTVCYNKDE-UHFFFAOYSA-N 412.446 2.354 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 803306402 TXMFAYBOBJFQTM-QGZVFWFLSA-N 411.502 2.368 10 20 HECD COCCOc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664084 GOUMTWZUQKXHDQ-UHFFFAOYSA-N 417.481 2.158 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(F)c(F)c1 803686054 ULQRFNWTWQQRQK-LJQANCHMSA-N 417.456 2.467 10 20 HECD O=C(NCc1nccn1C(F)F)C(=O)N(Cc1ccco1)Cc1ccccc1O 803803276 ZZRMPRKVEZANBF-UHFFFAOYSA-N 404.373 2.422 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N3CCC[C@H](C)C3)CC2)cc1 804318274 GCFHGMYNSBBOGI-ZWKOTPCHSA-N 416.566 2.017 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@H](C)C(=O)NCCN1CCOCC1 805968897 ISJOFGIFPOTUOH-MRXNPFEDSA-N 405.520 2.149 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c(O)c1 815631617 KLTJOMYWXPTVJO-ORAYPTAESA-N 411.458 2.417 10 20 HECD Cc1cc(Cn2nnc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2C)on1 815860589 RXVVFAYQIMUBPN-KRWDZBQOSA-N 411.462 2.458 10 20 HECD O=C1CN(S(=O)(=O)c2cccc(NCc3ccc4ccccc4c3O)c2)CCN1 816607424 RTICTQUSHCRBAW-UHFFFAOYSA-N 411.483 2.278 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccccc1-n1cccn1 918284374 COHKBZWQDQKGFG-UHFFFAOYSA-N 423.448 2.103 10 20 HECD O=C(Nc1cccc(-n2cnnn2)c1)C(=O)N(Cc1ccco1)Cc1ccccc1O 918293978 LCTVODRASYXIKY-UHFFFAOYSA-N 418.413 2.128 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCOCC3)cc2F)C[C@@H](C)O1 918996973 NIMKNTSHAZENHC-HUUCEWRRSA-N 408.470 2.025 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](CC(N)=O)C1 1319326778 NJVOJLZECZMDAN-LSDHHAIUSA-N 419.481 2.376 10 20 HECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc1 1342770002 UBCHARRQMGKWOJ-UHFFFAOYSA-N 403.429 2.442 10 20 HECD Cc1ncc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)s1 1796603513 QGIHFQAWWVLAQN-HOYONBQMSA-N 414.487 2.223 10 20 HECD CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813693153 JKHQOAMETHXYDD-OFGRBQKGSA-N 410.474 2.420 10 20 HECD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726567955 WVQLBGSKYAVESA-UHFFFAOYSA-N 422.388 2.143 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCS(=O)(=O)c3ccccc3)CC2)cc1 726699783 TVXFWYUNEKNPBP-UHFFFAOYSA-N 417.531 2.437 10 20 HECD Cn1cc(CCCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cn1 726762191 ABAIHJXKSQRUDS-UHFFFAOYSA-N 418.409 2.466 10 20 HECD CCCc1ccc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 726975486 CDCYVHOFHRDWCA-UHFFFAOYSA-N 422.572 2.352 10 20 HECD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 728948502 BJSVMHARTYFMFW-QWHCGFSZSA-N 407.492 2.430 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1 734064300 BYMALZWZVZOCAQ-KRWDZBQOSA-N 404.536 2.250 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@]1(N2CCOCC2)CCSC1 740909872 RUHJELKNPVLXQJ-OAQYLSRUSA-N 402.564 2.070 10 20 HECD C[C@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCCC1 741030849 ZZINPNNGGVUOSG-QGZVFWFLSA-N 421.513 2.086 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1nc(-c2cnn(C)c2)cs1 743049257 FOBBQEAWXQAVCS-UHFFFAOYSA-N 412.518 2.056 10 20 HECD COc1cccc2c1OCC(C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)=C2 751097544 LICBJXXDDXLVDP-SFHVURJKSA-N 421.497 2.489 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)cc3)ccc2O1 751968415 OCAWUQSQAQRDFI-IBGZPJMESA-N 404.488 2.098 10 20 HECD CC(=O)NC1CCC(N(C)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 753110666 ZZSHCOALHYWGPD-UHFFFAOYSA-N 406.502 2.251 10 20 HECD CO[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C[C@H]1OC 753387619 RHYXYQAZTBYXGI-CALCHBBNSA-N 417.428 2.097 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)o1 754045938 LPQIAYISVYCQQL-UHFFFAOYSA-N 412.439 2.115 10 20 HECD COC(=O)CC1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 756083543 QNYWFGMHLUOONV-UHFFFAOYSA-N 403.523 2.199 10 20 HECD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 758378992 CHBHOTXXNKFNDY-CYBMUJFWSA-N 405.842 2.325 10 20 HECD CNC(=O)Cc1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 759706861 LUZBQUUAXJCONV-DHZHZOJOSA-N 408.530 2.254 10 20 HECD CCN(CC)c1ccc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1 769529851 GOVQHLSPTCAWJL-UHFFFAOYSA-N 405.568 2.081 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCO[C@@H](C)C3)CC2)cc1 770826561 JGFINJDULNROKC-OALUTQOASA-N 404.555 2.322 10 20 HECD COc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nn1C 773194241 VFUBVFRVQHCLNQ-QGZVFWFLSA-N 417.510 2.491 10 20 HECD CC(C)CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 773739546 DEHCFFWVTIUMOH-CQSZACIVSA-N 406.504 2.393 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1)c1ccc(N(C)C)cc1 773857211 KNJGUCZQEFCCTO-HNNXBMFYSA-N 409.490 2.488 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F 774357351 RUGNMWALHOLWFT-UHFFFAOYSA-N 416.327 2.475 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc(Cl)cc1 774654026 NLDPFWNRVIFZAG-UHFFFAOYSA-N 415.921 2.494 10 20 HECD CCOC(=O)c1cnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 777783950 HKRNTUVNKVWDJW-UHFFFAOYSA-N 402.451 2.006 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 781438751 BGJMZAXPHLDTCI-UHFFFAOYSA-N 411.458 2.337 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)cc1 785424590 QOEYADOWYDMRTL-UHFFFAOYSA-N 411.502 2.234 10 20 HECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1Cc1ccccc1 785438939 IAUPRUKYAHIEAY-LJQANCHMSA-N 408.546 2.492 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 788270830 KGRIKQLCSROPAM-QGZVFWFLSA-N 418.538 2.193 10 20 HECD CCc1nc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788319520 LICINCLPYBHIRZ-AWEZNQCLSA-N 402.520 2.036 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(CCc2ccccc2)CC1 788912614 WZYOGFIOIOOLRT-UHFFFAOYSA-N 420.557 2.290 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC(=O)c4ccccc43)CC2)cc1 789297170 SVRFABHMWLVJED-FQEVSTJZSA-N 408.454 2.257 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@H]1C1CCCC1 789800800 OTOIKCVNWLQZIF-IBGZPJMESA-N 403.498 2.460 10 20 HECD Cc1nn[nH]c1C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 791044572 LXEHWFKOYIVOOG-NSHDSACASA-N 404.382 2.073 10 20 HECD C[C@@H]1c2nncn2CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 792664651 GYXZHLWVTFAECI-LLVKDONJSA-N 417.381 2.179 10 20 HECD COc1ccc(CNC(=O)NCc2ccccc2OCCN2CCOCC2)c(O)c1 792866751 LHPLUTHRGAQLAX-UHFFFAOYSA-N 415.490 2.111 10 20 HECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 793808682 LZWKPKCYEZHHBL-HNNXBMFYSA-N 406.490 2.135 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1 793862755 HLZFJVUOKOEDTH-UHFFFAOYSA-N 411.502 2.061 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)c2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 795249379 SDCGPPJSVZQIJX-KRWDZBQOSA-N 423.539 2.030 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](c4ccccn4)C3)CC2)cc1 799065041 AMIQNDWIXZLZCL-JBVUFVISSA-N 420.513 2.311 10 20 HECD CCn1ncc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1C(F)(F)F 799253306 LGCULBQZELDDMF-UHFFFAOYSA-N 401.364 2.382 10 20 HECD CN(c1ccc(CNC(=O)N2CCC[C@H](S(N)(=O)=O)C2)cc1)C1CCCCC1 799898346 UBCAUKOBVOCFRU-IBGZPJMESA-N 408.568 2.418 10 20 HECD C[C@@H](C(=O)N(C)C)S(=O)(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800148484 MJVPAAGNXUICNB-KGLIPLIRSA-N 401.960 2.472 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC4(CCCC4)C3)cc2F)CC1 805007768 PNZCOXRHOLSUNM-UHFFFAOYSA-N 416.541 2.377 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 806851318 NGBOCTREUCFABH-LJQANCHMSA-N 418.488 2.375 10 20 HECD O=C(NCC1(N2CCOCC2)CC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 809845009 ZXTPZQOFNSKYMX-UHFFFAOYSA-N 415.534 2.035 10 20 HECD Cn1nnc2c1C[C@H](C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 810449806 OBOHPLMLKCMYBA-ZIAGYGMSSA-N 405.449 2.307 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)c1 817951279 CTYCLKHUKXEJNR-UHFFFAOYSA-N 421.525 2.357 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3F)C2=O)cc1 915667086 PXDLVABVUFGHNN-OAQYLSRUSA-N 416.428 2.114 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1cc(O)cc(Br)c1O 917501811 QAEDTQBLYTXOTF-KRWDZBQOSA-N 420.263 2.197 10 20 HECD O=C(NCc1ccnc(-n2cccn2)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918204460 FSXJMGRQYFYQFN-UHFFFAOYSA-N 424.480 2.367 10 20 HECD Nc1c(Cl)cccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 919028749 UTTKTJQKQGCWEJ-UHFFFAOYSA-N 421.856 2.371 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@H](C)C(=O)N[C@H]1CCS(=O)(=O)C1 919568984 UTYXARHPWJNCPO-KGLIPLIRSA-N 410.517 2.004 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc2c1OCCO2 919971410 WKRDVNNMHNRGKE-UHFFFAOYSA-N 416.449 2.497 10 20 HECD CC(C)(C)N1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 1115868319 BSDZJFJDAFJVCA-GOSISDBHSA-N 401.555 2.014 10 20 HECD O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccc2cncc(Br)c2n1 1160559769 OGYDFVIMMRLQBJ-UHFFFAOYSA-N 401.249 2.388 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@](C)(CO)C3)CC2)cc1 1335448957 LNBBJXBVNDQBIJ-JOCHJYFZSA-N 404.555 2.011 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2CN2CCCC2=O)c1 1337056757 BAAQBSBGRSNQLY-UHFFFAOYSA-N 403.460 2.138 10 20 HECD O=C(CCC1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1786321368 KFTUNNGZDRFEMV-SZMVWBNQSA-N 417.506 2.057 10 20 HECD Cc1cc[nH]c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794705201 RYPBXONQPOAORF-NCSLWMNCSA-N 411.458 2.405 10 20 HECD O=C(CC[C@@H]1CCOC1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550895 VRLBFEQRQFOVIK-MRXNPFEDSA-N 417.506 2.154 10 20 HECD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1841733496 NMBBILONZFVYBA-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)Cn3ccnn3)C2)cc1 1843102578 GGWDWCCWMZFFHM-UHFFFAOYSA-N 418.501 2.203 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(F)cc2)C1 1844931342 WUBVNMUHBLQJSD-UHFFFAOYSA-N 420.444 2.436 10 20 HECD Cc1cc(C(=O)N2CCO[C@H](C(N)=O)C2)c(C)n1-c1cccc(Br)c1 50844738 JZDIYNBCPKFFDD-INIZCTEOSA-N 406.280 2.183 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCCN(S(C)(=O)=O)C3)ccc21 486750380 FVQJABIKLQPCKZ-KRWDZBQOSA-N 407.536 2.058 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(C)cc2)c1 728943687 BICYTFYWEAFOSF-CQSZACIVSA-N 407.492 2.048 10 20 HECD NC(=O)[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN1c1ccccc1 731858212 INAGFSJYEPLTBT-QUCCMNQESA-N 422.485 2.020 10 20 HECD COCCOC1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 735070563 FNABGBZVFFNWJW-UHFFFAOYSA-N 406.523 2.054 10 20 HECD C[S@@](=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 735574964 SFSVJLYHCPXCTG-GUNSETOZSA-N 414.531 2.447 10 20 HECD COc1ccc(Br)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 737278058 CYNXIFZHSKLNCA-UHFFFAOYSA-N 409.236 2.427 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(N4CCCCC4)n3)cc2)C1 739528472 YYGBCQKLIWOWLA-SFHVURJKSA-N 422.533 2.099 10 20 HECD C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 745779596 PAIIAISZLPPZIC-NQIIRXRSSA-N 404.555 2.336 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 745826787 DKGARGLYDORHDV-OAQYLSRUSA-N 417.598 2.079 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 746805294 PICWHNALTKQVMX-RLFYNMQTSA-N 421.538 2.415 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-n4cccc4)nc3)CC2)cc1 753295769 ZJFOGYZYTLPZGT-UHFFFAOYSA-N 405.502 2.433 10 20 HECD CCOC(=O)N1CCC(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753935804 XOSYGOVXJZHLQG-UHFFFAOYSA-N 408.474 2.287 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1 757879459 KTAAUSGMUVNNRH-IHRRRGAJSA-N 403.479 2.325 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2cc3ccccc3s2)c1 758320262 ZQRAUGARTWJIQC-HNNXBMFYSA-N 406.485 2.442 10 20 HECD COc1cc(Cl)cc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)c1O 761203437 RSSIOVQSJITOBM-UHFFFAOYSA-N 419.913 2.003 10 20 HECD COC(=O)N[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 761533762 HIJULXKRIHRWBI-ZDUSSCGKSA-N 416.430 2.351 10 20 HECD CC(C)(C)OC(=O)NCC(=O)NCC(=O)N(Cc1ccco1)Cc1ccccc1O 767070112 SKHPYCWDMJEQLP-UHFFFAOYSA-N 417.462 2.155 10 20 HECD COCCC(=O)N1CCC(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 769163564 CHBSETFYOKAJEZ-LJQANCHMSA-N 419.522 2.110 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 769540204 GSOKWAUJLNUFDA-BBWFWOEESA-N 420.531 2.314 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 770258677 WJKUQPLEXKVNAC-UHFFFAOYSA-N 419.528 2.343 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)c1 771635036 CVLHODFBCSQIPW-UHFFFAOYSA-N 416.547 2.379 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2ccc(CC(=O)N3CCN(C)CC3)cc2)c1O 774928538 UYNGIFKRWBJXKG-UHFFFAOYSA-N 414.462 2.238 10 20 HECD COc1ccc(O)c(CNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)c1 778915268 RFPJUXPDCAPDBT-UHFFFAOYSA-N 408.401 2.276 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1OC 778926908 HBQJMYHYNRCEDO-UHFFFAOYSA-N 408.476 2.067 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncn(C)n1 780306259 KHTCZFBNSUBMDQ-GFCCVEGCSA-N 412.416 2.231 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@](OC)(C(F)(F)F)C3)CC2)cc1 781986620 WBGUBYROYUVJSV-IBGZPJMESA-N 415.456 2.387 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1N1CCNC1=O 787479548 GAUJXRLLIHTOFK-UHFFFAOYSA-N 421.501 2.162 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2c(F)cc(F)cc2C1 788330836 FLMDJNHTWCHCIW-UHFFFAOYSA-N 415.440 2.003 10 20 HECD CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864157 MMTMCUNBTCMRHR-QRVBRYPASA-N 417.575 2.176 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)OC)ccc1C(=O)OC 790410748 CDQOOKXWAIQTQR-UHFFFAOYSA-N 409.416 2.165 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccn(-c2ccccc2)n1 793667456 WCFQSOGRCKFSFA-UHFFFAOYSA-N 401.470 2.181 10 20 HECD CC(C)(C)c1cnc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)o1 801608326 RAAHWUSJDLKHMT-UHFFFAOYSA-N 419.547 2.456 10 20 HECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803305893 NYGTXGIKZIKAQG-KBPBESRZSA-N 400.479 2.183 10 20 HECD O=C(NC[C@@H]1CCSC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450052 CAHHQRVLJYKSJU-ZDUSSCGKSA-N 413.490 2.242 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCC3CCN(c4ccncc4)CC3)ccc21 803686939 KDJHSSUDJHJWOG-UHFFFAOYSA-N 421.545 2.113 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 807754673 PWUKKFBXKSWRQY-MRXNPFEDSA-N 415.925 2.155 10 20 HECD CN(CC(=O)NCc1cc(Cl)cc(Cl)c1O)S(=O)(=O)c1cccnc1 807837824 CWNFMIRVFMRENR-UHFFFAOYSA-N 404.275 2.031 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(F)c[nH]3)cc2F)C[C@H](C)O1 815392748 VXJQXGIBKWNBIC-STQMWFEESA-N 407.417 2.380 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C(=O)C2CCCCC2)CC1 921242976 LLCFBJJJJDIWPA-UHFFFAOYSA-N 414.550 2.457 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc2ncccc12 1796604133 KEMVMUVUGNJQOR-QDMKHBRRSA-N 419.441 2.002 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CNC(N)=O)C3)cc1 1800515654 SMPXTGFRZDOEBG-FNLKRUPLSA-N 423.517 2.014 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccccc3O)C2)CC1 1807862861 UQLUMGXXMANNCP-UHFFFAOYSA-N 411.458 2.357 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1cc(O)nc(O)c1 1817847712 UFUOQVMHVHZQMI-MRXNPFEDSA-N 422.445 2.160 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(C)c(OC)c3)CC2)cc1 26249867 UBCYYAABPARRNW-UHFFFAOYSA-N 412.486 2.447 10 20 HECD COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 727468453 KPNQXNPQNISGQI-QGZVFWFLSA-N 420.481 2.209 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1O 727761272 RQMPHDATGZXFSW-ZSEKCTLFSA-N 403.479 2.154 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 727903009 CYGSGHRJUBFEEY-INMHGKMJSA-N 408.470 2.025 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](OC)C(F)(F)F)cc2F)CC1 733356490 TZPGFNCKZHXJQG-MRXNPFEDSA-N 406.424 2.344 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1 734016288 OOJMCQVOVRLQFJ-HNNXBMFYSA-N 404.488 2.118 10 20 HECD Cc1ccc(S(N)(=O)=O)cc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735515925 DRQOSNGYKRLUCF-MRXNPFEDSA-N 404.488 2.169 10 20 HECD CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741278640 FQCYEKZFIMAYEH-KANFNMMFSA-N 400.523 2.001 10 20 HECD O=C(CC1(O)CCCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746155298 HISRBFCMBKTBNX-UHFFFAOYSA-N 413.497 2.254 10 20 HECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCN1CCCS1(=O)=O 746513998 QZRXJFRDBQKFFT-UHFFFAOYSA-N 409.552 2.499 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C[C@H](C)O)C3CCCCC3)CC2)cc1 754027402 JLPIVKZTCCSWCG-UGKGYDQZSA-N 405.583 2.194 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3c3cn(C)nc3C)CC2)cc1 754058477 AWTJLASFVZVZKJ-REWPJTCUSA-N 413.566 2.057 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(O)n1 755190875 CIWNKRMUIPRMBO-OKILXGFUSA-N 416.453 2.103 10 20 HECD C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)ccc1O 756707314 UZKYGXBJPDVLCF-GXTWGEPZSA-N 421.357 2.294 10 20 HECD COC(=O)Nc1cccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758234180 ZGSIYTPVIXPHJS-IBGZPJMESA-N 415.490 2.435 10 20 HECD COc1cc(N2CCN(C(=O)c3ncn(-c4ccccc4)n3)CC2)cc(OC)c1OC 759199266 LEDOASOJWDMQSC-UHFFFAOYSA-N 423.473 2.256 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-c2cc[nH]n2)s1 761594152 OMTJAWNZQHHGHI-UHFFFAOYSA-N 416.528 2.303 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nonc23)c(C)c1S(=O)(=O)NC1CC1 765089149 GWHCTMHSVGCKPB-UHFFFAOYSA-N 422.488 2.081 10 20 HECD O=C(NCc1cccc(Br)c1O)c1ccc(CN2C(=O)CNC2=O)cc1 765754172 RYOWSBAUQRPSDT-UHFFFAOYSA-N 418.247 2.137 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-c2nnc(N(C)C)o2)cc1 768025915 RVHZZHBWTTVOSY-UHFFFAOYSA-N 422.489 2.466 10 20 HECD CCN(CC)C(=O)CN1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768252067 VJMONRZTZBGNCL-UHFFFAOYSA-N 406.546 2.038 10 20 HECD CC[C@@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780142215 LRBQCGBOZXCUQU-IAGOWNOFSA-N 408.470 2.027 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C[C@]4(CCc5ccccc54)C3=O)CC2)cc1 781137961 LOAIIWYUVFLKJX-DEOSSOPVSA-N 405.498 2.418 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785303228 HULRRTQOWBUKQS-CQSZACIVSA-N 424.457 2.037 10 20 HECD C[C@H](OC(=O)c1ccn(C)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785688379 NDXPDYDCPXUMAR-LBPRGKRZSA-N 403.394 2.380 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4cccn4)cc3)cc2)CC1 786261902 HAFOIVUAYGNQPI-UHFFFAOYSA-N 403.486 2.471 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1c(F)cccc1F)c1ccc(N2CCOCC2)cc1 787916645 XUXSOYPEFBGBHV-HNNXBMFYSA-N 417.456 2.338 10 20 HECD CCOC1CC(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 788747634 VPUBFAIGIMVYIB-FDYSRKEFSA-N 402.539 2.393 10 20 HECD C[C@@H](c1cccnc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843011 HAQAUMGMJCXUJC-HNNXBMFYSA-N 414.481 2.018 10 20 HECD Cc1cc(-c2nnc(N3CCN(CC(=O)N(C)C)CC3)n2C)c(C)n1-c1ccccc1 800725085 PNMFUMSXPKGWAE-UHFFFAOYSA-N 421.549 2.100 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298466 UHVMFUDGVHVCMS-QUCCMNQESA-N 416.566 2.081 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)O2 803686520 BYYFOMSBSGOHRG-VCDSYBKSSA-N 415.534 2.123 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3nccn3C(F)F)cc2)CC1 803797328 ZKYWOHDYEZPVDJ-UHFFFAOYSA-N 405.449 2.447 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCC3CCC(OC)CC3)CC2)cc1 806540864 JTLHVFMGQROATR-UHFFFAOYSA-N 417.550 2.445 10 20 HECD COC[C@@H](C)n1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)n1 807513374 ZQNGVBPJAUEZHZ-SECBINFHSA-N 401.250 2.358 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN([C@H](C)c2cccnc2)CC1)c1ccc(N(C)C)cc1 807673006 LLDKOGGKKGDCMO-QZTJIDSGSA-N 409.534 2.230 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1nccs1 808816482 NVQYANUNPOROGC-GDBMZVCRSA-N 403.504 2.276 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1)[C@@H]1C[C@@H]1C 815550075 BXLLTSMGWSSUTJ-SCLBCKFNSA-N 411.458 2.157 10 20 HECD CC(C)n1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)nn1 816704913 LRRCIAGLANUXPM-UHFFFAOYSA-N 421.504 2.357 10 20 HECD CS(=O)(=O)NC1(CNC(=O)NCc2ccc(N3CCCC3)cc2)CCCCC1 915708896 CEFKFBZTEZGMEG-UHFFFAOYSA-N 408.568 2.338 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 917864212 NBMLBUHOVCGXTJ-UHFFFAOYSA-N 410.517 2.192 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769087 LBCIELWLNYVZEJ-ROBVNOKSSA-N 408.882 2.001 10 20 HECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)nc1 1804285681 NWEOOZICEXHZRL-YKMDKHMNSA-N 423.469 2.472 10 20 HECD O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1813804794 MEUYPYGJFNNFAW-AWEZNQCLSA-N 424.482 2.418 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826841850 NVKFYANBGQYFRL-GZRFBZBPSA-N 418.538 2.100 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccn1 1846668497 PZSMQDWPJSGFBI-LOWQCSRCSA-N 423.469 2.219 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCC(C(=O)Nc4nncs4)CC3)ccc21 303006230 PNDUFMVSZRMZLE-UHFFFAOYSA-N 414.535 2.481 10 20 HECD CC(C)(C)NS(=O)(=O)CCNC(=O)N(Cc1ccco1)Cc1ccccc1O 726097535 IQYZAQQEHGLODR-UHFFFAOYSA-N 409.508 2.415 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1 729063675 KLGBCISBJIBCEK-CQSZACIVSA-N 401.463 2.157 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc(OC)c1OC 734702688 BWTGVSIDZJQNEU-UHFFFAOYSA-N 401.463 2.342 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(C)c(F)cc3C(N)=O)CC2)cc1 736612125 WXAGNVVIZQCGJA-UHFFFAOYSA-N 400.454 2.002 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3sc(C)nc3C)CC2)cc1 743044346 XFCQUKDBSQPFAZ-UHFFFAOYSA-N 423.560 2.032 10 20 HECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 745795716 JOTGNSZOIPGNNR-IBGZPJMESA-N 402.539 2.013 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCc2ccccc21 746878241 SZDQEMTWBAHTHU-XLIONFOSSA-N 406.530 2.456 10 20 HECD Cc1cncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 751010020 BPKULRQBBKKQQA-GASCZTMLSA-N 400.454 2.398 10 20 HECD CC(C)Nc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 752794655 VOQHNAJMYXKNHP-UHFFFAOYSA-N 402.520 2.067 10 20 HECD COc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5ccccc5n34)CC2)cc1F 753857587 NGYDCVYHJOGVQC-UHFFFAOYSA-N 422.464 2.051 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(C4CC4)n(C)n3)CC2)cc(OC)c1OC 759240892 CVFYKBZMJRXTOU-UHFFFAOYSA-N 400.479 2.286 10 20 HECD C[C@@H](NC(=O)N1CCN(c2ncc(F)cn2)CC1)c1ccc(N2CCOCC2)cc1 759246447 KGISFKVXORISHL-MRXNPFEDSA-N 414.485 2.045 10 20 HECD CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@H]1CCNC1=O 760116778 NKIVQOVQWHPFDP-IXJPEXDMSA-N 409.558 2.076 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccc(Br)s1 763282543 YMTXJMPQPMKPMO-VIFPVBQESA-N 413.293 2.399 10 20 HECD COc1cccc(CN2CCN(c3ncc(Br)c(OC)n3)CC2)c1O 769330808 ALYNPDFTXUCBLR-UHFFFAOYSA-N 409.284 2.284 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)nn1 773621370 XWUBLZSVQLIXRG-RHSMWYFYSA-N 400.483 2.238 10 20 HECD COc1cc(O)c(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)cc1OC 775645285 IULPDBXJKXDOST-UHFFFAOYSA-N 410.474 2.376 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 776040496 DLCSUEDVMFXGTQ-FXAWDEMLSA-N 409.552 2.068 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nn1[C@@H](C)C1CC1 784688686 XDDSOAILISRNCE-INIZCTEOSA-N 411.506 2.254 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(C)(C)S(=O)(=O)C3CC3)cc2F)C[C@H](C)O1 785885257 AUXYLNPDKMLMPP-KBPBESRZSA-N 412.527 2.411 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N(C)c3ccccc3)CC2)cc1 787640811 QRTGDOAJORSLLL-SFHVURJKSA-N 424.545 2.421 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nnn1CC1CCCC1 788743608 VVRWPLRYZOZRIS-LJQANCHMSA-N 424.549 2.408 10 20 HECD Cn1ncc2c1CCC[C@H]2NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 789592514 WANYCKLZPZDEOZ-GOSISDBHSA-N 408.458 2.441 10 20 HECD Cc1cccc2c1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 789813268 RJUSGZJHKGUSMJ-UHFFFAOYSA-N 411.477 2.172 10 20 HECD C[C@@H](NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(N2CCOCC2)c(F)c1 790755558 AOCNRFLAIRWBEG-MRXNPFEDSA-N 422.522 2.279 10 20 HECD Cc1cc(C(=O)NC[C@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccccc1Br 793901532 ISRMJYNVOBNOOA-GFCCVEGCSA-N 419.279 2.217 10 20 HECD Cc1cc2c(cc1S(=O)(=O)N(C)Cc1ccc(N3CCOCC3)cc1)OCO2 795067906 NEPHXSKQCPDXSX-UHFFFAOYSA-N 404.488 2.381 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccc(Cl)cc2-n2cncn2)c1 795466799 QVVWYCPZFWWNHB-UHFFFAOYSA-N 422.850 2.355 10 20 HECD COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797390869 XHQLHNQAQQNFGC-UHFFFAOYSA-N 416.430 2.230 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1c1ccncc1)c1ccc(N2CCOCC2)cc1 803300628 VBGZRNATNQPNGX-UWJYYQICSA-N 408.502 2.459 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCc3c(cnn3-c3ccccc3)C2)cc1F 803663334 WUPYLSMRJZTLDN-UHFFFAOYSA-N 421.476 2.279 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 807291726 MKCHHOKFVQNOSL-OAQYLSRUSA-N 409.461 2.418 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292058 UFXOPEDCSPOLQN-SFHVURJKSA-N 413.518 2.117 10 20 HECD C[C@H](NC(=O)C(=O)NCC1(N(C)C)Cc2ccccc2C1)c1ccc(N(C)C)cc1 807298009 QHXCYIGBUAVJHL-KRWDZBQOSA-N 408.546 2.145 10 20 HECD O=C(NC[C@@H]1CCCCN1C1CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809821881 ACMNRUQXGXVPJH-PMACEKPBSA-N 415.534 2.033 10 20 HECD COC(=O)N1CCN(c2ccc(NCc3ccc(N4CCN(C)CC4)cc3)cn2)CC1 815157837 XCVOUVOISIXMGF-UHFFFAOYSA-N 424.549 2.334 10 20 HECD Cc1cc(C(=O)NCCNS(C)(=O)=O)c(C)n1-c1cccc(Br)c1 918011816 ICEKJZYYCNUUAI-UHFFFAOYSA-N 414.325 2.136 10 20 HECD COC(=O)[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1ccc(OC)c(O)c1 1326281049 WISDWCHUYYTYLF-NRFANRHFSA-N 417.481 2.296 10 20 HECD CCCN1CCCC[C@@H]1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 1339413443 HADPUIWUFSIFKR-HXUWFJFHSA-N 403.523 2.152 10 20 HECD CCOc1ccc(N2CCN(C[C@H](O)Cn3c(-c4ccccc4)noc3=O)CC2)cc1 1341377352 RMZPNVPGCYEMAB-FQEVSTJZSA-N 424.501 2.085 10 20 HECD COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1C 1803478839 SOMJAVSPIYJWLN-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C1CCC(=O)N1Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 28255018 DQXOKYLGOVSXHQ-UHFFFAOYSA-N 402.457 2.141 10 20 HECD COc1c(F)cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1[N+](=O)[O-] 488259493 ZZRMXUQDXBZDIN-UHFFFAOYSA-N 411.411 2.396 10 20 HECD O=C(COc1ccccc1CNCc1cc2c(cc1O)OCO2)NC[C@H]1CCCO1 725848600 YMXBCIOZPSFAIZ-QGZVFWFLSA-N 414.458 2.085 10 20 HECD Cn1cc(-c2cncc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2)cn1 731168679 UVBFPLNVCLQUQT-QGZVFWFLSA-N 418.501 2.114 10 20 HECD COCCOc1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 732064554 SPVDGRVNBSTGBO-UHFFFAOYSA-N 413.518 2.272 10 20 HECD Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 737146940 UEGOFDWJRCRDNJ-UHFFFAOYSA-N 413.522 2.100 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)[C@H](C)c3ccc(C)cc3)nc12 745755541 ZTFHRDWDUORIRJ-ACJLOTCBSA-N 413.430 2.128 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1 752723418 CZUSFNJRWKRKHU-UHFFFAOYSA-N 400.454 2.157 10 20 HECD CCOC(=O)[C@H]1CCCCN1C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 756337338 UDSJHJIDMJKSCI-RTBURBONSA-N 404.507 2.317 10 20 HECD CN(C(=O)/C=C/c1ccc(Cl)nc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 759752635 LAGGVZLTNJEGAX-CSKARUKUSA-N 411.849 2.304 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCC[C@H]3CCCCO3)CC2)cc1 761009236 AYZMOQRUXABMKX-AXUYNXDZSA-N 415.534 2.366 10 20 HECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 767391212 YAAHSADNCMUFQO-UHFFFAOYSA-N 424.544 2.481 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(-c3cccnc3)c2)SC1=S 768478974 DOWYZDKLAXTWSU-WJDWOHSUSA-N 419.553 2.499 10 20 HECD COC(=O)[C@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 769878366 CYBODPIDNPVOHA-GOSISDBHSA-N 424.500 2.326 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N(C)C)nc3)cc2)CC1 770241259 BPRFTZSUTHPRHM-UHFFFAOYSA-N 416.547 2.498 10 20 HECD C[C@H](c1ccccc1)[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 771423259 RKDUOMPNSXODSG-ZNLUXHQJSA-N 424.545 2.352 10 20 HECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 772903746 BAGKOWCCEYUVER-UHFFFAOYSA-N 419.428 2.316 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2nnc(C(F)(F)F)s2)CC1 777398415 DSTMKIBHUQVWKH-DUXPYHPUSA-N 400.382 2.330 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](OCC4CC4)C3)CC2)cc1 778174371 RWHIFGXHMAUKBO-GGAORHGYSA-N 403.567 2.069 10 20 HECD COc1ccccc1CC(=O)N1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 779481372 NFFLVKGIZTYWGY-VQHVLOKHSA-N 410.470 2.470 10 20 HECD COc1cc(O)c(CNC[C@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc1OC 786002921 OYGOSMGIGYTQNE-AWEZNQCLSA-N 402.495 2.096 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(c4cccc(F)c4)=NO3)cc2)CC1 786657409 XKEIERSKRZMRNS-QFIPXVFZSA-N 424.476 2.304 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(O)c1 794369937 KJVZDBUIFLFXLF-GOSISDBHSA-N 404.488 2.260 10 20 HECD COc1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c(O)c1 794388859 BBBSEDJRMNCYDK-MRXNPFEDSA-N 410.426 2.106 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794830548 KIXCHHGRKQJUSH-JLTOFOAXSA-N 401.511 2.272 10 20 HECD CC[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686987 SKXGTRFNVGBCSM-NRFANRHFSA-N 409.530 2.485 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C 804262831 BAYZUVPAXCMGMZ-SFHVURJKSA-N 418.538 2.227 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)N3CCC[C@H](C)C3)CC2)cc1 804318273 GCFHGMYNSBBOGI-ROUUACIJSA-N 416.566 2.017 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 804366653 UOHTXCAXJRMDGQ-CQSZACIVSA-N 413.434 2.090 10 20 HECD CC(=O)OCCCS(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805018481 LTWBSMARYUTCAW-CQSZACIVSA-N 406.451 2.129 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCC[C@H](C(=O)N(C)C)C1 806177638 FAMSDPQUTFSYRI-OALUTQOASA-N 416.566 2.253 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCO1 808085156 IKLHBQWZZAVFGA-GGPKGHCWSA-N 404.507 2.220 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCO1 808085158 IKLHBQWZZAVFGA-NSHGMRRFSA-N 404.507 2.220 10 20 HECD Cc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918462980 FNRZUJHGHCTFAW-SFHVURJKSA-N 408.502 2.260 10 20 HECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1 1323829680 LLCQWYMNAHBARS-YOEHRIQHSA-N 404.536 2.425 10 20 HECD Cc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826030995 UMNHYFKVUPXJQW-QGZVFWFLSA-N 414.462 2.336 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(c3cccc(F)c3)CC1)C2 1843248873 CPIXDDZFDCQXHX-UHFFFAOYSA-N 411.433 2.181 10 20 HECD CCc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nn1C 1845501573 COVXRFBHSZUWME-UHFFFAOYSA-N 418.881 2.178 10 20 HECD C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 96955810 HQDXTYJFUQXMCH-INIZCTEOSA-N 418.563 2.051 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCO)CC(C)(C)C)cc2F)C[C@H](C)O1 730378676 SYUUZOZIMVIRKK-IRXDYDNUSA-N 409.546 2.396 10 20 HECD Cc1cc(C(=O)CN(C)C[C@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730809045 WTTWQSMKTKTJIF-QGZVFWFLSA-N 419.547 2.283 10 20 HECD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NCCCSc1nccs1 733973724 VAHBBRXNUBTPIP-UHFFFAOYSA-N 414.512 2.379 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(CC(F)(F)C(F)F)CC1 734066305 RHZDNBXXRBTDIZ-UHFFFAOYSA-N 418.435 2.251 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)cc1 741181016 NXIKWCCLOIYUKH-UHFFFAOYSA-N 418.538 2.228 10 20 HECD COC[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746756826 LCHOPOHXJFUBPA-RTWAWAEBSA-N 424.545 2.445 10 20 HECD COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NCc3ccccc3O)c2)cn1 749035166 VBQYZFOLECVGAB-UHFFFAOYSA-N 420.425 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCOC[C@@H]2C[C@H](O)c2cccs2)cc1 753855857 JIWLZYYDOGNBCG-OALUTQOASA-N 403.548 2.255 10 20 HECD O=S(=O)(Cc1noc2ccccc12)NCc1ccc(N2CCOCC2)c(F)c1 760543117 XOYKJRHXJSBNJQ-UHFFFAOYSA-N 405.451 2.423 10 20 HECD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCc1cccc(Br)c1O 765732779 SJBCKCPFJQZGDJ-UHFFFAOYSA-N 408.208 2.109 10 20 HECD CN(CCCOc1cccc(S(C)(=O)=O)c1)Cc1cc2c(cc1O)OC[C@H]2O 768443901 IRQQSXPNOHPFJX-LJQANCHMSA-N 407.488 2.122 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@]4(C3)OCc3ccccc34)CC2)cc1 770687809 DYAWPULIRWLTFV-RDGATRHJSA-N 423.557 2.310 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C)cc3)cc2F)CC1 774764213 SGUCNRWPHJSEPK-UHFFFAOYSA-N 412.509 2.209 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3CCN(C)CC3)cc2Cl)C1 774853523 JQEMMMIORQLNEW-OAHLLOKOSA-N 406.958 2.403 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@@H]2c2cccc(Br)c2)c(O)c1O 780999495 FCDJRUGHECFLQS-AWEZNQCLSA-N 405.248 2.482 10 20 HECD CNC(=O)[C@@H]1CN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)CCO1 781577422 PRYLZTFUGPGEFG-IBGZPJMESA-N 408.454 2.421 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1 785294876 PEZWBMXNJRKWGN-LLVKDONJSA-N 419.865 2.139 10 20 HECD Cc1ccc(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 788320884 QSUIHZWRADGVSQ-OAHLLOKOSA-N 401.532 2.257 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 788421762 ZKONWACMIXPVAM-OAHLLOKOSA-N 418.538 2.446 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)CN3CCOCC3)cc2F)C[C@@H](C)O1 788882352 BZHPYRXFRVNCPL-KZNAEPCWSA-N 422.545 2.301 10 20 HECD CN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788932342 KYBJNUVCUPJBRM-UHFFFAOYSA-N 419.485 2.210 10 20 HECD CN(CCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)OC(C)(C)C 788932897 RGTVQFQBTLNOBA-UHFFFAOYSA-N 418.538 2.228 10 20 HECD CCCC[C@H](COC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789823017 CEUIHUOLCRQGEW-SOLBZPMBSA-N 423.529 2.377 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(OCc2ncnn2C)cc1 790408684 GOECJUKPPPOZDT-UHFFFAOYSA-N 404.448 2.299 10 20 HECD COc1c(NC(=O)C(=O)N(C)Cc2ccccc2O)cc(Cl)cc1C(=O)N(C)C 792967895 XJKRAJUVXAIZSU-UHFFFAOYSA-N 419.865 2.353 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)Cc2ccon2)NC(=O)OC(C)(C)C)cc1 795249691 VLGOWRNFQMIWMR-KRWDZBQOSA-N 424.523 2.426 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nc(-c4cccs4)no3)nc12 796100625 UFGQNNZXQUMLRX-UHFFFAOYSA-N 414.447 2.355 10 20 HECD CC(C)C[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803297686 CXGRSAVAFANRSM-SLYNCCJLSA-N 417.550 2.410 10 20 HECD COc1cccc([C@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CCO2)c1 803689746 YXODGGUCMZANMM-JOCHJYFZSA-N 423.513 2.294 10 20 HECD CC[C@H]1CCCCCN1C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 803748257 ZQQGKJKQLZQWHG-IBGZPJMESA-N 416.566 2.115 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(N2CCCC2)CCOCC1 804739139 SAALKYGBGPWWMU-UHFFFAOYSA-N 417.550 2.282 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCCc3cccc(C)n3)CC2)cc1 805014158 RWPVKSGXJDHVQY-UHFFFAOYSA-N 411.550 2.453 10 20 HECD CSC[C@@H](C)NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807263053 FQXIDMTXSQJVQU-OLZOCXBDSA-N 401.479 2.241 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCn2c(nnc2-c2ccccc2)C1)c1ccc(N(C)C)cc1 807673733 YBCZXJSREATNSY-MRXNPFEDSA-N 418.501 2.231 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 807754671 PWUKKFBXKSWRQY-INIZCTEOSA-N 415.925 2.155 10 20 HECD COC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@H]1CCCO1 809451992 DKWWMHPWUDADCX-AZUAARDMSA-N 404.507 2.364 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1[C@@H]1CCCO1 812010201 MXZAKRYJYJRGDO-YSIASYRMSA-N 414.550 2.487 10 20 HECD CC(C)(C)OC(=O)N1CCN(CC(=O)NCc2ccc(N3CCCC3)cc2)CC1 917079430 LGJIIUUUWCMOGW-UHFFFAOYSA-N 402.539 2.456 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC3CCN(CC4CC4)CC3)cc2)C1 918014853 BOEMKAUEGNBCLK-IBGZPJMESA-N 413.566 2.062 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cnn(-c4ccccc4)c3)nc12 918940028 VSILOWGWFLVPJP-UHFFFAOYSA-N 421.413 2.083 10 20 HECD Cn1c(=O)n(CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc21 919968863 MKDGCTUJTFJARC-UHFFFAOYSA-N 422.529 2.255 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnn1-c1ccncc1 1319788368 YTGHTRYGVBCMFT-GOSISDBHSA-N 418.501 2.207 10 20 HECD C[C@@H](NC(=O)NC[C@H](CO)CC1CCOCC1)c1ccc(N2CCOCC2)cc1 1343834261 CIBRLFIZPQCTOS-IEBWSBKVSA-N 405.539 2.309 10 20 HECD O=C(c1ccncc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427025 MSHLSAIMORJDGT-SFHVURJKSA-N 410.474 2.435 10 20 HECD CC[C@@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)C(=O)N1CCOCC1 437975541 NMWRMKWLESOOHY-LJQANCHMSA-N 401.507 2.272 10 20 HECD O=C(COc1ccccc1CNCc1cc([N+](=O)[O-])ccc1O)NC[C@@H]1CCCO1 725848182 LAEPKAJDXOGJQQ-SFHVURJKSA-N 415.446 2.264 10 20 HECD NC(=O)CN1C(=O)/C(=C/c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)SC1=S 727177292 ZFYINANCXFQPRM-ZROIWOOFSA-N 406.489 2.272 10 20 HECD CS(=O)(=O)Cc1cccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739768081 KNAZXNIJRWCXFS-UHFFFAOYSA-N 415.515 2.185 10 20 HECD CCN1CCC[C@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)cc1 745746530 PRTDAAMFNYXLGH-QFIPXVFZSA-N 417.598 2.081 10 20 HECD CCCCn1nccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 746437021 RIDDEFFAYALDHG-UHFFFAOYSA-N 403.458 2.118 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccnn1C1CCCC1 746784175 SRBNOLPRAMUBSP-UHFFFAOYSA-N 415.469 2.229 10 20 HECD CN(C)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 748466435 IQLKUAKQXTZMHG-IBGZPJMESA-N 409.534 2.454 10 20 HECD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 748628427 WACMQHMWYZJQPP-CVEARBPZSA-N 408.449 2.319 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)s1 749007901 OBYHBQWCWHPBDJ-UHFFFAOYSA-N 414.490 2.201 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(C(=O)OC)c3)cc2F)CC1 751378667 MIPMOUHLTDTXAY-UHFFFAOYSA-N 400.454 2.079 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCC[C@]12NC(=O)N(C)C2=O 753020406 IOOJTSIMKQFAGJ-KKSFZXQISA-N 401.511 2.005 10 20 HECD COc1ccc(N2CCN(C(=O)CCc3c(C)nc4ncnn4c3C)CC2)cc1F 753737805 KXVUJDXXQBQJFR-UHFFFAOYSA-N 412.469 2.170 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)cc1F 754217416 VPXZJEUSJXJUIK-UHFFFAOYSA-N 416.409 2.338 10 20 HECD Cc1ccc(OC(F)F)c(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 756774510 IXWZOOWHZYZXKU-WQLSENKSSA-N 422.500 2.347 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(C(=O)C4CCCC4)C3)CC2)cc1F 762089525 OTUGYACBMHPCBD-KRWDZBQOSA-N 418.513 2.457 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](O)C(F)(F)F 766251330 NPBVYHBIRYPLFP-GDBMZVCRSA-N 407.408 2.288 10 20 HECD COC[C@@H]1CCCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 768297771 YACRVHPNNUJFBU-LJQANCHMSA-N 404.555 2.275 10 20 HECD NC(=O)CCOc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 771921435 QRYORMZBPGCABD-UHFFFAOYSA-N 403.822 2.269 10 20 HECD Cn1ccnc1Sc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774362906 HEZRCMQWOPBDSM-UHFFFAOYSA-N 412.471 2.280 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc([S@](C)=O)cc3)nc12 775618978 KSJPWUSXEMNZSU-YASQENCXSA-N 402.476 2.200 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 776074388 XUHIZMMQKMLEBS-GHTZIAJQSA-N 423.579 2.411 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1Oc1ccccc1 776273237 YVPFLNCCFKVSJB-BHIYHBOVSA-N 420.487 2.119 10 20 HECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1ccc(N2CCCS2(=O)=O)cc1 776748820 JQBOVJRAPIFNOG-UHFFFAOYSA-N 402.881 2.386 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](C4CCCCC4)C3=O)CC2)cc1 777628310 NUGSRDZPFZOIQO-HXUWFJFHSA-N 400.523 2.318 10 20 HECD C[C@@H]1C(=O)CC[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1(C)C 780404603 IQVZWBASVUTXCS-QAPCUYQASA-N 406.548 2.179 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N(CCNC(C)=O)[C@@H](C)C(=O)O)c2C)cc1 781136520 OIRRWVRKAJHZNN-HNNXBMFYSA-N 401.463 2.154 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(-n2cncn2)cc1 785401900 YYEBPZHZVNEGMO-INIZCTEOSA-N 406.490 2.169 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 788334593 XQBNZANONFHIKP-IFMALSPDSA-N 423.513 2.033 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C(=O)N1c1ccccc1 788911551 PHKXUXANRAJAGP-LAUBAEHRSA-N 420.513 2.213 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@@H](c2ccccc2)C1 789799610 KMTXKIMITRMQBK-LJQANCHMSA-N 411.477 2.295 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc(-n2cccn2)c1 792344930 VUGUSRNKHRGBAN-UHFFFAOYSA-N 411.437 2.341 10 20 HECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 795078305 VSHKDALNSBWDDF-UHFFFAOYSA-N 405.568 2.140 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2COC(=O)N[C@H]2CCOC2)cc1 796623544 LWVHFKMVZONMPM-HKUYNNGSSA-N 404.511 2.332 10 20 HECD CCn1ccnc1[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661924 OPQMCMTXSJWYKF-GOSISDBHSA-N 401.486 2.478 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H]3CCO[C@H](C)C3)CC2)cc1 804315914 VLMGSDKWYGPDDO-IAGOWNOFSA-N 403.523 2.102 10 20 HECD CC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 806847043 HQZHHEKKFMRMID-UHFFFAOYSA-N 413.449 2.462 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(c2ccc(Cl)cn2)CC1 807103877 WLNDDKUJJWMICS-UHFFFAOYSA-N 415.925 2.074 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC12CCCCC2 807678025 FAOSIUHZYXWVEB-QGZVFWFLSA-N 414.550 2.323 10 20 HECD CC(=O)NCC[C@@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 808219693 XJNFBALPENFMIF-IBGZPJMESA-N 417.550 2.165 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)c3nccs3)CC2)cc1 808816657 PVUIVNSSCAAAOE-HNNXBMFYSA-N 402.520 2.110 10 20 HECD CCOC(=O)[C@H](CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)=O 816890935 CPGFPWAESPMJIS-GRDNDAEWSA-N 408.470 2.214 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3Cc4ccccc4O3)cc2)C1 918008016 FDLLKKLIKSGJPF-QUCCMNQESA-N 408.502 2.191 10 20 HECD CN(C)C(=O)CN(C)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 920432136 LDYKCAZQHGBVJW-RAXLEYEMSA-N 411.574 2.276 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)O1 1817845172 DOLVFUPYWOPHOT-BYCMXARLSA-N 415.450 2.089 10 20 HECD O=C(Cc1ccc2ncccc2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847951739 ALHRFNVBNFFJRN-OALUTQOASA-N 418.453 2.099 10 20 HECD CC1CCN(C[C@H]2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)CC1 726193055 HZFSBFSSQAFPBO-MRXNPFEDSA-N 409.552 2.348 10 20 HECD COc1ncccc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726725556 AFCKOCWLFUVXRF-UHFFFAOYSA-N 420.416 2.415 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)o2)cc1 730765977 IDTABOGEXPQEQB-UHFFFAOYSA-N 402.450 2.019 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCOC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 731682814 XRFUKJMCWNUQBQ-JFIYKMOQSA-N 409.502 2.292 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN(C)Cc2ccccc2O)cc1 731843484 JYGPVYQFYGALRX-UHFFFAOYSA-N 405.520 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCSCC3)cc2F)C[C@@H](C)O1 732887502 JLVVHCMHBCVOBB-IYBDPMFKSA-N 410.559 2.287 10 20 HECD CN1N=C(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1=O 742748956 BMRRAJLHWPOSCJ-KRWDZBQOSA-N 417.510 2.043 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)C2CC2)cc1 743895300 FLNHDQKIVCWAKB-UHFFFAOYSA-N 422.485 2.238 10 20 HECD CN1CCCc2cc(CNC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)ccc21 746814315 MSPDJBSVIBQASR-UHFFFAOYSA-N 403.504 2.377 10 20 HECD CCc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 747463760 RKPLFQMREVZAFU-KBPBESRZSA-N 415.469 2.047 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c1O 750817130 JHVGFYQCAXPKQY-UHFFFAOYSA-N 416.478 2.121 10 20 HECD CC(=O)OC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 753185455 UUEVDWPZBGSBPS-HOTGVXAUSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 758202240 HGMHLSAGSKPSRH-BGWNEDDSSA-N 418.626 2.278 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C[C@@H](O)c3ccco3)nc12 758828366 RWXLODKJIVSUFA-GOEBONIOSA-N 400.435 2.293 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(N(C)C)ccn3)CC2)cc(OC)c1OC 760455095 RCUQTUJVBJUNGM-UHFFFAOYSA-N 400.479 2.136 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)cc2)C1 761116340 AENWGFJBXPKDCV-KOSHJBKYSA-N 418.497 2.282 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(=O)n(-c2ccccc2F)n1 765552961 HNWYQFGMKISNPU-UHFFFAOYSA-N 422.460 2.480 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCc4n[nH]cc4C3)cc2F)CC1 765850627 YGKXZXUVPCIQEJ-KRWDZBQOSA-N 400.502 2.047 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 766356300 KXUMZFFNJKULRT-UHFFFAOYSA-N 422.444 2.315 10 20 HECD NC(=O)c1ccc(N2CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)CC2)nc1 768381462 BMFMZDQCAAWXPM-UHFFFAOYSA-N 424.505 2.401 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ncn(-c4ccccc4)n3)cc2F)CC1 768390768 IWOOVOSNHHWHLI-UHFFFAOYSA-N 408.481 2.478 10 20 HECD CCOC(=O)c1ccc(N2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)nc1 768449696 YNHOHMHTMPBCGA-IBGZPJMESA-N 413.474 2.102 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CCCn3ccnc3)CC2)cc1 769018232 XGGWLNVSZCFPHK-UHFFFAOYSA-N 414.554 2.136 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)N1CCCN(c2ccc(OC)cc2)CC1 772109024 VPKNDZXWSPFDCJ-UHFFFAOYSA-N 401.511 2.422 10 20 HECD CCCc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n(C)n1 772208524 GYWCRKQCWOLONK-KRWDZBQOSA-N 400.479 2.225 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 774176077 AUXHAZQMECHIIW-LAUBAEHRSA-N 417.550 2.070 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3cccs3)cc2F)C[C@H](C)O1 775098783 FZSPQKFWHJMODE-GJZGRUSLSA-N 419.522 2.476 10 20 HECD C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(S(N)(=O)=O)CC1 777822260 FFYSSSKPJXCGDC-INIZCTEOSA-N 417.531 2.398 10 20 HECD Cc1nn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 779645975 RFWLPSXKVAFRSX-BETUJISGSA-N 405.430 2.169 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)CCc3ccc([N+](=O)[O-])cc3)CC2)cc1F 779905926 AWWARHGUYCNMJQ-UHFFFAOYSA-N 423.466 2.437 10 20 HECD CCc1ccc(CN2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)s1 785439819 WHXULPFEHSOROY-UHFFFAOYSA-N 414.575 2.337 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCCCSc1nccs1)c1ccc(F)cc1 787641503 SPLFKMSBLDXTDK-OAHLLOKOSA-N 410.540 2.300 10 20 HECD COCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 793818156 UPFRPGGAIREGSY-UHFFFAOYSA-N 417.550 2.281 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H]3CC(C)(C)OC3=O)cc2F)C[C@@H](C)O1 795649788 FJKSEVGYMXGDSP-SPYBWZPUSA-N 421.513 2.081 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797390285 CHJDQDDCZQCNIS-UHFFFAOYSA-N 408.838 2.334 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNCCNS(=O)(=O)c2ccc(Cl)cc2F)c1 799344985 NKXHHGQOTIMJCG-UHFFFAOYSA-N 403.819 2.161 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C 803089760 IJUDMVOBYLWDIA-FZKQIMNGSA-N 418.494 2.487 10 20 HECD C[C@@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccccc1 803688615 WULJYJRDXUMFCK-UTKZUKDTSA-N 409.530 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCc3cccc(C)n3)CC2)cc1 804143875 BAKFUROBAHVMLH-OUKQBFOZSA-N 422.529 2.352 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)Cc2c(C)nn(C)c2C)cc1F 804852735 FGKAVPNWQAGWCT-CQSZACIVSA-N 417.529 2.386 10 20 HECD Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807672914 KFKLUXPBWHCQKV-LAUBAEHRSA-N 422.529 2.156 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCN1C(=O)OC(C)(C)C 807675052 UBMRFGFSTYAKDB-JKSUJKDBSA-N 418.538 2.398 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN([C@H](C)c2nccs2)CC1)c1ccc(N(C)C)cc1 807675665 ZNSIISGAATZEJN-HZPDHXFCSA-N 415.563 2.292 10 20 HECD C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807954031 GSJUUQDIBWVJCI-MWSMCUOVSA-N 413.971 2.076 10 20 HECD COc1ccc(N2CCN(CCCNc3ncc(C(N)=O)cc3Cl)CC2)cc1 917388090 QDSKHKWBHFREKE-UHFFFAOYSA-N 403.914 2.467 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc2N1 918295685 SJIANIDGIFESPC-SFHVURJKSA-N 423.469 2.423 10 20 HECD Cc1cc(S(N)(=O)=O)cc(NCc2ccc(N3CCN(C)CC3)c(F)c2)c1C 1119340005 PTLUTJFAZQRKQP-UHFFFAOYSA-N 406.527 2.454 10 20 HECD CC(C)=CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777852780 UKBXRNNIGRHGEX-VGOFRKELSA-N 417.506 2.367 10 20 HECD CC1(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1802424364 WLNCHTDKBDWZML-BEFAXECRSA-N 410.474 2.398 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(F)(F)C1)CC2)c1cc(O)nc(O)c1 1816720320 KTJUKHIDHSVLPZ-JTQLQIEISA-N 424.429 2.220 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)O[C@@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1 7176667 AJJKYXPTXNNIRG-QFBILLFUSA-N 418.515 2.285 10 20 HECD Cc1nc2ncnn2c(C)c1CCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 145545309 NJCOHIUJQFAIJZ-OAHLLOKOSA-N 408.506 2.388 10 20 HECD O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 726293735 LADLILSRZSTOLP-UHFFFAOYSA-N 424.501 2.462 10 20 HECD NC(=O)c1ccc(NC(=S)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 726470792 YUVZFMCKHKGFBY-UHFFFAOYSA-N 402.495 2.372 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)C1CCCC1 727105264 YFRRIOQFXDWGTD-APWZRJJASA-N 414.550 2.090 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 731852889 OADCMPHAJMFLCN-UHFFFAOYSA-N 418.515 2.272 10 20 HECD CCS(=O)(=O)C[C@@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 733648224 SLZMZKXBSQXKQT-KFWWJZLASA-N 415.531 2.062 10 20 HECD O=C(NCc1cccc(-n2cncn2)c1)NCc1ccc(N2CCOCC2)c(F)c1 735509656 FHFJYAAKSVOFLU-UHFFFAOYSA-N 410.453 2.242 10 20 HECD COc1ccc(N(CC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)CC(C)C)cc1 744394284 GHGIMIDLTDNKCU-UHFFFAOYSA-N 416.522 2.139 10 20 HECD COC[C@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 746741426 MWBALXNSQNGTRS-FQEVSTJZSA-N 416.522 2.487 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)c1O 748050513 FJCLDRBLUUKPHK-HZPDHXFCSA-N 405.514 2.356 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)NCCNS(=O)(=O)Cc2ccon2)c1C 750076048 LITOCNRGPGBHJL-UHFFFAOYSA-N 416.503 2.240 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3c(F)cc(F)cc3F)c2)CC1 751212675 IJNCWPOVCCRBGF-UHFFFAOYSA-N 420.434 2.140 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c1 751316741 AHGSQEIGYFDDNA-ZDUSSCGKSA-N 418.475 2.148 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1C(=O)N(C)C 751818921 XBZGZWOJGBGZFW-UHFFFAOYSA-N 406.533 2.390 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@]3(C)CCO[C@H]3C3CC3)CC2)cc1 753092335 BJAABBVUWDDHJQ-GMAHTHKFSA-N 416.566 2.464 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@@H](CO)C3CC3)nc12 755045414 QRGPEBKKDVMJNE-IBGZPJMESA-N 410.474 2.385 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCS(=O)(=O)c2ccc(OC)c(OC)c2)c1 761971717 AWOLXGMUYIVHEJ-ZDUSSCGKSA-N 423.487 2.459 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](CO)OC[C@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 766944075 GLARCXDETIYCME-QAPCUYQASA-N 400.475 2.130 10 20 HECD CCOC(=O)[C@H]1CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767032962 RYILBPBTYPWJOX-LJQANCHMSA-N 406.438 2.428 10 20 HECD CCc1nn(C)c(Cl)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 767300342 WJBRYVHXXRVEPB-AWEZNQCLSA-N 403.914 2.268 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](CCO)c3ccco3)cc2F)CC1 769506710 GNVASIFXJIBWDH-GOSISDBHSA-N 404.486 2.484 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@]4(CCOC4)C3)cc2F)CC1 771435755 XYWWWMIUGOUWPA-XMSQKQJNSA-N 420.529 2.105 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(OCc2ncnn2C)cc1)c1ccc(N(C)C)cc1 773087183 GUECMMRVSBVFAR-HNNXBMFYSA-N 415.519 2.500 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1)c1ccc(N(C)C)cc1 773087241 HSCUMMRHQTYPNF-GFCCVEGCSA-N 400.497 2.335 10 20 HECD CC1(C)CC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC(C)(C)N1 774494718 NGYONRQPZCUQTK-SFHVURJKSA-N 417.550 2.325 10 20 HECD CS[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H]1N(C)C 776003443 XGHALLFIOUIJGS-MOPGFXCFSA-N 423.538 2.378 10 20 HECD COc1cc(N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c([N+](=O)[O-])cc1OC 781673639 ACXGWCFPCSAZGF-AWEZNQCLSA-N 413.496 2.443 10 20 HECD Cc1cnc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 782117040 GCIOTACKVIMFNJ-UHFFFAOYSA-N 413.547 2.238 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1c(C)ccn(C)c1=O 785193227 UMZXTILCCABZHR-UHFFFAOYSA-N 422.279 2.149 10 20 HECD COCCCOc1ccccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295299 SSRGYNBEYLZAIP-AWEZNQCLSA-N 402.447 2.199 10 20 HECD C[C@@H](O)CN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](C)CO 785873003 RTTBSCJJLJHXPN-ZIAGYGMSSA-N 401.454 2.030 10 20 HECD COc1ccc(NC(=O)c2ccc(C)c(O)c2O)cc1S(=O)(=O)N1CCCC1 787643938 HEWPGFYKIIWEMW-UHFFFAOYSA-N 406.460 2.452 10 20 HECD C[C@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 787954869 XMDSMUQHFDQRFD-GOSISDBHSA-N 424.545 2.175 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCO[C@H]3CCCC[C@H]3C)CC2)cc1 787991258 UOAYXYFKIXMPEG-NQIIRXRSSA-N 417.550 2.445 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(CC)CC 788313050 OPSABPPGCOYFRM-WOJBJXKFSA-N 417.550 2.239 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 788334594 XQBNZANONFHIKP-IRLDBZIGSA-N 423.513 2.033 10 20 HECD C[C@]1(CCCO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855898 ZSEZCYBNYGKWBG-OAQYLSRUSA-N 405.564 2.010 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCN(CC(F)(F)F)C3)cc2F)CC1 791572079 FRZQTVKRTQWZCK-MRXNPFEDSA-N 416.463 2.468 10 20 HECD CCN(CC)C[C@@H](C)NC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 793795788 RXYDBISFKXXQBD-CYBMUJFWSA-N 414.344 2.350 10 20 HECD O=C(CN1CCOC[C@H](C2CCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 795281573 OGVKYEOFMYFLJJ-LJQANCHMSA-N 405.514 2.027 10 20 HECD CN(Cc1ccccc1O)C(=O)c1cc([N+](=O)[O-])ccc1Sc1nnnn1C 798298698 UOKWYJZYAZZKOT-UHFFFAOYSA-N 400.420 2.247 10 20 HECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803664316 KJIJIIGVGAMWCL-AWEZNQCLSA-N 403.454 2.100 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCc4c(O)cccc43)CC2)cc1 804400375 SQBRDCZKOCDCPI-FQEVSTJZSA-N 409.486 2.243 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)CC[C@H]3C)cc2F)CC1 805007936 VNEZMCLHGBGJFW-DLBZAZTESA-N 404.530 2.231 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)NC[C@H](N1CCOCC1)C(F)(F)F 805845215 ROLHSNROTXOPHX-KRWDZBQOSA-N 401.429 2.333 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 806276261 AQHVYLORMKHXGG-GDBMZVCRSA-N 408.593 2.217 10 20 HECD CN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCCCSc1nccs1 806278518 UFODNMDCOSKKPX-UHFFFAOYSA-N 417.516 2.049 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NCc2cc(OC)ccc2O)s1 806809946 FAOYEPKFZRPHGG-MNOVXSKESA-N 407.496 2.277 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 807481157 IICIUKQRLMIHFT-KBXCAEBGSA-N 418.538 2.349 10 20 HECD CSC1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768926 BWDPFWULUABLQL-ZDUSSCGKSA-N 413.490 2.385 10 20 HECD CO[C@H](CCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C(F)(F)F 808973871 BPROGORCJIUCFI-MRXNPFEDSA-N 401.429 2.327 10 20 HECD CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 809235068 SOWKCSRMZCIWOY-ZOGCEEFFSA-N 419.591 2.440 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1ncnn1C(C)(C)C 809929706 YUBYKXLNGLZYRH-UHFFFAOYSA-N 412.538 2.298 10 20 HECD Cc1c[nH]nc1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 813539236 YSCFTENGLHDJQF-UHFFFAOYSA-N 417.403 2.385 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1F 815023782 HWXOVUHWGGLJCO-UHFFFAOYSA-N 422.404 2.098 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 883995933 XCGZEFWTYBAQFB-UHFFFAOYSA-N 405.476 2.393 10 20 HECD COCCN(CCOC)S(=O)(=O)NCCc1cc(C)n(-c2ccccc2)c1C 913075038 FSLNQOQPTUUMRK-UHFFFAOYSA-N 409.552 2.066 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2C1 919794767 HTPRPVJCRBDIEN-UHFFFAOYSA-N 408.502 2.066 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc(O)cc4)CC3)cc2F)CC1 1319810647 PEPLNOGTVDUJAR-UHFFFAOYSA-N 412.509 2.241 10 20 HECD O=C(Cn1cccn1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788272026 RPESESMVTIHIKD-UHFFFAOYSA-N 407.430 2.137 10 20 HECD Cc1cnoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428373 PMEJIDMIXAKQKT-MRXNPFEDSA-N 414.462 2.336 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CCN2CCCC2)C1 1847127760 ZSIPZLGAXNVULS-UHFFFAOYSA-N 407.898 2.054 10 20 HECD COc1ccc(C)cc1NC(=O)CNC(=O)CN(C)c1ccc(OC)c(OC)c1 63616744 ZZOOCNCPCHBGNN-UHFFFAOYSA-N 401.463 2.212 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726725818 JUQLQCXUHPXREW-UHFFFAOYSA-N 424.501 2.169 10 20 HECD CC[C@@H](C)NC(=O)CCNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730118735 BVCTWQSGPIKUHT-MRXNPFEDSA-N 407.534 2.072 10 20 HECD CCNC(=O)NC1(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CCCC1 730235814 NPGFOMBTZHSLTF-UHFFFAOYSA-N 419.545 2.216 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1 734015265 DPRPJBVYRIHXHL-HXUWFJFHSA-N 405.454 2.453 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2cc(OC)ccc2O)ccc1OC 734015418 IOERZEJWLFNSMY-UHFFFAOYSA-N 422.503 2.370 10 20 HECD Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 734403163 XHEZPCHTDXZVCL-QHCPKHFHSA-N 408.502 2.453 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)cc1 734526413 QTMCPOQMDYAENS-UHFFFAOYSA-N 408.499 2.319 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 738884068 DIJPXHXZMFSXPH-UHFFFAOYSA-N 419.503 2.260 10 20 HECD CC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 743322896 MADSHJRDPYQSTM-JTDSTZFVSA-N 420.529 2.497 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(-n2cccn2)cc1 743817468 VLZLEYWLHRFMFF-CYBMUJFWSA-N 400.460 2.440 10 20 HECD CCN(CC(=O)N1CCC(C(=O)OC)CC1)Cc1cc(Br)ccc1O 743870966 JOZRLOIDXIDCRK-UHFFFAOYSA-N 413.312 2.388 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(O[C@H]3CCOC3)CC2)c1 748267808 QHVIMXYINIYFPN-QFIPXVFZSA-N 418.534 2.197 10 20 HECD O=C(C(=O)N1CCN(Cc2ccc(OCc3ccccc3)cc2O)CC1)N1CCCC1 753536186 PFNRCSFFRPVNII-UHFFFAOYSA-N 423.513 2.238 10 20 HECD C[C@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc([N+](=O)[O-])ccc1O 756454137 AVYCNSHDUHOMGX-SWLSCSKDSA-N 401.419 2.276 10 20 HECD COCCNS(=O)(=O)c1ccc(CN[C@@H](C)c2cc(F)cc(F)c2O)cc1 756482835 JCYYALDRFRXSBV-LBPRGKRZSA-N 400.447 2.446 10 20 HECD COc1cc(N2CCN(C(=O)NCc3cccc(CO)c3)CC2)cc(OC)c1OC 759288562 GNPMEHYVYNHVQG-UHFFFAOYSA-N 415.490 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3CCCO[C@@H](C)C3)CC2)cc1F 764584394 QTMYOIBREVPXGZ-KRWDZBQOSA-N 408.518 2.167 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)NC(=O)CC2 768165923 JIEYVJPSJOROBL-UHFFFAOYSA-N 410.474 2.209 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@H]2CNS(C)(=O)=O)c1O 768342121 PIOANIPPAHBGHI-ZDUSSCGKSA-N 407.330 2.067 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3cccc(OC)c3O)cc(C(C)C)nc21 769498457 ITOFQLAOPLOBPQ-UHFFFAOYSA-N 412.446 2.285 10 20 HECD CCC1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOCC1 778294824 PAHSCWJBHFDHBP-HJWRWDBZSA-N 415.534 2.223 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1C(=O)O 780386780 DKZYBSONKWGCKC-UHFFFAOYSA-N 420.415 2.495 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](OC)CC3)CC2)cc1 783162564 MBOMVLFSSULDFQ-HXUWFJFHSA-N 404.555 2.418 10 20 HECD COC(=O)[C@H](Cc1ccc(F)cc1)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 783569636 NLVKYMKDRCDIHO-NQIIRXRSSA-N 413.493 2.401 10 20 HECD CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786259137 LDZPVSVEBQMTRH-KQWNVCNZSA-N 420.513 2.149 10 20 HECD CCC(CC)N1C[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786657504 YSLFMARRONQZFB-LJQANCHMSA-N 414.550 2.008 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(N2CCNC(=O)C2)ccn1 786707885 MTURUGDHYAQZMH-UHFFFAOYSA-N 407.518 2.280 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(Cn2ccnc2)c1 787298346 OSODBQBPLZUUOW-UHFFFAOYSA-N 405.502 2.238 10 20 HECD COc1cc(N2CCN(Cc3nccc(OC)c3OC)CC2)cc(OC)c1OC 789379688 YMDWMMBWJVBLTQ-UHFFFAOYSA-N 403.479 2.447 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)[C@@H](C)O1 789821017 RSCZQQNWTSDNHH-UHDSXZAQSA-N 421.513 2.080 10 20 HECD COc1cccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)n1 790108450 POYQIKCEGZXJDA-ZROIWOOFSA-N 421.525 2.139 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)Nc2ccc(S(=O)(=O)NC)cn2)cc1 792392894 FUNXROGWFOBKOG-UHFFFAOYSA-N 405.524 2.500 10 20 HECD Cc1nc2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2n1C 793128243 ZZQIPCBHSCKHBY-UHFFFAOYSA-N 412.515 2.047 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc2c1OCCCO2 793737806 PQSSIYUWMCQEPL-UHFFFAOYSA-N 407.517 2.219 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)cc1 793827259 VWBSHSQTGQFDFR-MRXNPFEDSA-N 411.502 2.233 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(O)(Cc4cccc(C)c4)CC3)nc12 796485991 WRWCNRZIRAWUPH-UHFFFAOYSA-N 424.501 2.490 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CC[C@@H](C(=O)N2CCCC2)C1 804968760 JQIMESSXKKNJFT-GOSISDBHSA-N 402.564 2.394 10 20 HECD O=C(NCCNS(=O)(=O)c1cccc(Cl)c1Cl)NCc1ccccc1O 806644712 GFSQMRIBIJGJJT-UHFFFAOYSA-N 418.302 2.477 10 20 HECD O=C(NCc1ccn2ccnc2c1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806991953 NFPAEOFXSRJSQO-UHFFFAOYSA-N 404.426 2.478 10 20 HECD COc1cc(/C=C2\SC(=S)N(CC(N)=O)C2=O)cc(OC)c1OCC(F)F 809144025 AWRYWFPFVDJLDT-WZUFQYTHSA-N 418.443 2.034 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnc(C(F)(F)F)c1 809615383 BTINAZUWEZYVLL-UHFFFAOYSA-N 413.421 2.265 10 20 HECD Cc1cc(CCNC(=O)N(C)[C@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1 813565617 IBINKFOUADUCOG-FQEVSTJZSA-N 418.563 2.312 10 20 HECD COc1ccc(N2CCCN(C[C@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 917016965 GWYOOYDLXMKMLV-NRFANRHFSA-N 404.532 2.344 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)c1ccc(CN2C(=O)CNC2=O)cc1 917387162 SFQGLIGVOAKEAD-UHFFFAOYSA-N 424.526 2.222 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919970341 WLMUPBFUHLXXKC-UHFFFAOYSA-N 420.513 2.230 10 20 HECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)s1 1843249077 UEAMOQGKVDERJG-UHFFFAOYSA-N 401.488 2.313 10 20 HECD CC(=O)N1C[C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)Oc2ccccc21 21963306 JJDQNEULEBLEPI-JOCHJYFZSA-N 409.486 2.296 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@H]1Oc2ccccc2NC1=O 27946566 MHMRFOCONAJMBD-LJQANCHMSA-N 411.458 2.044 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)Nc3cccc(COC)c3)nnc2n1 54760936 WLCOHIVDQNIMMU-UHFFFAOYSA-N 416.511 2.260 10 20 HECD Cc1nc2cncc(N3CCN(C(=O)NCc4c(C)c5ccccc5n4C)CC3)n2n1 472224726 UURSQICUUWEVEV-UHFFFAOYSA-N 418.505 2.265 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](C)N3C(=O)NC4(CCCC4)C3=O)CC2)cc1 726562340 IPEPYMDEXQAHLX-OAHLLOKOSA-N 414.506 2.033 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Br)cn1 727370949 DVNXOPAWMXBCPY-UHFFFAOYSA-N 424.320 2.009 10 20 HECD CN(C)c1ccc(CNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1F 730066945 PUJATBRMPSVVBM-UHFFFAOYSA-N 409.483 2.173 10 20 HECD C[C@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 730218309 JWGRCPQUWGSKTJ-CDDSVFCYSA-N 409.558 2.076 10 20 HECD Cc1n[nH]cc1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2 732046084 RBHYRNWXIFJIOG-GFCCVEGCSA-N 424.548 2.368 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3ccc(F)cc3)cc2)C1 734942763 QYDHESTWAGOIDO-PXNSSMCTSA-N 414.481 2.060 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nc2nc(O)nc(O)c12 740750691 YLPAEICVMAMSJV-UHFFFAOYSA-N 411.487 2.228 10 20 HECD CC(=O)NC(C)(C)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744934060 DIRZRUIDMRDHNF-LBPRGKRZSA-N 422.437 2.247 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCc2c1cnn2C 749542766 HXNFWEYFRNEWDS-IBGZPJMESA-N 415.513 2.021 10 20 HECD Cc1noc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 751059957 CCXJDWMDRMLINY-SECBINFHSA-N 408.461 2.437 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cc(C)oc3C)CC2)cc(OC)c1OC 759099437 AXJVBDZEUJYNGR-UHFFFAOYSA-N 410.492 2.433 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc4nc(O)[nH]c4c3)CC2)cc(OC)c1OC 759223968 XQRUZLFRUZNHPS-UHFFFAOYSA-N 412.446 2.257 10 20 HECD C[C@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)C[C@@H](C)O1 765063368 YNCMRXIVWNOALU-BETUJISGSA-N 416.459 2.273 10 20 HECD CCC[C@]1(CO)CCCN1C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 768975231 LJTCOWKAKZUTEP-JJNABOQBSA-N 415.534 2.054 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCOC4(CCOCC4)C3)CC2)cc1F 769204427 VTRDVWBQUADJKW-INIZCTEOSA-N 407.486 2.394 10 20 HECD O=C(NC[C@H](O)c1cccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 772509544 PDHVQSWNOBSOTP-INIZCTEOSA-N 419.484 2.113 10 20 HECD C[C@H](NC(=O)NCCNS(=O)(=O)Cc1ccccc1)c1ccc(N(C)C)cc1 773612364 MGURVLREWLXDIL-INIZCTEOSA-N 404.536 2.232 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 773618191 IOESSWMDVSBLQD-FUHWJXTLSA-N 418.538 2.257 10 20 HECD COCc1nc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)no1 775377878 OHTCPVKTBYWAEN-UHFFFAOYSA-N 400.357 2.001 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@](C)(O)C(F)(F)F)cc2F)CC1 776134900 KHEYJGQYVGMIOH-QGZVFWFLSA-N 406.424 2.080 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(CNC(C)=O)cc1 777827616 FAMLRBNHTLZBSU-UHFFFAOYSA-N 404.850 2.497 10 20 HECD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)sc1C 789379352 XEWXGMQUBPUMIG-UHFFFAOYSA-N 402.520 2.224 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccs1 789799501 HVQJVPIMECGXPK-HNNXBMFYSA-N 419.522 2.335 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@@H](C)O[C@]3(CCCOC3)C2)c1 794890334 OABPFMQXKCMFKK-UZUQRXQVSA-N 418.534 2.197 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1 797532557 NDXHESQSKBJJQD-UHFFFAOYSA-N 403.866 2.133 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(CN(C)C)c1 799263425 WGHOASHYFZVWTN-LBPRGKRZSA-N 405.882 2.499 10 20 HECD COc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686713 GXITYJNBQWLAJK-UHFFFAOYSA-N 411.502 2.231 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3scnc3C)CC2)cc1 804317018 QJRVEWUNULSWKS-UHFFFAOYSA-N 402.520 2.204 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(F)(F)Br 805838079 ZGYSRJURORFAAW-UHFFFAOYSA-N 424.261 2.198 10 20 HECD Cc1cc(C(=O)O[C@H](C)C(=O)NCCN2CCOCC2)c(C)n1-c1ccc(F)cc1 805970897 COKSHBDYIZTEEH-QGZVFWFLSA-N 417.481 2.227 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(Cc2cccs2)CC1 807097689 QOJFDLNXYLOCHM-UHFFFAOYSA-N 400.548 2.083 10 20 HECD COCCC1(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCC1 807911239 MLOYRTZJIPSOMZ-UHFFFAOYSA-N 417.550 2.195 10 20 HECD COc1cc2c(cc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F)OCC(=O)N2 808113565 CWJYBEZSDSNVTB-UHFFFAOYSA-N 402.787 2.325 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)NC(=O)c3cc(C)n(-c4ccccn4)c3C)cc12 816200160 BINXVVJRFGAMQR-UHFFFAOYSA-N 424.486 2.198 10 20 HECD C[C@@H](C(=O)NC1CC1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 915227492 YGMNZGJYXLMDKK-KRWDZBQOSA-N 415.538 2.370 10 20 HECD CN(Cc1ccccc1O)C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 917581669 PITUIZKVKDLWCU-UHFFFAOYSA-N 421.544 2.242 10 20 HECD CC(C)CN1C[C@@H]2CN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CCN2C1=O 1324829313 PYHDISSBNNIGNJ-IBGZPJMESA-N 403.546 2.155 10 20 HECD CN1CCN(c2ccc(CNCCCN3C(=O)c4ccccc4C3=O)cc2F)CC1 1345412527 SXMMCOMCHKBIPX-UHFFFAOYSA-N 410.493 2.353 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933132 RLGJMJJZSQBKRN-LXOAJXDASA-N 408.502 2.464 10 20 HECD CC(C)c1csc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)n1 1848293130 KUYSSWUOYRWOIJ-KBPBESRZSA-N 402.476 2.202 10 20 HECD CSc1nc2nc(C)c(CC(=O)N3CCOc4cc(N(C)C)ccc43)c(C)n2n1 444004012 PTQSCKXDYRQWFI-UHFFFAOYSA-N 412.519 2.497 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1 728950547 SFZXUCXPAWWAPW-HNNXBMFYSA-N 413.474 2.434 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)cc21 737181719 CPOVHKOLPWOKPO-CYBMUJFWSA-N 412.446 2.213 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@H](C)C(=O)Nc4ccccc43)CC2)cc1 745987143 NIDAULYMQGUABM-KRWDZBQOSA-N 408.502 2.439 10 20 HECD CCCN(C)CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 746172889 NWNRUWFIBUBHAO-YBEGLDIGSA-N 421.544 2.075 10 20 HECD COc1ccc(CN2CCN(C(=O)CN3CCOc4cc(N(C)C)ccc43)CC2)cc1 746492681 JIYRNDBGJKMKAI-UHFFFAOYSA-N 424.545 2.304 10 20 HECD CN(C)c1ccc(CNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1F 746864878 ZYHUWUNOHKBOBB-IEBWSBKVSA-N 419.497 2.490 10 20 HECD CN(C)CCCOC1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 748957796 CBVKIDVPKZOXKQ-UHFFFAOYSA-N 404.555 2.166 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)(C)CN(C)C 754357579 RWHOOIVWKJDBFH-SJLPKXTDSA-N 403.571 2.164 10 20 HECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 754544031 NYGNQPONIWZYBW-UHFFFAOYSA-N 412.405 2.288 10 20 HECD COc1cccc(-c2nsc(NC(=O)C(=O)NCc3cc(OC)ccc3O)n2)c1 755241172 HXPDNFPNKDTQMH-UHFFFAOYSA-N 414.443 2.183 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3C(C)(C)O)CC2)cc1 758315124 HKPRTHBDEDSFKG-HXUWFJFHSA-N 404.555 2.152 10 20 HECD COc1cc(N2CCN(C(=O)NCc3c(C)nn(C)c3C)CC2)cc(OC)c1OC 759276636 AFLCZPXKDXLPRQ-UHFFFAOYSA-N 417.510 2.095 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 760294668 FEHSNRVZMZDAQK-HNNXBMFYSA-N 407.478 2.161 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1 765292920 IVFOSGDFLWZIDX-UHFFFAOYSA-N 414.281 2.385 10 20 HECD CC1CCC(NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)CC1 769320496 RBGYPTOCPJGXIF-UHFFFAOYSA-N 414.594 2.336 10 20 HECD Cc1ccc(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1O 772155291 PVZVTKOUJVMIBH-UHFFFAOYSA-N 416.449 2.078 10 20 HECD COC(=O)[C@@H]1CN(Cc2cc(Br)cc(Br)c2O)CCO1 775676056 JWVYACBXPWBPJP-NSHDSACASA-N 409.074 2.291 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4ccc(OC)cc43)CC2)cc1 779222527 PXMSJDGZFKZYNX-IBGZPJMESA-N 413.518 2.086 10 20 HECD CN(CC(=O)Nc1ccc(Br)cn1)C(=O)/C=C/c1ccc(O)c(O)c1 779485223 ZLASSRJKWNEZOB-XVNBXDOJSA-N 406.236 2.366 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@@H](OCCO)C1 780506907 LMHBSCJWWBQCNQ-MAUKXSAKSA-N 413.465 2.440 10 20 HECD C[C@H](NC(=O)C(=O)NCCCOc1ccccc1)c1ccc(N2CCOCC2)cc1 785589181 UOVSOQVJYCJRDO-SFHVURJKSA-N 411.502 2.286 10 20 HECD CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 787498221 JIPCTBAZNFVKPI-UHFFFAOYSA-N 400.435 2.106 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1c1ccc(OC(F)(F)F)cc1 790460160 INYNSWJTUMTGPF-SJLPKXTDSA-N 424.375 2.390 10 20 HECD C[C@@H]1OCC[C@@]12CN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C[C@@H](C)O2 790503010 ZBJMPSLHSAHZFD-VWKPWSFCSA-N 407.486 2.140 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1Cl 791384514 HTSCPZHWZZEXFH-QGZVFWFLSA-N 417.893 2.458 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3c3nc(C)no3)CC2)cc1 796668884 LYSDAGRZRBKJGU-CTNGQTDRSA-N 415.538 2.097 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C3CCN(CC(F)F)CC3)CC2)cc1 798277602 VPOCMZDWORUSAE-UHFFFAOYSA-N 424.536 2.301 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)c2)CC1 801909041 CLSUGDDXIVHZSY-UHFFFAOYSA-N 401.398 2.270 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCCc2cnn(C)c2)cc1 804372378 RKQYXIZEKDWWJQ-UHFFFAOYSA-N 423.517 2.357 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3COC(C)(C)OC3)cc2Cl)C1 806655742 GTIBGDZHTVQYLS-AWEZNQCLSA-N 423.941 2.460 10 20 HECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807286976 FZHNDJVMYVGCBJ-QGZVFWFLSA-N 409.486 2.271 10 20 HECD C[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807768130 CWDKKRFDZUSUEM-CABCVRRESA-N 411.449 2.010 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCCC2)cc1)NCCN1CCCCCC1 814283535 HIMUBNIRTXLMRM-UHFFFAOYSA-N 401.555 2.078 10 20 HECD COc1ccc(N2CCN(CCN[C@H](c3ccc(F)cc3)c3nc[nH]n3)CC2)cc1 815569197 KJEQYEMHNKIESM-OAQYLSRUSA-N 410.497 2.454 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCc2cc(Br)ccc21 917840558 REHHXAYXWCMLRZ-UHFFFAOYSA-N 422.304 2.226 10 20 HECD C[C@H](NC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)c1ccc(N2CCOCC2)cc1 920887549 DWJPEPMBMRNSLA-INIZCTEOSA-N 422.485 2.066 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ncoc3[C@H]3CCCO3)CC2)cc1 1321869125 XCHPKWBQPPJQPR-GOSISDBHSA-N 400.479 2.087 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993081 SGOSUFWQDPGKFK-VZRKHXGSSA-N 422.485 2.254 10 20 HECD O=C(c1nccs1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427072 OMQLHMSBXSITEB-OAHLLOKOSA-N 416.503 2.496 10 20 HECD CC(=O)NCCC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1846009486 AYQSIZGYEZSELH-UHFFFAOYSA-N 422.529 2.437 10 20 HECD CC(C)OC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 730675018 TVNBYMSONHJDLG-GOSISDBHSA-N 402.539 2.487 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCCCN3CCC[C@H](C(N)=O)C3)cc2)CC1 731049812 PWFBCGGFEQLTPP-FQEVSTJZSA-N 415.582 2.310 10 20 HECD C[C@@H](C(=O)Nc1sccc1C(N)=O)N(C)Cc1ccc(N2CCOCC2)cc1 741734317 CJFFFHDIROKADL-AWEZNQCLSA-N 402.520 2.143 10 20 HECD CSC[C@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069302 ITJLXGXGSLUMLS-MRXNPFEDSA-N 416.546 2.098 10 20 HECD COc1cc(N2CCN(C(=O)c3c4c(nn3C)CCCC4)CC2)cc(OC)c1OC 759220056 GMUZKKIBETVRNC-UHFFFAOYSA-N 414.506 2.287 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](C)C(=O)OC(C)C)CC2)cc(OC)c1OC 760123582 JAXZBLZLOFGMAP-HNNXBMFYSA-N 423.510 2.132 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOc2ncc(Cl)cc2Cl)c1 762579818 VQVBBZFJVYRCIT-UHFFFAOYSA-N 420.274 2.274 10 20 HECD C[C@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1Cl 766021841 DUOLATKNRRPMKK-OALUTQOASA-N 423.001 2.234 10 20 HECD O=C(CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1)N1CCCCCC1 768211720 CTMLZIQIZHEZPT-UHFFFAOYSA-N 410.902 2.474 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F 774918237 MJPNTUWDMXODAQ-CYBMUJFWSA-N 421.419 2.434 10 20 HECD Cc1cc2c(cc1NCC(=O)NCc1ccc(N3CCOCC3)c(F)c1)OCO2 781127720 LJMUHXZZYNWMKT-UHFFFAOYSA-N 401.438 2.428 10 20 HECD CCN(CC)C(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1 785429056 WMZBUJRYVRSFLB-UHFFFAOYSA-N 410.518 2.167 10 20 HECD COc1ccc(Br)cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785434101 SIXGLDUQPFQDJT-UHFFFAOYSA-N 420.307 2.456 10 20 HECD COCc1nc(C)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)s1 786660667 GVFSOBHWNDNZNV-UHFFFAOYSA-N 402.520 2.196 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 787479146 DCMBTYQGWRUPDG-UHFFFAOYSA-N 421.501 2.162 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1nnc2n1CCCCC2 788930212 PFHVVZNPUWFOAU-IBGZPJMESA-N 424.549 2.488 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1 788949873 AYXOYDHIKLCVBT-UWJYYQICSA-N 422.529 2.459 10 20 HECD CSC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 789210796 UZXPLILQDVTQPN-ZIAGYGMSSA-N 410.511 2.494 10 20 HECD C[C@@H]1CCC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793727031 VHSLHNJMUQJDBF-ZHALLVOQSA-N 414.550 2.042 10 20 HECD COc1cc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1S(=O)(=O)N(C)C 797637824 BBMPYSPTYGQLIM-LBPRGKRZSA-N 423.491 2.109 10 20 HECD C[C@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN(Cc2ccccc2)C1 799013127 MXBKGOAUSSMUTK-OAQYLSRUSA-N 417.531 2.406 10 20 HECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803447936 CDMMXTJEPNYSJK-AWEZNQCLSA-N 411.449 2.010 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)[C@@H]2CCCc3ccccc32)cc1F 803661823 ASGCYNXDIMXKJA-HXUWFJFHSA-N 413.493 2.406 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nnc2n1CCCCC2 804101468 OGZCARAHAIEGBI-GOSISDBHSA-N 412.538 2.263 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c1 804426484 AKJVYQIYQKOQIP-GUDVDZBRSA-N 416.499 2.408 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN(C)[C@H](C)C1 806040152 DWYGWJJJSWILMN-IUODEOHRSA-N 412.328 2.102 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 807073293 GEWJEEFSNQYTSY-LRDDRELGSA-N 423.318 2.235 10 20 HECD CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1c(C)noc1C 809617341 NZRSBGFMSZLJQS-LJQANCHMSA-N 414.506 2.354 10 20 HECD C[C@@H](NC(N)=O)c1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 813342038 XQIMDENXTRQRQD-MRVPVSSYSA-N 409.449 2.034 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(-c4ncc[nH]4)c3)CC2)cc1 814256035 IQAJDGZTQGRLFJ-UHFFFAOYSA-N 420.517 2.422 10 20 HECD O=C1OCc2ccc(S(=O)(=O)NCc3ccc(N4CCSCC4)cc3)cc21 917912935 ZWEJJLMQASHADJ-UHFFFAOYSA-N 404.513 2.389 10 20 HECD C[C@H](Oc1ccccc1F)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339303 FJCAVKCFTVPFIQ-HNNXBMFYSA-N 406.479 2.144 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 918706335 PGNPGCHVKDPPLQ-UHFFFAOYSA-N 403.504 2.004 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3sc(N(C)C)nc3C)CC2)cc1 1320434596 GASIKDXOPASDED-UHFFFAOYSA-N 417.579 2.468 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnnn3-c3ccc(C)cc3)CC2)cc1 3555598 XKXPXUYMNBBUOL-UHFFFAOYSA-N 424.530 2.420 10 20 HECD CN(C)c1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])cc1 7366214 MQOUBHIWUAFPFB-UHFFFAOYSA-N 420.491 2.294 10 20 HECD C[C@@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 109181221 LPJPVMWHKWDBSZ-QGZVFWFLSA-N 417.531 2.021 10 20 HECD CS(=O)(=O)N1CCC(CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 725851533 UDAQAHBFWCDQNT-UHFFFAOYSA-N 410.540 2.346 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3ncccc23)cc1C(=O)O 728015274 OZGSFAJCBZBCLT-UHFFFAOYSA-N 421.456 2.105 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H]3CN3CCCC3)CC2)cc1 729606870 JYABXLMZUNLKOZ-OAQYLSRUSA-N 415.582 2.087 10 20 HECD CNS(=O)(=O)C1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 732126487 IQVPCMVGJDSAKL-UHFFFAOYSA-N 405.520 2.257 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(OCC)c(Cl)c3)nc12 732845878 ISAYHHISSNTQMB-UHFFFAOYSA-N 420.809 2.416 10 20 HECD Oc1cccc(Cl)c1CN[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1 733326547 KDHPPWJZWZPKDP-OAHLLOKOSA-N 403.914 2.431 10 20 HECD O=C(N[C@@H]1CCSC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743733087 BJVUIZTWWNHFOJ-GFCCVEGCSA-N 423.472 2.337 10 20 HECD CN(C)c1nc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 747507760 LMEIUNFMEZAEPK-UHFFFAOYSA-N 403.552 2.417 10 20 HECD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1 751235304 HDLUACYXDXTSCI-UHFFFAOYSA-N 413.517 2.026 10 20 HECD CC1(C)NC(=O)N(CCCOC(=O)c2csc(Cc3ccc(N)cc3)n2)C1=O 751946113 WRDDSEBVMKJUQS-UHFFFAOYSA-N 402.476 2.193 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1F 752010025 LLBYVCMVSXAZCC-VFNWGFHPSA-N 419.501 2.192 10 20 HECD CC[C@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)N1CCOCC1 753058042 OZSBGJYHDFSKRV-FQEVSTJZSA-N 402.539 2.456 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)cc1 755126200 HFRVKRVXALMVTM-IBGZPJMESA-N 415.582 2.371 10 20 HECD CS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 755916546 KIBIBHYTKKGOFA-UHFFFAOYSA-N 419.478 2.183 10 20 HECD COc1ccc(C[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 758537477 RLZVBCJCPYPHSL-KRWDZBQOSA-N 416.543 2.425 10 20 HECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 760236170 FMHGWRSNCHTUDL-UHFFFAOYSA-N 405.458 2.415 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3C(C)(C)O)cc2F)C[C@@H](C)O1 764355784 JMVFCKDYDIMLDC-QINHECLXSA-N 407.530 2.291 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@H](C4CC4)C3)cc2)C1 765315079 ACSPTBDRBJMDAT-WSTZPKSXSA-N 400.523 2.145 10 20 HECD C[C@@H](NCC1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1Cl 765525387 FZBCWADDCVOZIR-OAHLLOKOSA-N 415.987 2.499 10 20 HECD CSCC[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 767774132 KHFZOOPSKRBDCG-HRCADAONSA-N 420.531 2.053 10 20 HECD COCCC(=O)N1CCC(NC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 767937145 PGHPQPVZSQHJTE-UHFFFAOYSA-N 420.579 2.067 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(C)ccc3O)CC2)cc1 768159144 AWEKTFUTBFMZQO-UHFFFAOYSA-N 418.515 2.384 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccccc1Cl 774547899 GYELYSUMWWBMBA-UHFFFAOYSA-N 405.857 2.248 10 20 HECD Cc1nn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 779645980 RFWLPSXKVAFRSX-STQMWFEESA-N 405.430 2.169 10 20 HECD COC(=O)[C@H]1CCN(Cc2cc(Br)cc(OC)c2O)[C@H](C(=O)OC)C1 780784267 SKJQGWAHCMPVLN-GWCFXTLKSA-N 416.268 2.090 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3SCC(N)=O)c2)CC1 781270076 GJLIQNLHLOFOPT-UHFFFAOYSA-N 412.515 2.185 10 20 HECD CCN(CC)c1ccc(CN(C)[C@H](C)C(=O)N(CC)[C@@H]2CCS(=O)(=O)C2)cc1 781624571 KMSFEVVVWAUWER-YLJYHZDGSA-N 409.596 2.389 10 20 HECD Cc1cnn(-c2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2F)c1 785295363 UBEODRXBKRUGLO-ZDUSSCGKSA-N 412.421 2.417 10 20 HECD Cc1cccc(C)c1CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811387 GHSQLJYIRDVWSJ-UHFFFAOYSA-N 413.493 2.254 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2nnc3n2CCOC3)cc1 790672475 DUQOAFZVRAWMCI-UHFFFAOYSA-N 410.478 2.379 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2F)C[C@H](C)O1 791204246 GVTIGRMCZAVLIK-RYUDHWBXSA-N 403.414 2.255 10 20 HECD C[C@H]1c2nncn2CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 792664652 GYXZHLWVTFAECI-NSHDSACASA-N 417.381 2.179 10 20 HECD CN(C)CCNC(=O)Cn1cc(NCc2ccc(N(C)C)cc2C(F)(F)F)cn1 793075565 DMGKZJJAWNRMGL-UHFFFAOYSA-N 412.460 2.258 10 20 HECD C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 793910199 ITJAOIILXIWDER-FGTMMUONSA-N 400.567 2.168 10 20 HECD Cc1occc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 793912866 HLJZOGSNKXRQEY-UHFFFAOYSA-N 410.518 2.053 10 20 HECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803306212 RRHFHGRGMAJKNI-JPYJTQIMSA-N 417.550 2.100 10 20 HECD COCCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663669 WKOGRWKOAOOKJJ-UHFFFAOYSA-N 401.482 2.226 10 20 HECD Cc1nn(C)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 804956235 FJOANGZCPKAQRU-UHFFFAOYSA-N 418.441 2.062 10 20 HECD Cc1nonc1CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807956508 OZFQOMGASYCHNY-LBPRGKRZSA-N 405.886 2.200 10 20 HECD CN(C(=O)NCc1ccc(N2CCOCC2)cc1)C1CN(C(=O)OC(C)(C)C)C1 812011681 CMNSFYBIMJGLEC-UHFFFAOYSA-N 404.511 2.284 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/CN(C)CC(F)(F)F)cc2)CC1 816379324 LXXRFJYJJQQWPF-ONEGZZNKSA-N 412.456 2.022 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCCN3CCCCC3)CC2)cc1 916196060 LVMHFKWBUWVKBZ-UHFFFAOYSA-N 417.598 2.383 10 20 HECD Cc1cc(C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1cccc(Cl)c1 1115895799 UPZXHZISJBMTKQ-OAHLLOKOSA-N 424.906 2.208 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)c1ccc2c(c1)OCO2 1324540358 GQYRGDGNAYITOR-DOMZBBRYSA-N 401.415 2.221 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1nc(Cl)ccc1F 1796598791 IRADPVVMDIBWHT-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccco1 1805371044 JAPQGIVHRUPJCE-KUHUBIRLSA-N 408.414 2.114 10 20 HECD O=C([C@@H]1CC1(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427046 CJFYZUPGXYSVLW-LSDHHAIUSA-N 409.433 2.381 10 20 HECD COc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 64233304 RFFPWAJGFBXOKH-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)/C=C\c1cnn(C)c1 213869368 GLXBBVBMDXVHCM-FLIBITNWSA-N 402.520 2.443 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cccc(-n3cncn3)c2)n(C)c2ccccc12 561865073 NZXXJNFQLLQDHN-UHFFFAOYSA-N 402.458 2.000 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)n(C)c2ccccc12 581091638 KEVQCVKJEWESFL-FQEVSTJZSA-N 418.497 2.193 10 20 HECD CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1cnn(C)c1 726070684 FMZHWWOYIDKNJG-CALCHBBNSA-N 417.529 2.311 10 20 HECD CN1CC(=O)N(CCCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1=O 726565243 HZZTVJTZYTZGQQ-UHFFFAOYSA-N 424.448 2.047 10 20 HECD COC(=O)CCc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729788769 BGGJQQVYZQYGEA-ZDUSSCGKSA-N 400.431 2.322 10 20 HECD COC(=O)CN(CC(=O)NC[C@H]1Cc2ccccc2O1)Cc1cc(Cl)ccc1O 732202798 DNQYALJNTKBPHE-QGZVFWFLSA-N 418.877 2.141 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1 734073835 XGMQSGFXMZUSSR-UHFFFAOYSA-N 411.458 2.282 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)c3cn(C)c(=O)n(C)c3=O)c2C)c1 735153139 NHYRKMQKTIRHHT-UHFFFAOYSA-N 423.469 2.148 10 20 HECD COC(=O)[C@@](C)(NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 736051773 JRCKYJSGLXGLKD-QFIPXVFZSA-N 422.393 2.442 10 20 HECD C[C@@H](CN1CCOCC1)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743536432 KMLPPWCBQIFWMU-JKSUJKDBSA-N 412.481 2.277 10 20 HECD CCN(CC)S(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 746314155 UEADVAAEPAVIKU-AWEZNQCLSA-N 419.494 2.045 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCCN2C(=O)CCC2=O)cc1 750876056 XSMLMKNKJRNQSJ-LJQANCHMSA-N 401.507 2.189 10 20 HECD O=S(=O)(Cc1ccc(Cl)nc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227231 FXJVVMGJOYWRBC-UHFFFAOYSA-N 413.902 2.455 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCc4ccccc43)cc2)C1 752656063 ZRBQIUOONPKFEU-YADARESESA-N 422.529 2.022 10 20 HECD CN(CCc1nccs1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 753580233 ZZBIIIRTEOYIKE-MRXNPFEDSA-N 401.536 2.229 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCN(C(C)C)C3)CC2)cc(OC)c1OC 759280581 ANYFFOMIGOMGSN-QGZVFWFLSA-N 420.554 2.274 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3ccncc3)CC2)cc(OC)c1OC 760129808 PBBXOGRDCJADIR-UHFFFAOYSA-N 400.479 2.182 10 20 HECD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cccc2c1C(=O)c1ccccc1C2=O 761346952 FAHMZHHZZPLVTD-UHFFFAOYSA-N 418.361 2.389 10 20 HECD O=C(CN(CCCO)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 767901433 HHFCOZHVSACVTN-UHFFFAOYSA-N 415.509 2.163 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccoc1Br 770237639 RFCKEJYMBLGACJ-UHFFFAOYSA-N 413.293 2.207 10 20 HECD COc1ccc([C@@H](CNCc2ccc([N+](=O)[O-])c(OC)c2O)N2CCOCC2)cc1 774941771 DGOHQFZAXVWNII-LJQANCHMSA-N 417.462 2.481 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1Oc1ccccc1 776273239 YVPFLNCCFKVSJB-QXAKKESOSA-N 420.487 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3cccc(OC)c3)CC2)cc1 778233906 OIQQXSNXMVDQKF-KHPPLWFESA-N 423.513 2.268 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3N)cc2F)C[C@@H](C)O1 782166394 GIQICOAITQEAMS-VXGBXAGGSA-N 403.414 2.255 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(c4cc(C)[nH]n4)CC3)CC2)cc1F 784125892 OVTNOIPSVJAWHZ-UHFFFAOYSA-N 416.501 2.366 10 20 HECD CC[C@]1(C)CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 785861649 DZYMLUHFHQHEBL-JOCHJYFZSA-N 404.555 2.418 10 20 HECD CN(C)c1noc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 787973140 XFCHLPYWSMBJRU-UHFFFAOYSA-N 422.353 2.176 10 20 HECD COC(=O)c1cncc(S(=O)(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 788549775 UUFMLWOZRBGOBJ-UHFFFAOYSA-N 418.519 2.199 10 20 HECD COc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860165 IPPHYGJDCFKSBM-HNNXBMFYSA-N 414.531 2.137 10 20 HECD Cc1csc([C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 803304060 COKCJRDWPMJXEK-GDBMZVCRSA-N 416.547 2.385 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)[C@H]3CCCCO3)CC2)cc1 804317111 SDROKZLQDFLMQO-HXUWFJFHSA-N 417.550 2.492 10 20 HECD Cc1ccc(-n2nccc2NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)nn1 807511813 WMXPDFYHEWPRGA-UHFFFAOYSA-N 421.244 2.238 10 20 HECD Cc1cc(Cl)cnc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 812958265 CCFPVZKXTBNNGH-UHFFFAOYSA-N 420.872 2.399 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 813673018 PBOBJJOIWPONQI-LBPRGKRZSA-N 409.460 2.373 10 20 HECD Cc1cc(C(=O)N[C@@H]2CCCc3nc(O)c(C(N)=O)cc32)c(C)n1-c1ccccn1 916159542 GYLWZZSXFSXUIW-QGZVFWFLSA-N 405.458 2.496 10 20 HECD CN(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1 919722909 QMJVHKXTHWSNFW-UHFFFAOYSA-N 420.491 2.294 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N(C)Cc1cccc(F)c1 920636592 CTKNOMHZSIHQRY-LBPRGKRZSA-N 424.450 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4cccnc4C)n3)CC2)cc1 1343151414 VKVUNCVLGDGTOI-UHFFFAOYSA-N 407.474 2.264 10 20 HECD Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)o1 1788426745 PIEQJFHLCNQEHI-UHFFFAOYSA-N 423.429 2.175 10 20 HECD O=C(Cc1ccc(F)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599255 JDWRCUYXQLBKCW-QDMKHBRRSA-N 417.412 2.266 10 20 HECD Cc1nc[nH]c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827837458 VWKBXZVVCYJTKQ-MRXNPFEDSA-N 413.478 2.071 10 20 HECD O=C1CCCc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)ccc21 1843759220 JLOXXIVLHFTELK-UHFFFAOYSA-N 421.453 2.143 10 20 HECD O=C(c1cncc(F)c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501059 UTQPTZQFPPHSQY-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CC1(C)CC(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1847036775 CRXKAGJJPZVNCH-FNORWQNLSA-N 400.475 2.456 10 20 HECD CC1CCN(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1847708847 XACAXGJFYXKQIV-IRXDYDNUSA-N 421.925 2.299 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 109180761 CPYAFTOFDPHLEF-FXAWDEMLSA-N 423.579 2.295 10 20 HECD CN(Cc1ccc(N(C)C)cc1)Cn1c(=O)oc2cc(S(=O)(=O)N(C)C)ccc21 725764684 BSTCSFYKHUQRIX-UHFFFAOYSA-N 418.519 2.000 10 20 HECD O=C(NC[C@@H](O)COCC1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726718175 AFLGWEDFDBYQSQ-QGZVFWFLSA-N 413.465 2.344 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NCCc3cccnc3)CC2)cc1 727694029 OBBPISWLDGRKSP-UHFFFAOYSA-N 413.591 2.309 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CSCN1C(=O)C(C)(C)C 729259067 HBQIRASVOOFGIK-GOSISDBHSA-N 405.564 2.429 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc2F)CC1 730132801 GGHKWCAXZBSDPP-FCHUYYIVSA-N 412.509 2.425 10 20 HECD CC(C)[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(N)=O 730508762 JYUOKXOTPZNBKI-BRADTZPFSA-N 411.574 2.356 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1F 732256611 JBEKENVTBLMFKD-UHFFFAOYSA-N 408.499 2.287 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 734065853 JZJWMAZCZLSKDY-QFIPXVFZSA-N 401.482 2.494 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 734504245 ZUUZGRPYQLCXPH-UHFFFAOYSA-N 415.512 2.050 10 20 HECD CC(C)[C@@H]1C(=O)NCCN1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905344 NKWABUDMIVMCHE-WMLDXEAASA-N 410.465 2.423 10 20 HECD COc1cc2c(cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)O[C@H](C)C2 746310094 NFSXEJJOBOMFEY-LLVKDONJSA-N 406.460 2.026 10 20 HECD COc1ccc(N2CCN(C(=O)c3cn(Cc4cccs4)nn3)CC2)cc1F 753739015 ONOSZCBDMCJJIN-UHFFFAOYSA-N 401.467 2.498 10 20 HECD Cc1nnc([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1 755137699 AVQFNDSSPSVEIN-MCIONIFRSA-N 405.474 2.098 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)co1 756660598 PDEDPISXBVEOQH-UHFFFAOYSA-N 411.443 2.492 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1Br 758178287 NSKHCHWBLWIUJL-UHFFFAOYSA-N 424.320 2.009 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc2c(c1)CCC(=O)N2C 758588088 WHDWBKONHHGOPN-UHFFFAOYSA-N 409.486 2.477 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)cc(OC)c2)cc1 767739822 UDRAVRNWXIVRRW-UHFFFAOYSA-N 400.478 2.266 10 20 HECD OC[C@@H](c1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768445019 DZGMCDDPYFWJJB-ICSRJNTNSA-N 404.894 2.323 10 20 HECD COCC[C@]1(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCOC1 770262264 RMFJQXHGPMBVFD-MRUHUIDDSA-N 409.502 2.434 10 20 HECD COC(=O)C[C@@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 772584682 YVRLHWPNJKHDCS-ZDUSSCGKSA-N 424.500 2.422 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H]1COC2(CCCC2)O1 773741787 NZXSBGMXTPBZEC-QGZVFWFLSA-N 407.486 2.272 10 20 HECD C[C@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775259678 XDHLCWOXPCIGGH-INIZCTEOSA-N 417.531 2.216 10 20 HECD Oc1c(Cl)cccc1CN[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1 776169686 OYLMDODBMZPTKG-MRXNPFEDSA-N 403.914 2.431 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnc2cc(C)ccn2c1=O 777825970 CQCCIMSNDJQBGL-UHFFFAOYSA-N 415.833 2.177 10 20 HECD COc1ccc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778220685 KXKPHJCJYXSVQK-QXMHVHEDSA-N 409.486 2.225 10 20 HECD COCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCC1 778242106 FGMVSYRMXAYBQD-QXMHVHEDSA-N 415.534 2.318 10 20 HECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)Nc1nc(-c2ccco2)cs1 780703893 OJAPJTZFNRVJOW-UHFFFAOYSA-N 413.502 2.454 10 20 HECD Cc1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3CCSCC3)cc2)no1 780821113 QXHGPGVOJZLLMI-KRWDZBQOSA-N 403.508 2.214 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1CCN(Cc2ccccn2)CC1 787143389 KBFUZZJDPSMBBQ-UHFFFAOYSA-N 421.545 2.079 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@H](C)O[C@@H](CO)C3)c2C)cc1 787314225 BFOBGNDAHNSMHG-HNAYVOBHSA-N 400.475 2.145 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O 792180558 ZMVNUKHDLISULQ-IBGZPJMESA-N 411.424 2.309 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1 792238270 NJAJHBSEYUKKDI-VOJFVSQTSA-N 414.380 2.210 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1F 793824161 BEPFJUGSXMUHMJ-UHFFFAOYSA-N 410.493 2.461 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCN(C)c1ccccc1F 793826975 MGWNGZULKSLRRV-UHFFFAOYSA-N 400.498 2.459 10 20 HECD COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ccc(OC)cc2O)c([N+](=O)[O-])c1 795284963 OJFGXKCMCZNRDO-LLVKDONJSA-N 403.391 2.212 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C)O[C@]3(CCCOC3)C2)cc1F 804852696 MDGXVTVWDIQHLH-OPAMFIHVSA-N 421.513 2.085 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807095336 OEPIWCJZUAOMQZ-JOCHJYFZSA-N 403.523 2.115 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(N(C)C)cc1 807670011 AYVZYEVPGBMBCR-GOEBONIOSA-N 415.925 2.373 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@]2(CCO[C@H](C)C2)O1 807673337 QWROJJGATKYKHE-TXXWUTRGSA-N 403.523 2.115 10 20 HECD Cc1nc(CN2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)cs1 807674315 JWOCBZICWOWRSX-OAHLLOKOSA-N 415.563 2.039 10 20 HECD COCC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccco1 807899490 STPWZOGYRTWGNF-ZWKOTPCHSA-N 416.474 2.387 10 20 HECD CN(C)CCN(C)CCCN(C)C(=O)NCc1ccc(N2CCSCC2)cc1 812005782 LVFPZGLDQNTBOU-UHFFFAOYSA-N 407.628 2.265 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H]2CCCS(=O)(=O)C2)cc1 815153248 KHJJNUNIERPESM-AZUAARDMSA-N 408.564 2.475 10 20 HECD CC(=O)c1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 815277988 ABNKCTTYLWKQHJ-UHFFFAOYSA-N 420.462 2.400 10 20 HECD Cc1cc(CCNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c(C)n1-c1ccccc1 880251070 PSWMNHSTMNZIHH-UHFFFAOYSA-N 417.469 2.414 10 20 HECD COCCNC(=O)CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 917955518 GIFALIGSJFTFPD-UHFFFAOYSA-N 408.296 2.349 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1789783900 HOQQGICHKPAJMT-SECIVOMGSA-N 422.909 2.391 10 20 HECD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)nc2ccccn12 1796601180 BVQYHLROHJZBQA-MUJYYYPQSA-N 421.457 2.015 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3[nH]cc4c3CCC4)CC2)C1 1810546539 IPKOOOOJMQNLRM-UHFFFAOYSA-N 424.501 2.468 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N(C)[C@H]3CCN(S(C)(=O)=O)C3)ccc21 552837765 XWNZIPFKCJSONH-KRWDZBQOSA-N 407.536 2.010 10 20 HECD Cc1ccc(CN(CC(=O)N[C@H](C)C(=O)N(C)C)c2ccc3c(c2)OCCO3)s1 727146721 AJJRHUOBUJLXPL-OAHLLOKOSA-N 417.531 2.427 10 20 HECD COC(=O)[C@H]1CC12CCN(C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 733849237 WECNMQDBUGUIOL-QGZVFWFLSA-N 419.497 2.272 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 736334951 XVNVUMCVLLBAMP-INIZCTEOSA-N 418.515 2.490 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1O 737278185 FUMPILXSPDWNOC-QGZVFWFLSA-N 400.431 2.214 10 20 HECD O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc(N4CCCCCC4)c3)cc2[nH]c1=O 741136520 XMIXYNNTYWLHBO-UHFFFAOYSA-N 414.487 2.398 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cc1c(C)[nH]c2ccnn2c1=O 743807813 HKYAZZIWMIJKCS-UHFFFAOYSA-N 419.279 2.390 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1nc(CC(=O)NC)no1 749806867 HRXRYDAEWQGCST-UHFFFAOYSA-N 415.475 2.305 10 20 HECD COC(=O)[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 752338480 WYSKRTWNIAEMQJ-INIZCTEOSA-N 408.366 2.052 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(Br)nn1C 758792075 UMOOXBNMGXKQBX-UHFFFAOYSA-N 409.284 2.064 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccnc(OCC(F)F)c3)CC2)cc1 758798480 MRXFGIUNFZAOGU-UHFFFAOYSA-N 420.460 2.286 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCO[C@@H](C)C3)CC2)cc(OC)c1OC 759296834 GATPXSOECYGHFG-HOTGVXAUSA-N 407.511 2.359 10 20 HECD COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCCc2ccc(O)c(O)c2)c(OC)c1 762261124 HOYINUNBVNOVCI-KRWDZBQOSA-N 414.458 2.079 10 20 HECD CN1CCC(N2CC[C@H](NC(=O)NCc3cccc(Br)c3O)C2)CC1 764785177 STODZXVJRUJGAU-AWEZNQCLSA-N 411.344 2.122 10 20 HECD CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NCc1ccc(N(C)C)c(F)c1 768352824 SALSMJSSXZTFFL-SFHVURJKSA-N 424.517 2.173 10 20 HECD O=C(CN1CCc2cc(F)ccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 768819161 WWWZURJWNJHUPO-UHFFFAOYSA-N 401.457 2.476 10 20 HECD COc1ccc(O)c(CNC(=O)CS(=O)(=O)Nc2ccc(OC(C)C)cc2)c1 769540130 CMAXJKOKHFGSDO-UHFFFAOYSA-N 408.476 2.246 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cccc(CN4C(=O)CNC4=O)c3)c2)CC1 770155234 TXUXZBKZAPFVGB-UHFFFAOYSA-N 421.501 2.133 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 773618196 IOESSWMDVSBLQD-SJLPKXTDSA-N 418.538 2.257 10 20 HECD Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(C(=O)c3cccc(O)c3O)CC2)c1C 776327610 LIYBJUGKPNEKFG-UHFFFAOYSA-N 418.515 2.478 10 20 HECD COc1c(F)cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1[N+](=O)[O-] 777919219 HCQCFZVQOVZCBV-UHFFFAOYSA-N 401.391 2.426 10 20 HECD COc1cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cnc1Cl 780408105 AIACERNUAWAPIV-UHFFFAOYSA-N 424.910 2.213 10 20 HECD COC(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 781522680 CVASBYFFJNFEAM-UHFFFAOYSA-N 400.406 2.452 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 785295594 WYTUVSXZIXBQMZ-KSSFIOAISA-N 414.458 2.342 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cnn1-c1ccccc1F 785298665 YAXMAXIFYMEXDZ-LBPRGKRZSA-N 412.421 2.417 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCOc3ccccc3)CC2)cc1 785587327 JKAATYDCFSKSSW-UHFFFAOYSA-N 411.502 2.366 10 20 HECD O=C(NCCc1c(F)cccc1F)C(=O)NCc1ccc(N2CCSCC2)cc1 787916654 YCHAPSLDCDBIJA-UHFFFAOYSA-N 419.497 2.493 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 788270594 MGAFBWLCHSFLAK-WBVHZDCISA-N 418.538 2.446 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCN(c2ccccc2)C1 788824745 VKPCUXWYPGVLSF-HXUWFJFHSA-N 404.514 2.322 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cc1 788976292 WHQRJNCAZBMBGM-HNNXBMFYSA-N 414.472 2.244 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 789666470 ARLIHRJQZAJATP-NRFANRHFSA-N 408.546 2.492 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1COCCN1C1CCCC1 789977392 RGBFWNRALLGXAR-JOCHJYFZSA-N 401.551 2.155 10 20 HECD C[C@H](NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 797087688 SRNVAGXLRQDPBS-OHSMVPPVSA-N 418.557 2.397 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c(O)c1 797389170 SYBIKMIKAGPTMK-UHFFFAOYSA-N 405.838 2.011 10 20 HECD O=C(NC[C@H](CO)[C@H]1CCOC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797445274 SHZDLZURAVSZFV-LSDHHAIUSA-N 413.465 2.201 10 20 HECD C[C@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803297601 BFDZISBSYSGXPS-CEXWTWQISA-N 416.566 2.080 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)[C@H]2CCCc3ccccc32)cc1F 803661822 ASGCYNXDIMXKJA-FQEVSTJZSA-N 413.493 2.406 10 20 HECD Cc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803686511 BTCVZVZWOGFUON-UHFFFAOYSA-N 406.530 2.342 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O 808193711 MBZQMHMIWPMYEP-LJQANCHMSA-N 424.501 2.228 10 20 HECD CCS(=O)(=O)NC1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 809736504 XTFLBJTTWZWGJT-UHFFFAOYSA-N 410.540 2.489 10 20 HECD CC(C)OCc1cc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CC(=O)N3)ccc1O 811704181 XFFJVZMZLRJKDH-UHFFFAOYSA-N 419.459 2.399 10 20 HECD COc1cc(N2CCN(C(=O)c3ccnc(-c4ncc[nH]4)c3)CC2)cc(OC)c1OC 816100531 IGHAHFRIGLHFET-UHFFFAOYSA-N 423.473 2.460 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C(F)(F)F)n1 918372104 LHEVCPXSSSYUKB-ZDUSSCGKSA-N 409.412 2.071 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccccc1-n1ccnn1 918441306 YDQJSWGNGGEUTH-UHFFFAOYSA-N 422.514 2.075 10 20 HECD COCCOc1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919879520 IIQNMXUBXHZNKM-UHFFFAOYSA-N 404.488 2.199 10 20 HECD COc1ccc(N(C)CC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1OC 920418796 JMZMIFWELQBDJX-UHFFFAOYSA-N 421.519 2.337 10 20 HECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C/c1ccc(O)c(O)c1 1179682973 GGSPJOXGIOQJNA-LOWQCSRCSA-N 420.462 2.122 10 20 HECD CC1=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CCO1 1817845025 UWAYUXMYKJIHSN-OAHLLOKOSA-N 413.434 2.216 10 20 HECD CC(C)Oc1ccccc1/C=C1\SC(=S)N(CCNS(C)(=O)=O)C1=O 727177472 KHPRXSJMULURGC-UVTDQMKNSA-N 400.547 2.224 10 20 HECD O=S(=O)(c1ccccc1)N1CCC(CNCc2cc3c(cc2O)OCO3)CC1 729683866 DREOOPTWYSZUNB-UHFFFAOYSA-N 404.488 2.311 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4cnn(C)c4)C3=O)c2C)cc1 735477887 WUCDTKZVZMEXSX-HXUWFJFHSA-N 407.474 2.372 10 20 HECD CS(=O)(=O)Nc1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739766465 RDOBHRFKUXTCCM-UHFFFAOYSA-N 416.503 2.012 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CN(Cc2ccccc2)CCO1 741180996 NFZJGVAOSNKECP-QFIPXVFZSA-N 413.493 2.180 10 20 HECD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 742632595 CTQWWBXSEBZFTO-UHFFFAOYSA-N 405.476 2.472 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1O 745637080 PXYBFVJVAGAWPJ-UHFFFAOYSA-N 419.503 2.185 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(OCCN2CCCC2)CC1 745746621 APOKICGDHMJSLJ-UHFFFAOYSA-N 416.566 2.310 10 20 HECD COC(=O)c1ccc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 751034173 WWWAUURZTRHDMQ-UHFFFAOYSA-N 424.906 2.442 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc(S(N)(=O)=O)c1C 751294905 SIEIVQJLOOHGJT-SFHVURJKSA-N 418.515 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)c3c[nH]n4c3nc(=O)c3ccccc34)CC2)cc1F 753737155 ALTGCXCUSXLOFP-UHFFFAOYSA-N 421.432 2.286 10 20 HECD C[C@H](NC(=O)N[C@@H](CO)C[C@H](O)c1ccccc1)c1ccc(N2CCOCC2)cc1 754584932 YQLAOOCPMWCZOS-WEYGHZABSA-N 413.518 2.368 10 20 HECD O=C(NCCCSc1nccs1)NCC(=O)N1CCN(c2ccccc2)CC1 759577112 ZKAANUCNIBNHLO-UHFFFAOYSA-N 419.576 2.273 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccc(C)o1 759775801 WVHZIORTDKSZIE-UHFFFAOYSA-N 419.497 2.329 10 20 HECD COc1cc(N2CCN(C(=O)c3cnn(-c4cccnc4)c3)CC2)cc(OC)c1OC 760084661 OOLLCSBZNLMIOD-UHFFFAOYSA-N 423.473 2.256 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 762082963 NOXFSLHBPNTXBJ-UXLLHSPISA-N 406.502 2.249 10 20 HECD CC(C)NS(=O)(=O)c1cccnc1NCc1ccc(N2CCC(O)CC2)c(F)c1 763013374 LQMGKBSZYYVTDN-UHFFFAOYSA-N 422.526 2.481 10 20 HECD Cc1nn(C)c(=O)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 765177693 PORRRJLJLAORCE-MRXNPFEDSA-N 404.898 2.151 10 20 HECD O=C(CN1C(=O)NC2(CCCCC2)C1=O)NCc1cccc(Br)c1O 765732881 UKTXBEKWXFXUIB-UHFFFAOYSA-N 410.268 2.026 10 20 HECD COc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1[N+](=O)[O-] 766474994 QHWXPVCHELZFFR-UHFFFAOYSA-N 405.432 2.091 10 20 HECD CN(C)C(=O)c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1Cl 769733365 WXBBMHDZRUXHLU-UHFFFAOYSA-N 411.867 2.371 10 20 HECD C[C@H](NC(=O)N1CCC2(CCN(C)C2=O)CC1)c1ccc(N2CCOCC2)cc1 770345701 LWXBVTZEJXIFMK-KRWDZBQOSA-N 400.523 2.238 10 20 HECD C[C@@H](NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc(N(C)C)cc1 773088104 MAPQFZJRMBLEMK-OAHLLOKOSA-N 415.515 2.419 10 20 HECD CN1C(=O)CCc2cc(CNCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccc21 775305802 SAOYGADZKAESAE-UHFFFAOYSA-N 413.543 2.120 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 775376398 VYGZQFAPMNIJSY-OAHLLOKOSA-N 414.462 2.308 10 20 HECD O=S(=O)(c1cnn(CC(F)F)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 777963743 YQGLNSOUWKKTKB-CQSZACIVSA-N 401.435 2.224 10 20 HECD CC(C)OCC[C@@H](O)CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 788065217 BVCYARBRJAXEMJ-LJQANCHMSA-N 417.529 2.208 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)c1 788911111 OQKAIOASSRLPEW-LJQANCHMSA-N 422.529 2.307 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCCNCc2c(O)ccc(Cl)c2F)c1 790957773 CGVGRWZEJLMOPY-UHFFFAOYSA-N 403.819 2.161 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1 792702388 RXYMTLAIDWGTBB-NSHDSACASA-N 422.484 2.352 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1 792702719 YBSIQVFQCNZDAB-UHFFFAOYSA-N 414.530 2.356 10 20 HECD C[C@H](COc1ccccc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793688537 UVQAWXQXFHBFCJ-GOSISDBHSA-N 411.502 2.065 10 20 HECD C[C@H](NC(=O)C(=O)NCCCOC1CCCC1)c1ccc(N2CCOCC2)cc1 803297573 ACQFBMGDIGJCIO-KRWDZBQOSA-N 403.523 2.166 10 20 HECD Cc1nc(C)c(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803300875 WOAHPBLGDLFGPI-AWEZNQCLSA-N 416.547 2.133 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664040 FLJDCSAXRUOZHF-UZLBHIALSA-N 412.509 2.145 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3nc4c(s3)CCCC4)ccc21 803688173 LICYSRZIQNQDHJ-UHFFFAOYSA-N 412.559 2.379 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804060157 MUYODYRLNPYAJN-VQTJNVASSA-N 415.534 2.033 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC[C@H](C)C3)cc2F)CC1 805007759 PHQTZHBFRYOIQE-IRXDYDNUSA-N 404.530 2.136 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807545112 BZTYCAAIFPTRJE-PGRDOPGGSA-N 408.546 2.348 10 20 HECD CCN(CC)CC(=O)Nc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 808119118 GGHRMWWJYBLMLJ-UHFFFAOYSA-N 403.464 2.304 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C 809404983 MCCWTFXZNSSJRF-WBMJQRKESA-N 424.339 2.102 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3C[C@H](OC(C)C)C3(C)C)CC2)cc1 809438418 RIELFRAYBXBHOF-PMACEKPBSA-N 417.550 2.442 10 20 HECD COc1cc(Br)cc(CN2CCC[C@H]2C[C@]2(C)NC(=O)NC2=O)c1O 809705791 ZUTCAJHPYKLWTR-SJCJKPOMSA-N 412.284 2.116 10 20 HECD COCCn1nnc2c1CCN(C(=O)NCc1ccc(N3CCC(C)CC3)cc1)C2 814366597 QIYQYXJQISFLPM-UHFFFAOYSA-N 412.538 2.429 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)n1 815470993 RBIPYSVTCLAFSN-SNVBAGLBSA-N 421.475 2.124 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCN([C@H]2CCSC2)CC1 816891433 SBHYTAXHEILZJY-SFHVURJKSA-N 407.555 2.496 10 20 HECD Cc1cccc(O[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337588 BBAILNUFOKVZAL-KRWDZBQOSA-N 402.516 2.314 10 20 HECD CCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918440621 SZZHJHBFZNOAPX-UHFFFAOYSA-N 415.465 2.440 10 20 HECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 920036949 JSTSVQGBYOBDLN-QTJNJRLBSA-N 407.470 2.154 10 20 HECD Cc1oc2c(CN(C)CCNS(C)(=O)=O)c(O)ccc2c(=O)c1-c1ccccc1 1318513776 JKXHFPSHYHGVFN-UHFFFAOYSA-N 416.499 2.455 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cncs1 1796932733 YCICAIRFZHOATF-RBVVOMGSSA-N 423.498 2.188 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccc1 1821833940 ITOUTPHOKFMVTM-ZDUSSCGKSA-N 410.455 2.489 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)C3CC3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1827464586 WDDJTPCAFXNLLX-CYBMUJFWSA-N 423.498 2.258 10 20 HECD O=C(c1cc2cccnc2s1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249545 WWVWAPYYKDCNMO-UHFFFAOYSA-N 410.455 2.233 10 20 HECD O=C(c1ccoc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249953 UEKYOXLUYYAJDL-UHFFFAOYSA-N 411.336 2.235 10 20 HECD Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 47293730 HZPLXTYOLOULQS-UHFFFAOYSA-N 413.493 2.450 10 20 HECD NS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1 139511925 AQUKIGSIDUKUQZ-UHFFFAOYSA-N 414.531 2.118 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2OC(F)F)SC1=S 727177327 GPDHEIJJMUNTFP-DHZHZOJOSA-N 408.473 2.038 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 729062578 SKPAGJAQIYBEJG-GFCCVEGCSA-N 406.410 2.381 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](CO)Cc3ccccc3)cc2F)CC1 730134526 DPDVMTANUOLAOM-FQEVSTJZSA-N 414.525 2.370 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCc3ccccc3)cc2)C1 733039093 JXWUTXDVOQANQR-OAQYLSRUSA-N 424.545 2.135 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ccn(C(C)C)n3)CC2)cc1 735168183 DKYJDCZPWKZKES-MUUNZHRXSA-N 404.536 2.070 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCN(C(C)C)C3)CC2)cc1 743319817 ORNLUIOJXDZOLO-FQEVSTJZSA-N 417.598 2.237 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(-c3ccncc3)cs2)c1 748304059 SBXHVMHMDKPFPY-UHFFFAOYSA-N 418.500 2.255 10 20 HECD COCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCCO1 752850602 KRFRCAKMUVWFHD-QGZVFWFLSA-N 419.501 2.468 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@H]1C(=O)NCc1ccc(N(C)C)cc1 753782236 ODYNUUZUBPPGMM-ISWURRPUSA-N 423.435 2.354 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H](C)C(=O)N3CCCC[C@H]3C)CC2)cc1F 753894009 QXQTXUPPLABZHK-HZPDHXFCSA-N 406.502 2.455 10 20 HECD C[C@H](NC(=O)NCCCSc1nccs1)c1cccc(S(N)(=O)=O)c1 759546242 LYCPRHQUQFWMIR-NSHDSACASA-N 400.551 2.333 10 20 HECD CC[C@H](CN1CCCC1)NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760127043 BVWSDHGIIDWLBY-QGZVFWFLSA-N 420.554 2.418 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[S@](=O)C[C@H](C)C2)c([N+](=O)[O-])c1Br 763039994 DDKWOJPYSCGQLA-VPCRFOHKSA-N 422.257 2.479 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 767939050 QBGVYSZNSNDYSV-YADHBBJMSA-N 416.566 2.090 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H]3c3nncn3C)cc2F)CC1 768066935 AINUQRWAVSBODL-IBGZPJMESA-N 415.517 2.143 10 20 HECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3cc(C)ccc3O)CC2)c1 768201576 VADHRPWZGUFMAS-UHFFFAOYSA-N 406.504 2.224 10 20 HECD C[C@@H](Sc1nncn1C)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913279 XSKFYNJXRJNGBN-IUODEOHRSA-N 409.943 2.436 10 20 HECD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913768 AOGGRIJUPGLADA-OAHLLOKOSA-N 407.858 2.321 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c2ncccc12 770727768 OZCXUTDXUALRRF-UHFFFAOYSA-N 420.469 2.335 10 20 HECD CC(C)(C)n1nccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 772209796 SFADSCMEWJZOGD-MRXNPFEDSA-N 400.479 2.490 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 772448742 XKTLIGFHXJYXSH-ZWKOTPCHSA-N 412.577 2.391 10 20 HECD CN(Cc1ccccc1O)C(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 776245191 QUOOYXAKFPPMEF-UHFFFAOYSA-N 407.467 2.413 10 20 HECD CC(C)(C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccnc1 781255545 CBPFJTRTPWAJDN-UHFFFAOYSA-N 415.465 2.195 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)cc1 785424629 RQFWETWAWGDAJO-UHFFFAOYSA-N 408.546 2.397 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3CCCCC3)cc2)C1 788439323 ISWDYHUIZHHZAE-IBGZPJMESA-N 414.550 2.091 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCOC(F)(F)F)CC2)cc1 788692198 WWZVKLVHONUDSX-UHFFFAOYSA-N 404.433 2.043 10 20 HECD CN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCN(Cc2ccccc2)C1=O 788746740 JRXSOVKYOGWYSD-QFIPXVFZSA-N 422.529 2.466 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C[C@H]2COc3ccccc3O2)cc1 788940830 WEAIRNWLAIKWBV-IBGZPJMESA-N 411.502 2.447 10 20 HECD CS[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789824225 HEWCXODIRNUYTJ-NXNVCVFFSA-N 423.554 2.456 10 20 HECD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 791372632 FLHFUUYTJOSJLV-UHFFFAOYSA-N 406.389 2.346 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1)c1ccc(N2CCOCC2)cc1 793647243 USLJIWRSFRCNPR-DLBZAZTESA-N 411.502 2.070 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)cc1F 793860559 BIUKAMWQYHAMEE-INIZCTEOSA-N 416.472 2.290 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)cc1F 804853448 YDGHWYPMORHXMD-WCJKSRRJSA-N 421.513 2.083 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cnn4ccccc34)cc2)C1 805783096 SGOODPGQLWQHMI-QGZVFWFLSA-N 406.490 2.035 10 20 HECD CNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 806457598 PGRPQQOHNFAIDW-INIZCTEOSA-N 422.501 2.207 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806539529 RNVLUGJDAMZVEB-QGZVFWFLSA-N 403.523 2.374 10 20 HECD COCCn1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(=O)cc1C 806823564 XECLITVETYIIFF-GOSISDBHSA-N 400.475 2.330 10 20 HECD COc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc(OC)c1 807387195 CNIAPGRRGQOGRR-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CO[C@@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807768157 DBWPGHOSFSMHME-YOEHRIQHSA-N 413.465 2.160 10 20 HECD CCOC1CC(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 809810016 IHVFHCICYCNVFE-AVAKVYKDSA-N 404.507 2.221 10 20 HECD CNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)c(COC(C)C)c1 811705080 IXUZXCPFOIENFP-UHFFFAOYSA-N 414.505 2.026 10 20 HECD COCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284897 UGSSKVAYVVMBGL-UHFFFAOYSA-N 401.438 2.064 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1C[C@@H]1c1ccc(F)cc1 918340786 VCSCEGQTBAWURA-UXHICEINSA-N 402.491 2.480 10 20 HECD Cc1c[nH]cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 920578986 BHSHMJUFNIBWCQ-UHFFFAOYSA-N 415.471 2.418 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)c1ccc(Cl)cn1 1342915784 LLAPRNOUSYBSOY-HNNXBMFYSA-N 420.849 2.400 10 20 HECD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)co1 1827427241 SVNQEVSPTCHQNP-KRWDZBQOSA-N 414.462 2.336 10 20 HECD Cc1csc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1842042120 IFQRCXCHZONMRM-UHFFFAOYSA-N 401.488 2.313 10 20 HECD Cc1ccc(O)c(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847038519 UQHDXTMKZOWIJZ-VMPITWQZSA-N 424.453 2.348 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(c3ccccc3)CCOCC2)c1 726981376 SAEJJJXLTWISGX-UHFFFAOYSA-N 404.488 2.242 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1 729535503 SDLGCJAQDYSBBW-OGWOLHLISA-N 414.458 2.350 10 20 HECD CN(C)c1ccc(CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F 731051821 QTXQCNSSUIJXRX-UHFFFAOYSA-N 408.817 2.500 10 20 HECD CCOCCN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 732451476 WKYLTZVBIHUODU-HDICACEKSA-N 422.545 2.303 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(N(C)C)CCOCC3)cc2F)C[C@@H](C)O1 733847727 HLYMZWBZVUCHDU-CALCHBBNSA-N 422.545 2.349 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](OCCO)C1 734485157 BLLATDVBAVFFGT-CVEARBPZSA-N 422.481 2.262 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(C(=O)N(C)C)c(C)c3)CC2)cc1 740874022 UNIIFESFPOZRFA-UHFFFAOYSA-N 410.518 2.466 10 20 HECD CN(C1CCOCC1)S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742334546 PGLAZYAOPRPGLQ-CQSZACIVSA-N 419.494 2.202 10 20 HECD CNC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 745903259 FCOBWXLWPZDMMK-GJZGRUSLSA-N 410.465 2.424 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1N1CCOC1=O 746792403 DEJIZQPMHBHUPM-UHFFFAOYSA-N 414.437 2.412 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 746805293 PICWHNALTKQVMX-IIDMSEBBSA-N 421.538 2.415 10 20 HECD COC(=O)[C@H](O)C1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 747516709 GKXBMTVPPWMFLT-HXUWFJFHSA-N 400.475 2.489 10 20 HECD Cc1nnc2n1C[C@@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 750729534 OYXDDUPCRZVJGO-HNNXBMFYSA-N 423.439 2.321 10 20 HECD C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)Nc1ncnc2[nH]cnc12 751945951 SJNZKXRGBSISHH-JTQLQIEISA-N 423.458 2.166 10 20 HECD COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 753523253 WMXCQPZVCHQTTF-UHFFFAOYSA-N 407.404 2.458 10 20 HECD CO[C@H]1CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H]1OC 753809669 XHWKLWHLFSDMPO-FASAQXTFSA-N 408.454 2.135 10 20 HECD CNC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753884709 KCZFKCWXTMUFLX-UHFFFAOYSA-N 416.453 2.313 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 754041586 CNUYCGHZYOLIPO-CEMLEFRQSA-N 405.583 2.314 10 20 HECD O=C(CN1CCOc2ccc(F)cc21)NCc1ccc(N2CCOCC2)c(F)c1 756055360 HWJGIEJOEPIRSS-UHFFFAOYSA-N 403.429 2.317 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)N(C)Cc2ccccc2O)c(OC)c1 756770956 WJYKAKMXVAGJBV-UHFFFAOYSA-N 424.457 2.251 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)c1 760105305 RDCLOGCLNSFAAT-UKRRQHHQSA-N 400.431 2.384 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCCN3CCCO[C@@H](C)C3)CC2)cc1 764368199 LAXCFJYKHKBJOU-SFHVURJKSA-N 404.555 2.464 10 20 HECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)n1 768726331 GVHJADAEYPYOMM-UHFFFAOYSA-N 411.487 2.383 10 20 HECD CN1CCC(N(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 769570380 NQCABQXDHIJODW-UHFFFAOYSA-N 409.533 2.421 10 20 HECD COC(=O)c1cc(C)ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772898867 ZZVKZTZNKUKLBV-UHFFFAOYSA-N 416.449 2.453 10 20 HECD COc1cc(OC)cc(N2C[C@@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)c1 773740771 SWAHVFLHQPHEKB-HIFRSBDPSA-N 414.458 2.215 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1)c1ccc(N(C)C)cc1 773843896 BGQWHHSVNHRQIV-MRXNPFEDSA-N 419.485 2.174 10 20 HECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773847056 MSVAWMUSVIXQFG-HNNXBMFYSA-N 417.531 2.422 10 20 HECD CC[C@@H]1CN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCS1 778297051 FVQVIOSFBYTIMB-OLHLWXQYSA-N 403.548 2.254 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 785191993 IMZBPNALJPLRCJ-UHFFFAOYSA-N 409.284 2.438 10 20 HECD CN(C)Cc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 788422419 VBNYEELDVNBXHP-UHFFFAOYSA-N 403.548 2.406 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@@H]21 788921072 UJOJCMVBFWRPHV-KMKNWIINSA-N 411.546 2.423 10 20 HECD COc1ccc(N2CCC(NC(=O)N(C)CCN3C[C@H](C)O[C@H](C)C3)CC2)cc1 788957201 IJTCUODVXOMZCS-HDICACEKSA-N 404.555 2.415 10 20 HECD C[C@H]1CCSCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822409 WNRZXEYOZUDHRJ-ARFHVFGLSA-N 423.554 2.410 10 20 HECD CSCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826242 PISGJBAKKMRDSG-KFWWJZLASA-N 411.543 2.313 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 790409038 LFEXWPWDQBSZHR-GFCCVEGCSA-N 420.443 2.029 10 20 HECD Oc1cc2c(cc1CN1CCN([C@@H]3CCN(Cc4ccccc4)C3)CC1)[C@@H](O)CO2 795696794 DIMAELKYSIWROH-OFNKIYASSA-N 409.530 2.210 10 20 HECD CCOC(=O)c1ncn(C2CCN(c3cc(OC)c(OC)cc3[N+](=O)[O-])CC2)c1N 798214589 JLHOMNBQFIOOKV-UHFFFAOYSA-N 419.438 2.409 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@](C)(c4ccccc4)C3)ccc21 803685662 HXKKIBYXIPAMRS-DEOSSOPVSA-N 407.514 2.459 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@H](c4ccccc4F)C3)ccc21 803687082 TXBQNDDYGKDRDL-NRFANRHFSA-N 411.477 2.424 10 20 HECD C[C@@H](NC(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 804313396 YRNJFQPOYNDDPD-OAHLLOKOSA-N 418.538 2.446 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCC2(C)OCCO2)cc1 806372596 KOCKKTYAYWREIB-UHFFFAOYSA-N 415.490 2.144 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(CNS(C)(=O)=O)CC2)cc1F 806772560 SDMHJEQMSDYQIQ-UHFFFAOYSA-N 414.547 2.143 10 20 HECD Cc1cc(C)cc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 807429429 RXNCVPYXCLDMQF-UHFFFAOYSA-N 409.530 2.457 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 807674527 MKRIMPAUVRNUJS-UONOGXRCSA-N 403.483 2.069 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cnc1C 813671425 NIUBHRNLVHZZKY-MRXNPFEDSA-N 420.487 2.252 10 20 HECD CN(C/C=C/C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CC(F)(F)F 814588857 XQACVOXNSYTGKM-WMHVBEDNSA-N 412.456 2.055 10 20 HECD C[C@@H]1[C@@H](N(C)C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816767490 ZVJMAHOMDIMHOQ-DOMZBBRYSA-N 409.533 2.419 10 20 HECD CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 816922108 RBLXJELNCZOYNM-VQIMIIECSA-N 410.536 2.006 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 915922993 RXJCWNNOVXKPLG-UXHICEINSA-N 405.539 2.440 10 20 HECD O=C(Cn1cc(Br)ccc1=O)NCc1ccc(N2CCSCC2)cc1 917387161 SBEZCIKEAKTABB-UHFFFAOYSA-N 422.348 2.480 10 20 HECD Cc1cc(C(=O)OCC(=O)NCC(=O)N2CCCC2)c(C)n1-c1ccc(F)cc1 921417830 RCOARMGCPZOPJS-UHFFFAOYSA-N 401.438 2.129 10 20 HECD O=C(/C=C/C1CC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1784129445 FPDOGPBQVMXPAV-GGNBYKKCSA-N 420.893 2.311 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)n(C)c2ccccc12 472813008 RDBSELUYBXNBEN-UHFFFAOYSA-N 403.446 2.026 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3(O)CCOCC3)c2C)cc1 729026764 PDEQOGHOKCLIKM-UHFFFAOYSA-N 415.442 2.148 10 20 HECD CCC(CC)N1C[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1=O 729328858 WTSWXHBGNPJAGL-QZTJIDSGSA-N 414.550 2.042 10 20 HECD NS(=O)(=O)c1cc(F)cc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1 735749846 MGPRHWZELXIIEO-UHFFFAOYSA-N 424.523 2.348 10 20 HECD Cn1ccnc1[C@](O)(CCNC(=O)NCc1ccc(N2CC=CC2)cc1)C(F)(F)F 740909895 SGJMFEWHGFORGB-LJQANCHMSA-N 423.439 2.436 10 20 HECD Cc1ccc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c(F)c1 745965236 UKIGNGLORQUPGN-UHFFFAOYSA-N 418.471 2.469 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC34CCC4)cc2F)C[C@@H](C)O1 749542939 JNRHOTZSDRNGDO-CALCHBBNSA-N 405.514 2.310 10 20 HECD COc1cccc(CNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c1O 751304592 CZQALGZQJBCQJK-UHFFFAOYSA-N 418.393 2.171 10 20 HECD Cc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(O)n1 755230900 JEULFBDCEBFWCI-UHFFFAOYSA-N 420.416 2.421 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 758184107 DSLVXEQXMJIHGJ-VWNXMTODSA-N 424.589 2.042 10 20 HECD CCc1nn(C)cc1NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760010244 YIQSTCQGOOISEX-UHFFFAOYSA-N 403.483 2.362 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)CCCC(F)(F)F)cc1)C1=S=CC=C1 766678894 QYWSJDJUSLLEGE-UHFFFAOYSA-N 420.434 2.305 10 20 HECD Cc1ccc(O)c(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1 768202185 YSAZQLZRSAIYHD-UHFFFAOYSA-N 405.476 2.335 10 20 HECD C[C@H](OC(=O)C1(CCO)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 770547786 WLEUXQVYOCLQHT-ZDUSSCGKSA-N 407.422 2.495 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncccc3C(F)(F)F)nc12 771117616 PNIFBNGKFNPSHZ-UHFFFAOYSA-N 410.308 2.382 10 20 HECD CN1CCN(c2ccc(CNCc3ccc(C(=O)N4CCOCC4)cc3)cc2)CC1 771824369 XSKCASHNVWOJBI-UHFFFAOYSA-N 408.546 2.201 10 20 HECD O=C(NCCc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774655241 ROMJOJBYCCTTDK-UHFFFAOYSA-N 419.884 2.291 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1 776494938 RWAALXQSAHVXJM-CQSZACIVSA-N 409.895 2.426 10 20 HECD CC[C@H]1CN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCS1 778297052 FVQVIOSFBYTIMB-QWUACUGRSA-N 403.548 2.254 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccccc3O)CC2)cc1 778325937 LMUHKZTUPGMVOO-VAWYXSNFSA-N 409.486 2.264 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3ccccc3C)CC2)cc1 778350285 QLUGAHGADHXTEU-SSSWZJSRSA-N 423.513 2.058 10 20 HECD C[C@@H](NC(=O)N1CCN(CC(C)(C)O)C[C@H]1C)c1ccc(N2CCOCC2)cc1 780338126 JHUQEBGNSIYUQK-QZTJIDSGSA-N 404.555 2.071 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 781476708 BVPWOZJHHUQJMK-UHFFFAOYSA-N 417.412 2.389 10 20 HECD CCOc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)O[C@@H](C)C2 785426459 ZQMKKWQLMIAKNC-HNNXBMFYSA-N 411.502 2.407 10 20 HECD O=C1CC[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 785896777 KBESSPZIFXVNQQ-HXUWFJFHSA-N 412.511 2.298 10 20 HECD O=C(NCCc1cccnc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 786648134 HLVMAOMBORXNMU-UHFFFAOYSA-N 418.444 2.127 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C[C@H](O)C[C@@H]3C(=O)OC)c2C)cc1 788602544 QSAHHTCVBQXYPU-YLJYHZDGSA-N 400.475 2.284 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](CN(C)CC3CC3)C2)cc1 788929402 VPAQPMHZRNJZQP-HXUWFJFHSA-N 400.567 2.339 10 20 HECD CC[C@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842690 GIPGZJGYNOSMMK-OAHLLOKOSA-N 411.543 2.003 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864060 LPPPTLMQJAJUCA-LJQANCHMSA-N 418.607 2.093 10 20 HECD Oc1ccc(Cl)c(F)c1CN1CCN(Cc2nnnn2-c2ccccc2)CC1 792167788 RTLSTAVOJRCDTE-UHFFFAOYSA-N 402.861 2.478 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(-n2cnnn2)c(C)c1 802610816 SVNSYVURNUVRIT-UHFFFAOYSA-N 408.462 2.444 10 20 HECD CC1(C)CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803448405 QMKGIMGQYHPCKR-UHFFFAOYSA-N 411.449 2.010 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1nc2c(s1)CCCC2 804086526 YVXQZRHTMXVENA-UHFFFAOYSA-N 400.548 2.371 10 20 HECD CC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@H](C)S1(=O)=O 804990384 XXLXFCVLOMSGTC-FRQCXROJSA-N 409.552 2.191 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccc(N(C)C)cc1 807671469 PMLAELNXABQNHP-HZPDHXFCSA-N 418.538 2.398 10 20 HECD CCc1cc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)ncn1 807679470 SEWIXTLPTYTEIF-INIZCTEOSA-N 424.549 2.067 10 20 HECD COC(=O)C1(CS(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCCC1 809818428 IOLPXFQKDGAYIU-QGZVFWFLSA-N 411.520 2.436 10 20 HECD COc1cc(Br)cc(CN(C)Cc2ccccc2S(N)(=O)=O)c1O 816627695 URICHUZXCKUTHL-UHFFFAOYSA-N 415.309 2.443 10 20 HECD C[C@H]1CN(c2cccc(F)c2)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 817030009 VHDPRUABPONNGB-ZDUSSCGKSA-N 407.467 2.254 10 20 HECD Cc1cc(C(=O)NCC(=O)Nc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccccn1 914848112 VZNULARMXCVCEJ-UHFFFAOYSA-N 404.430 2.440 10 20 HECD COCCOc1ccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 916512942 PZRKBUPSDRRGIG-UHFFFAOYSA-N 414.506 2.285 10 20 HECD C[C@H](NC(=O)N1CCN(C[C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 920921584 MOTYTBBNJVZTSO-GHTZIAJQSA-N 402.539 2.090 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C)c1-c1ccccc1 1338286439 BDHAYIPFCDNYMM-KRWDZBQOSA-N 409.442 2.403 10 20 HECD CC/C=C(\C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509966 DKOFMZMAGLMYMD-PITQSHOHSA-N 416.474 2.003 10 20 HECD O=C(Cc1cscn1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1810067472 ROXPFUFUBIDMEA-UHFFFAOYSA-N 416.503 2.037 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1)CC2)c1cc(O)nc(O)c1 1816728794 VHXINTDFFZYPBY-JQWIXIFHSA-N 420.516 2.071 10 20 HECD CCN1CCN(CCCCNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 110464719 QJIVFXOFCSVLJG-UHFFFAOYSA-N 417.598 2.381 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CC(=O)OC(C)(C)C)cc2F)C[C@@H](C)O1 725800735 QDIFFHZKHFERQP-HZPDHXFCSA-N 423.529 2.329 10 20 HECD COc1ccc(O)c(CNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c1 734017319 CFVDPWCCJKRPGK-UHFFFAOYSA-N 414.487 2.473 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 734219954 CLRJYIXXNKCTCW-OALUTQOASA-N 402.539 2.312 10 20 HECD CC(C)(C)C(=O)Cn1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1 748040650 NAOGVMBFUQUWNF-MRXNPFEDSA-N 400.479 2.420 10 20 HECD NC(=O)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 752021825 UVVTZYLKGVDHQH-LBPRGKRZSA-N 408.405 2.448 10 20 HECD NC(=O)NC1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 757235252 OWAUYCGXDTXMJI-CQSZACIVSA-N 411.453 2.099 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](OC)C(F)(F)F)CC2)cc(OC)c1OC 759265180 FPNZUJSFIHSUTR-OAHLLOKOSA-N 421.416 2.121 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Oc3cccc4c3OCCO4)CC2)cc1 761011653 QFCARPUJDZOTJZ-MDZDMXLPSA-N 424.453 2.277 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765928578 ZTDQDGMOTJFKHQ-UHFFFAOYSA-N 420.263 2.078 10 20 HECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc2c(c1)CCCN2C 767173394 JTTNIQMMKVQBNO-UHFFFAOYSA-N 415.559 2.334 10 20 HECD COCCn1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 769748182 BUMIQDZXOGNQBG-UHFFFAOYSA-N 422.488 2.350 10 20 HECD CN(Cc1ccncc1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774229115 MFLHVXFQCLOGRB-INIZCTEOSA-N 418.444 2.427 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN(C)c3ccccc3)CC2)cc1 774990151 XNLNUZDCHVCCCJ-UHFFFAOYSA-N 424.545 2.377 10 20 HECD CCn1nccc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 775025905 ZBIQHIGUUZBKIQ-GJZGRUSLSA-N 418.469 2.129 10 20 HECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)Nc1ccc(O)c(C)c1 776748739 ZARALXNIHCIMAX-UHFFFAOYSA-N 400.478 2.272 10 20 HECD O=C1NC2(CCCC2)C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777615466 AYLRCXDQPNLZFR-UHFFFAOYSA-N 424.480 2.307 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@H]3CCO)CC2)cc1 779518892 HMRPACLHVNAXHJ-GHTZIAJQSA-N 404.555 2.058 10 20 HECD COc1ccc([C@H](C)N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788324056 QYIGXHORYAHUJM-KRWDZBQOSA-N 411.502 2.368 10 20 HECD CN(C)C[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933469 VMBQKTCAXNAFFB-NRFANRHFSA-N 408.546 2.192 10 20 HECD CCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950813 QTFSGPDQONCGEP-UHFFFAOYSA-N 401.429 2.465 10 20 HECD COc1ccc(OC)c(C2=NO[C@@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)C2)c1 792306984 LUCBFEITYLHQSP-FKIZINRSSA-N 400.431 2.355 10 20 HECD COc1ccc(CNS(=O)(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c(O)c1 795357144 BGSWSSLGDDZWGE-GOSISDBHSA-N 404.488 2.125 10 20 HECD COc1ccc(N2CCC(NC3C[C@@H]4CC[C@H](C3)N4CC(=O)N(C)C)CC2)cc1 797082250 DMMPXDCKEGJWQY-VCSGRIEYSA-N 400.567 2.337 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c(O)c1 797639762 LKGGUUNWWXQPRQ-UHFFFAOYSA-N 405.476 2.472 10 20 HECD O=C(Cn1cncc(-c2ccccc2)c1=O)NCc1ccc(N2CCOCC2)c(F)c1 800839794 PHFAHJDHQJUBJP-UHFFFAOYSA-N 422.460 2.202 10 20 HECD O=C(NCCOCc1ccccc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804344525 KMWSMLNDRGILGR-HXUWFJFHSA-N 412.486 2.233 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C)[C@@H](C)C3)cc2F)CC1 805006826 HLZNCDYMODHJCV-IRXDYDNUSA-N 404.530 2.088 10 20 HECD CC(=O)Nc1ccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cn1 807885706 JANAPGYWTRHBPM-UHFFFAOYSA-N 411.506 2.159 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCO1 808085155 IKLHBQWZZAVFGA-BJLQDIEVSA-N 404.507 2.220 10 20 HECD O=C(CCNS(=O)(=O)c1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364123 DXGKFQVTYOFJOZ-SFHVURJKSA-N 418.515 2.268 10 20 HECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3nc(O)nc(O)c3c2)cc1 917926832 MMYPOIFDOPPWSH-UHFFFAOYSA-N 414.487 2.460 10 20 HECD CCN(CC(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1)c1ccc(OC)c(OC)c1 921061688 KDLHFOLQYYJKJX-UHFFFAOYSA-N 421.519 2.385 10 20 HECD O=C(CC1CCC1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728147 LCDHNHVUIGYVNL-GFCCVEGCSA-N 402.476 2.365 10 20 HECD C/C=C(/C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821902721 IHLIJQUTAVMPPH-WVVNNJFASA-N 421.548 2.228 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 109180763 CPYAFTOFDPHLEF-PXNSSMCTSA-N 423.579 2.295 10 20 HECD CCOc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1OC 147111929 AGMVWFGWTAMDJG-UHFFFAOYSA-N 413.474 2.185 10 20 HECD COCCNc1ccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 552881067 GYRVVRLZVLLACU-UHFFFAOYSA-N 408.502 2.478 10 20 HECD CC(=O)N(C[C@@H]1CCCN1C(=O)C(=O)NCc1c(C)c2ccccc2n1C)C1CC1 563994234 BKBKTHQOCZEKIX-SFHVURJKSA-N 410.518 2.105 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(C4OCCO4)CC3)cc2F)CC1 730133556 ZBHUCKFCJHRHFK-UHFFFAOYSA-N 420.529 2.262 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 733648232 SLZMZKXBSQXKQT-SOUVJXGZSA-N 415.531 2.062 10 20 HECD CCCNC(=O)c1cccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 741211986 LGLFWZVRLFSRGG-UHFFFAOYSA-N 424.545 2.387 10 20 HECD CCC(CC)(CCO)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745690282 ALTHVJFLKQDVMR-SFHVURJKSA-N 404.555 2.376 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOCC34CCC4)cc2F)C[C@@H](C)O1 749542941 JNRHOTZSDRNGDO-IAGOWNOFSA-N 405.514 2.310 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1 751317472 FJUHEPPNAZBIQW-LLVKDONJSA-N 423.443 2.014 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCC2(CCOCC2)C1 753108936 OLDOXDOLGGDIRM-UHFFFAOYSA-N 407.486 2.001 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 754043666 UGWQSWUPCYQCJU-FYYLOGMGSA-N 416.610 2.128 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(F)c(OC)c(F)c3)CC2)cc1F 754212650 NWSJONQRCDMCEG-UHFFFAOYSA-N 423.391 2.408 10 20 HECD CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 755719562 JRPCNMRZDOBOPP-UHFFFAOYSA-N 420.579 2.455 10 20 HECD C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)ccc1O 756416048 GWZUEYLYGXGABF-NSHDSACASA-N 406.280 2.221 10 20 HECD CCOC[C@@H]1C(=O)N(Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C(=O)N1C 761102059 YQXCZJYRZJBGSF-MRXNPFEDSA-N 415.412 2.341 10 20 HECD O=C(Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1)N1CCSCC1 765069557 ZQLFDTXHSPCZTE-UHFFFAOYSA-N 418.500 2.142 10 20 HECD C[C@@H](NCc1ccc2c(c1)CCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1 765607981 GHNZUVGTNPXBAC-MRXNPFEDSA-N 402.516 2.493 10 20 HECD C[C@H](c1ccccc1)[C@H](CO)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 766979235 GMQQAXOSNMFTCP-UTKZUKDTSA-N 415.509 2.033 10 20 HECD CCOC1CC(CNC(=O)NCc2ccc(N3CC=CC3)cc2)(N2CCOCC2)C1 767814248 MXKLDNFXAPJJIS-UHFFFAOYSA-N 414.550 2.132 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCC2(C1)OCCO2 768255125 GFOOGGBKPACIEA-MRXNPFEDSA-N 407.486 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cccc4c3CCN4C(C)=O)CC2)cc1 768804936 XXGGTRKVIBWTSX-UHFFFAOYSA-N 408.502 2.365 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCOC2(CCOCC2)C1 769029233 TUOUXWHMLKRGOQ-KRWDZBQOSA-N 407.486 2.190 10 20 HECD CCOc1cccc(CN2CCN(CCNC(=O)c3ccccc3F)CC2)c1O 769342322 KVSMQRLBKDJNMA-UHFFFAOYSA-N 401.482 2.478 10 20 HECD C[C@H](NC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O)c1ccc(N(C)C)cc1 773019462 LWFRLWICKMRZKO-KRWDZBQOSA-N 406.486 2.002 10 20 HECD C[C@H](NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccc(N(C)C)cc1 773023847 KSWJBLDYBZEZOT-NPMXOYFQSA-N 406.486 2.323 10 20 HECD COCC[C@]1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCOC1 773949367 WWQOJUZQPLROLG-QHCPKHFHSA-N 408.454 2.186 10 20 HECD Cc1cn2cc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc2n1 774146006 MFJCDXMTKHNWCQ-UHFFFAOYSA-N 421.501 2.106 10 20 HECD CC(C)N(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(C)C 774786719 BMVLRYIUYQVYSO-LJQANCHMSA-N 405.539 2.135 10 20 HECD COCCO[C@@H]1C[C@@H](CO)CN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 774850730 RJRTYRPRADVBCJ-IFMALSPDSA-N 419.566 2.478 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCC(=O)N[C@@H](C)c2ccc(F)cc2)c1 775373189 OTUISUOZBIRFSQ-UONOGXRCSA-N 403.454 2.184 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)NC(=O)c1cccs1 777826872 UFXSRTRCMSKCTO-LLVKDONJSA-N 410.879 2.427 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)cc1 778388675 JWDOSLCEYDXCLT-YUIUBULTSA-N 423.513 2.353 10 20 HECD COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295374 UDDAJPQSJQWNAV-JTQLQIEISA-N 406.822 2.224 10 20 HECD CC(C)CN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 786330075 BOZOLAIHNYDOEH-FQEVSTJZSA-N 417.550 2.136 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(-n4cccn4)cc3)ccc21 788381707 YLTSUAYSSCQJSG-UHFFFAOYSA-N 403.486 2.187 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1 788949863 AYXOYDHIKLCVBT-LAUBAEHRSA-N 422.529 2.459 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)[S@]1=O 792389335 SJLTVWIOKJCQBE-YZPHYWLRSA-N 410.495 2.242 10 20 HECD COc1cccc(CNc2cccc(S(=O)(=O)N3CCC(CO)CC3)c2)c1O 796444919 QGFINUVNIXMHRX-UHFFFAOYSA-N 406.504 2.406 10 20 HECD CCCCN(CC(=O)N1CCc2cc(S(N)(=O)=O)ccc21)Cc1ccccc1O 801597711 MSQFISHSMSKPGP-UHFFFAOYSA-N 417.531 2.231 10 20 HECD COc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 803308929 MZBWEIHYTDFNKF-QGZVFWFLSA-N 411.502 2.334 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 803564567 ODLXBXLCNVCIFL-IBGZPJMESA-N 400.567 2.480 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CCO)c3ccc(Cl)cc3)nc12 805822818 WXIITAGWFPAOIJ-INIZCTEOSA-N 404.854 2.478 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387248 FRYZVTYIKPIRLX-UHFFFAOYSA-N 407.220 2.196 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CCCNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807674492 LVSTUZDIXFVBNZ-OAHLLOKOSA-N 406.527 2.303 10 20 HECD COc1cc(N2CCN(C(=O)c3nnc4ccccc4n3)CC2)cc(OC)c1OC 811044997 AIQLCWHLTUYTLQ-UHFFFAOYSA-N 409.446 2.013 10 20 HECD Cc1cc(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)ccc1N(C)C 815065151 SBIINJQLFUZSNR-UHFFFAOYSA-N 413.547 2.444 10 20 HECD Cc1cc(C(=O)Nc2ccc(C(=O)NCCC(N)=O)cc2)c(C)n1-c1ccccn1 817118634 QNQFPIVRZCQBCO-UHFFFAOYSA-N 405.458 2.347 10 20 HECD CCNC(=O)Nc1c(C)cccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 857535026 GMMGAXTUOSRWNX-UHFFFAOYSA-N 406.464 2.466 10 20 HECD Cc1cc(C(=O)O[C@H](C)C(=O)NC(=O)NCC(F)(F)F)c(C)n1-c1ccccn1 914903673 RLOFRWVREGNLMT-GFCCVEGCSA-N 412.368 2.423 10 20 HECD COc1ccc(/C=C\C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 916676778 RRTPXHGOKWLGPX-WDZFZDKYSA-N 400.500 2.260 10 20 HECD COC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917167441 IYFWVMFXPQYISV-UHFFFAOYSA-N 402.422 2.144 10 20 HECD Cc1cc(C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C)n1-c1ccc(F)cc1 920431058 OBAAORKGOMQFPY-IBGZPJMESA-N 419.522 2.178 10 20 HECD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920865484 FJDZGWPOIILHSB-CQSZACIVSA-N 421.475 2.480 10 20 HECD C[C@H](NC(=O)[C@@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O)c1ccc(N2CCOCC2)cc1 920881994 UHYYLVRMGCGHTD-ACZWYYKOSA-N 413.518 2.264 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCCOc2ccc3c(c2)OCO3)c1 921211283 GPZXSHXNCKUVBF-UHFFFAOYSA-N 409.416 2.118 10 20 HECD COc1ccc(N2CCN(Cc3ccc(OC)c(OCC(N)=O)c3)CC2)cc1F 1319729321 OFXVZNAQUFMPFD-UHFFFAOYSA-N 403.454 2.029 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)N1CCc2ccccc2C1 1337826287 IXXPVPBMMFZEBN-KXBFYZLASA-N 412.486 2.135 10 20 HECD Cc1nnsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1797063369 MVAPMYQQCBIBTL-ZSBIGDGJSA-N 422.894 2.477 10 20 HECD COCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816876937 RAVKNKBPGLMJTB-ZDUSSCGKSA-N 408.842 2.427 10 20 HECD CC(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877596 SWVRBNVBHZRUNB-DBWMJRBXSA-N 416.474 2.025 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 54284227 SKYLDAKEVBICCM-MRXNPFEDSA-N 415.440 2.471 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc2c1OCCO2)c1ccc(N2CCOCC2)cc1 141699391 FTFUCPLRCVWLPO-OAHLLOKOSA-N 411.458 2.110 10 20 HECD COCCCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCS(=O)(=O)C1 729342252 RYVZNBVNMWZENJ-KRWDZBQOSA-N 405.520 2.155 10 20 HECD COC1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 730823550 MFIICHAVBOOGCV-UHFFFAOYSA-N 404.555 2.212 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CN2CCCCC2=O)NC(=O)OC(C)(C)C)cc1 742751145 RVDAZWYAMGIJPE-SFHVURJKSA-N 418.538 2.447 10 20 HECD CCn1nccc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 746391357 SDXIBFQBMHJNRZ-UHFFFAOYSA-N 407.421 2.228 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cc(C(N)=O)ccc3CN(C)C)CC2)cc1 747562767 OTXWZMKMNLXZHF-UHFFFAOYSA-N 411.506 2.210 10 20 HECD CCN1C(=O)[C@@H]2CN(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)CCN2C1=O 752336557 UKSRNNPQBMWXGC-IBGZPJMESA-N 412.465 2.384 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)n3nnc(-c4ccccc4)n3)CC2)cc1F 753738844 LWWLBIXLVKEGNY-HNNXBMFYSA-N 410.453 2.398 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc4nn[nH]c4cc3F)CC2)cc1 753779271 DUIGNZRFQQRIEN-UHFFFAOYSA-N 412.469 2.048 10 20 HECD C[C@H](NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1cc([N+](=O)[O-])ccc1O 756459308 MNLQVWUDJXQUJJ-ZDUSSCGKSA-N 408.455 2.030 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O 757005702 KVJCSMPFDCGHFE-GJZGRUSLSA-N 400.523 2.424 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Cl)cc1F 757656880 PKRKUYYBOPQVAM-UHFFFAOYSA-N 403.771 2.470 10 20 HECD COc1cc(N2CCN(CN3C(=O)C[C@@](C)(C(C)C)C3=O)CC2)cc(OC)c1OC 758963926 JTJSGYKZBRFMNE-QFIPXVFZSA-N 419.522 2.213 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cnn(C(C)C)c3)CC2)cc(OC)c1OC 759099744 NPMWEWWHZCZEOM-UHFFFAOYSA-N 424.523 2.001 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)C3CCOCC3)CC2)cc(OC)c1OC 759289860 ZSPLJCQJTHJFNC-OAHLLOKOSA-N 407.511 2.359 10 20 HECD Cc1cccc(Cn2[nH]ccc2=NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)c1 759588231 JWFLNQWFZCKYRI-ZEJZPLCCSA-N 407.426 2.268 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCCN(c3ccccc3F)C2=O)c1 763668206 AFFSBXZWQPIOCP-KRWDZBQOSA-N 422.434 2.255 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)c1c[nH]c2ncccc12 767607841 CAZOGIBRAZCBMC-JTQLQIEISA-N 403.416 2.068 10 20 HECD CC1(C)CCCN(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 770299787 MCBRKCYJQVCYRE-IBGZPJMESA-N 415.582 2.310 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)[C@@H]1CN(C)CCO1 770436485 VWQSOPYBRLIXCY-LRDDRELGSA-N 400.317 2.405 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 773742576 XNNBOWVHRISUFI-OAHLLOKOSA-N 406.504 2.130 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1 774129924 QVEHIYLIBNVYGV-SFHVURJKSA-N 421.545 2.107 10 20 HECD COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 774535954 DLAPBFGGKKBILY-KRWDZBQOSA-N 411.502 2.068 10 20 HECD COc1ccc(N2CCN(CN3C[C@H](NC(=O)OC(C)(C)C)CC3=O)CC2)cc1F 782932256 ICQGAITWFFVHLH-OAHLLOKOSA-N 422.501 2.039 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 785428817 SJTFELTYZHSRIM-WIYYLYMNSA-N 408.546 2.396 10 20 HECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 788405061 ZDEOYURMFSMWLO-CQSZACIVSA-N 403.454 2.100 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1 788975580 RAIBBSMIVCPXQY-OAQYLSRUSA-N 422.529 2.379 10 20 HECD C[C@@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789818759 KUZDZNJSDQBHJN-HRCADAONSA-N 423.554 2.267 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1 792199083 QATNCSUCXJVVTO-UHFFFAOYSA-N 418.501 2.136 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc(Cl)c1F 792228704 OHYPZQMGIUHOHQ-UHFFFAOYSA-N 410.785 2.235 10 20 HECD CNC(=O)CNC(=O)c1cccc(NCc2cc(Br)cc(OC)c2O)c1 800312935 XBUVZFPUDLVLJU-UHFFFAOYSA-N 422.279 2.251 10 20 HECD CC(C)n1cc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 803310347 JCDVOKMCDBACAJ-IAGOWNOFSA-N 413.522 2.355 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1nc2c(s1)CCCC2 804086227 NSGUUKLCOADWOL-UHFFFAOYSA-N 400.548 2.405 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 804318629 QHWZJOOQAUJOOO-ZCNNSNEGSA-N 415.534 2.100 10 20 HECD Cc1nn(C)cc1S(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805018786 VRTCOBLTMYJCBC-CYBMUJFWSA-N 400.451 2.277 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12 806275852 XTHSXRADIGUPHT-IJLUTSLNSA-N 403.620 2.237 10 20 HECD Cc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807587484 HGBSTVHSGRZAFM-JXFKEZNVSA-N 408.502 2.160 10 20 HECD COc1ccc(OC)c(CCCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 807670666 HYTANFSMBFSKLM-UHFFFAOYSA-N 413.518 2.477 10 20 HECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cc(OC)ccc1O 809682091 CJNXUBXLOOVWTH-UHFFFAOYSA-N 422.503 2.433 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCC[C@@H]2COC(=O)N[C@H]2CCOC2)c1O 809707709 MGHAXJMGBRTZBK-LSDHHAIUSA-N 409.439 2.179 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)CC34CCC(CC3)C4)cc2)C1 812494122 DYPFHPAPZUAKIH-JGCRXCKMSA-N 405.564 2.388 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@H](O)c3ccccc3)CC2)cc1 813850919 OYHZMHYPMOJEBO-CICHRBOCSA-N 423.513 2.138 10 20 HECD O=C(COc1ccc(Cl)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334434 GLUCURPCMWKKBY-UHFFFAOYSA-N 408.907 2.270 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)cc1)NCc1ccc(N2CCOCC2)c(F)c1 918975425 YWKULMMDNWAGHV-YWEYNIOJSA-N 414.433 2.241 10 20 HECD O=C(CC(F)(F)F)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002780 VRVXXFYVAISWGJ-MRXNPFEDSA-N 422.787 2.147 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1C1CC1)CCO2 1782004483 WNLZHRVLHRHHAU-ZSDSOXJFSA-N 420.893 2.241 10 20 HECD COCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826450386 JAYRMPISNZHRNG-DBWMJRBXSA-N 418.490 2.083 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2 1843251551 JIJPYWZJMUFVOC-UHFFFAOYSA-N 419.481 2.432 10 20 HECD CC(C)NC(=O)CN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 7923749 GLKCXOMOERMMKR-CQSZACIVSA-N 407.470 2.245 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1 105819838 PMATVIYVYWRWKX-FQEVSTJZSA-N 411.481 2.360 10 20 HECD COc1ccncc1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726727346 VIWBLTWSNGVTNP-UHFFFAOYSA-N 420.416 2.415 10 20 HECD CCN1C(=S)N[C@@H](c2ccc(N3CCOCC3)c(F)c2)C(C(=O)N(C)C)=C1C 727352178 XDKSVGGABJTLTF-SFHVURJKSA-N 406.527 2.276 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCSc2nnnn2C)cc1 728838448 HPEQCHQJRAYEBU-UHFFFAOYSA-N 402.446 2.349 10 20 HECD CCNC(=O)COc1cccc(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)c1 728947338 SSCTUIHMQJSCPW-CQSZACIVSA-N 401.463 2.476 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc2c(c1)CCN2C(=O)CNC(C)=O 735686490 SXMJZZHXTCWUDF-UHFFFAOYSA-N 409.486 2.470 10 20 HECD COc1cc(N(C)CC(=O)N2CCN(Cc3ccco3)CC2)cc(OC)c1OC 741799250 UNVWQDAFFGSYAY-UHFFFAOYSA-N 403.479 2.086 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 742928573 WNQQFWPCDMBWHZ-UHFFFAOYSA-N 412.490 2.410 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCC[C@@H](C(N)=O)C1 745830869 CIWWVIYLAACVET-LJQANCHMSA-N 403.571 2.260 10 20 HECD NC(=O)COc1cccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 745898762 AZCNZACZYQSCPD-LJQANCHMSA-N 413.474 2.147 10 20 HECD COc1cc(NC(=O)C(=O)NCCCSc2nccs2)cc(OC)c1OC 749729915 DYFJTNRYTADJBB-UHFFFAOYSA-N 411.505 2.406 10 20 HECD CN(C)c1ccc(CNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1F 750323524 VGYNHUDMLNJRFN-UHFFFAOYSA-N 413.497 2.040 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](Cc3ccccc3)n3nnnc3C)CC2)cc1F 753741484 GSSZJCCHXNGWOI-FQEVSTJZSA-N 424.480 2.262 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](C)N3CCc4ccccc43)CC2)cc1 758209215 JAMOAOGKDWDIOQ-NFBKMPQASA-N 424.589 2.219 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 758226770 ZNWBOIMZNNRHHL-INIZCTEOSA-N 405.426 2.304 10 20 HECD CCc1nnc(O)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1CC 758258341 ONXTVSLZXYEGOH-UHFFFAOYSA-N 402.470 2.337 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc(-n4ccnn4)c3)CC2)cc(OC)c1OC 759224209 CTBHEAAICCEHJH-UHFFFAOYSA-N 423.473 2.256 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](O)CCc3ccccc3)CC2)cc(OC)c1OC 760085722 HOYCHTNOUGWMBU-IBGZPJMESA-N 414.502 2.355 10 20 HECD COc1cc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)cc(OC)c1OC 760124900 XKGGPBTYNXMPLS-OAHLLOKOSA-N 409.527 2.341 10 20 HECD Cc1cc(C(=O)N(CCO)CCNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 767201667 KPKJIVYZZZFLGF-UHFFFAOYSA-N 402.495 2.448 10 20 HECD Cc1cc(=NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc[nH]1 767896206 SBNBBTJWORSBTO-UHFFFAOYSA-N 421.480 2.389 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2 773739778 KCSKWRUHJDKCRA-DBDZUICISA-N 405.472 2.114 10 20 HECD CCN1CCC(NC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)CC1 775031325 ARZYBVZZMSRBMM-UHFFFAOYSA-N 412.328 2.104 10 20 HECD COc1cccc(O)c1CN1CCC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2=O)C1 777223880 XOXDNOMWMRZPOL-MRXNPFEDSA-N 419.522 2.445 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](OCCO)C3)cc2F)C[C@@H](C)O1 780311112 FCWAWCAHLCAQBX-NUJGCVRESA-N 409.502 2.122 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(F)n3)cc2F)C[C@H](C)O1 783207136 PREJNUQFJIAOSA-KBPBESRZSA-N 419.428 2.447 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H](F)C(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 784310143 MGXGFKJIPDMKIR-SFHVURJKSA-N 410.467 2.462 10 20 HECD CCC(CC)[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N1CCOCC1 786601187 YPHTZLZZNKZGSV-UTKZUKDTSA-N 418.582 2.183 10 20 HECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccnc1 788332429 MTCTXZMRNXQHSY-NRFANRHFSA-N 410.518 2.090 10 20 HECD CC(C)(C)CCN1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788931062 DFZSHGNOVZYRGN-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)COc3ccccc3)CC2)cc1 793704590 WHYJJXSGMLCDTC-SFHVURJKSA-N 411.502 2.318 10 20 HECD CCN(CC(=O)N1CCCCCC1)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 796600713 HVQXHICGOJOAOC-UHFFFAOYSA-N 416.566 2.068 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c(OC)cc2C)cc1 797431348 MYDQELHHOBTWNQ-UHFFFAOYSA-N 419.912 2.334 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1 801548421 FLYCYUCCFYQERE-UHFFFAOYSA-N 404.488 2.094 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688521 SJYKLONTPYOIMO-HNNXBMFYSA-N 418.538 2.105 10 20 HECD NC(=O)[C@H]1CCCN(CCCNC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 805073234 DGXMJVVVHKBKPX-NSHDSACASA-N 403.310 2.086 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@](=O)Cc1ccccc1 805406597 IJCQAZFUTSRWTR-LJAQVGFWSA-N 415.559 2.166 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 815575131 KFGYIOLKMPGUFX-GFCCVEGCSA-N 418.519 2.476 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCNC(=O)C1CC1 914439480 HCCIYIICIPTQJD-KAMYIIQDSA-N 423.585 2.372 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(C)cc(OC)c3O)CC2)cc1 915797744 OVOONZKYFUCPIP-UHFFFAOYSA-N 406.504 2.224 10 20 HECD COc1ccc(N2CCCN(C(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 917821746 YUTWXFXIWMMHHH-WOJBJXKFSA-N 413.518 2.299 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(-c4ccncc4)on3)cc2)C1 917836542 PGKLCMYXDUXKHG-KRWDZBQOSA-N 405.458 2.368 10 20 HECD Cc1c(F)ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1N 1796154363 NLNIOLPVODBEKF-BTTYYORXSA-N 414.437 2.088 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)Cl)C2 1804291553 MUMCQQINDQHAHT-NMHLOJTESA-N 416.808 2.286 10 20 HECD CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814163095 YPARCOUUSNQHAT-PHYPQJFDSA-N 411.458 2.328 10 20 HECD C/C=C(/C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900812 YETMFEBVRNBUBQ-FUYANPBUSA-N 423.604 2.433 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCC[C@]34NC(=O)NC4=O)ccc21 465374235 MTJSYCDMYPEGHI-AOMKIAJQSA-N 412.490 2.013 10 20 HECD COc1ccc(N(CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)C(C)C)cc1F 725816399 SQJXBCCLWOVNBJ-UHFFFAOYSA-N 421.494 2.286 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 729598740 JTVYJKNDPNLPPU-UXHICEINSA-N 415.582 2.308 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(Cc3cnn(C)c3)CC2)cc1F 731404142 HBCUAXGFEXIIRD-UHFFFAOYSA-N 402.518 2.433 10 20 HECD Nc1c(C(=O)OCCn2ccc([N+](=O)[O-])n2)ccc2c1C(=O)c1ccccc1C2=O 748103192 QYNLZWHLPGXLBA-UHFFFAOYSA-N 406.354 2.006 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H]1C 748962302 WBVYSLJONRBAKC-QFUCXCTJSA-N 415.582 2.403 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC(=O)NCc3ccccc3)cs2)cc1 751931941 QMUWTESRFXGXIB-UHFFFAOYSA-N 424.482 2.499 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(-n4ccnc4)c3)CC2)cc1 758230808 JFVRPWUGQGQFKS-NRFANRHFSA-N 408.502 2.443 10 20 HECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc2)C1 762268909 VBPWEMGBAJZEFX-OAHLLOKOSA-N 418.515 2.491 10 20 HECD Cc1cc(C(=O)CN(C)CC2CCOCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 767702427 OVYIJDWLXYJRMG-UHFFFAOYSA-N 419.547 2.283 10 20 HECD COc1cc(OC)cc(C(=O)N2CCN(Cc3cc(OC)c(OC)cc3O)CC2)c1 768441445 LOSPCPDQSOFPPU-UHFFFAOYSA-N 416.474 2.385 10 20 HECD COc1ccc(O)c(CNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)c1 769606583 PYKATJZTXPYSFW-UHFFFAOYSA-N 408.401 2.276 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3cnc(C)s3)CC2)cc1 771972584 VXRSRZUTLKWTIP-UHFFFAOYSA-N 403.552 2.124 10 20 HECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 772993942 JMQWYPVFRJPJMI-IQMFZBJNSA-N 424.501 2.406 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 776078614 ZXQNHFYYEISNCL-GHTZIAJQSA-N 423.579 2.409 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NC(=O)NCc2ccc3c(c2)CCCN3C)CC1 777726132 CGNPUFQGYCHFCP-UHFFFAOYSA-N 422.595 2.318 10 20 HECD CCOC[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 779251101 GAERHFNPYBOSLG-LBPRGKRZSA-N 423.447 2.256 10 20 HECD COC[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)O1 784374185 XVVMFXBVZNXSOC-LSDHHAIUSA-N 408.454 2.136 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(Cc3cccs3)CC2)cc1 784556967 KKOAKODGGOJHFZ-UHFFFAOYSA-N 417.531 2.081 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 784666103 PCJYTLHQMYEFKQ-UHFFFAOYSA-N 419.528 2.343 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3Cc4cc(C)c(C)cc4O3)nc12 786387303 UFVLEVXBUUXMHF-QGZVFWFLSA-N 411.414 2.275 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@@]3(N(C)C)CCSC3)cc2)CC1 788248936 XIMVHRZOKNEBMS-QFIPXVFZSA-N 418.607 2.093 10 20 HECD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)c1 789938393 BOEYDJKSJTXTRT-UHFFFAOYSA-N 408.451 2.000 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cnc4ccccc4c3)c2)CC1 800834915 BWESSMGBKHUYCT-UHFFFAOYSA-N 417.512 2.270 10 20 HECD CCN(CC)c1ccc(CN(C)c2nnc([C@H](C)NS(C)(=O)=O)n2CC)cc1 801869439 CCFGGROZKHJZNU-HNNXBMFYSA-N 408.572 2.391 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 801931384 ZRRASWGKDZMHQX-UHFFFAOYSA-N 413.430 2.281 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803298241 RQQJIXGPGMVIRJ-DBVUQKKJSA-N 417.550 2.410 10 20 HECD CS(=O)(=O)C1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCC1 805840046 KKAVCKAJDITRMW-UHFFFAOYSA-N 423.579 2.052 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2COC(=O)N[C@@H]2CCOC2)cc1F 806634296 JMCYPEFYIXVBRL-SJORKVTESA-N 422.501 2.471 10 20 HECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1 808114155 SFRMKWWYOQSBGU-UHFFFAOYSA-N 408.860 2.236 10 20 HECD CN1CCN(c2ccc(CN3CCCC[C@H]3COC(=O)N[C@@H]3CCOC3)cc2)CC1 809710480 XFAMYHYALTXQIB-IRLDBZIGSA-N 416.566 2.308 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCc3c(nnn3CCOC)C2)cc1F 814365753 CYXNZJLJNYRZLF-UHFFFAOYSA-N 404.490 2.178 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1nnn(Cc2ccccc2F)c1C 815500978 JZEDLLXGRWIVFJ-UHFFFAOYSA-N 424.480 2.403 10 20 HECD Cc1nc(S)sc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918373124 SLBSFPCKXGJOMM-CQSZACIVSA-N 404.561 2.301 10 20 HECD CCOC(=O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1320484263 VQBJKJLADFZKTB-IEBWSBKVSA-N 416.522 2.016 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 1323192141 FELIQULPBNTTRV-INIZCTEOSA-N 421.501 2.429 10 20 HECD O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NCc1cc(Cl)cc(Cl)c1O 1324074843 YMZRXVVHWIJNFB-UHFFFAOYSA-N 418.298 2.324 10 20 HECD Cc1noc(N)c1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426699 NCWMQCYAFYHYEV-UHFFFAOYSA-N 423.429 2.433 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ncccc3F)CC2)C1 1810547211 RZDWNANUGUHDFI-UHFFFAOYSA-N 414.437 2.186 10 20 HECD Cc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816512251 KYSSCFAPSSYDRO-AWEZNQCLSA-N 412.406 2.132 10 20 HECD Cc1[nH]ccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725773 PDBCOHHPWXYPPT-LLVKDONJSA-N 413.459 2.125 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)O1 1817845173 DOLVFUPYWOPHOT-KCPJHIHWSA-N 415.450 2.089 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnoc2)CC1 1827750190 GIWOUOVECAAKDM-MRXNPFEDSA-N 400.435 2.028 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)n(C)c2ccccc12 472787123 JQAGQOAESKWHMN-ZDUSSCGKSA-N 406.442 2.461 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3(C)CCOCC3)cc2F)C[C@@H](C)O1 726839835 SAQYCZUAXNKRNZ-HZPDHXFCSA-N 422.497 2.415 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)s3)cc2)CC1 726975534 FJTDJXJBPMETMT-UHFFFAOYSA-N 420.965 2.115 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)c1 728979787 MXFGLYWDTAGXNC-JTQLQIEISA-N 408.838 2.418 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1 728983171 VKCURWQCWZOBQQ-LBPRGKRZSA-N 418.471 2.445 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729502507 ANEWPLJHHHELRB-IEBWSBKVSA-N 424.492 2.419 10 20 HECD CN1C(=O)C(=O)N(CC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 733563738 BSQVBLQEYGMINU-UHFFFAOYSA-N 423.385 2.004 10 20 HECD CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(c4cnn(C)c4)C3=O)cc2)CC1 735513558 PYSUEBXQXDKDRZ-HXUWFJFHSA-N 410.522 2.261 10 20 HECD C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)N(C)Cc1ccc(N(C)C)cc1 735518143 IPOBZDZSKQLCSF-IBGZPJMESA-N 410.566 2.500 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@H](C(F)(F)F)C3)cc2F)CC1 740477915 GMLCTZAEEPAASG-QGZVFWFLSA-N 418.435 2.440 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc3c(c2)C(=O)NC3=O)cc1 741679111 KCECIKJAODKKGG-GOSISDBHSA-N 407.470 2.458 10 20 HECD C[C@H](C(=O)Nc1sccc1C(N)=O)N(C)Cc1ccc(N2CCOCC2)cc1 741734319 CJFFFHDIROKADL-CQSZACIVSA-N 402.520 2.143 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(-c4cccnc4)on3)CC2)cc1 742919057 BGOBVBVZSJHXDK-UHFFFAOYSA-N 407.474 2.297 10 20 HECD CC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 743322895 MADSHJRDPYQSTM-FCEWJHQRSA-N 420.529 2.497 10 20 HECD O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)N(Cc1ccco1)Cc1ccccc1O 743428958 SYOBHKGFVFCYIB-QCFAMHMHSA-N 424.453 2.067 10 20 HECD Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 749635166 MYZKUNPYFCSIBH-UHFFFAOYSA-N 421.457 2.137 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(CC(C)C)cn2)cc1C 749864495 MFUYPNADAUSFLR-UHFFFAOYSA-N 400.526 2.410 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC(OCC(F)F)C1 751069852 CEXRYBQEQRTXIQ-UHFFFAOYSA-N 418.443 2.361 10 20 HECD COCCc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751229182 XKIFBJAFRPNWIS-UHFFFAOYSA-N 422.522 2.454 10 20 HECD O=C(Cc1c[nH]c2cc(F)ccc12)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 751345368 LCALDHZQRVDXGA-UHFFFAOYSA-N 415.490 2.401 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)NCc3ccc(C)cc3)CC2)cc1F 753737639 HKFBDITYXQUNHJ-UHFFFAOYSA-N 414.481 2.291 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757267943 UTHGFJCXCBJSHC-UHFFFAOYSA-N 410.396 2.040 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 759221490 RQDOBSZPYXGGSW-BPQOCRPUSA-N 409.502 2.433 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)c1 763224840 VVRFDXPYFFHHJD-AWEZNQCLSA-N 407.467 2.302 10 20 HECD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCCCC2)c(F)c1 765758150 JOLJEHDLZSNTMT-QGZVFWFLSA-N 412.575 2.044 10 20 HECD COc1cc(OC)cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 767836715 LFXRZZBGLQLGOH-UHFFFAOYSA-N 406.504 2.361 10 20 HECD Cc1ccnc2nc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nn12 768914471 DCKKVOWHFALNBY-HNNXBMFYSA-N 400.870 2.186 10 20 HECD COc1ccc(C2(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCOCC2)cc1 769745778 CVIASMDRGLOZCL-UHFFFAOYSA-N 420.487 2.208 10 20 HECD Cc1cc(F)cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 770604127 WLPDWNAUKYOOIP-INIZCTEOSA-N 412.465 2.091 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O 773739340 FOBCIDGYCJKMPQ-CHWSQXEVSA-N 404.488 2.169 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 775036814 KAPWIISEOXKDTE-NRFANRHFSA-N 404.514 2.070 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 775046515 XHSBCMSCMBBQNI-NRFANRHFSA-N 408.546 2.492 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc(-c4ccccc4)[nH]3)nc12 776449753 AEECLGVYYRHWJC-UHFFFAOYSA-N 407.386 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)cc1 778458264 UTJOWPBZUUNAAY-OEIFXAAASA-N 415.534 2.362 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCN(C)CC2)cc1)[C@H](C)C(=O)OC(C)(C)C 781530129 UBZUGWWVLMZUNT-GOSISDBHSA-N 418.582 2.107 10 20 HECD COCCOc1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786256719 JPQUOOSNTLKJBW-UHFFFAOYSA-N 411.502 2.310 10 20 HECD CCOc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 787214894 QIPHKVKEEJPVJE-QGZVFWFLSA-N 411.502 2.416 10 20 HECD COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 787890536 KRWWYNCJJVNBAN-GFCCVEGCSA-N 422.865 2.462 10 20 HECD Cc1[nH]c2ccccc2c1CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310185 JFOYQPPGQUWMMV-UHFFFAOYSA-N 420.513 2.288 10 20 HECD O=C(NCCc1cccc2[nH]ccc12)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811182 CTXJYRHCMCMZPZ-UHFFFAOYSA-N 424.476 2.119 10 20 HECD CCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789825613 NAJRHDDBQWRJJF-XYJFISCASA-N 421.513 2.083 10 20 HECD CCC1(CC)CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789843772 OTOBORVGXVDTDJ-UHFFFAOYSA-N 405.514 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSCC[C@@H]3C)CC2)cc1 791897540 QVLKRJNBGXRCHD-QWPQOLDESA-N 403.548 2.254 10 20 HECD COc1ccc(CNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c(O)c1 794390182 ZUPHFKDKZADFGD-QGZVFWFLSA-N 404.467 2.359 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@H]3c3nc(C)no3)CC2)cc1 796668887 LYSDAGRZRBKJGU-FPOVZHCZSA-N 415.538 2.097 10 20 HECD CON(CC1CCOCC1)C(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 805024331 IETIZZIXABPFHA-UHFFFAOYSA-N 403.523 2.356 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 806855161 AWBSSPYIQNKSQI-UHFFFAOYSA-N 405.401 2.104 10 20 HECD CO[C@H](C)c1nsc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 809924662 RORGIBVBJVIBOL-OCCSQVGLSA-N 418.523 2.269 10 20 HECD Cc1cc(C(F)(F)F)nn1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 810182909 LAOGZOSHUJAMOZ-OAHLLOKOSA-N 423.439 2.228 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)cn1C 811705785 RGBNYMWYBDRBKR-UHFFFAOYSA-N 424.475 2.202 10 20 HECD CN(C)C(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 919772851 OCRAHEKRUFSXNG-UHFFFAOYSA-N 412.490 2.312 10 20 HECD CCOc1ncccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920416563 SESGCZYSAUBXRI-UHFFFAOYSA-N 404.492 2.037 10 20 HECD C[C@@H](NC(=O)NCCN1C(=O)c2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 920866392 COEKWDSPTFWUME-MRXNPFEDSA-N 422.485 2.180 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCCC1)C2)c1cc(O)nc(O)c1 1777847888 VLLMFNGVRINVKQ-VGOFRKELSA-N 417.506 2.201 10 20 HECD Cc1cc(N)ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 728366619 UCVNXKVMVKGUTD-UHFFFAOYSA-N 401.438 2.026 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4C)ccc21 729788509 RARIPRSPNVFESE-UHFFFAOYSA-N 406.486 2.233 10 20 HECD CN(c1ccc(CNC(=O)NCCCN2C(=O)CNC2=O)cc1)C1CCCCC1 731116093 JXZQRMWRDJFJSC-UHFFFAOYSA-N 401.511 2.197 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)CS(C)(=O)=O)cc2F)C[C@@H](C)O1 732675204 XLCIPNURJCKOCM-RBSFLKMASA-N 415.531 2.014 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H](c4cc[nH]n4)C3)CC2)cc1 734274284 UKLQRSVROPMLOC-SFHVURJKSA-N 412.538 2.130 10 20 HECD O=C1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CN1Cc1ccccn1 735517873 GBXJOTSJLSHGNV-UYAOXDASSA-N 409.486 2.344 10 20 HECD COCCCn1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 737008499 CJYNNUUTAMDYLU-UHFFFAOYSA-N 405.474 2.342 10 20 HECD CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NCc3ccccc3O)ccc21 737167801 OPURGJSCPAAFIF-UHFFFAOYSA-N 422.485 2.470 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(Cn4cccn4)o3)CC2)cc1 742920328 OBIYFAAUNNHVOA-UHFFFAOYSA-N 409.490 2.085 10 20 HECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 743649410 UKSPSHJZRHTGJT-FFGOWVMKSA-N 414.550 2.391 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 743893387 VANNHCXWEWVSQT-UHFFFAOYSA-N 409.515 2.381 10 20 HECD Cc1cccn2cc(CC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)nc12 750669794 IHDQMNWIAMNQMD-SFHVURJKSA-N 405.502 2.203 10 20 HECD Cc1nnc2n1C[C@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CC2 750731840 WILBVXDBHSZWLV-GRDNDAEWSA-N 401.486 2.218 10 20 HECD COc1ccc(CN2CCN(C(=O)CN(C)c3ccc(OC)cc3OC)CC2)cc1 752114010 UJVSUERQGRTYPM-UHFFFAOYSA-N 413.518 2.493 10 20 HECD CCOCCC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 752211931 MEIOGTSQRXIUIP-GOSISDBHSA-N 402.539 2.394 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl 753640054 HHAQDPSRTDBIQW-LLVKDONJSA-N 412.895 2.363 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCS(=O)(=O)[C@H]2CCCC[C@H]21 753857558 NDSJSPXEQHASNZ-MOPGFXCFSA-N 423.604 2.491 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)n3nnnc3C(C)(C)C)cc2F)CC1 758094283 BOFFZQUIJISZLR-HNNXBMFYSA-N 417.533 2.129 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc4ccc(=O)oc4c3)CC2)cc1 758223623 NZIIYPLHXMSAQB-LJQANCHMSA-N 410.470 2.364 10 20 HECD O=C(NCc1ccc(F)cc1)c1nnc(COC(=O)c2cccc(O)c2O)s1 758583025 WDXOOIMTXIVONB-UHFFFAOYSA-N 403.391 2.375 10 20 HECD COc1cc(N2CCN(C(=O)NOCCC(F)(F)F)CC2)cc(OC)c1OC 777722232 RDUWTFGYASVHOO-UHFFFAOYSA-N 407.389 2.428 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3[N+](=O)[O-])CC2)cc1 778236675 ZLQUHZNLYUXRJC-ZHACJKMWSA-N 424.457 2.125 10 20 HECD CCO[C@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 780310907 DAXUZUUKQWHHCP-RXVVDRJESA-N 409.502 2.028 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1CCN(C)C)c1ccc(N2CCOCC2)cc1 782473582 CMWHUTQMWKIZOJ-GOSISDBHSA-N 424.545 2.443 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CCCN(Cc2ccccn2)C1=O 784336102 PSPDIACJOVWBGE-OAQYLSRUSA-N 405.502 2.448 10 20 HECD CCN(Cc1ccccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C(C)=O 785293199 DEWDAEMQRBSOFU-CQSZACIVSA-N 413.474 2.152 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccccc2Cn2cccn2)cc1F 785639608 GRIXCIIZSBFTCL-UHFFFAOYSA-N 409.465 2.069 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc(Cn2ccnc2)c1 787299989 XJRSVAMABFUISI-UHFFFAOYSA-N 415.497 2.240 10 20 HECD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 787332244 ZNXBLWCYQJIMTB-PBHICJAKSA-N 415.465 2.311 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)NC(=O)OC(C)(C)C 788934718 YKGFNXJVGQRKGW-UHFFFAOYSA-N 418.538 2.323 10 20 HECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789819194 MKPSYERGIXFHMK-MUQADHOPSA-N 421.513 2.081 10 20 HECD COc1ccc(O)c([C@H](C)N[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794830732 KIXCHHGRKQJUSH-VBKZILBWSA-N 401.511 2.272 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1F 797674047 OFVSYPOTKIVLNM-UHFFFAOYSA-N 421.498 2.393 10 20 HECD Cc1cc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)no1 803305908 OCHZNBWWZNLSHM-OXQOHEQNSA-N 412.490 2.361 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(-n2ccnc2)cc1 803352983 VLFOQLVRHOGRJD-UHFFFAOYSA-N 401.470 2.181 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@]4(CCc5ccccc54)C3)ccc21 803686475 BCQXYVPNBHSNTI-VWLOTQADSA-N 419.525 2.386 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687998 JOQNDKOBDOPRFH-PGRDOPGGSA-N 420.557 2.322 10 20 HECD COc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 804628786 QSUBBDWTGIFDDH-UHFFFAOYSA-N 409.486 2.273 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](c4nccn4C)C3)cc2)CC1 805025061 HQWHCVDSRAXPFP-LJQANCHMSA-N 409.534 2.289 10 20 HECD C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806495577 IAYPCKSQKFIMNV-SLYNCCJLSA-N 413.566 2.157 10 20 HECD CN(C)c1nc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cs1 806664644 WFAUXZABOADLAQ-UHFFFAOYSA-N 414.487 2.353 10 20 HECD Cc1cnc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 807652194 OBCXGHWFLNRSNN-ZDUSSCGKSA-N 424.473 2.454 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 808346871 RISOUQPSNQTBTJ-PZJWPPBQSA-N 417.550 2.015 10 20 HECD CCn1nc(C)c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 815295363 BAAGDQREMHBFRW-UHFFFAOYSA-N 418.409 2.177 10 20 HECD COC(=O)c1cnn(C)c1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 815582283 BNQXGFCPSSKZTI-UHFFFAOYSA-N 414.462 2.212 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1c(O)cccc1Br 877845981 NYVACZSFUBPBKT-KRWDZBQOSA-N 404.264 2.492 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(N2CCOCC2)nc1 919968493 AWBPSFIDUNAZIM-UHFFFAOYSA-N 410.518 2.057 10 20 HECD CC(C)CN1C(=O)/C(=C/NC[C@@H](c2ccccc2)N2CCCC2)C(=O)NC1=S 920980670 VPMVUKDFIBTKTP-WQJNHMDYSA-N 400.548 2.196 10 20 HECD O=C1CCCc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)ccc21 1843249567 ZIWHUBKUXGKEKW-UHFFFAOYSA-N 421.453 2.143 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 58034797 ICTKZDYHNURAMI-UHFFFAOYSA-N 411.506 2.441 10 20 HECD C[C@@H](NC(=O)NCCS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 140915615 YTBOCIQGYPMIMF-QGZVFWFLSA-N 417.531 2.357 10 20 HECD COc1ccc(N2CCN(c3cc(N4CCCC[C@@H]4CO)ncn3)CC2)cc1F 302870000 AXTOSCAJTPYXLT-QGZVFWFLSA-N 401.486 2.302 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)n(C)c2ccccc12 472780130 ZPZZOCBWEUGKCR-UHFFFAOYSA-N 417.462 2.284 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)Nc3cccnc3)cc2F)C[C@@H](C)O1 725863243 AXIKTZNJYNZUPZ-GASCZTMLSA-N 415.469 2.272 10 20 HECD Cc1nnnn1-c1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 727938920 RAUFMZTXSFLWQS-UHFFFAOYSA-N 411.441 2.268 10 20 HECD C[C@@H](NC(=O)N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732572716 XZSLDMFVVJPEKW-CJNGLKHVSA-N 414.428 2.047 10 20 HECD Cc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 733527011 WTRAHMCXHDGPER-STQMWFEESA-N 405.426 2.209 10 20 HECD CCOC(=O)N1CCN(C(=O)CN(C)Cc2ccc(N3CCCCC3)cc2)CC1 741712439 VTWRIIALCYJTNL-UHFFFAOYSA-N 402.539 2.409 10 20 HECD CN1CCCc2cc(CNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)ccc21 746880007 RDMQOOPHAKFJGV-XKGZKEIXSA-N 402.564 2.411 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)C2CC2)cc1 747557470 NMGLRZLCYQOYBW-UHFFFAOYSA-N 421.501 2.073 10 20 HECD O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NCc2ccccc2O)c1 748461304 VKXZKBOZUCDSPZ-UHFFFAOYSA-N 412.490 2.052 10 20 HECD CC(=O)c1cc(F)cc(CN(C)c2c(O)nc(=O)n(Cc3ccccc3)c2N)c1O 750817477 NOWVMIWVWJSPSZ-UHFFFAOYSA-N 412.421 2.263 10 20 HECD CC(C)OC(=O)CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751058691 JGAGGZMMUVDHEV-UHFFFAOYSA-N 412.489 2.326 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227377 HUABZZVYMJNOEB-UHFFFAOYSA-N 406.479 2.468 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(OC[C@@H]4CCCO4)CC3)CC2)cc1 751488504 YFMSGDPCLKIGCN-QFIPXVFZSA-N 417.550 2.004 10 20 HECD C[C@H](OC(=O)CCc1nc[nH]n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 756758513 KQDZBRJJLQHYPE-LBPRGKRZSA-N 418.409 2.083 10 20 HECD CN(c1ccccc1NC(=O)NCc1ccc(N2CCOCC2)cc1)S(C)(=O)=O 758259710 KRMIYKNHKJGNLY-UHFFFAOYSA-N 418.519 2.241 10 20 HECD C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc2)C1 762268905 VBPWEMGBAJZEFX-HNNXBMFYSA-N 418.515 2.491 10 20 HECD C[C@@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763853956 LXBACADSIPZQGC-NYCQYLMKSA-N 424.522 2.489 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(C(=O)NCc3ccc(N(C)C)cc3C)CC2)n1 770630061 MHSVNPWQJYNNPP-UHFFFAOYSA-N 414.510 2.445 10 20 HECD C[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(S(N)(=O)=O)c1 774390517 BBPPGXJZMZHVCW-AWEZNQCLSA-N 407.511 2.285 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC 774765198 XNEXTVCHZRECKM-WBVHZDCISA-N 419.522 2.056 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1O 775023932 OFNHWVOWZXBIOH-MSOLQXFVSA-N 401.463 2.282 10 20 HECD COCCO[C@@H]1C[C@@H](CO)CN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 775205282 RTIPZMACBMITLH-RTBURBONSA-N 407.511 2.431 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 775370399 MLQMASDLTDFVQN-HNNXBMFYSA-N 417.481 2.344 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3nc4ccccc4n3C)CC2)cc1 779225725 OYPACTXNQSYTDN-HXUWFJFHSA-N 423.561 2.197 10 20 HECD Cc1ccc(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(=O)n1C 787002292 VXBBNOBXVWFKGO-HZPDHXFCSA-N 416.497 2.446 10 20 HECD Cc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788313403 SRKBUVXHUYQDTE-OAQYLSRUSA-N 407.514 2.464 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F 788319525 LKKQORWVWTUWLL-OAHLLOKOSA-N 417.456 2.338 10 20 HECD CN(CCN1CCOC(C)(C)C1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 788884503 SDJSWIAXLGOJJG-UHFFFAOYSA-N 422.545 2.039 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@]4(CCO[C@@H]4C)C3)cc2F)CC1 792077141 WQACAGOMLMSTEU-VGSWGCGISA-N 420.529 2.057 10 20 HECD CC(C)(C)[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 800326257 HKTAEZPLPYKPJD-OAHLLOKOSA-N 416.444 2.241 10 20 HECD COC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309648 BTLPUKCNLUKOJE-LPHOPBHVSA-N 415.490 2.106 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3C[C@@H](OC(C)C)C3(C)C)CC2)cc1 804317204 WCZYUWFVXBTQND-WOJBJXKFSA-N 417.550 2.489 10 20 HECD Cc1ccc(C(=O)N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c(O)c1O 804764593 ZLYNQIXAQRKQDT-HNNXBMFYSA-N 405.495 2.173 10 20 HECD CCCNC(=O)OC[C@H]1CCCCN1Cc1cc(O)n2ncc(C(=O)OCC)c2n1 805775245 ZCMCECXJQBTJTA-OAHLLOKOSA-N 419.482 2.102 10 20 HECD CCOC(=O)C1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 915790678 IDTMGFOTWINXGB-UHFFFAOYSA-N 404.507 2.202 10 20 HECD COC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 917172312 SHPMNOFHDOIDLL-AWEZNQCLSA-N 421.453 2.173 10 20 HECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1OC 918307983 BIIRPIMYKLVGMS-UHFFFAOYSA-N 413.474 2.138 10 20 HECD CCOC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 920088675 HQMIMBPJDABTPX-HOTGVXAUSA-N 421.513 2.083 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OCC)cc3)CC2)cn1C 1320463696 ZMWSKYCJDHYSJD-UHFFFAOYSA-N 421.519 2.111 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1)c1cc(O)nc(O)c1 1802234630 QWYCWDZRVYPHBC-SFNKJDCFSA-N 423.469 2.138 10 20 HECD CCc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n(C)n1 1844496887 UMXFITKUGOZHSY-UHFFFAOYSA-N 418.881 2.178 10 20 HECD Cc1nccn1[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846658875 ZXFIBXRFBPEOMS-LBPRGKRZSA-N 418.881 2.334 10 20 HECD Cn1c(=O)c2ccccc2n2c(CN(Cc3ccccc3O)C[C@H]3CCCO3)nnc12 302834436 UWBUWCWJIKLNNQ-QGZVFWFLSA-N 419.485 2.468 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cncc(Br)c2)cc1 321140290 NPEJRXXGXIBMER-UHFFFAOYSA-N 420.310 2.407 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1 729062735 DIEXHUAPQOKQOE-HNNXBMFYSA-N 421.453 2.427 10 20 HECD CC1CCN(c2ccc(CNC(=O)CN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)cc2)CC1 731016879 SLGVPQFDSZFFKG-GPHNJDIKSA-N 407.514 2.346 10 20 HECD CN(Cc1ccccc1O)C(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1 731119206 ZJEYSFYKVPWCTD-HXUWFJFHSA-N 410.518 2.431 10 20 HECD CN(CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)S(=O)(=O)c1ccccc1 731856994 WDISECTUWVHWDT-GOSISDBHSA-N 418.515 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(OC)c(N4CCNC4=O)c3)CC2)cc1 742034227 WGZPJPGVEIUUAW-UHFFFAOYSA-N 410.474 2.196 10 20 HECD NC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1Cl 743954973 FERWNWQLMMDQHC-UHFFFAOYSA-N 401.850 2.278 10 20 HECD COC(=O)c1ccc(OC)c(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c1 747254101 BUIKFJOJUWXCCG-UHFFFAOYSA-N 404.488 2.343 10 20 HECD CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 749623812 ZCSUUKHFQKLYAU-UHFFFAOYSA-N 403.504 2.190 10 20 HECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCCc2ccc(O)c(O)c2)C(C)C)cc1 750795707 RFNMLONPCPDWDP-IBGZPJMESA-N 406.504 2.068 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCc2c[nH]nc2C1 750809038 JQFLOBVNBACHQI-UHFFFAOYSA-N 404.473 2.176 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2csnc2C(=O)OC)cc1F 751086816 AAAHFTMTBHWHOY-UHFFFAOYSA-N 401.485 2.394 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CC1(N2CCCC2)CCOCC1 761241273 VDLWWYRVTNOJHQ-UHFFFAOYSA-N 407.898 2.455 10 20 HECD CC(C)(C)c1ncc(NC(=O)C(=O)NCc2cccc(Br)c2O)cn1 765903226 HZMJAIIXGXQKLM-UHFFFAOYSA-N 407.268 2.497 10 20 HECD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1F 767778516 LYHQNGFPYHBUIK-UHFFFAOYSA-N 410.467 2.286 10 20 HECD CCC(=O)[C@H]1CCCCN1C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 773538904 QYFMOEOMLOVTEL-YVNCXZRQSA-N 413.518 2.260 10 20 HECD COc1cccc(C(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)c1 775648499 ALWQSERBQWAXNF-UHFFFAOYSA-N 408.546 2.405 10 20 HECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 783189104 KVVAMSAWBSWDMP-UHFFFAOYSA-N 410.467 2.207 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(F)c1 786261877 GTZRTMAQNZDRPV-UHFFFAOYSA-N 413.449 2.211 10 20 HECD CCOC(=O)[C@H](CC)N(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787350771 GCXXGLMXFVPPOY-FQEVSTJZSA-N 403.523 2.150 10 20 HECD COc1cccc(CNC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 788529406 MRJSKLCKDHCUMX-GOSISDBHSA-N 402.466 2.347 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 789798387 GRMBQOLSYHUUAB-KZNAEPCWSA-N 403.498 2.364 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789836604 TVQGGMQKIZCOLF-WBVHZDCISA-N 405.514 2.488 10 20 HECD C[C@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789845041 JCDYPBFQSPEWGP-HDICACEKSA-N 418.607 2.235 10 20 HECD Cc1nn[nH]c1C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 791044571 LXEHWFKOYIVOOG-LLVKDONJSA-N 404.382 2.073 10 20 HECD C[C@H]1OCC[C@]12CN(CC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CCO2 791591995 YCNFXRNCNGPJOY-MYYSRTQBSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(Cl)cn3)CC2)cc1 792704529 KCKADKDXFROWQR-UHFFFAOYSA-N 403.866 2.178 10 20 HECD CCOC(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 795291024 UOWOSOKPBNTXKU-UHFFFAOYSA-N 416.452 2.175 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451260 IATWDXKZHDCWHA-ZFWWWQNUSA-N 411.449 2.057 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@H]4CCCO[C@H]4C3(C)C)CC2)cc1 807611372 FCPFMROZFPAAFA-VAMGGRTRSA-N 415.534 2.054 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807676420 GEXCMATZHXBSDD-HNNXBMFYSA-N 418.538 2.446 10 20 HECD CC[C@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)OCCc2ccccc21 811589140 GSDBZPRQWODNKK-HXUWFJFHSA-N 404.488 2.372 10 20 HECD CCOCc1nc([C@@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 812567499 FUAUASFRVRQNAH-OAHLLOKOSA-N 403.483 2.345 10 20 HECD CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 917136487 BYPLENBDCMLIOM-UHFFFAOYSA-N 423.561 2.238 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 917364916 RWZZQYYQSPCTKB-SFHVURJKSA-N 413.430 2.238 10 20 HECD O=C(CCOCc1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644710 HGGCLJFHOXYYJT-UHFFFAOYSA-N 402.516 2.145 10 20 HECD C[C@@H](NC(=O)c1cc(S(N)(=O)=O)ccc1Cl)c1ccc(N2CCOCC2)cc1 920889717 BKSRBZRQASPRSH-CYBMUJFWSA-N 423.922 2.315 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CC34CCS(=O)(=O)CC4)cc2F)C[C@@H](C)O1 1325807614 HZMMPCVVPZDTRP-BFYDXBDKSA-N 424.538 2.270 10 20 HECD O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)cc2)CCC1)c1cc(O)nc(O)c1 1792042406 SNMFLXKTKMJIRM-MNZLEMJZSA-N 409.442 2.133 10 20 HECD C[C@H](CN)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1814749610 BIADTFSGYWXMDQ-SCZZXKLOSA-N 424.910 2.028 10 20 HECD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250700 FADOUUQWNZUOEN-CQSZACIVSA-N 413.449 2.328 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2CCCSC2)C1 1847022369 YCVIAEPIUYYAMR-KEDPEKRHSA-N 418.515 2.163 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 65715827 DKMURZGIOODROE-OAHLLOKOSA-N 413.474 2.356 10 20 HECD C[C@@H](OC(=O)Cc1cnn(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 726000335 GXSXGLNNORHGEO-CYBMUJFWSA-N 417.421 2.308 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1 734074009 GIARRYKVGAMWDZ-UHFFFAOYSA-N 411.458 2.200 10 20 HECD COc1cc(N(C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc(OC)c1OC 741795283 INFWPCBECMAVEZ-UHFFFAOYSA-N 423.416 2.182 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)c2)n1C 746378863 FMFUXYTUJRHEAA-UHFFFAOYSA-N 410.453 2.251 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(Br)nc3)CC2)cc1 746592880 IMUSTNPBMGJQLK-UHFFFAOYSA-N 419.323 2.405 10 20 HECD C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 747364113 NAMWKEYFGNIDHY-VGOFRKELSA-N 416.543 2.092 10 20 HECD Cn1ccc(CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 747949491 QRZQFYNTPAVUEM-UHFFFAOYSA-N 423.496 2.280 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OCC)o2)cc1 748640713 CDMIORKPVRZMON-UHFFFAOYSA-N 416.477 2.409 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C[C@H]3C(=O)Nc4ccccc43)CC2)cc1 748705785 VZKKLEBTKHFQPA-OAQYLSRUSA-N 422.529 2.450 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1[C@H]2CC[C@H]1CC(=O)NC2 748826512 SDIIXMDZDUJLEC-BPUTZDHNSA-N 417.465 2.142 10 20 HECD Cc1cccn2cc(CC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)nc12 750669793 IHDQMNWIAMNQMD-GOSISDBHSA-N 405.502 2.203 10 20 HECD Cc1nnccc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 753524582 JRUBGPHOEKOXFA-KBPBESRZSA-N 416.453 2.011 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCC[C@H]3O)CC2)cc1 755053375 JYCCCZIPHYOYKX-GHTZIAJQSA-N 404.555 2.010 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cncc(Br)c3)ccc21 757161692 VPDQEGBBVLGOTF-UHFFFAOYSA-N 403.280 2.481 10 20 HECD CC[C@@H](C)NS(=O)(=O)Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 760271556 WSZPWKBNVBXNQC-GFCCVEGCSA-N 424.504 2.242 10 20 HECD CC[C@H]1C(=O)N(CCCN2CCN(c3ccc(OC)cc3)CC2)C(=O)N1C1CC1 760951656 PGQPXDOZYFEHGG-FQEVSTJZSA-N 400.523 2.413 10 20 HECD CCc1ncc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)s1 763373872 MVRCOOJZLGADTF-UHFFFAOYSA-N 405.523 2.277 10 20 HECD COC(=O)c1csc(S(=O)(=O)NCc2cccc(Br)c2O)c1 766201847 VSUJFEBLIZNRNA-UHFFFAOYSA-N 406.279 2.481 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCS[C@@H]3COCC[C@@H]32)c1 767784562 DEHHXKFNCQMXBK-VQTJNVASSA-N 406.548 2.133 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1 767958296 NANJDJKOBWCTQU-MRXNPFEDSA-N 412.490 2.102 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1 768146823 UUYSXESXDZAEGN-GFCCVEGCSA-N 422.445 2.070 10 20 HECD C[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CN(C)CCO1 770107069 GRMLXPKJZVTTAZ-KDOFPFPSSA-N 412.481 2.275 10 20 HECD C[C@H](CN1CCOCC1)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 771185115 CTMIFRVRTGLMQJ-CYBMUJFWSA-N 424.409 2.248 10 20 HECD COc1ccncc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784767710 RDVZAYRHEBKWKE-HNNXBMFYSA-N 418.881 2.169 10 20 HECD CCC(=O)COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400476 XDDJFPMUHPXYHN-UHFFFAOYSA-N 408.388 2.237 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@H](C(N)=O)CC[C@H]2C)c([N+](=O)[O-])c1Br 785753861 OAJXJSFLMCUVKG-HTQZYQBOSA-N 417.216 2.364 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccnc2-n2ccnc2)cc1F 787441485 FGXPIIVFWMFSAA-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)NCC(F)(F)F)n(C)c1 790412168 YQUZZSSAZJWJBA-UHFFFAOYSA-N 421.397 2.222 10 20 HECD O=S(=O)(C1CCOCC1)N1CCC(NCc2c(O)ccc(Cl)c2F)CC1 790968068 IBKNFTZALMYXSW-UHFFFAOYSA-N 406.907 2.248 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(F)cc4nn[nH]c34)cc2F)CC1 800485428 SSFYNRZLFVHWBO-UHFFFAOYSA-N 400.433 2.308 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 801549610 SRQXMHPBFCLBKD-UHFFFAOYSA-N 422.503 2.449 10 20 HECD Cc1cncc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 803450349 HLNVSDBEUSLNCX-UHFFFAOYSA-N 418.444 2.393 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCN(CC(F)F)CC3)cc2)CC1 803650433 GXUNAVQOWKMZGQ-UHFFFAOYSA-N 422.520 2.385 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](C3(C)OCCO3)C2)cc1F 804852126 ZXZQKRNSHUWMLK-KRWDZBQOSA-N 421.513 2.290 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCC3(O)CCOCC3)cc2F)C[C@H](C)O1 804969498 QRGMWNMGWYZDRL-HOTGVXAUSA-N 409.502 2.170 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4ccccc4C3)cc2F)CC1 805009369 IWMYZWLWFPTPPS-UHFFFAOYSA-N 424.520 2.169 10 20 HECD Cn1cccc1C(=O)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805650575 LZHPEQGKRDLJDW-UHFFFAOYSA-N 416.389 2.165 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(F)c(CN(C)C)c1)c1ccc(N(C)C)cc1 806042979 BQKDSXZSIRCTQB-HNNXBMFYSA-N 400.498 2.447 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H]2C[C@@]2(C)NC(=O)NC2=O)cc1F 806772346 OPOXBYVPXRHOET-YCRPNKLZSA-N 419.501 2.334 10 20 HECD COC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(C)o1 806779618 QFFITLZAARMEJS-MSOLQXFVSA-N 416.474 2.305 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 807290574 YYJOSRFJPOTZRF-JAXLGGSGSA-N 408.546 2.012 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c2ccccc21 807292150 MMNVOHMEWIIOBY-OAQYLSRUSA-N 418.497 2.293 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cn(C)nc1C(F)(F)F 807576021 NNAMPTXBEMOOQX-UHFFFAOYSA-N 411.428 2.170 10 20 HECD Cc1csc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 807679758 VADLWMAOJYEGPT-HNNXBMFYSA-N 401.536 2.044 10 20 HECD CC(=O)Nc1ccc(NC(=S)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1 812262185 XGBPDQLPCSVNDI-UHFFFAOYSA-N 407.521 2.209 10 20 HECD COc1ccc(N2CCN(CCNC3CCC(CS(C)(=O)=O)CC3)CC2)cc1 815569356 PZWAIUIYLGPLQQ-UHFFFAOYSA-N 409.596 2.010 10 20 HECD CCCS(=O)(=O)N1CCC(NC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 917134199 MBSUTOMFVAUHCS-UHFFFAOYSA-N 404.536 2.423 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOC4=O)cc3)cc2)C1 917835017 XAAOJLBGFCLEEY-SFHVURJKSA-N 422.485 2.275 10 20 HECD CC(C)[C@H](CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 920921033 QAVZJHOUCOLTDC-UGKGYDQZSA-N 417.598 2.155 10 20 HECD CC(C)c1noc(CCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 1321672266 HLJZAWRBFFJCPS-UHFFFAOYSA-N 405.474 2.335 10 20 HECD Cc1noc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n1 1788220406 OETIRKKLNKXBTQ-UHFFFAOYSA-N 423.429 2.175 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc2ccoc2cn1 1796604139 KJBPFWRGLIMKIE-QDMKHBRRSA-N 408.414 2.200 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1(O)CCC1 1841048717 NLNWALXBYRIPAD-LBPRGKRZSA-N 408.882 2.119 10 20 HECD Cc1cccnc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034274 GVMVWEKHHRJXHR-SOFGYWHQSA-N 409.442 2.037 10 20 HECD Cc1ncc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847037322 KRMDKQPETVQNJQ-GQCTYLIASA-N 415.471 2.099 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)Nc3ccccc3)cc2)C1 733644331 FHBWWELIPKIHEF-SFHVURJKSA-N 423.517 2.216 10 20 HECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NCc1ccc(N(C)C)cc1C 734504066 XGDCTWMYLQMWPG-UHFFFAOYSA-N 405.520 2.184 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1ccccc1CN1C(=O)CNC1=O 740679330 IAABCYSIQKAFSA-UHFFFAOYSA-N 405.458 2.436 10 20 HECD COc1ccc([C@@H](CNC(=O)NCc2ccccc2O)N2CCOCC2)cc1OC 748463513 UKTNGGUJHOBOLF-GOSISDBHSA-N 415.490 2.282 10 20 HECD NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 751374022 VLYVSNMHRCSSPM-MRXNPFEDSA-N 423.922 2.087 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)oc2C)cc1C 754747208 NDLZIRBBAPSDPI-UHFFFAOYSA-N 416.477 2.245 10 20 HECD COc1ccc(OC)c([C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755305788 SZJXBGCIXCQSOQ-NRFANRHFSA-N 400.475 2.485 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3C(C)(C)O)CC2)cc1 758315123 HKPRTHBDEDSFKG-FQEVSTJZSA-N 404.555 2.152 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CC3CCC(OC)CC3)CC2)cc1 758611956 QLZFVZKVOPDEBM-UHFFFAOYSA-N 404.507 2.482 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccn4ccnc4c3)cc2)C1 762269907 DUDHXKVSWDQRBM-SFHVURJKSA-N 406.490 2.035 10 20 HECD COC(=O)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)C 769654590 XGCYQVMONSNTRZ-OAHLLOKOSA-N 412.489 2.182 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C(C)(C)C(N)=O)c2C)cc1 769682088 MEVVDJUIUKJFNF-UHFFFAOYSA-N 400.431 2.118 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CO)(Cc4ccccc4)CC3)nc12 769989043 HICQSBDKMUDSOM-UHFFFAOYSA-N 424.501 2.429 10 20 HECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)CN1Cc1ccccc1 770157027 MGWFJSWTOGJLNV-HOTGVXAUSA-N 417.531 2.499 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1)c1ccc(N(C)C)cc1 773847619 RGAVMJHIGMRCKF-SFHVURJKSA-N 424.545 2.443 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCCN2CCCCCC2=O)cc1 775098134 UBYHOLMAVZZJGG-UHFFFAOYSA-N 416.566 2.400 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H]1CC1(Cl)Cl)c1ccc(N2CCOCC2)cc1 775156758 AFFHTDOMBVHFOP-OCCSQVGLSA-N 400.306 2.010 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(O)nc(CC(C)C)c3)nc12 777140359 RIFPLMUYJRXFQX-UHFFFAOYSA-N 414.418 2.268 10 20 HECD O=C1NC2(Cc3ccccc3C2)C(=O)N1Cc1ccc(N2CCC(O)CC2)c(F)c1 777605987 YLCCJMRZWJYOOU-UHFFFAOYSA-N 409.461 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCSCC(C)C)CC2)cc1 778394530 JIZPBRKDYGSVRT-CMDGGOBGSA-N 405.564 2.405 10 20 HECD O=C(Nc1ccnn1-c1ccncc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 780050498 LFDPCXJKGWRTFY-SFHVURJKSA-N 421.457 2.119 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1 785526657 GJAUDISZIRYMMR-RTBURBONSA-N 416.566 2.018 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C2CC2)cc1 786005572 DIKQPNOXLGZOBX-UHFFFAOYSA-N 418.501 2.141 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(-n2cccn2)c1 787244383 XIVLUUNRQWOPJP-UHFFFAOYSA-N 420.517 2.387 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](C)N(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 787635742 GAAUJILHRJTQFD-RTBURBONSA-N 424.545 2.342 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@H](OCC2CC2)C1 789867464 GEXCNCRSODPKRU-FQEVSTJZSA-N 417.575 2.274 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)nc3Cl)cc2)CC1 790050331 ZIKUCAAHXQBZJM-UHFFFAOYSA-N 422.938 2.190 10 20 HECD COc1cc(OC)c(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(OC)c1 790098430 QPBANQQXNOVVRV-UHFFFAOYSA-N 415.490 2.019 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3CCO4)CC2)cc1 794144282 YZIIJNUHMWWSQR-KTKRTIGZSA-N 407.470 2.474 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c(O)c1 797390167 PWUJFWBHCQRMSV-UHFFFAOYSA-N 405.838 2.011 10 20 HECD Cc1cc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)on1 803309502 YOIJCSXJEQYEMC-QFBILLFUSA-N 412.490 2.361 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664037 FLJDCSAXRUOZHF-JXFKEZNVSA-N 412.509 2.145 10 20 HECD Cn1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c2ccccc21 805742875 PPYOCYOAGOKGDL-QGZVFWFLSA-N 422.485 2.103 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1nccn1CCc1ccccc1 807100686 NDDQDXIIFKKFPI-UHFFFAOYSA-N 419.529 2.433 10 20 HECD CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807386658 DHKPOIFKRSVAQL-UHFFFAOYSA-N 420.263 2.392 10 20 HECD COC[C@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770498 LMBPOGLEABIGMZ-GDBMZVCRSA-N 411.449 2.010 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C(C)(C)[C@H]3c3cnn(C)c3)CC2)cc1F 808168630 PXUTZDRXXOGLOZ-LJQANCHMSA-N 401.486 2.257 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1(CCOC)CC1 809435131 OWBWZCDEBNZUJJ-UHFFFAOYSA-N 413.312 2.436 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cc(COC)c2)cc1 811700326 IXRFSFMCSYXNSI-UHFFFAOYSA-N 419.912 2.163 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1 916502187 DVRKXOAAIRQOSU-UHFFFAOYSA-N 414.531 2.230 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(-c2ccccc2)[nH]n1 916676313 GPEHIIQNKFINGC-UHFFFAOYSA-N 410.499 2.242 10 20 HECD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCCc1ccc(O)c(O)c1 917355467 DSZITIJVYFQNPO-UHFFFAOYSA-N 418.515 2.174 10 20 HECD O=C(O)CCc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 919730035 LPHMWLKFQWAESZ-UHFFFAOYSA-N 404.488 2.019 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cocn2)CC1 1826161681 BKRBXFRMXGPPGJ-INIZCTEOSA-N 400.435 2.028 10 20 HECD COc1cccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1842320032 WKWUYWIXVJJXLO-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=C([C@H]1CCC(F)(F)C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034344 CNZPQZUZFJJDNH-KQIUPUNMSA-N 422.428 2.455 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)cc1 7094132 IVMQFGQATMPESU-UHFFFAOYSA-N 412.490 2.050 10 20 HECD COc1ccc(COC[C@H](O)CNCc2ccc(N3CCOCC3)c(F)c2)cc1 727467641 KKRODJWDVKUIBB-LJQANCHMSA-N 404.482 2.338 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1 728982161 JFZZLJPTYBOGQS-LLVKDONJSA-N 416.455 2.199 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729067971 ZJIJZXWFBCCLBY-CYBMUJFWSA-N 409.446 2.495 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)NCc1cccc(OC)c1O 729859498 SMMSWCVPCAYMRL-UHFFFAOYSA-N 404.488 2.186 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3CCO)cc2F)C[C@@H](C)O1 731751536 ZQQONIOXOYOREU-ZIFCJYIRSA-N 407.530 2.292 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(CS(C)(=O)=O)cc3)ccc21 734841390 PUNOSKYOABJDNQ-UHFFFAOYSA-N 408.545 2.092 10 20 HECD C[C@H](OC(=O)c1ncccn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 741037217 PYEDLBJJIQOABW-LBPRGKRZSA-N 401.378 2.436 10 20 HECD COc1cc(Br)cc(CN[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1O 742390978 XYHNUULNAMPKOS-HZMBPMFUSA-N 409.284 2.180 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1 743182825 DMLFQOLIHDETJE-UHFFFAOYSA-N 416.459 2.312 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(-n4nccn4)cc3)CC2)cc1 743294484 KWTDSWAQSVHZPC-UHFFFAOYSA-N 421.505 2.220 10 20 HECD COc1ncc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 746787042 QJSBEONUIRNAFX-UHFFFAOYSA-N 400.504 2.207 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC2(CC1)OCCO2 748025644 SYGDNZWVTMQUTQ-UHFFFAOYSA-N 424.500 2.234 10 20 HECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 749623501 VCMPGVHXAQKUFR-UHFFFAOYSA-N 412.490 2.108 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc2nsnc12 751241216 YCRXRYDAUSQHHO-UHFFFAOYSA-N 418.544 2.379 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)cc2F)CC1 753926831 YBQRUWKDCARGHI-AEFFLSMTSA-N 403.546 2.392 10 20 HECD C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1ccc(Br)cc1O 756706228 NVSUSFHAOOLGHE-GXTWGEPZSA-N 421.357 2.294 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCc3nc(COC)nn3C2)cc1 757778893 YYDBEPQJTKKDIY-QGZVFWFLSA-N 400.527 2.427 10 20 HECD CNS(=O)(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)c1 766891210 BBXJGYZVQLHKAR-UHFFFAOYSA-N 411.288 2.408 10 20 HECD CC(C)C(=O)NCCN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767775194 LRUDMXLXDSVASK-OAHLLOKOSA-N 421.497 2.493 10 20 HECD Cc1cc(C)nc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 772954105 NLXKBHDANNGDLT-UHFFFAOYSA-N 400.454 2.054 10 20 HECD COc1c([N+](=O)[O-])ccc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1O 775089191 KSQNONSQCZPIAD-OAQYLSRUSA-N 401.463 2.378 10 20 HECD COCCO[C@H]1C[C@@H](CO)CN(Cc2cc(Br)cc(OC)c2O)C1 775203544 LUAWLOJFZYIJPM-DOMZBBRYSA-N 404.301 2.009 10 20 HECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 775372447 BIVPTFYARZKTGA-KBPBESRZSA-N 421.519 2.329 10 20 HECD C[C@@H](NCC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C)c1ccc(N(C)C)cc1 775835561 UYAWOXJXCINDJI-HUUCEWRRSA-N 416.547 2.028 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)c1 776494937 RWAALXQSAHVXJM-AWEZNQCLSA-N 409.895 2.426 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)c3cnccc3C)CC2)cc1 778420258 UDIDEHSIXQOBKP-BLGFXRMMSA-N 408.502 2.481 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCO4)c2)CC1 780408068 UUTTVOPCIFEDRY-UHFFFAOYSA-N 401.488 2.091 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 785433952 QBTAESVBNOZIHN-HXUWFJFHSA-N 409.465 2.147 10 20 HECD C[C@H](OC(=O)Cc1cc[nH]n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787782314 XQYRDUNAMUWCOX-LBPRGKRZSA-N 403.394 2.298 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cn2c(n1)CCCC2 788847068 PZDFBVABIJFWET-UHFFFAOYSA-N 411.550 2.381 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1cccc(F)c1 788936361 KNLQSSYAYAVRPZ-NRFANRHFSA-N 412.509 2.461 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccnc3)cc2F)C[C@@H](C)O1 789828630 XSFWBMPURUGOKB-HZPDHXFCSA-N 414.481 2.109 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCn4cnnc4[C@H]3C)cc2F)C[C@@H](C)O1 790220484 WFLLYGAJMJRARP-RBSFLKMASA-N 402.474 2.317 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ncccc3Br)cc2)C1 793131601 KHRJHGFNYJCWHW-CQSZACIVSA-N 417.307 2.476 10 20 HECD COc1cccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 795157211 UCVSIMYCWDBZHO-UHFFFAOYSA-N 422.503 2.232 10 20 HECD Cc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nnn1Cc1ccncc1 795592457 KJWVXWRLZCQQPN-INIZCTEOSA-N 406.490 2.357 10 20 HECD C[C@@H](NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 797087692 SRNVAGXLRQDPBS-VOBGVNJCSA-N 418.557 2.397 10 20 HECD C[C@@]1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 805758485 MKTPXGPDYSZRTN-VLIAUNLRSA-N 411.449 2.058 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)NC[C@@H](N1CCOCC1)C(F)(F)F 805845216 ROLHSNROTXOPHX-QGZVFWFLSA-N 401.429 2.333 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)c2ccccc21 806282982 ZPWINHOFFWDKGV-OAHLLOKOSA-N 418.544 2.356 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@H]3CCO[C@H](C)C3)CC2)cc1 807973772 YWDKADVBDFMLST-MSOLQXFVSA-N 403.523 2.055 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 808095165 UEPCEERSJBQKNN-WBVHZDCISA-N 423.506 2.476 10 20 HECD CCOc1cccc(CN(CCN)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1O 809727876 APHIVHUCLOFAFQ-UHFFFAOYSA-N 409.464 2.068 10 20 HECD COc1ccc(N2CCC(NC[C@H](O)COc3ccc4c(c3)OCO4)CC2)cc1 812826242 HMQSKJYWASLGJZ-SFHVURJKSA-N 400.475 2.422 10 20 HECD CCn1nc(C)c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 815298135 CLKAUPBNMPELPT-UHFFFAOYSA-N 418.409 2.177 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 815575132 KFGYIOLKMPGUFX-LBPRGKRZSA-N 418.519 2.476 10 20 HECD O=C(C[C@@H]1CCCS(=O)(=O)C1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835078 JQIBCHGDGIJJAM-WMLDXEAASA-N 414.955 2.341 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCNC(=O)C1CC1 914439481 HCCIYIICIPTQJD-SDNWHVSQSA-N 423.585 2.372 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\c3ccc4c(c3)OCO4)cc2)C1 917833926 VUJSXLXOMUKKCY-OEPRFQHASA-N 407.470 2.447 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)C4CC4)CC3)cc2F)C[C@@H](C)O1 918219641 DCABKRXDKZBCIJ-HZPDHXFCSA-N 418.513 2.203 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccnc2-n2cccn2)C2CC2)cc1 918456601 MMXBDTJWPQCYJA-UHFFFAOYSA-N 404.474 2.463 10 20 HECD Cn1cc([C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2)cn1 1320364394 HQKFFPWAAFXWDO-GOSISDBHSA-N 400.460 2.017 10 20 HECD Cc1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1800715853 SNZUPOYGKXFFEW-BTTYYORXSA-N 416.865 2.415 10 20 HECD CC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816833241 XIQIPAJFWPJMMH-GFCCVEGCSA-N 423.564 2.308 10 20 HECD O=C(c1ccc2occc2c1O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250735 JAELRALVXWWEIO-UHFFFAOYSA-N 409.398 2.075 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cc2F)CC1 303308292 OIBKLWHDPUWGBU-OAHLLOKOSA-N 408.518 2.497 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](O)C3CCCCC3)CC2)cc1 727938253 ISKMNNUZHBUMOQ-QFIPXVFZSA-N 418.582 2.448 10 20 HECD O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)c(F)c1 731681534 DXXABFLRTLQPAD-UHFFFAOYSA-N 418.425 2.449 10 20 HECD CNC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 732207008 KANKKKRSNAJIIF-GJZGRUSLSA-N 419.481 2.247 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)c1cnn(-c2ccccc2)c1 733757208 QOUNYNDEYGEFTO-UHFFFAOYSA-N 408.433 2.347 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1 734072486 CDZDICQTAJVKCS-GOSISDBHSA-N 400.431 2.214 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F 734525673 OKGNOFAMIXGGFN-GOSISDBHSA-N 413.444 2.434 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1 735193836 BEKADIAXNAICRO-CYBMUJFWSA-N 420.487 2.070 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1C(=O)N(C)C 741095901 NDXDMEMAOCDEIZ-UHFFFAOYSA-N 400.454 2.157 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2ccc[n+]([O-])c2)NC(=O)OC(C)(C)C)cc1 742750208 BEEPZLQJXQXUBO-GOSISDBHSA-N 400.479 2.382 10 20 HECD COc1ccc(C(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 746736170 JDCVHDUBWFLDEM-LLVKDONJSA-N 423.443 2.209 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN3C3CCCC3)CC2)cc1 749241467 NOCIXKMAJQAEOI-JOCHJYFZSA-N 400.567 2.340 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)c3csc(C)n3)CC2)c1O 750825075 DUEYUYNCZFUCMS-UHFFFAOYSA-N 413.496 2.005 10 20 HECD CS(=O)(=O)c1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(Cl)s1 753522479 SEINQUHODVGZKH-UHFFFAOYSA-N 412.854 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1F 754213301 QRUKUVXUKBHQPK-UHFFFAOYSA-N 402.382 2.030 10 20 HECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 756888449 CMBABTXFEYFSAI-MFKICJERSA-N 400.523 2.458 10 20 HECD COc1ccc(N(C)CC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)cc1Cl 757856632 DVFHDTJFJABZBA-LBPRGKRZSA-N 423.922 2.410 10 20 HECD CCCCn1c(N)c(N(CCOC)C(=O)/C=C/c2ccc(Cl)nc2)c(O)nc1=O 759752866 OXDCECXLWPPYEY-SOFGYWHQSA-N 421.885 2.072 10 20 HECD COC(=O)[C@]1(C)CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 759784577 NNCUSXLXHCFGGA-HSZRJFAPSA-N 406.438 2.286 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1ccccc1Cl 763279086 IIWLXHUWGDFQCH-LBPRGKRZSA-N 412.895 2.167 10 20 HECD C[C@@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H](C)CN1C 770161567 GPWPVRMGWHVLGG-CHWSQXEVSA-N 409.533 2.419 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 774953432 IEUORTPDSHZKJM-SFHVURJKSA-N 400.548 2.384 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)n1nnnc1C(C)(C)C 777860151 GDEFWLOAVQBOLC-OAHLLOKOSA-N 400.527 2.057 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)cc1 778275532 KXCNEERUCBEBDL-AXUYNXDZSA-N 421.497 2.409 10 20 HECD O=C(NCCn1cnc2ccccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786988709 ZSNOMZCJAXUFKZ-SFHVURJKSA-N 422.485 2.066 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]c4ccccc4c3=O)cc2)CC1 787329238 WDYROCZIFFRFNC-UHFFFAOYSA-N 404.470 2.127 10 20 HECD CN1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2C1=O 787401813 GEDRBEBQRTYYNW-LJQANCHMSA-N 411.477 2.272 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1c(F)cccc1F 787908666 FRRJETXAUWGSHT-UHFFFAOYSA-N 417.456 2.119 10 20 HECD CCSCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789836711 VPUUOGGEEWQRCQ-GJZGRUSLSA-N 411.543 2.315 10 20 HECD CN(C)S(=O)(=O)c1cccc(NC(=S)NNc2cccc(F)c2[N+](=O)[O-])c1 790607256 HFMLKNOSVIVWMQ-UHFFFAOYSA-N 413.456 2.298 10 20 HECD COc1ccc(-n2cnnc2SCC(=O)NCc2ccc(OC)cc2O)cc1 794378108 CMEQPTDOBRJKNM-UHFFFAOYSA-N 400.460 2.399 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nnn1Cc1ccncc1 796546806 PVUGVYQQJFUQSI-UHFFFAOYSA-N 420.517 2.169 10 20 HECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NCc2ccc(OC)cc2O)cc1 797630209 OSVVABLZWBWAOU-ZDUSSCGKSA-N 415.446 2.404 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCCN3CCCC3)cc2F)C[C@@H](C)O1 799174013 IJZBUHUJKXKYPP-RTBURBONSA-N 420.573 2.473 10 20 HECD CN(CC(=O)Nc1cccc(C(=O)NC2CC2)c1)Cc1ccc(N2CCOCC2)cc1 800709130 HPIRRHRIMNMLLI-UHFFFAOYSA-N 422.529 2.486 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H]1CCCO1 803678147 ZBXYEUCQTHYBDV-RTWAWAEBSA-N 417.550 2.382 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@H](c4cccc(F)c4)C3)ccc21 803688717 ZNVMBPJNQPYTLL-OAQYLSRUSA-N 411.477 2.424 10 20 HECD Cc1ncsc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804620378 NCOKSKSJVGDTDO-ZDUSSCGKSA-N 424.473 2.454 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](CC(C)C)C3)cc2F)CC1 805008005 XJQCAHSYTWKOHV-LJQANCHMSA-N 418.557 2.478 10 20 HECD CCCN1CC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805023052 NBWUBMUDNSDBTP-HXUWFJFHSA-N 400.567 2.387 10 20 HECD CO[C@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cs1 807288186 RJYROUPGBBHMSF-CQSZACIVSA-N 400.504 2.159 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)s1 808086320 ASLRCGUHUWJMCS-UHFFFAOYSA-N 420.520 2.213 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCc2nn(C)c3ccccc23)C2CC2)cc1 809320931 MXDDKFNLWXOJCR-UHFFFAOYSA-N 419.529 2.489 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1OC 914438633 DVPUBWXHXMIYJO-UHFFFAOYSA-N 417.531 2.474 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3OC(=O)c4ccccc43)cc2)C1 917832501 BTWYKEMUIQYXEX-UZLBHIALSA-N 407.470 2.306 10 20 HECD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 918195489 WCRFTTJOBDDKMH-UHFFFAOYSA-N 413.402 2.188 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)c[nH]3)cc2)C1 918373171 UTSAKOXQMAXQPI-CYBMUJFWSA-N 405.296 2.409 10 20 HECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCCC[C@@H]1C 920636678 WMXJUFZQCHXHED-GUYCJALGSA-N 412.508 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)CC2)cc1 921302280 ZNYSJHPQQGPGCK-CMKODMSKSA-N 418.563 2.070 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cc(C(C)(C)C)n[nH]1 1320877214 ZOGQHMNDONDYBZ-UHFFFAOYSA-N 417.529 2.431 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]c(Br)c3)nc12 1324807540 PLXAWHGWBLUPJI-UHFFFAOYSA-N 409.196 2.059 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1NC(=O)OC 1325382650 YHNXEXCZUCMAEC-HNNXBMFYSA-N 402.403 2.180 10 20 HECD C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)c1ccc(N2CCOCC2)cc1 1343688451 CDDVDTNEHFMMLT-MAUKXSAKSA-N 421.538 2.365 10 20 HECD Cn1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)cn1 1791905096 ONCOFGQFVHVMNA-UHFFFAOYSA-N 421.457 2.217 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cscn1 1804283919 OWTJRGUSPIWGEH-LJWNITHASA-N 415.471 2.225 10 20 HECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1 1804336097 VQEOHHUTQSEPQB-MUJYYYPQSA-N 417.556 2.107 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccn2)[nH]n1)c1cc(O)nc(O)c1 1817843901 HEQWRPMFHHKLER-HNNXBMFYSA-N 408.418 2.231 10 20 HECD O=C([C@@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428958 MOWRWPFOMVYGHE-AEFFLSMTSA-N 417.506 2.153 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)CN(C)C4)CC2)cc1 195616604 OVCHIJYCVLIBRN-UHFFFAOYSA-N 408.502 2.318 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN4CCCC[C@H]34)cc2F)CC1 730118794 MIEJGKXINSJPLS-TZIWHRDSSA-N 403.546 2.394 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCc3c(C)nc(C)nc3O)cc2F)CC1 730193650 PHSIIPWFJRVNJR-UHFFFAOYSA-N 415.513 2.329 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)[C@H](CCSC)NC3=S)cc2F)CC1 730273430 QYIRLGGHIDZJMB-INIZCTEOSA-N 410.584 2.306 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(N4CCCC4)n3)cc2F)CC1 739565332 WLZBIHOCDRELLB-UHFFFAOYSA-N 412.513 2.288 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCN2CCCC2=O)NC(=O)OC(C)(C)C)cc1 742755067 VHNFCELCHFEBSV-GOSISDBHSA-N 418.538 2.447 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CC2(CS(C)(=O)=O)CC2)cc1 746840822 APWHFBVDVCQRDH-LJQANCHMSA-N 408.564 2.475 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12 748481755 MTGRXDYSQASZOZ-UHFFFAOYSA-N 406.442 2.032 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC4(CCCCC4)C3)CC2)cc1 754052199 XXEKYWQXUIWAJR-OAQYLSRUSA-N 403.567 2.213 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 754563016 LNHIINYDNGGLLF-SFNKJDCFSA-N 407.530 2.460 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 755257449 NMLXWCSPYGTBRC-FMWKFLBASA-N 424.545 2.481 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 755257451 NMLXWCSPYGTBRC-JYAXBFRTSA-N 424.545 2.481 10 20 HECD COc1cc(C[C@H](NCc2ccc(N3CCN(C)CC3)cc2)C(=O)O)cc(OC)c1 756358763 CQXNPOPJJFLTJU-QFIPXVFZSA-N 413.518 2.241 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NCc1cccc(Br)c1O 765731996 OJWDYONZKDITCG-CQSZACIVSA-N 419.341 2.365 10 20 HECD COc1ccc2c(c1)CCCN2Cn1nc([C@@H]2CCS(=O)(=O)C2)n(C)c1=S 766341144 NZUVHIYXOKEHFB-CQSZACIVSA-N 408.549 2.272 10 20 HECD C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769937643 SMKVRJCTLIWJCT-RYZVSIALSA-N 410.517 2.334 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1F 776492112 KHUUJKURGKEXTG-UHFFFAOYSA-N 414.359 2.483 10 20 HECD O=C(COC(=O)[C@H](F)Cc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 778199530 FIPUMFXHQZCXKJ-LJQANCHMSA-N 418.440 2.403 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@H]3CCCC[C@H]3O)CC2)cc1 779338451 UUWMDAXXYGQXES-WIYYLYMNSA-N 404.555 2.010 10 20 HECD O=C(CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCC(F)(F)F 779671829 ZEJUWCGWMXBGFE-LLVKDONJSA-N 409.355 2.442 10 20 HECD Cc1cc(C)nc(-n2nc(C)c(CC(=O)OCC(=O)c3ccc(O)c(O)c3)c2C)n1 782693638 CZBAUEAHUUIZBE-UHFFFAOYSA-N 410.430 2.276 10 20 HECD CCc1nnc(-c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)o1 785296260 MYDRPWNQMLAXFR-GFCCVEGCSA-N 410.430 2.396 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1 786349352 FNVNRVVDIVNULB-UHFFFAOYSA-N 422.529 2.230 10 20 HECD O=C(NCc1ccc2c(c1)CCO2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788345346 YPVSEANSFFIAFH-LJQANCHMSA-N 410.470 2.151 10 20 HECD COCCS(=O)(=O)c1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 797626750 SSRYSMHXZJMHQK-CYBMUJFWSA-N 408.476 2.271 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC3([S@](C)=O)CCC3)cc2F)CC1 798104970 JQVXNSSQXVLUNN-NDEPHWFRSA-N 410.559 2.068 10 20 HECD C[C@H](NC(=O)C(=O)N1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 803307613 JCHQQZBRJCZRKQ-SFHVURJKSA-N 415.534 2.262 10 20 HECD C[C@@H]1CSCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449053 MSYFJWLKMDIZPI-CYBMUJFWSA-N 413.490 2.337 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN(CC)C1CC1 804225851 UTXCUMIFEZKOCY-UHFFFAOYSA-N 412.328 2.104 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1nncn1C 805824022 SRUGGYFKZZAZLB-CYBMUJFWSA-N 403.442 2.050 10 20 HECD CC[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(Cl)cc(Cl)c1O 806137180 HMHSHELUOVZGPH-OAHLLOKOSA-N 410.367 2.317 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCC[C@H](C(=O)N(C)C)C1 806178569 HRKLYCFBIBGTHM-WMZOPIPTSA-N 403.523 2.284 10 20 HECD Cc1noc(C)c1CO[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806279089 DRVRCNOXMPDOKR-AWEZNQCLSA-N 424.548 2.164 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(C4CCCC4)nc3N)cc2)C1 806538985 CJHMZEINAPGXNP-QGZVFWFLSA-N 422.533 2.348 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1C1CC1 806539042 DTVAUPRTMBKVLJ-QGZVFWFLSA-N 408.502 2.123 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)CNC(=O)OC(C)(C)C 806760873 QITLUWZNKDIXEP-OAHLLOKOSA-N 406.527 2.131 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN3C(=O)C(F)(F)F)CC2)cc1F 807032275 DWSQAQNVHRALJD-AWEZNQCLSA-N 403.376 2.036 10 20 HECD COCCn1c(-c2cccc(S(C)(=O)=O)c2)nnc1N(C)Cc1ccccc1O 812167632 DSGWIVDEMSCSMS-UHFFFAOYSA-N 416.503 2.337 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1nc(N2CCOCC2)sc1=S 920303745 SQXIMFKVJOBXQH-UHFFFAOYSA-N 421.592 2.437 10 20 HECD CCOc1ccc(N2CCN(CC3=Nc4ccccc4S(=O)(=O)N3)CC2)cc1 1323178177 SSSVCYQBLBCPPD-UHFFFAOYSA-N 400.504 2.229 10 20 HECD CC(C)NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796167483 ZKXFLIXAHVFBMK-QDMKHBRRSA-N 409.914 2.391 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)Cn2cncn2)C3)cc1 1845398535 ZHLVIBNKKVLYOP-UHFFFAOYSA-N 418.501 2.203 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)C2CN(C)C2)C3)cc1 1845399530 IIUHGLSZTMZJCG-UHFFFAOYSA-N 406.530 2.473 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(c3ccccc3F)CC2)C1 1847012754 XOBUSTURVDZWDT-UHFFFAOYSA-N 411.433 2.181 10 20 HECD CNC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 729785143 UXGWQUPYUGPZIR-UHFFFAOYSA-N 424.501 2.007 10 20 HECD CCOc1cc2c(cc1CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)O[C@@H](C)C2 730971288 PFFPFTKCPWNTIS-RKPNYOAGSA-N 417.531 2.282 10 20 HECD CS(=O)(=O)NC1(CNC(=O)NCc2c(O)ccc3c2CCCC3)CCCCC1 745427817 MTHAICQIMPGPJS-UHFFFAOYSA-N 409.552 2.322 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](COCCOC)C3)cc2F)CC1 745810023 WWPSVBPWXMQPJX-LJQANCHMSA-N 422.545 2.162 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 754075750 QYHLEOOHRJAUOH-NOZRDPDXSA-N 424.589 2.167 10 20 HECD CN(CC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)c1ccc2c(c1)OCO2 756654771 MLCMGOXGKCLOCO-UHFFFAOYSA-N 401.507 2.493 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 758184106 DSLVXEQXMJIHGJ-UPVQGACJSA-N 424.589 2.042 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@@H](c4cccc(O)c4)C3=O)CC2)cc1 760951606 OQXFHHIZUQVKGD-NRFANRHFSA-N 424.501 2.206 10 20 HECD COc1cc(OC)cc(C(=O)NCC(=O)NCc2cccc(Br)c2O)c1 765732797 SSWVPJDQZQLWJK-UHFFFAOYSA-N 423.263 2.218 10 20 HECD COC[C@H]1CCCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 768255767 IYMNNAHXZBXFLV-OALUTQOASA-N 402.539 2.346 10 20 HECD COc1ccccc1NC(=O)CN1CCN(Cc2cc(OC)c(OC)cc2O)CC1 768461810 FOZMJMWUASIMMT-UHFFFAOYSA-N 415.490 2.174 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cccc(N4CCNC4=O)c3)no2)c1 770920224 SVEKFXCARBVEOH-UHFFFAOYSA-N 415.431 2.010 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(N)=O)cc3F)cc2)CC1 774223027 QDGNIMRZEXLFMY-UHFFFAOYSA-N 412.465 2.416 10 20 HECD Cn1c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2cc(Cl)ccc21 779231961 PTARXVYYKICIPO-UHFFFAOYSA-N 408.867 2.234 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(CN2CCOCC2)c1)c1ccc(N(C)C)cc1 787289290 FAGIZWQWMVXUGF-GOSISDBHSA-N 424.545 2.078 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)F)c2)cc1 790053230 FRHAUFDHVJDKAO-UHFFFAOYSA-N 408.452 2.101 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c(O)c1 794380727 AZJAMQLAUASIKQ-OAHLLOKOSA-N 422.478 2.257 10 20 HECD CO[C@@H]1CCC[C@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 796052043 FXUOXQGLHLRVIV-FUHWJXTLSA-N 422.497 2.417 10 20 HECD CCn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801910504 RRAJZPOVSMLEFL-UHFFFAOYSA-N 421.505 2.418 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1F 803663441 OYVJZCUUZZRVSL-IBGZPJMESA-N 403.429 2.247 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)c2ccccc21 806282981 ZPWINHOFFWDKGV-HNNXBMFYSA-N 418.544 2.356 10 20 HECD CC(C)C1(O)CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 806443832 TUMJHCBBRYJKHR-UHFFFAOYSA-N 401.429 2.454 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc4c3CNC4=O)CC2)cc1 806754366 QSXLCAARMOPBHR-UHFFFAOYSA-N 423.517 2.272 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806953891 KTULCXQCJMGXKO-RBSFLKMASA-N 411.449 2.057 10 20 HECD COCC[C@@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccco1 807902665 WKLFRFBSSFMGQF-LJQANCHMSA-N 415.490 2.221 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@]3(CCc4ccccc4O3)C2)c1 811608441 VUWZBAYVMXMUSM-FQEVSTJZSA-N 402.472 2.374 10 20 HECD O=C1CC(=O)Nc2cc(S(=O)(=O)Nc3nc(-c4cccnc4)cs3)ccc2N1 832245140 JWHOAUZDXSHCQY-UHFFFAOYSA-N 415.456 2.287 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cc(C2CC2)[nH]n1 919699688 WNLNHRCOOXDILS-UHFFFAOYSA-N 421.480 2.473 10 20 HECD Cc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1317947295 UGMOFEPEARJSHW-KBPBESRZSA-N 416.453 2.011 10 20 HECD CCOc1ccc(N2CCN(CCCN3C(=O)CS/C3=C\C(=O)OC)CC2)cc1 1336435240 KEXKBNSUYGHCPN-HKWRFOASSA-N 419.547 2.187 10 20 HECD O=C(c1nccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427070 OMQLHMSBXSITEB-HNNXBMFYSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnn3c2CCC3)C1 1845626634 WJNFUQZURRYVGZ-UHFFFAOYSA-N 416.865 2.025 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 27578587 QUFAYTFZGOYKHJ-UHFFFAOYSA-N 403.504 2.337 10 20 HECD Cc1cccc(NC(=O)CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 55110833 LSLHUQZHQIKYNK-UHFFFAOYSA-N 405.476 2.091 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)n(C)c2ccccc12 550398175 ATPKFBPFSGSMHU-IBGZPJMESA-N 404.514 2.494 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726600541 AJZUVKWZXYKOQN-UHFFFAOYSA-N 404.488 2.429 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc4c3COC4=O)n2)c[nH]1 727247717 KDMZWOGRZDGRHC-UHFFFAOYSA-N 419.440 2.396 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCCN3C(=O)NC(C)(C)C3=O)ccc21 728639668 RLZQLGMBSPVUQV-UHFFFAOYSA-N 401.463 2.392 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCN1CCCC1=O 733195702 UMWHECYEPSEVIK-HNNXBMFYSA-N 419.481 2.343 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 744380761 DQYRMXNULORRII-FGTMMUONSA-N 403.548 2.276 10 20 HECD COCCOC[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 744417095 NMFSTHUZOKKDLF-INIZCTEOSA-N 422.481 2.385 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC4(CCOCC4)C3)CC2)cc1 745784114 MWNKVYCGBSDVQW-UHFFFAOYSA-N 416.566 2.419 10 20 HECD COC(=O)c1csc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751238806 DFTKQYLFKZWEQG-UHFFFAOYSA-N 424.544 2.222 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccccc3-c3nnco3)CC2)cc1 758230123 GVZQUCRXWKASOJ-GOSISDBHSA-N 410.474 2.307 10 20 HECD COc1ccc(OCC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759238666 OKCLWLGJCNJUOH-UHFFFAOYSA-N 416.474 2.449 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1 759380851 OWZDXLKSEKWDGM-CYBMUJFWSA-N 400.431 2.007 10 20 HECD C[C@@]1(c2ccc(CNC(=O)NCCCSc3nccs3)cc2)NC(=O)NC1=O 759571870 ASYJPKPGZUDVAM-SFHVURJKSA-N 419.532 2.179 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](CCO)c3ccco3)cc2F)C[C@@H](C)O1 769220960 JKVIGRMMIWUAQB-GPMSIDNRSA-N 419.497 2.362 10 20 HECD CC(=O)NC[C@H]1CN(Cc2cc(Br)cc(Br)c2O)CCO1 775701611 UMLAJRUZMNSXLN-LBPRGKRZSA-N 422.117 2.254 10 20 HECD COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 784317539 JHQURRGGPCLSSM-SNVBAGLBSA-N 410.404 2.135 10 20 HECD O=C(NCCCn1cnc2ccccc21)C(=O)NCc1ccc(N2CCCC2)cc1 785412702 SZKSSSWTXMLJTD-UHFFFAOYSA-N 405.502 2.459 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)O[C@@H](C)C2 786627915 SXORVIMFBONVPQ-INIZCTEOSA-N 421.497 2.327 10 20 HECD C[C@H](NC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccc(N2CCOCC2)cc1 787063956 IROHRQXTWLGBLQ-MOPGFXCFSA-N 416.566 2.479 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)cc1 787467959 IBUDWVKQYMGGBZ-UHFFFAOYSA-N 412.538 2.251 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1O 788330269 WQVUNAPMRFSKII-UHFFFAOYSA-N 400.822 2.495 10 20 HECD O=C(NCCCc1cccs1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789843394 KMIQGQYDYJFTQQ-UHFFFAOYSA-N 419.522 2.214 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)ccc1O 790407114 SNUGGUMRWNUGQP-UHFFFAOYSA-N 411.288 2.408 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)OC3(CCOCC3)C2)c1 790407293 ZSUSXCMJQJTXSV-KRWDZBQOSA-N 418.534 2.197 10 20 HECD COCCCS(=O)(=O)N1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 792839827 PRXZGFKCVAYILU-UHFFFAOYSA-N 423.501 2.255 10 20 HECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCCCSc2nccs2)nc1 797653126 HFNPENGCJWODCQ-UHFFFAOYSA-N 401.539 2.092 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC(C)(C)c1ccc2c(c1)OCO2 804040047 NJUBQORGJCVBHG-UHFFFAOYSA-N 411.502 2.500 10 20 HECD CC(C)(C)OC(=O)CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 804904155 KZDNEQFRSRVTDV-UHFFFAOYSA-N 402.447 2.362 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C 807099960 IHDUCADISFMOHS-OAHLLOKOSA-N 406.527 2.049 10 20 HECD CN1C(=O)COc2cc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)ccc21 807513840 VWVXKXAUIHXREL-UHFFFAOYSA-N 424.240 2.309 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCCN(C2CCC2)C1 808022301 IZXNGAQMAZZDDE-MJGOQNOKSA-N 400.567 2.480 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1=O 808549090 WIHFCSRLDVKSMC-HXUWFJFHSA-N 423.513 2.357 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H](C)CCC3CC3)CC2)cc(OC)c1OC 809190596 IKSNFGNMQSAGBT-OAHLLOKOSA-N 419.522 2.056 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1C[C@@H]2CNC[C@@H]2C1 842516911 DPRQNFLKYNIKEM-QSRUBSGKSA-N 407.586 2.407 10 20 HECD COc1ccc(OC)c(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 917832870 IZRLNZRJTQJZED-QGZVFWFLSA-N 411.502 2.264 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(-c4cccs4)[nH]n3)nc12 919193688 ISYGDCVQPQXYOP-UHFFFAOYSA-N 413.415 2.420 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 1115869102 BTGGTJKGNWMDLN-UHFFFAOYSA-N 406.502 2.062 10 20 HECD CCOCCCNC(=O)C1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1341523270 MIVPZFFKIUEXMA-UHFFFAOYSA-N 420.573 2.332 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C1 1841243849 RLCFBLCCRKRUKV-IAGOWNOFSA-N 411.433 2.253 10 20 HECD Cc1ccc(C(=O)NCCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1F 562777604 YPHFYALAHXLEOW-UHFFFAOYSA-N 424.476 2.097 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1O 727761269 RQMPHDATGZXFSW-ASSNKEHSSA-N 403.479 2.154 10 20 HECD COc1cccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1O 727761282 SXIRRCFFCULDRP-HNNXBMFYSA-N 410.426 2.106 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1 728016052 VGRKSDQFAIWEMN-UHFFFAOYSA-N 415.880 2.007 10 20 HECD CC1CCN(c2ccc(CNC(=O)CN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)cc2)CC1 731016881 SLGVPQFDSZFFKG-YHDSQAASSA-N 407.514 2.346 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 734502298 NEXXJXQCRBNJGV-UHFFFAOYSA-N 407.448 2.219 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741058353 FHQVTMCCMGXHIF-UHFFFAOYSA-N 422.485 2.216 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3cc(OC)ccc3O)cc(C3CC3)nc21 748040338 YCUMWBUDCCOGNN-UHFFFAOYSA-N 410.430 2.039 10 20 HECD CN(C)C(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 751137430 RJFPXGACQPEUSY-GOSISDBHSA-N 418.515 2.464 10 20 HECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccccc2O)c1 751151939 YOUAIVWWPXWGRA-CMDGGOBGSA-N 407.444 2.074 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1F 752723432 WXMQCDYKDUCGKS-UHFFFAOYSA-N 400.454 2.191 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 758721303 AGQDTOVPZIKEJM-NRFANRHFSA-N 422.529 2.371 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C[C@H]3CCOC3)CC2)cc1 759767716 WVQCPZNJNSHEQJ-RBUKOAKNSA-N 404.555 2.322 10 20 HECD CS(=O)(=O)c1ccc(Br)c(C(=O)NCCc2ccc(O)c(O)c2)c1 762262629 ZSCJFIPLJWNBIL-UHFFFAOYSA-N 414.277 2.236 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(Br)c(=O)c([N+](=O)[O-])c1 763271504 IWOBZNYWRKSYRT-UHFFFAOYSA-N 423.267 2.244 10 20 HECD O=C(Cn1nnnc1/C=C\c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 768458018 OOCQYUZVWYKURO-CLFYSBASSA-N 422.464 2.136 10 20 HECD Cn1cnc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 769122011 KFJAZYMNEULRJD-WQLSENKSSA-N 407.546 2.174 10 20 HECD CCOc1ccc(O)c(CN2CCN(CCNC(=O)c3ccccc3F)CC2)c1 769342301 JZCIGMQHTGIUGI-UHFFFAOYSA-N 401.482 2.478 10 20 HECD CC(=O)Nc1sc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)nc1-c1ccccc1 775208638 NZOCQDDEPYVCGE-UHFFFAOYSA-N 419.488 2.007 10 20 HECD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(Cc2cccc(C)c2O)CC1 775655869 LUUXUPQAMZLJDG-UHFFFAOYSA-N 422.503 2.204 10 20 HECD C[C@H]1CCN(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 777972564 WYSVQYIIHFAUKY-ZDUSSCGKSA-N 407.458 2.218 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccn3)C3CC3)CC2)cc1 778220021 PDBKIZUPCJXJCL-QXMHVHEDSA-N 420.513 2.486 10 20 HECD COC(=O)[C@H]1[C@@H](O)CCCN1Cc1cc(Br)cc(Br)c1O 783704108 JKAFQZYLANWXML-NWDGAFQWSA-N 423.101 2.416 10 20 HECD CCOc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787284451 NZVAISAPPRPSDB-GOSISDBHSA-N 413.474 2.010 10 20 HECD C[C@H](c1ccccn1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842708 GWGRHZUOCUVTIG-OAHLLOKOSA-N 414.481 2.018 10 20 HECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 789879721 GHOZYXHJCWJHFZ-UHFFFAOYSA-N 411.550 2.248 10 20 HECD COC[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)[C@H]1CCCO1 791042138 QNCQCEUXDOEECV-IAGOWNOFSA-N 424.409 2.294 10 20 HECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N(C)C)cc1 801796634 QRZMPWBIEHKMLJ-INIZCTEOSA-N 404.536 2.309 10 20 HECD C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N(C)C)cc1 801796636 QRZMPWBIEHKMLJ-MRXNPFEDSA-N 404.536 2.309 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CCc1cccs1)c1ccc(N2CCOCC2)cc1 803299759 AQKFMKXNILMHIA-INIZCTEOSA-N 401.532 2.463 10 20 HECD COc1cc(F)cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803303447 NLUBBRGTECHGPA-OAHLLOKOSA-N 415.465 2.165 10 20 HECD CC(C)[C@@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)N(C)C 803697153 XNZUXQKICOSKRQ-QYWGDWMGSA-N 423.529 2.185 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 807100608 LHDCURUNOPNEAT-RXVVDRJESA-N 408.546 2.456 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807676362 FHDLUBICLDHGCJ-WMZOPIPTSA-N 410.518 2.334 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](c3cccnc3)C3CC3)CC2)cc1 808291184 GAXQIQKDGPNUTH-NRFANRHFSA-N 408.502 2.396 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 809728963 NBUGSGLPWSTJPU-KRWDZBQOSA-N 404.854 2.298 10 20 HECD CN(Cc1ccccc1O)c1nnc(-c2cccc(S(=O)(=O)N(C)C)c2)n1C 809815929 XGWOEIIMVTYSQQ-UHFFFAOYSA-N 401.492 2.074 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)N1CCN(c2ccccc2)CC1 812574317 LSUCRADOJGDZEV-UHFFFAOYSA-N 418.291 2.120 10 20 HECD CN(C)c1ccc(CN(C(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)C2CC2)cc1 914438348 RKJSSISQULCITM-OAQYLSRUSA-N 405.502 2.364 10 20 HECD C[C@H](CO)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 914544771 GPFBLQWMLZLCKZ-DKBJHAQFSA-N 415.334 2.147 10 20 HECD CC(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 917832955 JZXOBKNVKICCIY-FQEVSTJZSA-N 420.513 2.227 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(OCC(=O)OC)cc1 918303357 FYUGAOOPVCYOSC-UHFFFAOYSA-N 413.474 2.292 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C(F)(F)F)nc3)nc12 918986085 HIWBLWAUOUSVMH-UHFFFAOYSA-N 410.308 2.382 10 20 HECD NC(=O)c1cn(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc12 919968770 WGNPQUVRNIWOSK-UHFFFAOYSA-N 420.513 2.265 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccccc3C(=O)OC)CC2)cc1 1116414688 WWRFGEWHMLFHRL-UHFFFAOYSA-N 404.488 2.383 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCCO1 1792650459 DZDHWSFSRPIVHH-MXJZGFGZSA-N 416.474 2.024 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]1(F)Cl 1802496526 FWGRTCNHBDEEQJ-VNEBTJPNSA-N 424.856 2.379 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cnc[nH]1)c1cc(O)c(O)c(Cl)c1 1802767710 FXXHMQCFBOTTJL-NLVNQHKVSA-N 416.865 2.440 10 20 HECD CC(C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815591723 YCTSQTJPNFOMLC-AWEZNQCLSA-N 417.466 2.337 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1 1828892147 GHKDYDZGDXJTSW-ZWKOTPCHSA-N 415.490 2.419 10 20 HECD C[C@H]1CCCC[C@H]1NC(=O)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387017 YUOZZOWLWBCGMT-FXAWDEMLSA-N 402.539 2.360 10 20 HECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)cc2)nc1)N1CCCC1 53583238 GPOMEXHLELGUKB-UHFFFAOYSA-N 402.520 2.315 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 116046451 CJKFBAJCIZRXIJ-CHWSQXEVSA-N 405.430 2.169 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3Cc4ccccc4C(=O)O3)cc2F)CC1 303273102 GQLSDQRQAVUUSN-NRFANRHFSA-N 411.477 2.366 10 20 HECD CN(CC(=O)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 303497685 UIPHXPJCPHGVEV-MRXNPFEDSA-N 408.545 2.101 10 20 HECD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 726235875 ICBYXPAWRHSDSA-IBGZPJMESA-N 402.539 2.217 10 20 HECD O=C1N[C@@H](c2ccc(N3CCOCC3)c(F)c2)Nc2ccc(N3CCOCC3)cc21 727463707 LFWHZVNFCAWXKH-NRFANRHFSA-N 412.465 2.353 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c1 729062328 QGOHOCKAHJXSSK-HNNXBMFYSA-N 413.474 2.049 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1 729062960 GPWQOEOBGVXRFM-ZDUSSCGKSA-N 424.457 2.015 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C(C)C)N3CCCC3=O)cc2F)CC1 730193534 LBLVHURXNWMENN-OAQYLSRUSA-N 404.530 2.231 10 20 HECD NC(=O)COc1ccc(CNC(=O)CN(Cc2ccccc2O)C2CCCC2)cc1 731845559 DHRYUZSUJDNQPA-UHFFFAOYSA-N 411.502 2.317 10 20 HECD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2cc(O)cs2)cc1 731912590 UHEXONUDARAJNP-NSHDSACASA-N 412.489 2.324 10 20 HECD CNC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 732207610 ZTKZHMSHWNDGBA-CABCVRRESA-N 419.481 2.247 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1 735518139 IKUURVWAHNYYIF-LJQANCHMSA-N 410.566 2.466 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)c[nH]1 743045334 GAFMJDKSEKMIFR-UHFFFAOYSA-N 421.456 2.497 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N(C)C)c(F)c2)n([C@H]2CCS(=O)(=O)C2)n1 746759241 DHZQKCKKIOCLJX-AWEZNQCLSA-N 409.487 2.078 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H]1[C@H](O)C(F)(F)F 750638729 PREQFLHYONUZIJ-IRXDYDNUSA-N 419.419 2.384 10 20 HECD O=C(CC[C@@H]1CCOC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 751244856 MLNFRSKGJFPTML-QGZVFWFLSA-N 413.497 2.375 10 20 HECD Cn1cnc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)c1 751260839 GPNOHQZTLSTMER-GFCCVEGCSA-N 424.548 2.070 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)N3CCc4ccccc43)CC2)cc1 758209217 JAMOAOGKDWDIOQ-NZQKXSOJSA-N 424.589 2.219 10 20 HECD CC(C)OC(=O)[C@@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759793804 YGBIHJOEMXNWNK-IXDOHACOSA-N 423.529 2.327 10 20 HECD Cc1nn(CC(F)(F)F)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 763279965 GQHXNBGYZDDCBG-HNNXBMFYSA-N 423.439 2.386 10 20 HECD CC1(c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc2)OCCO1 767721826 IMONGZXXMZTTKA-UHFFFAOYSA-N 418.515 2.221 10 20 HECD CCNc1nc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 768660386 UQQYZFFJCSRQJI-UHFFFAOYSA-N 404.492 2.089 10 20 HECD COc1cccc(/C=C(/C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n2nnnc2C)c1 773739253 CZPQMFWTIVAOCH-FHNWIRHTSA-N 409.446 2.147 10 20 HECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1F 774273230 BOCUCONCEYXCPN-NDEPHWFRSA-N 404.463 2.402 10 20 HECD C[C@@H](C(=O)N1CCN(c2ccccc2O)CC1)N1CCOc2cc(N(C)C)ccc21 774750229 BWZBZWCTWDCTCN-KRWDZBQOSA-N 410.518 2.394 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1O 775023934 OFNHWVOWZXBIOH-QZTJIDSGSA-N 401.463 2.282 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)N(C)CC2)c1ccc(N2CCOCC2)cc1 776042254 PJELLWDXWPYPDY-MRXNPFEDSA-N 408.502 2.331 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)c3nc(C)cs3)CC2)cc1 778268710 NBNROEXTLLCJTN-CMDGGOBGSA-N 400.504 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4c(c3)CCN4C)CC2)cc1 778582960 QARKDQPSWJQSMS-UHFFFAOYSA-N 409.486 2.193 10 20 HECD C[C@H]1C(=O)CC[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1(C)C 780404602 IQVZWBASVUTXCS-MAUKXSAKSA-N 406.548 2.179 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1ccc(N(C)C)nc1 787632602 DTUHFDBSBUXPLV-UHFFFAOYSA-N 409.534 2.413 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 787833314 PRFWEYXNOBUVRA-UHFFFAOYSA-N 422.529 2.141 10 20 HECD O=S(=O)(c1ccc(CNCc2c(O)ccc(Cl)c2F)cc1)N1CCOCC1 790947672 VZLTXXMJFCOYSQ-UHFFFAOYSA-N 414.886 2.495 10 20 HECD O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NCc1cc(Cl)cc(Cl)c1O 805195162 WENBCZYAJHVKKT-CHPZLBCBSA-N 424.284 2.305 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C(=O)N1c1ccccc1 806279534 RHKCHFSGJSZOLF-UKRRQHHQSA-N 418.544 2.052 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1 806620058 NLMPVSMNGOZYQN-WCRBZPEASA-N 415.582 2.084 10 20 HECD C[C@H](NC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807665480 CNAWEWBKIDPBLH-AWEZNQCLSA-N 406.527 2.349 10 20 HECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 808039447 BGKVDMKTKKVQRH-WMZOPIPTSA-N 418.538 2.084 10 20 HECD C[C@@H](OC(=O)c1cn(C)cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 811227495 JONRXWHQPDVRNR-GFCCVEGCSA-N 403.394 2.380 10 20 HECD C[C@@H](OC(=O)c1cn(C)cn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 811228403 HVSKVIGCRMAYKM-GFCCVEGCSA-N 403.394 2.380 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C)c(-n2cnnn2)c1 918304459 RQVFKALLSIARBF-UHFFFAOYSA-N 407.478 2.024 10 20 HECD CS(=O)(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919971463 ZHTCCCSODVEJPE-UHFFFAOYSA-N 421.494 2.088 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCc4ccccc4C3)CC2)cc1 920250290 DMRXENJRPNUTMP-KHPPLWFESA-N 405.498 2.485 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3COc4ccc(F)cc4C3)nc12 1116401381 VBFQZAAOYALCJN-LBPRGKRZSA-N 415.377 2.045 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc(-n2cccn2)cc1 1116570531 AZABHCLRIJWBCL-SFHVURJKSA-N 409.442 2.117 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1F 1319173636 XBRVXVVVHUYLRU-UHFFFAOYSA-N 419.478 2.230 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(OC4CCC4)c3)nc12 1320942415 RDNNSETUQGBUAG-UHFFFAOYSA-N 412.402 2.295 10 20 HECD CN(C)C(=O)OCCOC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1321334886 NHXZYSQDZQYQAF-UHFFFAOYSA-N 412.354 2.225 10 20 HECD O=C(CCCc1ccncc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598748 DMLGNKHHBQQBIF-BCDXTJNWSA-N 410.474 2.163 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c[nH]1 1802044389 QCTMIIVGYHWFFC-BPQKRJORSA-N 415.421 2.236 10 20 HECD Cc1ncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)s1 1810552400 XHRVDQNBCIHFHA-UHFFFAOYSA-N 416.503 2.416 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](C)NC=O)C3)cc1 1845399123 SWRWOIVUGDTWAX-SFHVURJKSA-N 408.502 2.046 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)ccc1F 1847384545 ZEECWMPZIOPCSX-GJZGRUSLSA-N 405.813 2.415 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)Cc3ccc(C)cc3)CC2)cc1 11900623 UDBHTFMGYFVXSB-UHFFFAOYSA-N 403.548 2.245 10 20 HECD NC(=O)c1ccc(OCC(F)F)c(NS(=O)(=O)c2cccc3nsnc23)c1 577909038 YHRBGGWSEVKIIM-UHFFFAOYSA-N 414.415 2.235 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCn1cncn1 726537953 SYXOKMLIEUSULQ-UKTHLTGXSA-N 407.546 2.137 10 20 HECD CO[C@@H](C)CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726612327 BJKDKEHCQUPRRD-INIZCTEOSA-N 416.501 2.167 10 20 HECD CCCN1CCC(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 730579242 CWCHHNWZOWSHGD-UHFFFAOYSA-N 417.598 2.381 10 20 HECD Cn1cc(-c2cncc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2)cn1 731168678 UVBFPLNVCLQUQT-KRWDZBQOSA-N 418.501 2.114 10 20 HECD C[C@H](CN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1)NC(=O)/C=C\c1cnn(C)c1 733955237 CVMIUZJANSBYLK-YYEUPPNASA-N 418.501 2.418 10 20 HECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NCc2cccc(OC)c2O)cc1 743222355 YWLWMJFLEALQIQ-ZDUSSCGKSA-N 415.446 2.404 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1F 747011011 LUNAHKHJQSZKQO-UHFFFAOYSA-N 402.451 2.191 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 751318342 MQLRLDAENNFPKO-VIFPVBQESA-N 400.840 2.275 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)c(OC)c1 752113300 RBFSFVPYZNXBAT-UHFFFAOYSA-N 413.883 2.080 10 20 HECD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cccc(O)c2O)c(=O)n(-c2ccccc2)n1C 758560927 YTECYDLTPMTTRW-CYBMUJFWSA-N 411.414 2.080 10 20 HECD CC1(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)OCCO1 760108668 IWCGJVRYYNTFCD-UHFFFAOYSA-N 412.489 2.137 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 762275043 LVNQNZRMVDIEJI-MRXNPFEDSA-N 408.458 2.185 10 20 HECD O=S(=O)(Cc1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768191593 KMIDBZNPNGVPRR-UHFFFAOYSA-N 415.559 2.171 10 20 HECD CCNS(=O)(=O)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 771467310 RZDKHFKWVVGXTB-GOSISDBHSA-N 407.511 2.430 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 779473186 KKIDSZZACJONKB-KRXBUXKQSA-N 422.890 2.298 10 20 HECD CC(C)N1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1=O 779982521 ZSEZCCIXSBPPDD-HZPDHXFCSA-N 406.502 2.202 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccnc1-n1cncn1 783317426 RUQBTEGQVHJVEX-UHFFFAOYSA-N 407.478 2.104 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 784689857 RCMDNJXTLMDYGZ-CYBMUJFWSA-N 417.487 2.187 10 20 HECD C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438673 DUBJKRUSFGUNCC-WBVHZDCISA-N 418.538 2.131 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1OCC(F)(F)F 787279580 ICRYHOCKWZJQBW-UHFFFAOYSA-N 424.423 2.364 10 20 HECD CCO[C@@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 788744712 ZNOUIMVCQHOERN-DENIHFKCSA-N 423.529 2.152 10 20 HECD C[C@@H](NC(=O)N(C)CCN1CCOC(C)(C)C1)c1ccc(N2CCOCC2)cc1 788909784 RYCZPCPHGWROLH-GOSISDBHSA-N 404.555 2.336 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 792691563 AJGMFVHDIDJSEC-IYBDPMFKSA-N 422.497 2.415 10 20 HECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2c1=O 792994227 SNNSXCFVLUSEDX-UHFFFAOYSA-N 402.454 2.170 10 20 HECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c1OC 795776789 UAKXVUBCSFLWEL-UHFFFAOYSA-N 411.911 2.253 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 795905908 CBLCEAXHRAJMMM-JFIYKMOQSA-N 422.497 2.415 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)c(O)c1 797387182 GMMHUNYQMAECIY-UHFFFAOYSA-N 409.446 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)C3=C(C)N(C)c4ncnn4[C@@H]3C)CC2)cc1F 798974890 VUGWBGFKYCVGHX-CQSZACIVSA-N 400.458 2.059 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(-n2cnnn2)c1 802609943 OSWWDTWJKARPRE-UHFFFAOYSA-N 408.462 2.444 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(OCC2CC2)CC1)c1ccc(N2CCOCC2)cc1 803298539 CCSHRDPCQWTDDG-KRWDZBQOSA-N 415.534 2.118 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCOC4(CCSCC4)C3)ccc21 803687235 YJQGSNIOTIIKKO-SFHVURJKSA-N 417.575 2.246 10 20 HECD CN(C)CCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687844 IKXSKQPBDOHPEK-UHFFFAOYSA-N 422.573 2.318 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2ccccn12 804100927 JHICDXRYIFEMAT-LJQANCHMSA-N 408.506 2.267 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C)[C@H](C)C3)cc2F)CC1 805006824 HLZNCDYMODHJCV-DLBZAZTESA-N 404.530 2.088 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(-n2ccnn2)cc1 806282239 INKBYOQVEUKZBS-CYBMUJFWSA-N 416.532 2.200 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 806421440 SPCFIYXKJUSDCD-OAQYLSRUSA-N 422.529 2.413 10 20 HECD Cc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)sc1C 807338815 HQNAQCCFEYXORV-MRXNPFEDSA-N 403.504 2.290 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(Br)c(C2CC2)n1 815550268 JAEBVHFFFJGEMA-UHFFFAOYSA-N 420.263 2.430 10 20 HECD Cc1nn(C)c2ncc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc12 918035347 AGVFCEWMIDGFGS-INIZCTEOSA-N 421.505 2.300 10 20 HECD O=C(CSCC(=O)N1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 918138838 XQAMWWGSYKIMCA-UHFFFAOYSA-N 409.527 2.024 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 1324899817 HDPBTRDBIVUANM-UHFFFAOYSA-N 421.494 2.441 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N(C)CCNS(C)(=O)=O)cc2Cl)C1 1344629976 VCFSPMUKPWRZSX-AWEZNQCLSA-N 416.975 2.267 10 20 HECD CCN(C)[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718726 AIYLTLOLNYERKG-REBRKWNGSA-N 409.914 2.343 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c[nH]1 1817845880 ZVKKIWZIRHGULZ-OAHLLOKOSA-N 410.434 2.472 10 20 HECD C[C@H](OC(=O)c1nccnc1N)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 10140645 RSTWDDOOUAYFCG-NSHDSACASA-N 416.393 2.018 10 20 HECD COc1ccc(COCCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 569718504 PMSFMJVLCHRSTE-UHFFFAOYSA-N 409.486 2.445 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)n(C)c2ccccc12 576367365 YVHAROMCCMYUOD-IBGZPJMESA-N 406.530 2.392 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(N2CCCC2)c1 726292571 ZJKOJDQNFJYWOB-UHFFFAOYSA-N 408.502 2.378 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCC[C@H]1C 726611306 OCCNSBPSTXONGF-HZPDHXFCSA-N 406.502 2.251 10 20 HECD C[C@H](NC(=O)NCCn1c(=O)oc2ccccc21)c1ccc(N2CCOCC2)cc1 730124490 ZCYQHGCJXGWGIB-INIZCTEOSA-N 410.474 2.492 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN(C)S(=O)(=O)CC)cc1F 731363591 GHWWXKLLKPZTIV-UHFFFAOYSA-N 402.536 2.143 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCCN1CCN(c2ccncc2)CC1 734526194 SUIXCNKDGJPFEH-UHFFFAOYSA-N 410.566 2.468 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc2c1OCCO2 739767552 CWZIJYSZMXGJLZ-UHFFFAOYSA-N 411.458 2.420 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cccc(Cl)c3)c2)CC1 748673974 OIQIYTRVBRXEQW-UHFFFAOYSA-N 400.909 2.376 10 20 HECD CNS(=O)(=O)c1csc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 748705416 VQHQVOHPXGPKRM-UHFFFAOYSA-N 409.533 2.017 10 20 HECD COC(=O)c1sccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751239737 MWGGJTNGZRSMLQ-UHFFFAOYSA-N 424.544 2.222 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccn1Cc1ccncc1 751343741 ATRNDTOKYSAZTP-UHFFFAOYSA-N 424.526 2.096 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2csc(S(N)(=O)=O)c2)cc1 751405823 MONAGJXRROPZFT-QGZVFWFLSA-N 423.560 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)CCn3c(=O)n(C)c4ccccc43)CC2)cc1F 753740567 RSOFDDCGIIXJEG-UHFFFAOYSA-N 412.465 2.227 10 20 HECD COc1ccc(N2CCN(CN3C(=O)NC4(CCC(C)CC4)C3=O)CC2)cc1F 754014101 QFQVZJPATWOVCY-UHFFFAOYSA-N 404.486 2.415 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Nc3cccc(C(N)=O)n3)cc2F)C[C@H](C)O1 761875261 RBXPZBXVGBCXPH-STQMWFEESA-N 401.442 2.255 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1 762089335 NQCCQANUKIWXPA-SFHVURJKSA-N 418.513 2.253 10 20 HECD Cc1ccc([C@H](C)[C@@H](O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 764861977 JHYRAHSBFPJHRK-LAUBAEHRSA-N 416.543 2.011 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NCc1cccc(Br)c1O 765731992 OJWDYONZKDITCG-AWEZNQCLSA-N 419.341 2.365 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3c(F)cccc3F)cc2)C1 766774599 FIRDCANAOZYUHB-OAHLLOKOSA-N 423.485 2.286 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)NCCc2ccc(O)c(O)c2)cc1OC 768900593 KAIVNFLZYVKJLG-UHFFFAOYSA-N 406.391 2.012 10 20 HECD Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2F)n1 774363664 VEYWEQJEUZGBPV-UHFFFAOYSA-N 412.421 2.337 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)N1CCOC(C)(C)C1 776860969 ABNNMJXZYNXIML-UHFFFAOYSA-N 407.330 2.332 10 20 HECD O=C(NC[C@@H]1COC2(CCOCC2)O1)N(Cc1ccccc1O)C[C@@H]1CCCO1 777757329 YSVQUKUXULQVOH-ZWKOTPCHSA-N 406.479 2.005 10 20 HECD O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NCc1ccc(O)c(O)c1 778924349 COGJHNLPIDLMOV-UHFFFAOYSA-N 400.456 2.236 10 20 HECD Nc1cnccc1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783185477 FXDGQAGDIDBKRQ-UHFFFAOYSA-N 401.378 2.235 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C(=O)c2ccoc2)CC1 786648479 HGXNNZWXVMKWAY-UHFFFAOYSA-N 413.474 2.145 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1C(F)(F)F 786683211 QSCCIFPQCIFXQJ-UHFFFAOYSA-N 421.419 2.475 10 20 HECD Cc1cccnc1C(F)(F)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 787086660 IZANYGNMUZUINQ-UHFFFAOYSA-N 409.458 2.033 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1OCC1CC1 788321135 SWGKGDLXZVUKAV-UHFFFAOYSA-N 423.513 2.245 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1CCN(c2nccs2)CC1 788931511 HHWYTYZQKVOWRX-UHFFFAOYSA-N 413.547 2.145 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cccn(CC)c3=O)cc2F)CC1 788980184 JGLMCRKVEQUOSG-UHFFFAOYSA-N 415.513 2.149 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2c(F)cccc2C1 789812755 ONNSEHJVISIGFH-UHFFFAOYSA-N 415.440 2.003 10 20 HECD COCCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CC[C@@H](C)C1 792466433 WTJDYLWBQNEIQK-CEMLEFRQSA-N 405.583 2.315 10 20 HECD COc1ccc(CNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)c(O)c1 792774062 MTPSYOAIVBANJA-UHFFFAOYSA-N 421.519 2.228 10 20 HECD Cc1cc(=O)c(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)co1 794727481 RZINUPWWULSPSE-HUUCEWRRSA-N 404.438 2.396 10 20 HECD COc1cc2c(cc1S(=O)(=O)Nc1ccc(O)cc1OC(C)C)OCC(=O)N2 797432059 JLKFGIHASNADSQ-UHFFFAOYSA-N 408.432 2.320 10 20 HECD COc1ccc(CNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c(O)c1 797633064 VJZRERYCOTYOJT-AWEZNQCLSA-N 420.491 2.156 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(-n2nnnc2C)c1 802609999 PJBINSKAOBDLFM-UHFFFAOYSA-N 408.462 2.444 10 20 HECD Cn1ccc(N2CCC[C@@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C2=O)n1 805277213 RASSKGALYNKUOY-CYBMUJFWSA-N 412.277 2.427 10 20 HECD O=C(NC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768976 CKSNQXXCXANCHR-ZIAGYGMSSA-N 413.490 2.242 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nn(C)cc1Br 815952261 GJMKCFFCEGDNII-UHFFFAOYSA-N 416.659 2.357 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1 917751770 KNDBBLWKXIKVCA-UHFFFAOYSA-N 423.516 2.376 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(N4NC(=O)CCC4=O)cc3)CC2)cc1 1336535401 VSANWPDYRYOXGV-UHFFFAOYSA-N 422.485 2.206 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3n[nH]cc3Br)CC2)cc1 1348374223 HNHXRUVNHKJPGO-UHFFFAOYSA-N 422.327 2.123 10 20 HECD C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)n1cccc1 1810550648 PNWJRTNADROMCK-MRXNPFEDSA-N 412.490 2.400 10 20 HECD CC(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1823864906 HCCDCOWHQGTIIS-KRWDZBQOSA-N 405.495 2.151 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccns2)CC1 1825679494 UNIJAFMTBZIAGG-HNNXBMFYSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccon2)CC1 1826146033 RCERVTIYEZRBJI-MRXNPFEDSA-N 400.435 2.028 10 20 HECD O=C(c1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427387 XILCAGNSVPCDNE-MRXNPFEDSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1 1828375739 YPBBBTYMJHMLOT-LSDHHAIUSA-N 409.433 2.381 10 20 HECD CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(OC)cc3)CC2)n1 14195302 XUSDXFUECZBRSX-UHFFFAOYSA-N 418.519 2.018 10 20 HECD CCN(CCCNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)S(C)(=O)=O 486945861 SFLFCFRXRKPZDW-UHFFFAOYSA-N 409.552 2.306 10 20 HECD CC1CCN(C[C@@H]2CCCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)CC1 726193054 HZFSBFSSQAFPBO-INIZCTEOSA-N 409.552 2.348 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cnn(-c4ccc(O)nn4)c3C)CC2)cc1 726562415 MGNPCUABWMEZAA-UHFFFAOYSA-N 408.462 2.084 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1 728983179 VPZCNGHZYVZQAJ-CYBMUJFWSA-N 407.426 2.215 10 20 HECD COC(=O)[C@@H](C)CSCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 734368993 VWNDLINQCOBIIT-LBPRGKRZSA-N 424.544 2.467 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@](C)(O)c3cccs3)CC2)cc1 740038223 JAHOKEMUBYPJDX-OAQYLSRUSA-N 418.563 2.086 10 20 HECD Cc1nc(S(=O)(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1C 742334668 RNIRLPMYZOQRQP-CYBMUJFWSA-N 400.451 2.277 10 20 HECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 747010259 YVEDQIMWKUQJDT-ZDUSSCGKSA-N 416.453 2.120 10 20 HECD CN(C)C(=O)Cn1cnc(NC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 747544252 INRUURJXEIGHGY-UHFFFAOYSA-N 413.526 2.457 10 20 HECD CSc1ccncc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 750252801 CAZSFWFVGNBEOS-CQSZACIVSA-N 400.504 2.456 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](O)c3ccc(Cl)cc3)nc12 750371540 IRONOVWFRALDHP-OAHLLOKOSA-N 419.821 2.432 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(CCCN(C)C)CC3)CC2)cc1 754083969 YUZCCRNRVASJIN-QHCPKHFHSA-N 418.626 2.232 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3c(C)nc4sccn34)CC2)cc1 757352832 XOTAECQBNROYFX-UHFFFAOYSA-N 413.547 2.493 10 20 HECD CCOC(=O)c1ccccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758222974 KAHMTNPOWMKRML-IBGZPJMESA-N 414.502 2.434 10 20 HECD COc1ccc(CC(=O)O)cc1S(=O)(=O)NCc1ccc2c(c1)CCCN2C 761286641 NTBOBHMTDAOLLN-UHFFFAOYSA-N 404.488 2.183 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(F)c(OC)c3)CC2)cc1 764052622 NSIKCMOJZSOYAR-UHFFFAOYSA-N 402.422 2.349 10 20 HECD O=C(Cc1ccccc1)NCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912611 PTNLUCGIKDZHES-IBGZPJMESA-N 415.921 2.485 10 20 HECD COc1ccc(O)c(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)c1 769540894 UQGIBATYSRCRJT-UHFFFAOYSA-N 424.544 2.496 10 20 HECD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769618589 XDJMXYSMWSNFEN-CYBMUJFWSA-N 415.475 2.178 10 20 HECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc2c(c1)OCCO2 769710939 LJWGRZRHFCYPKV-OAHLLOKOSA-N 406.460 2.416 10 20 HECD CCC(=O)N1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 773031725 GCCXRHHLPVNCPX-HNNXBMFYSA-N 413.440 2.417 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1 774361806 IZACBELPPZAKNE-INIZCTEOSA-N 414.458 2.343 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1 774780230 LEQBLFNFRWHLMY-JOCHJYFZSA-N 424.545 2.199 10 20 HECD Cc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 775125203 GPYSCUDOAWCHRR-UHFFFAOYSA-N 420.557 2.460 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](C3(C)OCCO3)C2)c1 784029111 DVYNNEKPZNYBNT-NRFANRHFSA-N 418.534 2.402 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785304620 QWQLIOAOZSQXCG-GFCCVEGCSA-N 422.865 2.462 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(Cc3cccs3)CC2)cc1 785423991 JLTOMWUFGMRSLW-UHFFFAOYSA-N 414.575 2.459 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(N4CCOC4=O)c3)cc2)CC1 786253998 ACDASRHCLBYOIQ-UHFFFAOYSA-N 422.485 2.242 10 20 HECD COCc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 787506372 SOEIECOPBNJLTR-QGZVFWFLSA-N 411.502 2.163 10 20 HECD C[C@@H]1CCCN(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 787677140 UXVORGLQAXDTCG-LJQANCHMSA-N 400.567 2.483 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ccc(NC(C)=O)nc3)CC2)cc1F 789298318 AQIQBSISPJZVGI-UHFFFAOYSA-N 401.442 2.220 10 20 HECD O=C(Nc1nc2c(s1)CCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 789370394 LVQDKQSWGYJIFQ-AWEZNQCLSA-N 401.488 2.484 10 20 HECD CCS[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789810558 BDGZFFZZRTYVSV-PKOBYXMFSA-N 423.554 2.459 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854258 GJJSVIDXPJHUDT-LJQANCHMSA-N 418.607 2.237 10 20 HECD Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855701 WPYNIMMCWMGTCZ-UHFFFAOYSA-N 416.547 2.210 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1 792306321 HLRMVTVHPZRZGY-HNNXBMFYSA-N 407.511 2.088 10 20 HECD Cc1cccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803661415 AGTHLCLUAYEYTA-UHFFFAOYSA-N 414.525 2.407 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)O2 806277938 LTKAMEGZOSHQDX-TXKKKEFDSA-N 413.565 2.180 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCC1CCN(CC(F)(F)F)CC1 807291631 YWCPMOLHGHHPOY-UHFFFAOYSA-N 424.467 2.070 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@H](C)c2cccnc2)CC1)c1ccc(N(C)C)cc1 807673008 LLDKOGGKKGDCMO-ZWKOTPCHSA-N 409.534 2.230 10 20 HECD O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 814211479 HEULXLDRLUBXRC-UHFFFAOYSA-N 419.415 2.119 10 20 HECD CCOc1ncccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918006336 PHIUNNKCSYIGQH-GOSISDBHSA-N 411.506 2.181 10 20 HECD Cc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1 918336059 UFAKQWJFKVLEAW-UHFFFAOYSA-N 402.516 2.233 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC[C@H]3CCCC[C@@H]32)c1 920637051 YGKQKWSCSHNGLD-CJNGLKHVSA-N 410.492 2.102 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)C3CC3)cc2)CCC1 1792071040 JXJVDCZMEGEZTK-UHFFFAOYSA-N 403.529 2.391 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991024 MQRWCKNPXMDZTN-UZLBHIALSA-N 408.458 2.318 10 20 HECD O=C(NCCNc1cnccn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726707909 HYWDDNRZVIMRKK-UHFFFAOYSA-N 406.437 2.458 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1 729033788 RHFVUEUVOSNLPE-CHWSQXEVSA-N 408.480 2.148 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1 734657300 ZCUFJEMDTLTWON-NRFANRHFSA-N 409.534 2.115 10 20 HECD CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736194799 DLTCMGYZJJVVAU-DEOSSOPVSA-N 421.541 2.485 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 737108415 WLQPRDDGKUZSKL-RYUDHWBXSA-N 404.442 2.299 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1ccc(CN2C(=O)CNC2=O)cc1 740680212 NRQGWMOTWFHDMW-UHFFFAOYSA-N 405.458 2.436 10 20 HECD Cn1cc(/C=C\C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)cn1 746043620 KBGUAZIREAANGQ-TWGQIWQCSA-N 400.504 2.197 10 20 HECD Cc1cc(C(=O)COC(=O)c2cc[nH]c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750496869 UUXFRFDCMJHXLK-UHFFFAOYSA-N 401.444 2.109 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c(C)n1-c1ccc2c(c1)CCC2 758493363 NFNIRPAYUYHOBS-AWEZNQCLSA-N 418.515 2.246 10 20 HECD CN(CCC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758708062 HAXBOWZZBMQZBU-KRWDZBQOSA-N 418.538 2.262 10 20 HECD Cn1ccnc1[C@@](O)(CCNC(=O)NCCCSc1nccs1)C(F)(F)F 759549515 GSCOXMUSTFXLRF-AWEZNQCLSA-N 423.486 2.498 10 20 HECD COc1cc(N2CCN(C(=O)C3(C)COC(C)(C)OC3)CC2)cc(OC)c1OC 760084106 KBLNPXRJLZEMAT-UHFFFAOYSA-N 408.495 2.150 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(c4nc(N)ns4)CC3)cc2)CC1 769107918 YCSLSJVYUDFTOL-UHFFFAOYSA-N 415.567 2.388 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)c2)CC1 771638091 ZGLZFORFZXQJSS-QHCPKHFHSA-N 421.501 2.135 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773089678 UCBYPWFKMAFUAT-CQSZACIVSA-N 423.560 2.233 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCO[C@H](C)C3)cc2F)C[C@@H](C)O1 776403416 GFOJWBMMMGZEQY-CBZIJGRNSA-N 422.497 2.414 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(Cl)n1 778563328 TUXDMWIIEZLTIF-UHFFFAOYSA-N 421.856 2.492 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CC(=O)NCC(F)(F)F)cc2F)C[C@H](C)O1 779658345 WLNMFGCFOLVUBJ-RYUDHWBXSA-N 405.392 2.124 10 20 HECD C[C@H]1CN(CC(C)(C)O)CCN1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 780338128 JHUQEBGNSIYUQK-ZWKOTPCHSA-N 404.555 2.071 10 20 HECD CNC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 787863868 PAHAQJMMJVMHIA-UHFFFAOYSA-N 422.529 2.215 10 20 HECD CC(C)N(CCc1nccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788314173 ZMUDBLFHXPMVBL-UHFFFAOYSA-N 416.547 2.076 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCc4c(O)cccc43)nc12 789248568 DFVHMGSXVOLUFE-HNNXBMFYSA-N 411.414 2.481 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c1 789502697 PSPKMWAMHZZPRN-UHFFFAOYSA-N 416.384 2.334 10 20 HECD CN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798322 FNJRDFVMQFQBJY-UHFFFAOYSA-N 403.429 2.076 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C)c3nnnn3C3CC3)cc2F)C[C@@H](C)O1 790220135 UAPMLWHDKXQOSR-MJBXVCDLSA-N 417.489 2.321 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2c(O)ccc(Cl)c2F)c1 790960488 VABZMVDBUJZZOT-SNVBAGLBSA-N 415.874 2.210 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 795905909 CBLCEAXHRAJMMM-JZXOWHBKSA-N 422.497 2.415 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cc2c(cc1OC)NC(=O)CO2 797441382 DOOSKFKZFXSIFH-UHFFFAOYSA-N 419.503 2.303 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 797646452 ZKTSUEACPCJAHX-GFCCVEGCSA-N 405.476 2.173 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(C)cc(OC)c3)CC2)cc1 804318041 WZYNSKBRVAGILK-UHFFFAOYSA-N 411.502 2.414 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)CC2)cc1 806620538 ZAGHXLBGCSBSLS-DENIHFKCSA-N 415.582 2.085 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC[C@H]1C1CC1 807768424 JHYIKEHSMBWAHW-YJBOKZPZSA-N 423.460 2.010 10 20 HECD CN(Cc1ccon1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768709 ADLYFZMCIREZBI-CYBMUJFWSA-N 408.405 2.020 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1 809329001 IJMCAYCWDGPUNJ-UHFFFAOYSA-N 411.502 2.472 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@@H]1COC(=O)NC1CC1 810036985 VQIGIDXKKVUJIN-HXUWFJFHSA-N 402.539 2.454 10 20 HECD CC[C@H]1CN(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 818978479 WFVFOGYBVJDKBA-AWEZNQCLSA-N 409.533 2.421 10 20 HECD CCNC(=O)CN1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 916220825 CVQPICBWSFTERF-UHFFFAOYSA-N 411.550 2.100 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(-n2cccn2)cc1 918284038 VVOXBMQKYGVNCD-UHFFFAOYSA-N 423.448 2.103 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(N2CCCC2=O)c1 919839441 JUCSJNDGINDUGI-UHFFFAOYSA-N 413.499 2.301 10 20 HECD Cc1nnnn1/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1 919860144 OCZDCYFMJUBSTL-RCCKNPSSSA-N 404.474 2.133 10 20 HECD O=C(CNC(=O)c1ccc(F)cc1F)NCc1ccc(N2CCC(CO)CC2)cc1 919969158 XIPABJQYTREUIJ-UHFFFAOYSA-N 417.456 2.220 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 1320180086 HFQMYPGOEHEEKI-HSVJCBRXSA-N 403.460 2.183 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] 1324120917 KUMGXTNWMIWZTA-AWEZNQCLSA-N 406.366 2.358 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccncc1 1816381507 OIQZKVBHZJDJOU-HNNXBMFYSA-N 408.418 2.231 10 20 HECD O=C(Cc1ccccc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038983 HRPLKPYXLAWWPL-CSKARUKUSA-N 408.454 2.263 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1 105819842 PMATVIYVYWRWKX-HXUWFJFHSA-N 411.481 2.360 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)N[C@@H](C)Cc3ccsc3)nnc2n1 108659674 VISSIPCFFGKYJN-NSHDSACASA-N 420.568 2.284 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCN(C(=O)COC)CC3)ccc21 486954308 JISWPSCCEBYKOS-UHFFFAOYSA-N 401.507 2.272 10 20 HECD COC1CCN(C(C)(C)CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 580668247 ONDQDOXIGSKKLI-UHFFFAOYSA-N 414.550 2.109 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc3n(c2=O)CCS3)cc1 728021416 RFBWRGZMUIDXFM-QGZVFWFLSA-N 414.531 2.236 10 20 HECD NS(=O)(=O)c1cc(F)cc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 735750929 ZGULJBDRHYWHAU-INIZCTEOSA-N 423.466 2.392 10 20 HECD Cc1ccc(N2CC[C@@H](OC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2=O)cc1 744855320 YBVAQRFVAQXSIH-QGZVFWFLSA-N 404.444 2.034 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C[C@@H]4CCOC4)CC3)CC2)cc1 749567444 XHAALBNFERDLLB-SFHVURJKSA-N 402.539 2.028 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3c3c(C)n[nH]c3C)CC2)cc1 754080192 CBUROGZDYKINRB-IFMALSPDSA-N 413.566 2.355 10 20 HECD COC(=O)[C@@H]1CCCC[C@@]1(C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 759841611 AUNGYENPAIHJBO-SIKLNZKXSA-N 403.523 2.055 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3cccc(O)c3)CC2)cc(OC)c1OC 760109015 KVWAZBCWAXNCBU-UHFFFAOYSA-N 415.490 2.492 10 20 HECD O=C(CN1CCc2cccc(F)c2C1)NCc1ccc(N2CCOCC2)c(F)c1 767777971 FPGJTADAPOITIF-UHFFFAOYSA-N 401.457 2.476 10 20 HECD COCCCN(Cc1cc(Br)cc(OC)c1O)[C@H]1CCS(=O)(=O)C1 768203477 HRGALCQCUWTEIT-AWEZNQCLSA-N 422.341 2.189 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(F)ccc4O)n3)CC2)cc1 771064414 BSEGFLWTAGTVOM-UHFFFAOYSA-N 412.421 2.481 10 20 HECD CS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 771841827 QIIBHRNRCDWUQV-UHFFFAOYSA-N 420.506 2.368 10 20 HECD CCN(CC)c1ccc(CN(C)[C@H](C)C(=O)N(CC)[C@H]2CCS(=O)(=O)C2)cc1 781624360 KMSFEVVVWAUWER-XLIONFOSSA-N 409.596 2.389 10 20 HECD O=C(Cc1cncs1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 782341197 TVAVZLPLSJZKGU-UHFFFAOYSA-N 412.494 2.258 10 20 HECD CC(=O)Nc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)ccc1F 786257770 SVEQIDLOFMIJNT-UHFFFAOYSA-N 412.465 2.383 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1 786750980 DOMRGLQOCZBYSS-UHFFFAOYSA-N 418.515 2.241 10 20 HECD C[C@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)(N(C)C)C1 793816275 ZHWNNJITTMRNDZ-SBUREZEXSA-N 400.567 2.312 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2OC)c(O)c1 794379292 OGHTXMVPDFROJJ-SFHVURJKSA-N 414.458 2.339 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2cccc(F)c2)N(C)C)cc1F 803659053 JLVKNMDEISHQHL-LJQANCHMSA-N 404.461 2.066 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c2ccccc21 807100499 OCNVRALABPMUKL-HXUWFJFHSA-N 408.502 2.291 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc([C@H]2CCOC2)cc1 815410236 WUEWUDYRWXQWRA-IBGZPJMESA-N 409.486 2.282 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 819755979 OQZBWXNOMQQJPP-OAQYLSRUSA-N 420.437 2.100 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCN2CCCS2(=O)=O)cc1 918321117 RXZMQPYEUAPLLN-UHFFFAOYSA-N 405.520 2.300 10 20 HECD COC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 920255574 ZSWYPJXZNMLKNT-KHPPLWFESA-N 423.469 2.325 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CO[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 1318924424 UATYXWUEENSCMT-ROUUACIJSA-N 407.511 2.240 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)OCC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)c1 1318955935 DYEXPOICFWLLJO-QGZVFWFLSA-N 418.515 2.171 10 20 HECD Cc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795199636 WWOUYASALKCFIK-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)ccc(F)c1F 1843251229 KBWGJLRZXGDYIH-UHFFFAOYSA-N 403.385 2.210 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 726281750 CNJPYKZOZAQNEZ-QFIPXVFZSA-N 409.490 2.149 10 20 HECD O=C1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCCN1 726781218 XVBAKOVVSXTWOA-JLHYYAGUSA-N 409.558 2.078 10 20 HECD Cc1cc(C(=O)COC(=O)C2CC(=O)NC(=O)C2)c(C)n1-c1ccc2c(c1)CCC2 726820472 DSPLYVDMWQVVJR-UHFFFAOYSA-N 408.454 2.362 10 20 HECD COC(=O)c1ccccc1-c1ccc(/C=C2/SC(=S)N(CC(N)=O)C2=O)o1 727176337 JXLKSDCCRMBFTN-RIYZIHGNSA-N 402.453 2.420 10 20 HECD CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 728068469 OGKFWSYKYPHGNV-IBGZPJMESA-N 423.554 2.495 10 20 HECD O=C(NCCCc1ccccc1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 729522957 ATHOTJOBZYXVHA-UHFFFAOYSA-N 409.530 2.261 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(NC(=O)COC(=O)c2cc(O)cs2)cc1 731911287 JERCDOLCTLMBLY-UHFFFAOYSA-N 412.489 2.280 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)N2C(=O)c3ccccc3C2=O)c1 734015273 FCNBFYYMDGPBBI-QGZVFWFLSA-N 414.483 2.435 10 20 HECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(N2CC=CC2)cc1 740903577 LQTIBZQSXNZGAW-UHFFFAOYSA-N 411.506 2.117 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccc1-n1cncn1 742051067 WEKNLMZYYCMCNB-IBGZPJMESA-N 418.501 2.207 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC(C)(C)c3cnn(C)c3)CC2)cc1 745349389 HEZMXMISZCDFON-UHFFFAOYSA-N 414.554 2.175 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)ccc21 746813106 RSEVVDCTGVVSHV-XMMPIXPASA-N 418.497 2.079 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3(c4ccccc4OC)CC3)nc12 749291373 JLKKIJICHNETRK-UHFFFAOYSA-N 411.414 2.395 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@]4(CCc5ccccc54)C3)nc12 753272652 PSHRHKWKTKOZTI-JOCHJYFZSA-N 408.458 2.286 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)[C@@H]3CCCN(C4CCC4)C3)nc12 754465856 QBIKLOUJDSRLDF-HUUCEWRRSA-N 401.511 2.354 10 20 HECD COCCNS(=O)(=O)c1ccc(CN[C@H](C)c2cc(F)cc(F)c2O)cc1 756482832 JCYYALDRFRXSBV-GFCCVEGCSA-N 400.447 2.446 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCN(C(C)C)C3)CC2)cc(OC)c1OC 759280573 ANYFFOMIGOMGSN-KRWDZBQOSA-N 420.554 2.274 10 20 HECD CC(C)Oc1ccc(N(C)CC(=O)N(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 759915978 SZZGVDXWKINONC-UYAOXDASSA-N 424.563 2.105 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCCN(Cc3ccccc3)C2=O)c1 760505549 VWDLEJIQGKRHES-SFHVURJKSA-N 418.471 2.112 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc2c(c1)ncn2C)c1ccc(N2CCOCC2)cc1 772928526 IXUFVBDNFVJVLG-OAHLLOKOSA-N 400.504 2.449 10 20 HECD C[C@@H](NC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 773990113 SPBFGAVMXACDPH-CQSZACIVSA-N 420.491 2.159 10 20 HECD COc1ccc(CN2CCN(C(=O)CN[C@@H](C)c3cc(OC)ccc3O)CC2)cc1 775373740 VSECMRQRFIXHOH-KRWDZBQOSA-N 413.518 2.404 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CO[C@H](C)Cc3ncc[nH]3)cc2F)C[C@H](C)O1 782914094 ZCQNNQWGFBAQPJ-PMPSAXMXSA-N 404.486 2.426 10 20 HECD CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422360 KEGIYMOMTZQPQX-UHFFFAOYSA-N 420.554 2.378 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910850 DQZNTGSCAYGFNU-INIZCTEOSA-N 418.538 2.180 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)cc1 788929602 WUXABLDOAQQYGB-LJQANCHMSA-N 416.566 2.160 10 20 HECD Cc1cc(F)ccc1CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813323 TUWVLFOKBUZPJU-UHFFFAOYSA-N 417.456 2.085 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)cc(Cl)c3N)nc12 791478985 JQLNNIWNXPZTHN-UHFFFAOYSA-N 408.773 2.343 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccccc2O)cc(N2CCN(C(C)C)CC2)c1 792217967 TWGNVJWPGOXVBJ-UHFFFAOYSA-N 410.518 2.486 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12 807288495 VOLDXQHVUVCELY-XMMPIXPASA-N 403.482 2.337 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(OC(F)F)cn1 807530520 MPDCGNJNBSLXLV-UHFFFAOYSA-N 406.433 2.414 10 20 HECD CSc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccn1 808329602 UEVWKCZFUUCZDY-KRWDZBQOSA-N 415.515 2.333 10 20 HECD CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1Cl 808486903 MDUWJMJGWUNDKQ-UHFFFAOYSA-N 423.874 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C)c4nccn4c3)CC2)cc1F 815539831 ADSMBNMNJJIXDG-UHFFFAOYSA-N 411.437 2.078 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C(=O)O 871821627 FMYRGVFZYOOYJD-UHFFFAOYSA-N 408.451 2.147 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c1 919808936 OWUCEWSYSZCMSR-UHFFFAOYSA-N 423.922 2.375 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cc3ccccc3NS(C)(=O)=O)CC2)cc1 1319626797 ZEFQOPXRDCXINX-UHFFFAOYSA-N 417.531 2.348 10 20 HECD COC(=O)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(C)cc1 1341587545 PJYFIUJQZAWNQV-INIZCTEOSA-N 406.460 2.106 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2)[nH]n1)c1cc(O)nc(O)c1 1817844189 SNQMQZGYISORNC-HNNXBMFYSA-N 408.418 2.231 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3nc[nH]n3)C2)cc1 1843190087 FGHISOGQJUQAAZ-UHFFFAOYSA-N 404.474 2.343 10 20 HECD C[C@@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847733716 RZMSMUMVWXIKMC-COXVUDFISA-N 413.499 2.489 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 16134707 FPMPYKVFZFLLQM-UHFFFAOYSA-N 417.531 2.094 10 20 HECD C[C@H](NC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc(N2CCOCC2)cc1 65435602 IYZHHUHCLWEDNU-KRWDZBQOSA-N 412.490 2.345 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3-n3cnnn3)cc2F)C[C@H](C)O1 108287591 MHDBPTZWQGNXCZ-GJZGRUSLSA-N 410.453 2.345 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C(C)C)N3CCCC3=O)cc2F)CC1 730193533 LBLVHURXNWMENN-NRFANRHFSA-N 404.530 2.231 10 20 HECD COC(=O)CN(CC(=O)NC(=O)NCc1ccccc1)Cc1cc(Cl)ccc1O 731847123 TUTPBJWECNYKGX-UHFFFAOYSA-N 419.865 2.047 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccc(Cl)cn2)cc1)C1=S=CC=C1 732614081 IJNBUDXGLDAZTA-UHFFFAOYSA-N 421.887 2.070 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c1 734072901 TXMCWGGTEJLZIO-HUUCEWRRSA-N 413.474 2.269 10 20 HECD O=C(CCCS(=O)(=O)N1CCCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 735518754 KVBYOLIBTGLYOF-SFHVURJKSA-N 410.536 2.106 10 20 HECD C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)c1ccccc1SCC(=O)N1CCCC1 736269778 GSGNDKZTZRBSPO-GJZGRUSLSA-N 410.561 2.049 10 20 HECD COCc1cccc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 742947597 INAAKGVYJPDGOM-UHFFFAOYSA-N 412.534 2.463 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1 745387450 HZXASLWFDKLIDE-UHFFFAOYSA-N 413.430 2.417 10 20 HECD COc1ccc(C)cc1NC(=O)CNC(=O)CN1CCOc2cc(N(C)C)ccc21 746493019 PFMLNOQDALJLNT-UHFFFAOYSA-N 412.490 2.023 10 20 HECD COc1ccc(N2CCN(C(=O)NCCc3cccc(C(N)=O)c3)CC2)cc1F 753893784 PLNFGKGOCVVHPA-UHFFFAOYSA-N 400.454 2.008 10 20 HECD NC(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cn1 757953799 JIJCYWZYSJBGMC-UHFFFAOYSA-N 416.349 2.116 10 20 HECD Cc1cc(F)cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1[N+](=O)[O-] 758426919 SGIBFKQTOWHMMS-UHFFFAOYSA-N 421.450 2.207 10 20 HECD CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 763424985 HSVILPUWSUUQBO-UHFFFAOYSA-N 420.506 2.315 10 20 HECD C[C@@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 765735007 BVMZZHSJRBKKDJ-WCFLWFBJSA-N 409.280 2.335 10 20 HECD Cc1cc(Cl)ncc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 766328239 QYLFROJNSRTZBY-UHFFFAOYSA-N 406.845 2.274 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3ccc(F)cc3)cc2)C1 770302730 YLHGKXVCMQMTJL-PXNSSMCTSA-N 414.481 2.060 10 20 HECD O=C(NC[C@@H](O)c1cccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 772509550 PDHVQSWNOBSOTP-MRXNPFEDSA-N 419.484 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@H]3c3ncc[nH]3)CC2)cc1 778252081 NHICRTXPGHAEEU-XTXLJPNXSA-N 423.517 2.377 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCc3nccs3)CC2)cc1 778254653 QLVIPBJZDSSDGI-CMDGGOBGSA-N 414.531 2.106 10 20 HECD CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C[C@@]1(O)CCN(Cc2ccccc2)C1 778491152 SPYIMLUFMQDOCH-VWLOTQADSA-N 424.589 2.280 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 779475409 LQHPGYAQHXVRKF-OQFOIZHKSA-N 420.462 2.173 10 20 HECD CCN(CC)CCCNC(=O)C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779520473 HUPNXJVWOLCALO-VQHVLOKHSA-N 403.523 2.198 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc2c1OCCC2=O 780051148 RIMHNFNKXNHWHA-UHFFFAOYSA-N 423.469 2.086 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCOCC4)cc3)c2)CC1 781272009 VYUMHMYPMNZSLS-UHFFFAOYSA-N 408.502 2.444 10 20 HECD O=C(N[C@H](CO)C1CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 782731932 FUCXSXGVGMYTQD-CRAIPNDOSA-N 413.465 2.344 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)cc1 785422119 ISBDBXVXUWWNDB-NRFANRHFSA-N 413.493 2.480 10 20 HECD CC(C)OCCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822062 VHFHMVIQIRZALE-IAGOWNOFSA-N 423.529 2.377 10 20 HECD CSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789826279 PISGJBAKKMRDSG-RRFJBIMHSA-N 411.543 2.313 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)sc2Cl)ccc1O 790405560 LPTMTPHGYQPWDU-UHFFFAOYSA-N 417.317 2.469 10 20 HECD COc1ccc(OC)c(C2=NO[C@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)C2)c1 792306989 LUCBFEITYLHQSP-ODXCJYRJSA-N 400.431 2.355 10 20 HECD C[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 792471003 XXRXHBNGKAGWJV-GFCCVEGCSA-N 416.441 2.073 10 20 HECD COc1ccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c(O)c1 794369609 IHFAZFGJYVMWMI-BZSNNMDCSA-N 400.475 2.383 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 795932881 OUQHLLVKIOTSEV-OAHLLOKOSA-N 405.520 2.168 10 20 HECD COc1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1S(=O)(=O)N(C)C 797637823 BBMPYSPTYGQLIM-GFCCVEGCSA-N 423.491 2.109 10 20 HECD CCCCCNC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807675260 VQJAPZGEMZEQHE-QGZVFWFLSA-N 416.566 2.475 10 20 HECD O=C(COC(=O)C[C@H]1CCCC(=O)N1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808691997 RQDIFZWTBAOLTI-CYBMUJFWSA-N 420.421 2.003 10 20 HECD O=C(COC(=O)c1ccccc1S(=O)(=O)N1CCCCC1)c1ccc(O)c(O)c1 916616867 TXZKPXGNRCMMOD-UHFFFAOYSA-N 419.455 2.312 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H](C)O1 918201176 GFLVLVVFBAAOGT-IRXDYDNUSA-N 422.545 2.085 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nnc2ccccn12 918202999 RFPMUYOREOHCRT-CQSZACIVSA-N 412.469 2.390 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 918373265 UVUNFFXFXOXWJE-AWEZNQCLSA-N 401.488 2.166 10 20 HECD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1ccc(N2CCSCC2)cc1 918617065 JBYGSCXLJURJLV-UHFFFAOYSA-N 409.533 2.027 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3cccc(F)c3)cc2)C1 921122483 JWULYMZKIKXQPR-PXNSSMCTSA-N 414.481 2.060 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cc1 1116421249 LOIJXUBMCUCDQG-UHFFFAOYSA-N 417.531 2.346 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1CCCCO1 1804283008 KKUQTKOEGVDIOK-ALDGSTNNSA-N 416.474 2.024 10 20 HECD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1Cl 1846844999 XRADEMDYPUHOPE-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 108804829 QTDIXOKWXKIXFO-UHFFFAOYSA-N 423.922 2.015 10 20 HECD Cc1c(CNC(=O)NC[C@H](O)CS(=O)(=O)c2cccs2)n(C)c2ccccc12 472219238 CBIVEODDNNOIDP-AWEZNQCLSA-N 421.544 2.182 10 20 HECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCc3ccc(N(C)C)cc3C)cc2)[nH]1 734467849 HASYVTKGXBVNML-UHFFFAOYSA-N 422.485 2.186 10 20 HECD COc1ccc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc1C(=O)N(C)C 734490938 UMOFANXVFGQOJE-UHFFFAOYSA-N 405.520 2.284 10 20 HECD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798644 AMOHQSOTOPDBNN-ZDUSSCGKSA-N 422.388 2.143 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCOC[C@@H]2C[C@@H](O)c2cccs2)cc1 753855858 JIWLZYYDOGNBCG-RBUKOAKNSA-N 403.548 2.255 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)co1 755566157 ZGDHDBVPSFQQPC-UHFFFAOYSA-N 409.533 2.013 10 20 HECD COC[C@H](C)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 756664170 CBVJNFUZXJIKJQ-OAGGEKHMSA-N 410.486 2.271 10 20 HECD O=C(OCc1nnnn1CC(F)(F)F)c1cccc2c1C(=O)c1ccccc1C2=O 758363442 LVQLWOVQOOZFCR-UHFFFAOYSA-N 416.315 2.368 10 20 HECD C[C@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)NC2(CCCC2)C1=O 765770369 PCIQHCIBKJWGDN-SNVBAGLBSA-N 410.268 2.024 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(-c4nc[nH]n4)c3)CC2)cc1 767339310 OFHGMNRXGVRPIA-UHFFFAOYSA-N 406.490 2.032 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3ccc(F)c(S(N)(=O)=O)c3)c2)CC1 767383350 MCNVOERKTMGJKM-UHFFFAOYSA-N 420.510 2.256 10 20 HECD CCC[C@@]1(CO)CCCN1C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 768975234 LJTCOWKAKZUTEP-ZUTVHTERSA-N 415.534 2.054 10 20 HECD Cc1cccc(CN(CCN(C)C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 769763151 SSAHZGPAHNBICU-UHFFFAOYSA-N 405.520 2.276 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)CC(=O)N4)CC2)cc1 778277880 QKHBSPWVCMZUCE-CMDGGOBGSA-N 420.469 2.033 10 20 HECD NS(=O)(=O)c1ccc(NC(=O)C2CCN(Cc3cc(F)ccc3O)CC2)cc1 778993882 DDGPRTJTLSMSKF-UHFFFAOYSA-N 407.467 2.029 10 20 HECD CCOC(=O)c1cc(C)sc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296491 FVQOKEVOEMBCOP-SNVBAGLBSA-N 406.460 2.330 10 20 HECD COC[C@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400120 STHOCBVDMZJPFR-NSHDSACASA-N 410.404 2.293 10 20 HECD COCC[C@]1(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCOC1 785405498 UNZKOFQEVRHYME-QFIPXVFZSA-N 424.409 2.296 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1Br 785753876 OAJXJSFLMCUVKG-YUMQZZPRSA-N 417.216 2.364 10 20 HECD C[C@H](O)CN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](C)CO 785871089 XPXUQCNUOCCVAN-KKUMJFAQSA-N 401.454 2.030 10 20 HECD COc1ccc(CNC(=O)C2(C(=O)NCc3ccc(OC)cc3O)CCC2)c(O)c1 794389650 BPNZRTDAATZHGJ-UHFFFAOYSA-N 414.458 2.218 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(CN(C)C)c1 799263424 WGHOASHYFZVWTN-GFCCVEGCSA-N 405.882 2.499 10 20 HECD CCN(CCOCCO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 800710319 SFNBSPDESNMCEA-OAHLLOKOSA-N 401.454 2.297 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc2c(c1)OCCCO2 803634983 ZFMXSQVCGBXYBK-UHFFFAOYSA-N 407.470 2.157 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3cnn(C(C)C)c3)CC2)cc1 804318901 FJHNPQLZPSGMOI-INIZCTEOSA-N 413.522 2.435 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2nc(C)n(C)c2Br)c1 805011209 IRZZFPXYAADMFT-QMMMGPOBSA-N 404.286 2.245 10 20 HECD COc1cccc([C@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CCO2)c1 807100358 LQTZAVWXJRTFNR-OAQYLSRUSA-N 411.502 2.286 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc2c(c1)OCCO2 807385842 RTBQNVCZHJFSQP-UHFFFAOYSA-N 407.220 2.181 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(Cc3cc4c(cc3O)OCO4)CC2)C1 808227398 DVEFCWUUKFJPIE-MRXNPFEDSA-N 405.495 2.248 10 20 HECD CCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCOC(C)(C)C1 810042679 FACHUJUKSLOEHJ-NHCUHLMSSA-N 405.583 2.458 10 20 HECD C[C@@H]1CN(c2cccc(F)c2)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 817030008 VHDPRUABPONNGB-CYBMUJFWSA-N 407.467 2.254 10 20 HECD CCn1cnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917198469 BLOKUNIBEGSGSI-KBPBESRZSA-N 407.515 2.459 10 20 HECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(F)cc1 917955055 WFBYZIYUNXIDBW-INIZCTEOSA-N 420.506 2.483 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cn2)C[C@@H](C)O1 919814716 MOMBMDVYTQXORU-CHWSQXEVSA-N 420.491 2.025 10 20 HECD C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600669 BUIUHOLHDWTZAT-NKGKWGDASA-N 410.474 2.245 10 20 HECD O=C(C1=CCCS1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806101596 FMPSTWCBIXJVEC-UHFFFAOYSA-N 403.504 2.358 10 20 HECD CC(=O)O[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C(C)C 1845501347 FLKFPHNWVGQQDH-QGZVFWFLSA-N 424.881 2.156 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(-c3ccc(F)cc3)no2)c1 138518178 OXXGCYBDJBRZID-UHFFFAOYSA-N 407.379 2.310 10 20 HECD NS(=O)(=O)c1cnc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 301417698 BMLWFUGLJGNTAC-JTQLQIEISA-N 404.464 2.473 10 20 HECD NC(=O)CN1C(=O)/C(=C\c2cnn(-c3ccc(Br)cc3)c2)SC1=S 727175335 ACWNUVPPEBZDSQ-LFYBBSHMSA-N 423.317 2.321 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1 729063743 LNOQDYKKCNDSBI-CYBMUJFWSA-N 413.430 2.169 10 20 HECD COC(=O)NCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733544441 NHAGLOANJRBPSY-GFCCVEGCSA-N 424.409 2.078 10 20 HECD C[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCCCCC1 741030847 ZZINPNNGGVUOSG-KRWDZBQOSA-N 421.513 2.086 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc1F 754028635 ZLVDRHDVKMBNGX-UHFFFAOYSA-N 407.392 2.191 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc2ccncc12 756161971 VTOROUBXQZHFBT-UHFFFAOYSA-N 408.433 2.465 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)ccc(F)c3OC)CC2)cc1 756679008 XIFXUKAJULKOAH-UHFFFAOYSA-N 420.412 2.488 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 760086108 RYLWXZCSWCSKMX-CQSZACIVSA-N 423.510 2.274 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 761186424 QISXDBYSRVYUSI-FQEVSTJZSA-N 405.539 2.300 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CCS(C)(=O)=O)cc2F)C[C@@H](C)O1 762014050 ZDRXQBJMSCUUHP-KFWWJZLASA-N 415.531 2.062 10 20 HECD C[C@@H](NCCNS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765408218 JTNZMCOTCKCLNQ-MRXNPFEDSA-N 407.511 2.291 10 20 HECD CS(=O)(=O)CC1(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 768913196 WITPBIGNRIACET-INIZCTEOSA-N 414.955 2.341 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773849771 ZXQACQQIILKURN-HNNXBMFYSA-N 412.490 2.036 10 20 HECD COCCNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773990696 WGVOOZHBJKASES-OAHLLOKOSA-N 405.520 2.168 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2Cl)C1 774243999 MODQEDUDAJUINA-INMHGKMJSA-N 407.942 2.422 10 20 HECD COc1cccc(NC(=O)CN(C)C(=O)CN[C@@H](C)c2cc(OC)ccc2O)c1 775365001 TXQIBZBKVFNFNH-AWEZNQCLSA-N 401.463 2.157 10 20 HECD COc1cccc(CC(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)c1 775663992 IOWLCIDVTDOJPH-UHFFFAOYSA-N 422.573 2.334 10 20 HECD NS(=O)(=O)c1cccc(NCc2ccc(N3CCSCC3)cc2)c1[N+](=O)[O-] 779428836 PHTUVRFRIHBJBY-UHFFFAOYSA-N 408.505 2.408 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(N)=O)cc1F 783316798 MYYVUAQFAMRPLB-UHFFFAOYSA-N 400.454 2.366 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1N(C)S(C)(=O)=O 784031079 WJHQBAWNGBCSHV-UHFFFAOYSA-N 419.503 2.165 10 20 HECD CCOC(=O)NCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 785667882 ILOBNVOHNTWPJO-GFCCVEGCSA-N 424.409 2.078 10 20 HECD O=C(NCc1ccc(F)c(F)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 786683847 NTEOORGZEYPKRL-MRXNPFEDSA-N 404.413 2.494 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(N4CCCCC4)nc3)ccc21 787195405 BDLOMNZKRBSMIW-UHFFFAOYSA-N 421.545 2.387 10 20 HECD COCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 787993370 SBPKBSXVHCPHDD-UHFFFAOYSA-N 411.502 2.245 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CC3CCC4(CC3)OCCO4)cc2)C1 788090398 RGYLZFMOEAMEFX-LJQANCHMSA-N 415.534 2.328 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 789666471 ARLIHRJQZAJATP-OAQYLSRUSA-N 408.546 2.492 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCC(F)(F)C3)CC2)cc1 797768132 KTZGLZGLPNIGCN-WLMCBFPDSA-N 407.461 2.452 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCCC34CCOCC4)CC2)cc1 799898276 SNIOVRFIUOOPPJ-NRFANRHFSA-N 416.566 2.466 10 20 HECD C[C@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 800854161 QDQUOKTZKQJFCB-LPHOPBHVSA-N 414.550 2.090 10 20 HECD CCOC(=O)[C@H](C)[C@H](C)NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 801541680 UCTGTMIUEZGMLF-VQHPVUNQSA-N 423.529 2.233 10 20 HECD CO[C@H](CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807768156 DBWPGHOSFSMHME-WMLDXEAASA-N 413.465 2.160 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H]1C 807770539 MAPHBMIOERPSBN-SOUVJXGZSA-N 411.449 2.009 10 20 HECD O=C(NC1CC1)C(=O)N1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809548507 DSCIIEPFLKVCJW-UHFFFAOYSA-N 418.541 2.172 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1F 810365483 SUTUPHAWSMVBSD-UHFFFAOYSA-N 405.401 2.381 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3c(N)noc3C)c2C)cc1 810827925 BKDDEHMTRMUZLU-UHFFFAOYSA-N 404.448 2.100 10 20 HECD COCC[C@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 813042162 HGIAGBSBWVHYKL-JZXOWHBKSA-N 409.502 2.386 10 20 HECD COc1ccc(N2CCN(c3ccc(S(=O)(=O)N(C)C)cc3[N+](=O)[O-])CC2)cc1 912739487 LNURKIVCSYYAHL-UHFFFAOYSA-N 420.491 2.180 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1 916502634 IWPKIPKQRUYDHL-UHFFFAOYSA-N 412.446 2.483 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CCC4)cc2)C1 918464180 SLWMXCURHRBXFG-LJQANCHMSA-N 420.513 2.132 10 20 HECD COCCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787830894 TXTOYKJXVYDNKF-UHFFFAOYSA-N 421.544 2.017 10 20 HECD O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502383 RSVDTKLJRNDTHG-IOASZLSFSA-N 406.866 2.136 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1nc(N)nc(N(C)C)n1 25041290 WHDXCLXJDXNPKE-UHFFFAOYSA-N 413.507 2.467 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1F 731408017 ALOSPANDHWBSST-UHFFFAOYSA-N 414.437 2.258 10 20 HECD Cc1nnc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1C 733151537 FTRJUFUZKOXJFL-UKTHLTGXSA-N 421.573 2.483 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 734284118 RRDZOTUYTGNVQT-IBGZPJMESA-N 415.582 2.085 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(-c2ccccc2)[nH]1 736070280 RREXXBUXWVBBMW-UHFFFAOYSA-N 410.499 2.242 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1O 737284788 RXMPZYGHNZFBGW-UHFFFAOYSA-N 405.838 2.011 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](N4CCCC4)C3)CC2)cc1 743362956 MKFHXANVDCLVGJ-OAQYLSRUSA-N 415.582 2.087 10 20 HECD Cc1nc(C(C)C)nc(O)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 747368014 WVGYKLPKBLFTJF-INIZCTEOSA-N 411.506 2.246 10 20 HECD COc1ccc2ccc(O)c(CN3CCN(S(=O)(=O)CCOC(C)C)CC3)c2c1 747469614 PGQRCOYAJUAHKN-UHFFFAOYSA-N 422.547 2.426 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1Cl 749730752 UQHXGWOFWBMYKA-UHFFFAOYSA-N 412.924 2.393 10 20 HECD COc1cc(OC)cc(-n2nnnc2CN(C)Cc2cc(F)cc(C(C)=O)c2O)c1 752096008 RFWLZEJOFXFUJJ-UHFFFAOYSA-N 415.425 2.359 10 20 HECD CN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1ccc(Cl)s1 752688421 HDJMFQSWUSOSOR-UHFFFAOYSA-N 403.913 2.227 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 753642356 BBINUGMJMMQBDF-CQSZACIVSA-N 406.504 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)NCC3(N4CCCC4)CCOCC3)CC2)cc1F 753919222 JQVGEYHNPKUYHX-UHFFFAOYSA-N 420.529 2.311 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1ccccc1I 758548882 WTSQDBWXSOKPLE-UHFFFAOYSA-N 413.167 2.498 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCCCSc2nccs2)cc1 759548160 QUPJKAPNENACNY-UHFFFAOYSA-N 414.578 2.211 10 20 HECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)Nc1ccccc1S(C)(=O)=O 759594066 FHBARIGAOGJDSY-VPUINMBXSA-N 405.428 2.085 10 20 HECD C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2ccccc2)no1 760931713 GWXITNOEIATCAB-LBPRGKRZSA-N 416.459 2.347 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCS[C@H]3COCC[C@@H]32)c1 767784559 DEHHXKFNCQMXBK-PMACEKPBSA-N 406.548 2.133 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 769304727 CJWTWOITNJYHNQ-UHFFFAOYSA-N 413.858 2.187 10 20 HECD CN1CCC[C@@H](N(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 769914373 YAZBIPGRWWAIHP-CQSZACIVSA-N 409.533 2.421 10 20 HECD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)c1c(F)cccc1F 770043603 YCRTXQRRGVNKGA-RHSMWYFYSA-N 414.430 2.284 10 20 HECD COC1(CO)CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 770701073 PILUJMMNDSIBCH-OAHLLOKOSA-N 413.465 2.440 10 20 HECD C[C@H](NC(=O)NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773615944 ZXDQSRXJSRMUCG-BBRMVZONSA-N 411.549 2.009 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O)c1ccc(N(C)C)cc1 773845054 GDFNILMJGWGPFY-GFCCVEGCSA-N 410.396 2.293 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(OC[C@H]2CCCO2)c1 774363739 LJACETFSBSJKSG-MRXNPFEDSA-N 414.458 2.261 10 20 HECD O=C(N[C@H]1CCn2ccnc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 779218422 YVFMAXHKVPQNOY-LBPRGKRZSA-N 418.500 2.196 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(Cl)c3c(c2)OCCO3)cc1 785423626 DKYCWPJWGIIKQC-UHFFFAOYSA-N 403.866 2.110 10 20 HECD Cc1ccc(-n2cnc3c2CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C3)cc1 785428024 JFTBTNDQDXCLJY-UHFFFAOYSA-N 417.513 2.448 10 20 HECD C[C@H](O)CN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](C)CO 785872664 RTTBSCJJLJHXPN-KBPBESRZSA-N 401.454 2.030 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)cc2)CC1 786257500 PWJRPDXNQFRGPE-FQEVSTJZSA-N 420.513 2.024 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCc3nc4ccccc4[nH]3)ccc21 788458299 COAPBOQDNNLKMX-UHFFFAOYSA-N 405.502 2.311 10 20 HECD CCc1nc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)sc1C 789369617 FZOYPFVDBWXNMC-UHFFFAOYSA-N 402.520 2.448 10 20 HECD COCCC(C)(C)CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789828800 YQBARBHRWDLJBD-IYBDPMFKSA-N 423.529 2.234 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(N(C)S(=O)(=O)c2cccc3nonc23)cc1 792664324 DOTDEGBRQXWRTP-UHFFFAOYSA-N 424.504 2.077 10 20 HECD C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(O)nn1 796701277 HDTFFMRTYNFIIO-HNNXBMFYSA-N 409.469 2.289 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803296372 BNVMIZBIIOYBOV-XMSQKQJNSA-N 423.513 2.301 10 20 HECD COCC1(C)CCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 804316159 ZLOBNEUJGIVKMC-UHFFFAOYSA-N 403.523 2.055 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3c3nncn3C)cc2)CC1 805026045 ZZUPTIZFFWILCU-IBGZPJMESA-N 410.522 2.031 10 20 HECD CC[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1O 810225700 KJZFTRWWVDLQTM-RDJZCZTQSA-N 415.456 2.385 10 20 HECD COCCOCc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 812481816 QSBSNXLCTDWJMR-UHFFFAOYSA-N 418.515 2.337 10 20 HECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 915082701 UDMNUHWCCWUHAF-UHFFFAOYSA-N 401.532 2.309 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc2ncccc2c1 918284453 HCFZTUYKMBJLIF-UHFFFAOYSA-N 408.433 2.465 10 20 HECD C[C@@H](NC(=O)CNC(=O)c1cc(Cl)ccn1)c1ccc(N2CCOCC2)cc1 1115897575 ILGCUTZXMWBMFK-CQSZACIVSA-N 402.882 2.179 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)n([C@H](C)C2CC2)n1 1320386640 OMQOMGKTWHHGGD-DYVFJYSZSA-N 401.463 2.478 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)N1CCc2ccccc2C1 1337826286 IXXPVPBMMFZEBN-BEFAXECRSA-N 412.486 2.135 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)Cl 1802608973 HXFZWNRIRZAIFR-NMHLOJTESA-N 416.808 2.286 10 20 HECD Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807992144 VMGLDXYTATZSAZ-MGPUTAFESA-N 421.457 2.158 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCCCO1 1814505069 IJWKLJZKNSTWPJ-GJZGRUSLSA-N 415.450 2.091 10 20 HECD C[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740482 JSHYQJOZLSRBCT-LRDDRELGSA-N 410.898 2.365 10 20 HECD Cc1cc(C(=O)COC(=O)CCN2C(=O)CCC2=O)c(C)n1-c1cccc(F)c1 12958323 HHYIWAUJYRASTA-UHFFFAOYSA-N 400.406 2.498 10 20 HECD C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 726616172 ZWBVTWQWHOQBAX-ZWKOTPCHSA-N 402.539 2.454 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 727177578 MBKRCEUKTWTRHS-DHZHZOJOSA-N 421.363 2.200 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2C)cc1 734558833 YJFWQGHXIIOYKQ-UHFFFAOYSA-N 417.531 2.248 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](CC(=O)OC)c4ccccc43)nc12 741789419 FLJIHROHBWUWGM-ZDUSSCGKSA-N 410.430 2.279 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)c3cc(OC)c(OC)c(OC)c3)nc12 741798720 KHULPTGHRPHNEH-UHFFFAOYSA-N 416.434 2.274 10 20 HECD CC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 744907924 MGHUQBLHFCLXCN-INIZCTEOSA-N 424.501 2.322 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(CCO)CCCC3)CC2)cc1 745784595 YSNSXKFCHDUBJU-UHFFFAOYSA-N 404.555 2.059 10 20 HECD CSCc1noc(CCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 747418104 ALWQJNZLVWEBDD-UHFFFAOYSA-N 408.499 2.282 10 20 HECD CC[C@@H](C)[C@@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)C(=O)OC 749821049 OEZUWVCTTUHCBE-RFAUZJTJSA-N 407.492 2.356 10 20 HECD COc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227699 JXLBUNSRZLWTMV-UHFFFAOYSA-N 424.494 2.283 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1 751273117 WBYXNBNHEPVNIN-UHFFFAOYSA-N 423.520 2.229 10 20 HECD COc1ccc(N2CCN(C(=O)NCCOc3ccc4c(c3)OCO4)CC2)cc1F 753856468 AFGYLOLONDRTQW-UHFFFAOYSA-N 417.437 2.474 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(OCC4CC4)CC3)CC2)cc1 754050705 QWUGVSKMUWLVBG-OAQYLSRUSA-N 403.567 2.069 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1 756152428 GEOSXLRAIABTHZ-UHFFFAOYSA-N 404.470 2.218 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(NC(C)=O)ccc3OC)CC2)cc1 756421249 OLDLHTKWFXCCED-UHFFFAOYSA-N 412.490 2.423 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccccc3-n3ccnc3)CC2)cc1 758233323 VZWDJPIMDKHDRR-HXUWFJFHSA-N 408.502 2.443 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3c(C)ccn(C)c3=O)cc2F)CC1 758627967 UJLUBGXOKMHRDZ-UHFFFAOYSA-N 401.486 2.296 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCc4c[nH]nc4C3)cc2F)CC1 758754583 VCSSSZSENVBJCY-KRWDZBQOSA-N 400.502 2.047 10 20 HECD COc1cc(N2CCN(CN3C(=O)c4ccccc4C3=O)CC2)cc(OC)c1OC 758956157 UYQLBQDHNCDTCC-UHFFFAOYSA-N 411.458 2.088 10 20 HECD COC(=O)N[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 761517258 FMEFQSMRZIMMQF-ZDUSSCGKSA-N 416.430 2.336 10 20 HECD CCc1nnc(S[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 768398065 HNSYTVISBXINGP-LLVKDONJSA-N 421.482 2.449 10 20 HECD COc1cc(O)c(CN2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)cc1OC 768445783 HYRFSIUZGNKQCO-LJQANCHMSA-N 411.502 2.333 10 20 HECD C[C@@H](C[S@](C)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768448955 QIKTVMXYGHZMEC-FTJNGKRUSA-N 416.546 2.094 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc3c(c2)CCCN3C)s1 772605270 RYJCRYVXMZXWFT-UHFFFAOYSA-N 422.576 2.217 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)NC(=O)CC2 773847068 NDNRFEFVPDOWJR-CYBMUJFWSA-N 410.474 2.462 10 20 HECD CCN(CC)c1ccc(CNC(=O)N(CCCOC)[C@@H]2CCS(=O)(=O)C2)cc1 774179516 PFBXBQRNAWVDPK-LJQANCHMSA-N 411.568 2.268 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN(C(C)C)C(C)C)CC2)cc1 774792100 ZRCAQYDAGDJKGP-UHFFFAOYSA-N 404.555 2.015 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NC[C@@H]1CC1(Cl)Cl 775152996 QDCHLRVKWAYDGE-ZDUSSCGKSA-N 402.347 2.166 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(C)n3C(C)C)CC2)cc1 777665981 SRPYUYQXWQGFHV-SFHVURJKSA-N 405.568 2.451 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(C(F)F)CC3)CC2)cc1 778379313 HSEDWXYYAAQTPU-SREVYHEPSA-N 407.461 2.404 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCOc3cccc(C)c3)CC2)cc1 779221673 MBYIWGKHKGEEDW-JOCHJYFZSA-N 413.562 2.497 10 20 HECD CCn1cc(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 781415207 QODZYMBUGZWCFR-UHFFFAOYSA-N 417.421 2.403 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(N(C)C)nc3ccccc23)cc1 785424422 PGZXCLKROXOPDR-UHFFFAOYSA-N 405.502 2.299 10 20 HECD CC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 785535463 KBVXEOBNEZKIIX-UHFFFAOYSA-N 415.515 2.118 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2sccc2C1 789724322 DYTATTGMQZWRLE-KRWDZBQOSA-N 424.570 2.304 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nccs1 789802465 YOJHRNICYDJNKO-HNNXBMFYSA-N 406.483 2.003 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C1Cc2ccccc2C1 789848119 ZTWDYXBTQRILAW-UHFFFAOYSA-N 409.555 2.482 10 20 HECD COc1cc(Cl)cc(CN[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 793247714 RJPUCORQTOEPGF-SFHVURJKSA-N 421.929 2.365 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccccc1-n1ccnc1 793721782 ZNOFNYPFJAXRBL-UHFFFAOYSA-N 401.517 2.244 10 20 HECD C[C@H]1CCC[C@@](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)(N(C)C)C1 793816273 ZHWNNJITTMRNDZ-GAJHUEQPSA-N 400.567 2.312 10 20 HECD Cc1cc(Cn2nnc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2C)on1 794239251 PJMCJSHNEIMTLK-UHFFFAOYSA-N 412.519 2.414 10 20 HECD CNc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 795476660 RVGSJIZAMFRNTO-UHFFFAOYSA-N 421.480 2.309 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H]3CCC[C@@H](OC)C3)CC2)cc1 796059496 BRFARWAYMODFJX-FXAWDEMLSA-N 404.507 2.482 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H](CCN(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 803309919 CEKZICUQROCNDW-XLIONFOSSA-N 418.582 2.183 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CC[C@@H]1CCCCN1C)c1ccc(N2CCOCC2)cc1 803310021 FMHKDGMAAQYGDQ-QUCCMNQESA-N 416.566 2.033 10 20 HECD COc1ccc2cc(NC(=O)C3=S=C(CCNS(C)(=O)=O)C=C3)ccc2c1 803456005 ZWIPTQJNFDMWMR-UHFFFAOYSA-N 404.513 2.374 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCC2(C)OCCO2)cc1)C1CCCCC1 803676716 CMCRAUFGZWFHRO-UHFFFAOYSA-N 403.523 2.341 10 20 HECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@H](C)O1 803677432 OZNYNZILBSLBBD-UWJYYQICSA-N 417.550 2.334 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3N(C)CCCC3(C)C)CC2)cc1 804318465 KPPGGEGHXPHBJJ-HXUWFJFHSA-N 416.566 2.017 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 806279774 ZIORPFNFYPSJHK-CYBMUJFWSA-N 415.606 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1 806831679 WVAYJLRMKOULFP-UHFFFAOYSA-N 418.444 2.122 10 20 HECD Cn1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c(C(F)(F)F)n1 814993143 OWJLPDQMBYHLAA-UHFFFAOYSA-N 420.482 2.471 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCN1C(=O)CCNC1=S 816940788 MUUSXWKLHGZFCS-UHFFFAOYSA-N 414.325 2.000 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc4c(=O)n5c(nc4c3)CCC5)CC2)cc1 872032822 ZYVXYWUYLLPRDE-UHFFFAOYSA-N 404.470 2.314 10 20 HECD CN1C(=O)c2ccc(S(=O)(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)cc2C1=O 917926868 OZDFKMWZNSSHHA-UHFFFAOYSA-N 413.499 2.332 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1nncn1-c1ccccc1 918209888 RCDVMPJZLLVRRB-UHFFFAOYSA-N 424.480 2.367 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H]1CCS(=O)(=O)C1 1116868531 BWVPJSGMFZDDHG-OAHLLOKOSA-N 410.536 2.200 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@H]3C(=O)NCc3ccco3)cc2F)CC1 1324717200 XAQBNEHADHLWQT-NRFANRHFSA-N 400.498 2.451 10 20 HECD COC(=O)N1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1334279912 PBIALLUWLXHJNP-UHFFFAOYSA-N 421.453 2.175 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)CCNS(C)(=O)=O)cc2Cl)C1 1344629977 VCFSPMUKPWRZSX-CQSZACIVSA-N 416.975 2.267 10 20 HECD CN1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1792634283 FDKWNQZLTXZNER-MUJYYYPQSA-N 421.925 2.345 10 20 HECD Cc1cc(C(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccc(C#N)cc1 303209033 QRITYEZVCSLYPR-UHFFFAOYSA-N 400.504 2.120 10 20 HECD COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 525225844 CWHFLRSRPZAVLS-UHFFFAOYSA-N 405.476 2.307 10 20 HECD COc1ccc(N2CCC(NC(=O)NCc3ccc(-n4cncn4)nc3)CC2)cc1 726610528 HSJNALUMRFMYBJ-UHFFFAOYSA-N 407.478 2.139 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c1 728979861 OZTPMHLILYUZAE-GFCCVEGCSA-N 420.487 2.341 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1 737183237 KJJMRWPJIWUTGJ-LBPRGKRZSA-N 417.487 2.184 10 20 HECD CC(C)Cc1nnc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 738885678 QWOGDXKKOGVFIX-UHFFFAOYSA-N 423.564 2.293 10 20 HECD COc1ccc(NC(=O)NC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 741736151 OGYMDSLSMJHWTA-UHFFFAOYSA-N 412.490 2.312 10 20 HECD CC(=O)c1cc(F)cc(CN2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)c1O 749447777 GAWAWTPIZUVAKE-INIZCTEOSA-N 412.417 2.231 10 20 HECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCCCSc2nccs2)c1 749730853 XIKBBRYTCBYHEE-LBPRGKRZSA-N 422.532 2.354 10 20 HECD Cc1nc2n(n1)CCN([C@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)C2 750058816 XOGFGTZGYKTIQW-CYBMUJFWSA-N 415.453 2.205 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1C 751271751 GNRZHUONKZWQOI-UHFFFAOYSA-N 423.520 2.148 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC(c4nc5ccccc5[nH]4)C3)CC2)cc1 757346825 AOTBJCORTAYQSY-UHFFFAOYSA-N 405.502 2.320 10 20 HECD CCC(=O)N1CCCC[C@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759220868 LQFBCEFSIYBHPS-KRWDZBQOSA-N 419.522 2.152 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3Cc4ccccc4C3)CC2)cc1 762671401 GBWCUDULVKTACY-ZHACJKMWSA-N 405.498 2.184 10 20 HECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc2c(c1)OCCO2 769710919 LJWGRZRHFCYPKV-HNNXBMFYSA-N 406.460 2.416 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3cccnc3)cc2F)C[C@@H](C)O1 774131214 VKDDBMRISOFWKC-BZUAXINKSA-N 414.481 2.328 10 20 HECD Cc1cc(CNC(=O)NCCCSc2nccs2)ccc1S(N)(=O)=O 775227248 YHEOHRZNQONBMF-UHFFFAOYSA-N 400.551 2.081 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2cc(Cl)cc(F)c2O)c1 776170241 SHHOMWFNRRAMOH-JTQLQIEISA-N 415.874 2.210 10 20 HECD C[C@H](NC(=O)N1CCC(CNC(=O)c2cnn(C)c2)CC1)c1ccc(N(C)C)cc1 776245582 HXTHADYVMIALLC-INIZCTEOSA-N 412.538 2.399 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc(O)n1 777366601 FVTHZYPBFUYFPT-UHFFFAOYSA-N 422.464 2.281 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C 777826659 PVRHHHOMIIZCPB-UHFFFAOYSA-N 424.841 2.359 10 20 HECD CCN(CCc1ccccn1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778247798 ONOGODQZPFXRKW-QXMHVHEDSA-N 422.529 2.386 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 779491301 MYBJUMQHKULDQE-FNORWQNLSA-N 422.890 2.298 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@H]2c2cccc(Br)c2)c(O)c1O 780999499 FCDJRUGHECFLQS-CQSZACIVSA-N 405.248 2.482 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCOCC2)c(F)c1)[C@H](C)C(=O)OC(C)(C)C 781529067 JLQDIXOGMGKZIW-MRXNPFEDSA-N 423.529 2.331 10 20 HECD Cn1cc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C(F)(F)F)n1 782814019 LNDFWPSGNIJAIT-CYBMUJFWSA-N 424.427 2.462 10 20 HECD COc1ccc(N2CCN(CCCNc3ncnc4c3NC(=O)CS4)CC2)cc1 784561217 WBHULBSZSTVWQM-UHFFFAOYSA-N 414.535 2.154 10 20 HECD Cc1ccccc1CN1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785433598 NQZUMPNMGOYELG-UHFFFAOYSA-N 408.546 2.412 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 788773619 CDYZSIWMLWKGGH-MRXNPFEDSA-N 414.472 2.102 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C(=O)N1c1ccccc1 788911550 PHKXUXANRAJAGP-DYESRHJHSA-N 420.513 2.213 10 20 HECD CCS[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789812204 KJRHYSWUIXPKFH-SJORKVTESA-N 423.554 2.459 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OC)c(C)c1OC 797110178 XBUWUCSIIVYECP-LLVKDONJSA-N 418.446 2.118 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCOc3ccccc3)CC2)cc1 804317957 UGZXOFQESMNNKT-UHFFFAOYSA-N 411.502 2.318 10 20 HECD COC(=O)N1CCC(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 805831343 HCHCMHGQZFJUHE-UHFFFAOYSA-N 418.538 2.173 10 20 HECD COCc1cnc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 806597757 KVLSHEBEJPDLCK-CQSZACIVSA-N 403.508 2.313 10 20 HECD COC(=O)c1cc(CNCCCN2CCN(c3ccc(OC)cc3)CC2)cn1C 809603130 KMFSEMURMREMNU-UHFFFAOYSA-N 400.523 2.122 10 20 HECD CN1CC[C@@]2(CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 817043632 NTDSRYVJLFRXNB-LJQANCHMSA-N 421.544 2.422 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O 917355977 PRPWDEUEWHLVCC-UHFFFAOYSA-N 417.421 2.262 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C(F)(F)F 917835862 GGHJKJBAANFLJP-ZDUSSCGKSA-N 409.412 2.071 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1c(F)cccc1F 918438641 IXBNKOMNKNOPJK-UHFFFAOYSA-N 407.392 2.320 10 20 HECD COC(=O)c1ccc(F)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 920315498 GVWCHBCKRRMFCT-UHFFFAOYSA-N 422.478 2.270 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1Cc1ccccc1 1325382372 LQGASOCUXWSJIQ-OALUTQOASA-N 412.486 2.353 10 20 HECD CN1CCN(c2ccc(CNc3ccc([C@H]4CC(=O)NC(=O)N4)cc3)cc2F)CC1 1350294794 TZEDEARDWYLBCC-LJQANCHMSA-N 411.481 2.460 10 20 HECD O=C(Cc1cnc[nH]1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788550880 LAGVPHSIDNTBNZ-UHFFFAOYSA-N 407.430 2.206 10 20 HECD COc1ccc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796604866 SEGWNHZFIGGQFH-MUJYYYPQSA-N 411.458 2.375 10 20 HECD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(F)c1 1800384302 FYKJIQZGEVOTBZ-BTTYYORXSA-N 415.421 2.206 10 20 HECD CC(C)(C)CC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988304 XHBFBCYLJMPETG-UHFFFAOYSA-N 418.538 2.114 10 20 HECD O=C(C[C@H]1OCCc2ccccc21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249073 UAIIMHJXKMBQCC-GOSISDBHSA-N 423.469 2.014 10 20 HECD Cc1cc(C(=O)COC(=O)C2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1 14172074 ALPBCDPOIILBFW-UHFFFAOYSA-N 418.515 2.492 10 20 HECD Cc1ccc(C(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1F 53190809 RURSBXKYITUBKM-UHFFFAOYSA-N 412.509 2.274 10 20 HECD Cc1cc(O)c(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)cc1C 237224940 VCJQUWIRHSZSJN-UHFFFAOYSA-N 403.548 2.235 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc(-n4ccnn4)cc3)cc2)C1 727029841 CKSFBKBGIPDJFS-QGZVFWFLSA-N 419.489 2.291 10 20 HECD COc1cc(C(=O)NCC(=O)NCc2cccc(OC)c2O)ccc1OC(F)F 727761245 PQCVSFWVLDFPDO-UHFFFAOYSA-N 410.373 2.057 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC[C@H](CNS(C)(=O)=O)C3)cc2)CC1 731048349 JQMKNKDMEHSVKA-LJQANCHMSA-N 422.595 2.394 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(OCC(=O)NC(C)C)c(OC)c2)c1 734016359 LLQLWINXBMEWFK-UHFFFAOYSA-N 402.447 2.243 10 20 HECD CN1CCC(N2CC[C@@H](NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)C2)CC1 734281460 KXVGHJKJRDGKHL-CTNGQTDRSA-N 416.566 2.251 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1 741779717 TYPOHKCPWJGDKK-UHFFFAOYSA-N 410.518 2.425 10 20 HECD COCCCN(C)CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 743555269 UOPPIZLHSAAABK-IRXDYDNUSA-N 410.534 2.207 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 745786196 HPNLKNCQNWDMTB-UHFFFAOYSA-N 422.526 2.320 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(C)o1 746757668 QJHSACTYFWFOLU-MJGOQNOKSA-N 414.506 2.477 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cc(F)ccc4F)CC3)nc12 750072206 QCLARANOLMBQDE-UHFFFAOYSA-N 417.416 2.212 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCc2n[nH]cc2C1 751059716 FHOIXVCUNCUPAH-UHFFFAOYSA-N 404.473 2.176 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 752151692 LOLGMJRPSNNSSC-KRWDZBQOSA-N 418.515 2.478 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 753642684 FPRMENCFDBHPHY-BBRMVZONSA-N 424.453 2.234 10 20 HECD COC(=O)c1cc2c(cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)OCO2 753841075 KYAKAZOZGREXQA-GFCCVEGCSA-N 413.430 2.084 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCN(C)c3ccccc3)CC2)cc1 754031044 QKCZXLFQTSJDSX-QHCPKHFHSA-N 412.578 2.246 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc(OC)c1OC 760084192 LRUVZVQBSFYCEF-UHFFFAOYSA-N 416.434 2.165 10 20 HECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2=O)cc1 761121340 NJUWBUWMZXSHCJ-XLIONFOSSA-N 422.485 2.190 10 20 HECD C[C@H](CCS(C)(=O)=O)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 762106598 RACBIQHKEVQQDQ-CYBMUJFWSA-N 419.494 2.379 10 20 HECD C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)c1ccc(N2CCOCC2)cc1 765136303 LGANQWTVZIXXSU-QFBILLFUSA-N 419.522 2.336 10 20 HECD COC[C@H]1CCCCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 768662633 CWWYPBRIVIRAIG-VYENPZKTSA-N 415.534 2.175 10 20 HECD CCCn1cc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cn1 771054790 FLFFKUMLBVMZMQ-UHFFFAOYSA-N 410.478 2.243 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1 772017712 XCLTWWGKSRHIGX-LBPRGKRZSA-N 413.521 2.143 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCNS(=O)(=O)c1ccc(F)cc1 773739384 GQOKZKLKYSSEHE-ZDUSSCGKSA-N 410.467 2.043 10 20 HECD COc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1OCC(=O)NC(C)C 773764250 YRLWMLQBWGXRBA-CQSZACIVSA-N 416.474 2.371 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1 774363141 HYYPCMMGAHJZEF-UHFFFAOYSA-N 400.822 2.234 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)cc1 775220573 DAOZYAQQZLTHIB-UHFFFAOYSA-N 404.536 2.488 10 20 HECD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NCc3ccc(O)c(O)c3)nn2)CC1 778919940 QOQRLKYRINHYMZ-UHFFFAOYSA-N 417.466 2.191 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2N2CCCC2=O)cc1 784564775 SILUMCHBQRFROH-UHFFFAOYSA-N 411.458 2.440 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)cc1 787644085 ZSZPYTANDSSXQD-NRFANRHFSA-N 410.493 2.237 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788911743 QPZABHWSVNPHCX-GOSISDBHSA-N 415.534 2.341 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@H](C(F)(F)F)C2)cc1 788969081 YQISEUPVHDHSSD-XJKSGUPXSA-N 401.429 2.327 10 20 HECD C[C@@H](CN1CCOCC1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 789339292 BOTKPMMPJFESIQ-INIZCTEOSA-N 421.497 2.053 10 20 HECD CC1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793733309 MDHCYANMBSEVEW-GOSISDBHSA-N 414.550 2.043 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(Cl)c(-c4nn[nH]n4)c3)ccc21 799766244 RKIGIPLRQVBKEJ-UHFFFAOYSA-N 418.910 2.381 10 20 HECD CN(c1ccc(CNC(=O)NC2CC(NS(C)(=O)=O)C2)cc1)C1CCCCC1 801002796 QSCIORYIFJGXKH-UHFFFAOYSA-N 408.568 2.335 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCC12CCOCC2)c1ccc(N2CCOCC2)cc1 803304577 ZQYWQXUWLGCFLJ-FXAWDEMLSA-N 415.534 2.166 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1F 804853872 WQNTUTANJZXNAF-INIZCTEOSA-N 401.486 2.417 10 20 HECD CC(C)N(CCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 807667203 UWGWIUXMYSJPCB-UHFFFAOYSA-N 418.582 2.107 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1 810305566 ODUCWEHGBJJIAH-UHFFFAOYSA-N 404.488 2.312 10 20 HECD CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@@H]1CCOC1 812388510 DRRTVPCQHPUCME-HNNXBMFYSA-N 408.462 2.304 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn2ccnc12 815419840 DQBYXROYNZVOJO-MRXNPFEDSA-N 407.474 2.295 10 20 HECD CCOc1ccc(N2CCN(C(=O)CN(C)S(=O)(=O)c3ccccc3)CC2)cc1 1116351794 HUUUFIYGVQBKFZ-UHFFFAOYSA-N 417.531 2.055 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)nc1C 1842294998 FLVUJDYOHWHPGW-RMKNXTFCSA-N 423.469 2.346 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037765 TUTPREMTMNATCW-SBYGYFDASA-N 400.475 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3c(C)noc3C)CC2)cc1 7058511 MFKRSTGHFSTIFW-UHFFFAOYSA-N 401.463 2.125 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1 728942986 BICNQCJZFSWYPM-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H](C2OCCO2)C1 729597915 ULSQGNWJNKFHDT-INIZCTEOSA-N 407.486 2.081 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)Cn2ccccc2=O)NC(=O)OC(C)(C)C)cc1 742751084 RJTTZSTYXBKIDD-GOSISDBHSA-N 414.506 2.297 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 745935681 XHRHQSFOFSBGFK-UHFFFAOYSA-N 418.515 2.439 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 746497408 NFMUVNXGJNZGFK-UHFFFAOYSA-N 400.391 2.227 10 20 HECD Nc1c(C(=O)OCCn2cc([N+](=O)[O-])cn2)ccc2c1C(=O)c1ccccc1C2=O 748103840 ZXPXYWOQFHKNSI-UHFFFAOYSA-N 406.354 2.006 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3c(OC)cccc3OC)CC2)cc1F 753856535 CLTRRDWJWDGKHW-QGZVFWFLSA-N 420.481 2.413 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)c3nccs3)CC2)cc1 756688552 OSGWEOAJFKLRAL-PTZVLDCSSA-N 414.531 2.276 10 20 HECD CS(=O)(=O)Nc1ccc(CNC(=O)NCCCSc2nccs2)cc1 759549055 AXKURJAYQKRIFO-UHFFFAOYSA-N 400.551 2.496 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)c1 761981724 HSIZQASJRCZJEG-LLVKDONJSA-N 409.435 2.394 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3nc(C)c(C)s3)CC2)cc1 763596637 UGIJNAAYQARNSW-UHFFFAOYSA-N 417.579 2.432 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](CO)Cc1ccc(F)cc1 766762652 FNLWHHCMBJQYRV-SFHVURJKSA-N 405.445 2.204 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCc2c(F)cccc21 767105696 GWXAFZAEYSDWGZ-UHFFFAOYSA-N 403.479 2.333 10 20 HECD Cn1cc(C(=O)NCC2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC2)cn1 769230080 XWPNOGJIYAPXCH-UHFFFAOYSA-N 407.858 2.329 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CCO)c3ccco3)CC2)cc1 769497355 WTFMYTMZJKXBKR-HXUWFJFHSA-N 416.522 2.223 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccc(F)cc3)cc2)C1 770302726 YLHGKXVCMQMTJL-FXAWDEMLSA-N 414.481 2.060 10 20 HECD CS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771054756 WKLFOIWGBZBHRF-AWEZNQCLSA-N 412.895 2.437 10 20 HECD COc1ccc(N2CCN(CCNC(=O)/C=C\c3ccc(OC)c(O)c3)CC2)cc1 772510719 MUFKGDPTARZAFP-WMZJFQQLSA-N 411.502 2.361 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](CCO)CC(C)C)CC2)cc1 778324006 AQQDASWKYBXKJB-SGQUHAKNSA-N 417.550 2.061 10 20 HECD Cn1nnnc1Sc1ccc(Cl)cc1NS(=O)(=O)c1cccc2nonc12 778665459 GNPRTMOCXZIDNC-UHFFFAOYSA-N 423.867 2.352 10 20 HECD CC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407759 OVAMQSCUYMBAOK-UHFFFAOYSA-N 401.488 2.359 10 20 HECD C[C@@H](NS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 780849692 QOXRNGLGTHPELV-CQSZACIVSA-N 411.549 2.042 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)C2CN(C(=O)c3cccc(Cl)c3)C2)cc1 781520350 GGWRBXUWAJMCJG-UHFFFAOYSA-N 407.923 2.350 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cn(-c2ccccc2)nn1 783150202 BAHFNXFXYHJLCX-LBPRGKRZSA-N 402.432 2.262 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccc(C)cn3)CC2)cc1 789868528 ZNLFJFDRWNGWDX-KHPPLWFESA-N 408.502 2.262 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(Cl)ccc2Cl)ccc1O 790407769 QCCXCVSDLRXGJW-UHFFFAOYSA-N 411.288 2.408 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)CC3CCC3)CC2)cc1 792791260 IAKYYTQHZXXROH-LJQANCHMSA-N 404.555 2.058 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(F)cc1C 793050235 DBMYEMZMWSDZJK-LBPRGKRZSA-N 418.421 2.408 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1nccs1 793761037 INNQBISMLDVULX-UHFFFAOYSA-N 412.309 2.319 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCO[C@H](c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803296368 BNVMIZBIIOYBOV-GCJKJVERSA-N 423.513 2.301 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@H](c4ccccc4F)C3)ccc21 803687083 TXBQNDDYGKDRDL-OAQYLSRUSA-N 411.477 2.424 10 20 HECD COC[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807448611 UPQKYNALTGJHNU-WMLDXEAASA-N 413.465 2.160 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 808095163 UEPCEERSJBQKNN-NVXWUHKLSA-N 423.506 2.476 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CC(=O)NC(C)C)c([N+](=O)[O-])c1Br 836046375 TWOCCDPRSJCYPL-UHFFFAOYSA-N 405.205 2.235 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CC(=O)N(C)C2)c(C)n1-c1ccc2c(c1)OCCO2 914918560 BNELMAOHEDJADJ-HNNXBMFYSA-N 412.442 2.070 10 20 HECD CCOc1ccc(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)cc1 917906796 JOGJPBDVQIXWOH-UHFFFAOYSA-N 406.489 2.447 10 20 HECD C[C@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 1343430334 VYEPXHRUARUWBP-SFHVURJKSA-N 416.566 2.343 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2CC=CCC2)C1 1845126478 OUOPESWIESGIMX-KRWDZBQOSA-N 406.486 2.339 10 20 HECD CNC(=O)CC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845397995 NTSDUMYIVKGUGH-UHFFFAOYSA-N 408.502 2.047 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccnc2OC2CCCC2)c1 55249221 VHJVQXDPIBHYID-UHFFFAOYSA-N 405.476 2.410 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C/C=C/c4ccccc4)CC3)nc12 108065479 IKKDSEZOSDELKW-RMKNXTFCSA-N 421.501 2.443 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O 426867343 UKACWBDRVQUBDF-QFIPXVFZSA-N 414.506 2.369 10 20 HECD CNC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 732207611 ZTKZHMSHWNDGBA-GJZGRUSLSA-N 419.481 2.247 10 20 HECD O=C(NC[C@H](O)COc1ccc(I)cc1)c1cc(O)cs1 732284533 VPDMZMTYLZSMTB-NSHDSACASA-N 419.240 2.228 10 20 HECD COc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1NC(C)=O 743046307 AODHGZSVXSMNBS-UHFFFAOYSA-N 407.477 2.311 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn(C(C)(C)C)c3)CC2)cc1F 746436222 KKXWWHHRHCDJKJ-UHFFFAOYSA-N 403.458 2.073 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1ccccc1CN1CCOCC1 746492151 AGSPDCKJHBHLFW-UHFFFAOYSA-N 424.545 2.100 10 20 HECD CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1 749621539 DZTQLXSWODKMGF-UHFFFAOYSA-N 418.519 2.159 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 751566869 BIESJUUVHRTJJM-UHFFFAOYSA-N 417.531 2.060 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@]3(C)CCOC3)cc2F)C[C@@H](C)O1 755122715 ZZUBUICFLIDAQT-VTJXTGGHSA-N 408.470 2.025 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@](C)(O)C3CC3)cc2F)C[C@@H](C)O1 756331795 YYZAIZYNMIPGJU-HLFMIMNKSA-N 422.497 2.150 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1 756455467 JTRBEGVBZPTUAD-BBRMVZONSA-N 414.458 2.154 10 20 HECD O=C(NC[C@@H]1CCCS1(=O)=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765899450 NPZKKPWRTVAAAU-BBRMVZONSA-N 417.478 2.133 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)c1 770886360 VRSSCXJLBMPMSB-AWEZNQCLSA-N 418.393 2.246 10 20 HECD COC[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H](C)O1 784374183 XVVMFXBVZNXSOC-GJZGRUSLSA-N 408.454 2.136 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)CCN4C(C)=O)cc2)CC1 786259095 LQLHPJLLTOBFGM-UHFFFAOYSA-N 420.513 2.194 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H](Nc2ccccc2)C1 788318970 JRASJORQYXMXHG-NRFANRHFSA-N 422.529 2.243 10 20 HECD CCc1nc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)sc1C 789369788 DYEWYHKIDHHMTP-UHFFFAOYSA-N 406.483 2.245 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1nc2c(s1)CCC2 789378956 UIUWCNUPEMAOCR-UHFFFAOYSA-N 402.545 2.440 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCOC2(CCCC2)C1 789860170 ISZOOMFZRDKRLK-GOSISDBHSA-N 417.575 2.464 10 20 HECD CNC(=O)[C@@]1(C)CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 797466274 HVEWUZMFNFPVCV-VLIAUNLRSA-N 410.465 2.424 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC([C@@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 803308496 GFNAXBCIZOGLCP-UWJYYQICSA-N 415.534 2.118 10 20 HECD COC1CCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 803451458 LKJGPOPIOOIFIQ-UHFFFAOYSA-N 411.449 2.010 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3[C@H]3CCCO3)cc2)C1 806494721 VUSFPPJZIWSRRE-MISYRCLQSA-N 400.523 2.241 10 20 HECD Cc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807287692 MDTBQHHIQJPAPX-UHFFFAOYSA-N 418.541 2.332 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](N3CCCC3)[C@@H]2C)c1 808193792 XNUDVRQTZSUOBT-HTAPYJJXSA-N 401.551 2.486 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 809728766 HGUAQDJSYIGFOW-QFIPXVFZSA-N 412.509 2.007 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)NCCS(=O)(=O)N(C)C)cc2Cl)C1 811914821 UXQOZCXCLVKWTL-AWEZNQCLSA-N 416.975 2.267 10 20 HECD C[C@H](Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 864004604 OXHOTPKESYRSNB-ZDUSSCGKSA-N 406.464 2.252 10 20 HECD Cc1ccccc1OCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1328488793 IECIJQSVJVQFLG-UHFFFAOYSA-N 402.516 2.315 10 20 HECD CC(C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816771400 LQWLPNHZQRDVJK-CYBMUJFWSA-N 423.564 2.308 10 20 HECD CC1CCN(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1841502430 RKBNEBMZTQEOIF-UHFFFAOYSA-N 421.925 2.300 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C[C@@H]2OCCc3ccccc32)C1 1841553086 SMZCQUFHHFTYDC-SFHVURJKSA-N 423.469 2.014 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccccc3F)CC2)cc1 12069516 AXXYXWTYAGPRDD-UHFFFAOYSA-N 414.481 2.101 10 20 HECD COc1ccc(N2CCN(CCNC(=O)/C=C\c3ccc4c(c3)OCO4)CC2)cc1 213662672 USSNFZFNPOYNOZ-OQFOIZHKSA-N 409.486 2.376 10 20 HECD C[C@@H](OC(=O)Cc1cnn(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 726000190 PPMWOYNSLWGOTQ-CYBMUJFWSA-N 417.421 2.308 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(-n4cnnn4)cc3)cc2F)CC1 730134206 SFQULHYNXSMSIH-UHFFFAOYSA-N 424.484 2.265 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)cc1C(=O)N(C)C 734503663 VDQGCIRPVXRQAW-UHFFFAOYSA-N 405.520 2.250 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c1O 737283967 IVPBQSWUGNUFDZ-UHFFFAOYSA-N 421.881 2.250 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCCCSc2nccs2)ccc1OC 739957322 AJOIPRKBKXYTEZ-UHFFFAOYSA-N 402.519 2.399 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 744407095 KYWNTOBTYPORIV-QGZVFWFLSA-N 412.494 2.201 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCOC(C)(C)C3)CC2)cc1 754130072 DLQCTTMQGFBMKB-SFHVURJKSA-N 404.555 2.464 10 20 HECD C[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(Cl)c(Cl)c1O 756736364 FIXNOTZVSKAQSM-OLZOCXBDSA-N 402.322 2.283 10 20 HECD O=C(CN1CC[C@H](N2CCCC2=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 761121755 YWKRQDQAVMICQQ-HNNXBMFYSA-N 417.465 2.097 10 20 HECD Cc1cc(=O)n(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1[N+](=O)[O-] 761859643 CPIXLGDXBYWNQC-UHFFFAOYSA-N 417.377 2.479 10 20 HECD O=C(COC(=O)c1ccc(O)c(Cl)c1)NCc1ccc(N2CCOCC2)c(F)c1 762828455 DJWJKAFVWAHMHR-UHFFFAOYSA-N 422.840 2.495 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)c([N+](=O)[O-])cc1OC 766924517 FYXZPLVVJVZLPZ-IYBDPMFKSA-N 420.510 2.239 10 20 HECD C[C@@H](NC(=O)NCCCN1CCN(c2ncccn2)CC1)c1ccc(N(C)C)cc1 773136465 IIHIEOAETVKVQH-GOSISDBHSA-N 411.554 2.115 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 773740190 OHOXRZYNXLSAPO-CJNGLKHVSA-N 412.442 2.179 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4ccccn4)n3)cc2F)C[C@H](C)O1 776293683 YINFREQLFKWMLA-HOTGVXAUSA-N 424.480 2.409 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3[nH]2)cc1F 779627774 NPCLMMIYRKRQJC-RTBURBONSA-N 400.454 2.259 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 785870102 NEZBIQOBZRCRSZ-QZTJIDSGSA-N 418.582 2.105 10 20 HECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cn2)n1 787490522 RGHWCZOFBQFRTF-QGZVFWFLSA-N 420.517 2.444 10 20 HECD CC[S@](=O)CC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787947712 HCXKQIDDCHBYLI-AOAWJKDVSA-N 413.451 2.101 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(N2CCCC2=O)c1 788223927 LKTNCPMLAUEBFQ-UHFFFAOYSA-N 408.502 2.154 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1 789462524 GZEATRFPJMBTSE-LBPRGKRZSA-N 415.446 2.103 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 789662403 WEDYOVGOEPUUHY-NRFANRHFSA-N 408.546 2.458 10 20 HECD CCc1nc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 789800387 OHERNNSWYFQGSS-CYBMUJFWSA-N 420.510 2.175 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCn4cnnc4[C@@H]3C)cc2F)C[C@@H](C)O1 790220485 WFLLYGAJMJRARP-ZNMIVQPWSA-N 402.474 2.317 10 20 HECD COc1ccc(CNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c(O)c1 792793098 CKGSJHMWLTXQSG-KRWDZBQOSA-N 404.536 2.250 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(c4c[nH]nc4C)CC3)CC2)cc1 792925181 IRPHLHUCDHMVCU-NRFANRHFSA-N 413.566 2.089 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(Cl)n1 792966638 ORFJKHPCVSUBGM-UHFFFAOYSA-N 406.845 2.090 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(N3CCc4ccccc43)CC2)c1 800581478 IOZZHKZUBWJNCO-UHFFFAOYSA-N 415.515 2.431 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H]1C 803310481 KLXUPOQGMLLRGX-UEXGIBASSA-N 416.566 2.032 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1 806179656 UIOQPMGNSPAKFV-MOPGFXCFSA-N 416.566 2.254 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3c(C)noc3C)CC2)cc1 806386291 JFZDHWDZCIBTOS-AWEZNQCLSA-N 400.479 2.216 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(C(N)=O)c(Cl)n3)cc2F)CC1 806810199 QETXDAXVWGIYHL-UHFFFAOYSA-N 419.888 2.045 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCSC[C@H]1c1nccs1 807095981 GHMJORCEKOXECD-INIZCTEOSA-N 404.561 2.450 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCO[C@H](C)C1 807925918 CABYFCJXGBISPE-LJQANCHMSA-N 418.582 2.107 10 20 HECD Cc1nc(N2CCOCC2)sc1-c1nnc(N(C)Cc2ccccc2O)n1C 809868227 BWGHLJLLPAWONR-UHFFFAOYSA-N 400.508 2.426 10 20 HECD COC(=O)[C@@H]1[C@H]2CN(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C[C@H]21 813662200 VHUWONVMCZRJBM-VZEFYGNVSA-N 409.433 2.317 10 20 HECD N=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1ccccn1 849063319 BZSVIFMDBSCNFJ-UHFFFAOYSA-N 406.469 2.474 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN2CCCN(c3ccc(OC)cc3)CC2)cc1 917017613 UZDMHFQXMUMLQS-HXUWFJFHSA-N 414.502 2.434 10 20 HECD Cc1cccc(NC(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918672887 MILVLDJVFIHHGL-GOSISDBHSA-N 423.517 2.135 10 20 HECD COCCN1C(=O)/C(=C/Nc2ccc(Br)cc2Cl)C(=O)NC1=S 920978884 LYDWETJBOQDSMM-VQHVLOKHSA-N 418.700 2.288 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)[C@H](C)c1ccc(C)cc1 1324120575 FYAZZDOETWYCLQ-LIVBEALHSA-N 401.459 2.161 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cncnc1 1800715796 PEFDFJQOZZVEON-BTTYYORXSA-N 402.838 2.107 10 20 HECD CCN(C)[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718724 AIYLTLOLNYERKG-MHEUCROKSA-N 409.914 2.343 10 20 HECD Cc1nccn1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1801350556 DILRBCMAQHZDOY-QDMKHBRRSA-N 418.881 2.208 10 20 HECD Cc1cnoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428370 PMEJIDMIXAKQKT-INIZCTEOSA-N 414.462 2.336 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)/C=C/c2cccnc2)C1 1842085459 MRLKNLGYICEIIB-HNJDCKIISA-N 421.453 2.128 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccccc2)C1 1844848896 CCDPFUZCNCNSTN-UHFFFAOYSA-N 402.454 2.297 10 20 HECD O=C(/C=C/C1CCCCC1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054843 UOWSFSJCOQAFHH-BQYQJAHWSA-N 421.588 2.187 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccc(F)cc3)CC2)cc1 12069053 MBPUXGDTHKILMN-UHFFFAOYSA-N 421.538 2.466 10 20 HECD C[C@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 65277629 PFYXNYQMJZCRQJ-HNNXBMFYSA-N 415.515 2.447 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)nc3sccn23)cc1 325136217 SGDVCIYEIIHYKP-UHFFFAOYSA-N 406.898 2.222 10 20 HECD CCn1cc(-c2noc(-c3ccc(NC(=O)C4=S=CC=C4)c(C)c3)n2)c(O)nc1=O 563292298 IQGRIHBBZNFGTN-UHFFFAOYSA-N 423.454 2.210 10 20 HECD O=C1c2ccccc2C(=O)N1CCC1=CCN(c2cc(-n3ccnc3)ncn2)CC1 684598484 ZUZGDLDEELSJMV-UHFFFAOYSA-N 400.442 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)NCc3ccc(Cl)cc3)CC2)cc1 727364096 LWJPWKFWYPJNJN-UHFFFAOYSA-N 416.909 2.497 10 20 HECD Cc1ccc(N2CCC[C@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1 743718438 PAUGJYYVLFMLGD-INIZCTEOSA-N 403.504 2.471 10 20 HECD C[C@@]1(c2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)NC(=O)NC1=O 748024620 SXGZWXGKBAHFIH-QFIPXVFZSA-N 424.526 2.224 10 20 HECD Cn1cc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc1Cl 751359840 KWUNQMCUZLKXLJ-CYBMUJFWSA-N 419.334 2.375 10 20 HECD O=C(NCC(F)F)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 752807751 MSVIBLKCMDKQBA-UHFFFAOYSA-N 401.347 2.096 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC([C@]3(C)NC(=O)NC3=O)CC2)cc1F 754377024 WEMVCHDYEWAWKX-NRFANRHFSA-N 419.501 2.192 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 755125324 BWNKNSUQSPWBOK-ZULIPRJHSA-N 410.518 2.139 10 20 HECD C[C@@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)c(F)cc1O 756635099 PMXZZWTTZIGCLH-SECBINFHSA-N 422.276 2.052 10 20 HECD COCCc1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758225090 SLBJIIICEUQKBY-OAQYLSRUSA-N 400.519 2.446 10 20 HECD COC1CCC(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 758607053 HQZXEAISGCVGJB-UHFFFAOYSA-N 422.497 2.417 10 20 HECD CC[C@@]1(C)NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 761116404 CDIRFHKDUSJXAL-OAQYLSRUSA-N 412.469 2.163 10 20 HECD C[C@H](NC(=O)N[C@H]1CS(=O)(=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 763021923 YMARWZAESOOQGC-KXBFYZLASA-N 415.515 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)N3CCc4c(F)cccc43)CC2)cc1F 763422993 YUDVVAKQBHWEKD-UHFFFAOYSA-N 401.413 2.211 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 769395359 GOSVTNPTJZCOLP-KRWDZBQOSA-N 409.552 2.020 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCC(=O)c3ccccn3)CC2)cc1 771103979 LRIOGZAYXFVTKM-UHFFFAOYSA-N 410.518 2.382 10 20 HECD CNC(=O)COc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 772067939 FSNGSIXGSBXFMS-QGZVFWFLSA-N 411.502 2.068 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 772106264 IVQHSGNNPXTXRU-UHFFFAOYSA-N 419.501 2.091 10 20 HECD C[C@H](NC(=O)NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773615949 ZXDQSRXJSRMUCG-XJKSGUPXSA-N 411.549 2.009 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 773749518 QJKXODWLWDFRQF-AWEZNQCLSA-N 404.488 2.243 10 20 HECD C[C@@H](NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(S(N)(=O)=O)c1 774390753 DHSFFXWPGJYDHO-MRXNPFEDSA-N 403.548 2.394 10 20 HECD C[C@H](NCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 775836098 ZAOCAYKFTSNJAR-SFHVURJKSA-N 424.545 2.192 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 776074391 XUHIZMMQKMLEBS-WIYYLYMNSA-N 423.579 2.411 10 20 HECD CN(c1ccc(CNC(=O)c2ccnc(S(N)(=O)=O)c2)cc1)C1CCCCC1 776342350 BIKWJAOJXBLTCY-UHFFFAOYSA-N 402.520 2.428 10 20 HECD CC[C@@H](CSC)N(C)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778420195 RXQGQHUIQHYLBM-DVQDXYAYSA-N 405.564 2.500 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1 779473174 JZGXTYGUGXZVRG-VQHVLOKHSA-N 401.444 2.220 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)NCC(=O)Nc2c(C)cccc2C)c(O)c1O 785274307 QSGRPYILPROAER-AWEZNQCLSA-N 400.431 2.323 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OC(C)C)c(C)c2)ccc1O 790406741 GHLPDZXYOUFXTC-UHFFFAOYSA-N 414.505 2.197 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 793745678 XKYUUVKWEZOCGX-KRWDZBQOSA-N 416.566 2.080 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@@H](C(N)=O)O3)cc2Cl)C1 799949890 CAPXXMDUFPMSTL-XUWXXGDYSA-N 408.930 2.408 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCOC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803299332 JJFWANKDMRFCPX-HKUYNNGSSA-N 415.534 2.308 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(Oc3ncccc3F)CC2)cc1F 803661745 LLNLFGOBKUFCIU-UHFFFAOYSA-N 418.444 2.112 10 20 HECD CCN1CCCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 803677019 CRHJMNKYWRBZCZ-UHFFFAOYSA-N 414.550 2.153 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CSc2ccccc21 806154018 ZVZMBGKSYLXNCF-IBGZPJMESA-N 411.527 2.445 10 20 HECD CNC(=O)C[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)c1ccccc1 807733468 VHMJPQZJUPRZDE-NRFANRHFSA-N 424.545 2.483 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)C[C@H](O)C3CC3)cc2Cl)C1 807957023 VRKFJBNIZCMKFC-LIRRHRJNSA-N 407.942 2.422 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCCC(F)(F)C1 809763018 HQERWOKHBYSTQW-KRWDZBQOSA-N 409.477 2.423 10 20 HECD COc1ccc(N2CCN(CCNC(=N)N[C@@H]3CCOc4ccccc43)CC2)cc1 849091225 LZCNPGAZHXVJPB-OAQYLSRUSA-N 409.534 2.455 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCOCC(F)(F)F)cc2)C1 918123258 SAMKTDYZTUHNHV-HNNXBMFYSA-N 416.444 2.157 10 20 HECD O=C(NCc1ccnc(-n2cccn2)c1)NCc1ccc(N2CCOCC2)c(F)c1 918204929 VJEHNDYLIKGHPK-UHFFFAOYSA-N 410.453 2.242 10 20 HECD NC(=O)COc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 918293703 DHXNBATUJPRSCS-UHFFFAOYSA-N 423.425 2.017 10 20 HECD Cc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283392 UBTKKOIGAIWWPQ-FJXIAYRNSA-N 423.469 2.472 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848509 NRMNNIDPWQRJNW-MYFIVHGGSA-N 423.832 2.446 10 20 HECD Cc1cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c2[nH]1 1843736421 PSCLTEZOXXOEIV-UHFFFAOYSA-N 406.442 2.413 10 20 HECD CCOC(=O)c1cnc(SCC(=O)N(C)Cc2ccc(N(C)C)cc2)nc1N 7095397 BAUKCNJXLSNYOD-UHFFFAOYSA-N 403.508 2.052 10 20 HECD CC(=O)N1c2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc2C[C@@H]1C 23398288 SMIRYVJQTFJSIB-LBPRGKRZSA-N 423.516 2.156 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(F)cc2Cl)cc1 109410728 ZZJIUZHRMFGMQE-UHFFFAOYSA-N 422.843 2.350 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)CN(Cc2ccccc2O)C2CCCC2)c1 731847452 KXTASYVCYJCPFV-UHFFFAOYSA-N 403.504 2.423 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)N1CCc2ccccc2C1 731864782 DMSDDIUVMNDHEC-UHFFFAOYSA-N 422.529 2.250 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1 737116129 CNFXARGBQSUULQ-UHFFFAOYSA-N 410.453 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)CC(C)(C)C)cc2F)C[C@@H](C)O1 751767477 VJHQRMDLFKGIHK-KHYOSLBOSA-N 424.513 2.396 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)N(C)Cc3ccc(N(C)C)cc3)C2)nc1 753279444 LFDNAPFESYJCPQ-UHFFFAOYSA-N 411.506 2.355 10 20 HECD Cc1oc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1S(=O)(=O)N(C)C 754013920 JMBORKUEMKZMLH-MRXNPFEDSA-N 422.503 2.365 10 20 HECD C[C@@H](NC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 756812674 OPKUMPIIBDVGBC-OSPHWJPCSA-N 423.513 2.107 10 20 HECD COc1cc(Cl)cc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1O 761192659 XIKWJEXBQCVKBQ-UHFFFAOYSA-N 421.906 2.321 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1csc(S(C)(=O)=O)c1 767052160 FZGWQYQLWNHJGZ-UHFFFAOYSA-N 410.517 2.033 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@@H]2CCNS(C)(=O)=O)c1O 768437714 DQGUGKYTPQXEBA-CQSZACIVSA-N 421.357 2.457 10 20 HECD COC(=O)C1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCC1 769716404 IXEAPSJVHYWWNY-UHFFFAOYSA-N 424.500 2.470 10 20 HECD Cc1cc(C(=O)NN2CC(=O)N(C)C2=O)c(C)n1-c1cccc(Br)c1 770451486 DCFLLXKSWLZKHF-UHFFFAOYSA-N 405.252 2.395 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCN(Cc2ccccc2)CC1 774538966 DHPGHKWCHMRAFN-UHFFFAOYSA-N 408.546 2.458 10 20 HECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCCCSc1nccs1 775202532 POMXHIUQYKNMPD-UHFFFAOYSA-N 400.551 2.081 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCC(C(=O)NCCC(C)C)CC2)c1 775372824 JSXRTQVLWKPIBN-MRXNPFEDSA-N 405.539 2.452 10 20 HECD COC(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 775665432 BCAYLRYBSKFECB-GOSISDBHSA-N 409.486 2.034 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1cccc(C(N)=O)c1 777827502 ARAMULLYFGZDMN-UHFFFAOYSA-N 420.849 2.115 10 20 HECD CNC(=O)[C@@H]1CN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CCO1 781547352 MXYBRUNKJBAWES-OALUTQOASA-N 421.457 2.181 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](CC3CCC3)NC(C)=O)CC2)cc1 782051613 DHEYMOBEILAIKC-JOCHJYFZSA-N 416.566 2.018 10 20 HECD Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)nnn1Cc1ccc(F)cc1F 784939690 VTQWERFQCXZLMJ-UHFFFAOYSA-N 403.341 2.364 10 20 HECD CC(C)CNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785298751 WVFOUANCOMJGJI-AWEZNQCLSA-N 413.474 2.170 10 20 HECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934707 YIVGSVCNOHCJRQ-GDLZYMKVSA-N 413.543 2.299 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC[C@@H]1c1ccco1 789864758 QWHLTMUORWZMRX-GOSISDBHSA-N 415.515 2.049 10 20 HECD COc1ccc(CNC(=O)[C@@H](CCSC)NC(=O)Cc2ccccc2)c(O)c1 794390041 FPIALJGRUQJCQK-GOSISDBHSA-N 402.516 2.498 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1C(N)=O 796769676 ULPOZPDDNHGZST-UHFFFAOYSA-N 416.453 2.033 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(NCC2CC2)nc1 800689730 VBYLSLUGKVHRHR-UHFFFAOYSA-N 414.531 2.068 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCC12CCOCC2)c1ccc(N2CCOCC2)cc1 803304579 ZQYWQXUWLGCFLJ-XLIONFOSSA-N 415.534 2.166 10 20 HECD COC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 803451304 JBONFKRUTOOUCZ-KRWDZBQOSA-N 413.465 2.160 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1cc(Br)cn1C 807099429 VIZOGYHTMIJKHU-UHFFFAOYSA-N 421.339 2.437 10 20 HECD CN(Cc1nc(O)c2sccc2n1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288735 ZUYYSKGARDTFOB-UHFFFAOYSA-N 423.498 2.048 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccc(N(C)C)cc1 807674998 SKMAAQXBUMPBNZ-WBVHZDCISA-N 405.564 2.491 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cc3n(n2)CCO3)NC(=O)OC(C)(C)C)cc1 810447829 RRELDKZSTUISHC-KRWDZBQOSA-N 415.494 2.337 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C3CC3)C(C)(C)CO)cc2F)C[C@@H](C)O1 815248531 CETSZNFHZPRHHO-ZMPRRUGASA-N 421.557 2.442 10 20 HECD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 912558222 MYJGCLPPBWCIOM-UHFFFAOYSA-N 423.432 2.337 10 20 HECD CCC(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 914671622 AGXKTHCWRMBYDZ-STQMWFEESA-N 422.437 2.247 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(Cn4cccn4)o3)cc2)C1 917834931 UQUFHMBZUPVSPZ-QGZVFWFLSA-N 407.474 2.156 10 20 HECD CC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497193 SCTCQOWWMYBVTF-GFCCVEGCSA-N 423.564 2.308 10 20 HECD O=C([C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424843 PSJZUROQBSCXKY-ZWKOTPCHSA-N 417.506 2.295 10 20 HECD COCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877216 AWUSQZUABYUFEK-DBWMJRBXSA-N 418.490 2.083 10 20 HECD O=C([C@@H]1[C@H]2C=CS[C@H]21)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502109 PWVUEXHBMCGTCJ-DJSGYFEHSA-N 406.891 2.443 10 20 HECD C[C@@H](NC(=O)CNC(=O)c1cc(F)cc(F)c1)c1ccc(N2CCOCC2)cc1 109190223 YAOHSBUFOFCRIX-CQSZACIVSA-N 403.429 2.409 10 20 HECD CCC(CC)N1C[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1=O 729328862 WTSWXHBGNPJAGL-ZWKOTPCHSA-N 414.550 2.042 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 730808974 UVUYSFGWHGZXMH-SCTDSRPQSA-N 407.530 2.414 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1 730838285 PYPAEPACHWVVNK-HNNXBMFYSA-N 418.393 2.246 10 20 HECD Cc1ccc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1C(N)=O 732619603 ZBLXCHYPLYOFCV-UHFFFAOYSA-N 412.471 2.015 10 20 HECD CCn1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 733925454 WGGFWALDMWUAJT-UHFFFAOYSA-N 409.469 2.089 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1 734072474 BMXHHOGUFCEDAG-HNNXBMFYSA-N 413.474 2.049 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC3CCOCC3)cc2F)C[C@H](C)O1 735358681 BSHZUAOYGUXEHQ-HOTGVXAUSA-N 422.497 2.415 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4ccc(C)cc4)nn3)CC2)cc1 742920478 QNKZPJMGHQSACB-UHFFFAOYSA-N 420.517 2.136 10 20 HECD CCN(C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)CC(F)(F)F 747943393 HUJSIOZVBFVZMG-LBPRGKRZSA-N 423.457 2.110 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)C4)cc2F)C[C@@H](C)O1 752005807 UUXQQBHUTVVIML-HZPDHXFCSA-N 418.513 2.251 10 20 HECD O=C(COC(=O)CCc1ccncn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 755635486 NPGBRSWBQZMMAL-UHFFFAOYSA-N 415.405 2.367 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)C2CC2)cc1 756094407 KUXVIWPXSUAJLU-USNOLKROSA-N 422.529 2.234 10 20 HECD COc1cc(CN2CC[C@H](NC(=O)NCc3cccc(OC)c3O)C2)cc(OC)c1 756105307 ZMQQGTNYBOHGOC-KRWDZBQOSA-N 415.490 2.492 10 20 HECD O=C([C@H]1CN(C(=O)/C=C\c2ccc(Cl)nc2)c2ccccc2O1)N1CCOCC1 759778315 AVTWDCTVUCBSHC-XOWYPZSQSA-N 413.861 2.401 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCN(C[C@@H]2CCCO2)CC1 761003955 LCZMKOWACSSRQZ-KRWDZBQOSA-N 407.898 2.453 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@H]3C3CC3)cc2F)C[C@@H](C)O1 761127379 SMPIABAWOJSLTG-ZOCZFRKYSA-N 405.514 2.166 10 20 HECD Cc1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1S(N)(=O)=O 767382692 USQRNDIFCXITNU-UHFFFAOYSA-N 416.547 2.425 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)COc3ccc(C)cc3)CC2)cc1OC 768445901 VLQXXNNVIKMHGS-UHFFFAOYSA-N 400.475 2.441 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(=O)oc4cccnc43)cc2F)C[C@@H](C)O1 768518104 NDFCYECBJUZNIE-OKILXGFUSA-N 414.437 2.059 10 20 HECD CC(C)c1[nH]nc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 771292928 GUMIILWLUPKCHL-AWEZNQCLSA-N 414.466 2.073 10 20 HECD Cn1cc(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccc(F)cc21 771558473 AFSRKIJVQUNLQR-UHFFFAOYSA-N 405.451 2.367 10 20 HECD CNC(=O)CCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773847679 SAOSRCOFNRCBEY-HNNXBMFYSA-N 412.490 2.083 10 20 HECD CN(CCS(C)(=O)=O)Cc1cc(Br)cc(Br)c1O 775651820 QNHSUCNIYLAIKP-UHFFFAOYSA-N 401.120 2.394 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)n(C)c1 779360776 OLXPJJQNQJPJBB-UHFFFAOYSA-N 424.486 2.237 10 20 HECD Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781965970 NWWJWIQCULODTM-UHFFFAOYSA-N 411.506 2.169 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](O)C(C)(C)C3)cc2F)C[C@@H](C)O1 782583857 OJUNMDYCYQGCDY-QINHECLXSA-N 407.530 2.148 10 20 HECD C[C@@H](C[S@@](C)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 784212577 HPWQKRWFUXHCAX-BIXPNRAVSA-N 407.458 2.108 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)cc1 785422120 ISBDBXVXUWWNDB-OAQYLSRUSA-N 413.493 2.480 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCOc1ccccc1)c1ccc(N2CCOCC2)cc1 785589180 UOVSOQVJYCJRDO-GOSISDBHSA-N 411.502 2.286 10 20 HECD COCc1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 787519336 MIIVPDOEFOEWGI-HXUWFJFHSA-N 412.486 2.363 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(Oc3cnccn3)CC2)cc1 788954841 QJHKTCZGBAXRQF-UHFFFAOYSA-N 411.506 2.009 10 20 HECD COc1cc(Br)cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)c1O 789768771 ICEHXDKLQSGQCW-CQSZACIVSA-N 419.341 2.163 10 20 HECD Cc1cc(F)ccc1CN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789812757 OOCHDTCMXWSFAG-UHFFFAOYSA-N 417.456 2.385 10 20 HECD CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C(C)(C)O1 789862909 YHKPNBALFCYPMN-KRWDZBQOSA-N 405.564 2.318 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1c1ccncc1)c1ccc(N2CCOCC2)cc1 803300623 VBGZRNATNQPNGX-LAUBAEHRSA-N 408.502 2.459 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(C)[C@H]3c3ccccc3)ccc21 803686565 DTISPHLEUDPNJA-UNMCSNQZSA-N 406.530 2.247 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCC3(O)CCOCC3)cc2F)C[C@@H](C)O1 804969506 QRGMWNMGWYZDRL-IYBDPMFKSA-N 409.502 2.170 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805023513 IIMUFMDCWDITKO-IBGZPJMESA-N 415.534 2.341 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCN(C)C[C@H]3C)cc2)CC1 805025665 SVVOAEKRLGXKNN-NQIIRXRSSA-N 400.567 2.338 10 20 HECD Cc1noc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 806493929 ITJCRXXUHLCHIQ-AEFFLSMTSA-N 412.494 2.126 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c[nH]nc4c3)cc2)C1 806494957 ZBHNDYSWGIGHQX-IBGZPJMESA-N 420.517 2.307 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC2(CCC2)C1 807771936 ZGPODWRBVUIMEL-HNNXBMFYSA-N 423.460 2.155 10 20 HECD CCCCN(CC)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856270 QLUXUECMGDTBBW-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COc1ccc(S(=O)(=O)NC2CC2)cc1NCc1cc(OC)c(OC)cc1O 809682103 CUCXSSXMTVQPPE-UHFFFAOYSA-N 408.476 2.471 10 20 HECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 809785877 GIIAJMABCXNLSN-CYBMUJFWSA-N 415.512 2.191 10 20 HECD CCCC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 919971047 HGEXXJHHGHXARJ-QGZVFWFLSA-N 405.514 2.442 10 20 HECD C[C@H](NC(=O)N1CCN(C[C@@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 920921585 MOTYTBBNJVZTSO-RXVVDRJESA-N 402.539 2.090 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3nnn(Cc4cc(C)no4)c3C)CC2)cc1 1117755302 LWGCICXCGODVHH-UHFFFAOYSA-N 410.478 2.292 10 20 HECD Cc1ncnc(O)c1CCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1317921150 STINNCYGFPJBNR-ZIAGYGMSSA-N 402.470 2.492 10 20 HECD CN1CCCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793143892 IOTJJQUPNJWBPF-IVSAIRAKSA-N 421.925 2.487 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2cccc(F)c2)CC1 1848041232 LNPMDRADEIFQOW-IRXDYDNUSA-N 411.433 2.179 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1csc(N2CCCC2=O)n1 16134945 SXDXIVOPSWZCSC-UHFFFAOYSA-N 414.531 2.308 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1cccc(S(N)(=O)=O)c1 729231673 WZSXIFCYMCQIGB-QGZVFWFLSA-N 408.499 2.490 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)cc2F)CC1 730194248 CRQPQYGIOKBWGR-SFHVURJKSA-N 416.541 2.375 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@@H]2[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730261359 IGXLDLGGISUFHS-OXQOHEQNSA-N 419.547 2.160 10 20 HECD CN(C)c1ccc(CN(C(=O)NCc2cc(S(N)(=O)=O)ccc2F)C2CC2)cc1 734673894 OOSXLJBHFKPVJX-UHFFFAOYSA-N 420.510 2.413 10 20 HECD O=C(CC1(N2CCOCC2)CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 736004853 WBEBEJLVBWQJEQ-UHFFFAOYSA-N 405.514 2.314 10 20 HECD CN(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)Cc1ccc(N2CCOCC2)cc1 741733171 HERBMOFBAXNXRZ-UHFFFAOYSA-N 410.518 2.296 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3COc4ccccc4C3)CC2)cc1 742939909 LOUPUIHEWGSAPC-LJQANCHMSA-N 424.545 2.368 10 20 HECD COC(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 743719921 AKLGUGVJRHSWMC-UHFFFAOYSA-N 423.447 2.256 10 20 HECD CN(C)CCN1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1=O 746118139 RRALOMVQHLJQBW-IBGZPJMESA-N 412.534 2.285 10 20 HECD C[C@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 747502757 ZMXUFSSJDOKKLF-SFHVURJKSA-N 402.539 2.090 10 20 HECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC1 751063523 BMWLXWDAGWGFSW-CYBMUJFWSA-N 409.533 2.469 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)c1 751355740 HQTQSJJDVSHIKF-UHFFFAOYSA-N 410.517 2.173 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC[C@@H]1COc2ccccc2O1 756336813 QTJLKBPUOOSTEA-RTBURBONSA-N 412.486 2.329 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1cn2c(n1)SCC2 767942180 OXNHNIRPUYOAQX-UHFFFAOYSA-N 401.536 2.210 10 20 HECD CN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C(C)(C)C1 770156059 FXXFCCVISZWQHB-UHFFFAOYSA-N 409.533 2.421 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772714164 NFLVUKBPMISTGP-UXHICEINSA-N 424.563 2.047 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 774357689 XTCKQKNZGZIZPX-HUUCEWRRSA-N 413.474 2.009 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN(C)c3ccccc3)CC2)cc1 774990837 ZAZFHHKUMDPHIG-UHFFFAOYSA-N 424.545 2.423 10 20 HECD C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(N2CCN(C)CC2)cc1 775644701 ROEGUTHSZPVVJH-QGZVFWFLSA-N 402.564 2.279 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC3(CO)CCCCC3)cc2F)C[C@@H](C)O1 776592060 XTUSZAGMCLOEIK-IAGOWNOFSA-N 407.530 2.340 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CSc3ccncc3)CC2)cc1 779108480 ZKBFQPMMIRXWTC-UHFFFAOYSA-N 401.488 2.074 10 20 HECD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 779498926 GUPRCOGDLZIVJF-SOFGYWHQSA-N 405.495 2.170 10 20 HECD CNC(=O)CCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781230713 VAERGEUVRZIREG-CYBMUJFWSA-N 422.437 2.249 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2c(F)cccc2F)N(C)C)cc1 785425203 YDAFJLSOFBZXAM-GOSISDBHSA-N 404.461 2.066 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccsc1 787322220 JCCVTVMNVKSEGS-UHFFFAOYSA-N 412.559 2.213 10 20 HECD Cc1ccccc1C1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788318914 JJNBIACBICSVHI-UHFFFAOYSA-N 407.514 2.296 10 20 HECD CCc1cnccc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799554 JEWADYJNYUZUDL-HNNXBMFYSA-N 414.481 2.113 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)Nc2ccc(O)cc2SC)c1 792703593 ZPFCEJJWVKOLAU-UHFFFAOYSA-N 411.457 2.488 10 20 HECD COc1ccc(CNC(=O)CS(=O)(=O)c2cccc(Br)c2)c(O)c1 794376658 HXMTYMHUROWYMV-UHFFFAOYSA-N 414.277 2.253 10 20 HECD COC(=O)[C@]1(C(F)(F)F)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 796289787 XSLXFZIFWCUWNA-SFHVURJKSA-N 401.429 2.138 10 20 HECD Cc1noc(C)c1C(C)(C)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796664428 WWIYFFFLGLAXPA-UHFFFAOYSA-N 404.486 2.408 10 20 HECD O=C(NC[C@H](CO)[C@H]1CCOC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 797466762 QTAPMTHDBWZIJL-ARFHVFGLSA-N 413.465 2.201 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](Oc3ncccc3F)C2)cc1F 803664935 UDIUULNSPSQGBZ-OAHLLOKOSA-N 418.444 2.112 10 20 HECD CSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807053185 KUSMKAQXNDGCDG-KRWDZBQOSA-N 418.607 2.093 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1 807100431 MYJQEZQJMFWLGE-UHFFFAOYSA-N 418.538 2.193 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N[C@@H]1CCCOCC1 807562629 RAWMDOXLGTWWQB-CABCVRRESA-N 411.449 2.058 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 807674528 MKRIMPAUVRNUJS-ZIAGYGMSSA-N 403.483 2.069 10 20 HECD CC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C1CCOCC1 807982580 GBDCIUINTSNZFQ-RBUKOAKNSA-N 404.507 2.221 10 20 HECD CCN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 808284252 MHXRKMVYWSUHAX-UHFFFAOYSA-N 417.531 2.094 10 20 HECD CC(C)(C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 811156814 RZLFJQXYCQAWMG-CSKARUKUSA-N 409.394 2.298 10 20 HECD Cn1c(=O)nc(O)c2c(C(=O)NCc3ccc(N4CCCC4)cc3)cc(C3CC3)nc21 915198957 XXGHNOLFEFMEKT-UHFFFAOYSA-N 419.485 2.442 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCC4)C3)cc2)C1 918122419 KRHMKKZSPLLHNA-TZIWHRDSSA-N 413.566 2.158 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNc3cnccn3)cc2F)C[C@@H](C)O1 918211378 LTFLIYMKSTYWGT-GASCZTMLSA-N 402.474 2.141 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1 918369825 VUMHRANGAMCAII-UHFFFAOYSA-N 403.504 2.419 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CCCN2c2ccccc21 920195598 WEUOYYZQDBKAPD-HXUWFJFHSA-N 420.513 2.155 10 20 HECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C/c1ccc(O)c(O)c1 1179682972 GGSPJOXGIOQJNA-HEWZJLJBSA-N 420.462 2.122 10 20 HECD Cc1csc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804334530 NRWAGNJKKAMJDH-CLLJXQQHSA-N 423.585 2.169 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1cc(O)nc(O)c1 1817848592 ROIRQMJBQMFPCN-UONOGXRCSA-N 417.491 2.417 10 20 HECD O=C(c1ccc([N+](=O)[O-])o1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500394 XBBUWWFEAIYMLS-UHFFFAOYSA-N 421.793 2.383 10 20 HECD Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)on1 1848103343 URRYECCUBXCCIU-GJZGRUSLSA-N 405.838 2.106 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(c3ncnc4sccc34)CC2)cc1 97131677 JHTLKDWHHBRIDP-UHFFFAOYSA-N 410.547 2.196 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2C(=O)OC)cc1 139804753 UBJKDPYTMJAHPZ-UHFFFAOYSA-N 412.489 2.426 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c(O)c1O 727004956 ABSCZXPWIOHNHZ-NSHDSACASA-N 416.386 2.071 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1 728946068 XXHXWENEJWNRLA-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD C[C@@H]1Oc2c(cccc2C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)NC1=O 729742449 QOFJZIRBWCWAMC-AWEZNQCLSA-N 411.458 2.287 10 20 HECD COc1cccc(CNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c1O 729859408 NXFNKIMTZIHWHM-SFHVURJKSA-N 406.504 2.329 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccccc3S(C)(=O)=O)cc2F)CC1 730192897 PGIADXVYPYWDLP-UHFFFAOYSA-N 419.522 2.301 10 20 HECD CCO[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 738318273 BZQFJSVAVDICOX-GOSISDBHSA-N 419.547 2.425 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 740388307 LUDLLTWTEAVAJL-INMHGKMJSA-N 408.470 2.025 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cn(C)nc3-c3cccnc3)CC2)cc1 743929141 ZQESTLDQLUXWJA-UHFFFAOYSA-N 420.517 2.043 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 751240565 QTQMYVYEKIPNSQ-UHFFFAOYSA-N 405.476 2.282 10 20 HECD CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 752095432 UYTMDYRALHDKBG-WOJBJXKFSA-N 416.566 2.065 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N(C)C)c(F)c1 752661343 SWKWYCJKCSJVRT-IBGZPJMESA-N 416.497 2.065 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCCS1(=O)=O 753497495 HRLAYBSUTACVBE-CJNGLKHVSA-N 402.463 2.340 10 20 HECD Cn1cc([C@H](CO)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 757644454 WSYJXUAZXDUZNZ-KRWDZBQOSA-N 409.437 2.023 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(OC)cc(OC)c3)CC2)cc1 758224588 PKBATZFLHSBWET-GOSISDBHSA-N 402.491 2.274 10 20 HECD COc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 764060894 NCELYBJZXZGOJC-UHFFFAOYSA-N 420.412 2.283 10 20 HECD Cc1noc(C2CN(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)C2)n1 765468764 YCXVRGDJAHKSDH-STQMWFEESA-N 403.458 2.440 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCOC3(CCOCC3)CC2)c1 768908590 VKLVVTJQLOUYPT-UHFFFAOYSA-N 418.534 2.199 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 770086072 ANRGKQQHHUGRDA-MRXNPFEDSA-N 420.487 2.291 10 20 HECD O=C(Cn1ccnc1[C@H](O)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 777526932 ODTRDXUZABXOSQ-JOCHJYFZSA-N 424.476 2.257 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1 784026270 UYXVVJXDMTXMFC-UHFFFAOYSA-N 412.425 2.193 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc(N(C)C)c3)CC2)cc1 786897206 FGBUFEGSCBUPCP-UHFFFAOYSA-N 410.518 2.116 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 787189817 HVFPPUPJVCGWDP-UHFFFAOYSA-N 409.534 2.461 10 20 HECD CS[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834259 LHCCBSQQMYTKAM-WBVHZDCISA-N 423.554 2.193 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)ccc1O 790071197 GQIYKCDIKJBKAW-UHFFFAOYSA-N 412.823 2.033 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cccc(Cl)c2Cl)ccc1O 790406861 IMNHBUWOKIODBT-UHFFFAOYSA-N 411.288 2.408 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)N=c1cc[nH]cc1I 797642692 KMWLYXBFEQZCDU-VIFPVBQESA-N 413.215 2.272 10 20 HECD COCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 803301808 ZEOMPPRNRWAJTI-VQIMIIECSA-N 415.490 2.187 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 803662549 CYJMLFLIOTWLBO-GOSISDBHSA-N 412.469 2.064 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1F 804853743 UCHUCRMXJUOITB-PKOBYXMFSA-N 404.530 2.231 10 20 HECD CCOC(=O)c1sc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nc1C 807672538 CZPFXHLEHMBGLG-LBPRGKRZSA-N 418.519 2.188 10 20 HECD C[C@H](NC(=O)C(=O)N1C[C@@H](C)O[C@@]2(CCO[C@H](C)C2)C1)c1ccc(N(C)C)cc1 807673334 QWROJJGATKYKHE-DBHNTLKXSA-N 403.523 2.115 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCCSCC1 807768379 IMJZHJNKYUHOSQ-AWEZNQCLSA-N 413.490 2.339 10 20 HECD C[C@@H]1CCCN([C@H](C)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 918117422 KOHNNDFLZPIQGG-GGPKGHCWSA-N 415.582 2.308 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2 918307580 ZKYOKVZBHXBBME-CQSZACIVSA-N 410.474 2.459 10 20 HECD COc1c(F)cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 918312025 YZVTXJDLHLZVRR-UHFFFAOYSA-N 419.428 2.407 10 20 HECD Cc1cc(C)nc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847039066 PVJYFGQAMMSQCF-FNORWQNLSA-N 423.469 2.346 10 20 HECD Cc1nn(CCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1[N+](=O)[O-] 726525412 OAXRIEIXUJYECD-UHFFFAOYSA-N 401.467 2.293 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CCO)C3)cc2F)C[C@@H](C)O1 729544660 KNUKCCNCBBMITL-KZNAEPCWSA-N 407.530 2.150 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(OCC(N)=O)cc2)cc1 730663577 OEFNDPFIIVWSNB-OAQYLSRUSA-N 411.502 2.438 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c1 734017596 PWCIGARTJNIWTA-MRXNPFEDSA-N 418.515 2.426 10 20 HECD COC(=O)CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741097775 FAPIBMKADJYXDI-UHFFFAOYSA-N 407.470 2.423 10 20 HECD CN1CCCC[C@@H]1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 745080096 RKDUAGMETHZUAB-GOSISDBHSA-N 406.438 2.428 10 20 HECD C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 745779598 PAIIAISZLPPZIC-WIYYLYMNSA-N 404.555 2.336 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 748055611 PBDODFZUEDPGOY-UHFFFAOYSA-N 405.520 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)COCCNC(=O)OC(C)(C)C)CC2)cc1F 753737658 BIAMXXZJPNYZHK-UHFFFAOYSA-N 411.474 2.024 10 20 HECD C[C@@H](Nc1ccn(CCO)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 754814405 DKDCANGKCXZBQN-CYBMUJFWSA-N 404.426 2.090 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccnc(C(=O)N(C)C)c3)cc2)CC1 754939014 RWMDQQDBUKADPO-UHFFFAOYSA-N 423.517 2.275 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccccc3O[C@H]3CCOC3)ccc21 760096641 LKMCGJUPOWKNCJ-SFHVURJKSA-N 409.486 2.492 10 20 HECD C[C@@H](CNC(=O)c1ccccc1)c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762275652 CMQNGOSZEUCHHW-LBPRGKRZSA-N 416.459 2.347 10 20 HECD Cc1cc(Br)ncc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769927688 ZTWFJAARILHEQN-UHFFFAOYSA-N 400.254 2.482 10 20 HECD CCc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)co1 772385186 FLMYXAVTTKLILX-OKILXGFUSA-N 419.453 2.463 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)C2CC2)cc1 772470684 IXSRYQIHPYOWHB-SFHVURJKSA-N 420.513 2.486 10 20 HECD COC(=O)c1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772907408 UFQBGPPXGHGVNC-UHFFFAOYSA-N 401.438 2.177 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1F 774223241 AGAFXHHGNRERPT-UHFFFAOYSA-N 404.417 2.165 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCCC[C@@H]3CCO)CC2)cc1 776039244 QMWPNQQCXIELCN-HXUWFJFHSA-N 404.555 2.154 10 20 HECD C[C@@H](NC(=O)N1CCC(CNC(=O)c2cnn(C)c2)CC1)c1ccc(N(C)C)cc1 776245588 HXTHADYVMIALLC-MRXNPFEDSA-N 412.538 2.399 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@]3(C)CCCS3)CC2)cc1 778323787 LEFUSHPLKFBHDX-GEPASTNRSA-N 403.548 2.302 10 20 HECD Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C 785857266 PCKLUTUVPKFALI-AUUYWEPGSA-N 405.520 2.493 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cnn(-c2ccccc2)c1 785965603 DTBYJUVKGLNADY-UHFFFAOYSA-N 403.486 2.405 10 20 HECD Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 786224503 JYHQDZLNUGXDFK-SFTDATJTSA-N 424.545 2.100 10 20 HECD O=C(NCCCC1CCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 788221879 FUUOYDRGBKGRFK-UHFFFAOYSA-N 405.514 2.490 10 20 HECD CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788910499 LPDLTZQHWHESLB-DPELMXMRSA-N 405.564 2.099 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNCc1c(O)ccc(Cl)c1F 790966566 GOQGRVIOANUIIX-UHFFFAOYSA-N 403.819 2.161 10 20 HECD Oc1ccc(Cl)c(F)c1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 792164642 BNDJLBGQLFBEQP-UHFFFAOYSA-N 407.877 2.134 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)cc2)cc1 798322229 POQJIMWJLWKFQO-IBGZPJMESA-N 417.531 2.221 10 20 HECD CCNC(=O)CN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC1 800731826 WJVLAEUIHCKTET-UHFFFAOYSA-N 421.549 2.148 10 20 HECD CCO[C@H](CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803307645 JSTFJWCLSBCIMH-FXAWDEMLSA-N 405.539 2.268 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C2CCC(NC(C)=O)CC2)cc1F 804853626 TXDNIOMNTYSYNO-UHFFFAOYSA-N 420.529 2.194 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCCN4C)C3)cc2)CC1 805026224 GWVUTFXXMJFTOV-IFMALSPDSA-N 412.578 2.482 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C 807099959 IHDUCADISFMOHS-HNNXBMFYSA-N 406.527 2.049 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)OC1CCOCC1 810043560 XAUSIDDXZMRMKT-UHFFFAOYSA-N 415.469 2.348 10 20 HECD CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917391067 JXWBIOFXUSDCLK-OAHLLOKOSA-N 411.462 2.268 10 20 HECD O=C(O)CCCN1C(=O)/C(=C\c2cc3c(cc2[N+](=O)[O-])OCCO3)SC1=S 920397217 KCSJCIYIRMZCFB-NTUHNPAUSA-N 410.429 2.432 10 20 HECD COc1ccc(CNC[C@@H]2CN(C(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)CCCO2)cc1C 1078432535 CBUIJOLUDALZKV-BHNQRHOYSA-N 400.519 2.134 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)NC)cs3)CC2)cc1 1319626258 TXJVOTQDFZHSJQ-UHFFFAOYSA-N 409.533 2.017 10 20 HECD O=C(/C=C/c1cccc(O)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602429 INALIUBCGJOKKC-SRXHPEDYSA-N 409.442 2.164 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccccc2n1)c1cc(O)nc(O)c1 1797286231 RHJOJROOOKAZEX-QDMKHBRRSA-N 419.441 2.002 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCC=CO1 1819373358 RIEXSQRQLHMNOQ-LSDHHAIUSA-N 413.434 2.215 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843963994 KBWSFOSLXULLNI-AEFFLSMTSA-N 408.502 2.419 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNc1ccccc1[N+](=O)[O-] 64103723 KJXPETDLGRGLGS-UHFFFAOYSA-N 400.435 2.275 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(CN2CCOCC2)c1 732060520 YCCRICIGJANVTH-UHFFFAOYSA-N 413.493 2.425 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCN1CCCC1=O 733195422 NBNYIGBCQQVJCF-HNNXBMFYSA-N 419.481 2.343 10 20 HECD CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NCCCSc1nccs1 733884792 YIYRVLYDEIICSB-UHFFFAOYSA-N 424.573 2.336 10 20 HECD COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 734066354 SQILCDARRRSYPM-CYBMUJFWSA-N 407.492 2.212 10 20 HECD O=C(COC(=O)COC1CCOCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 735363854 KWZXGXUQQKRBIP-UHFFFAOYSA-N 423.421 2.139 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1cccs1 745648813 PBXUVDOGKSGQAN-SFHVURJKSA-N 418.494 2.107 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H](NC(=O)C2CC2)[C@@H](C)O)c(C)n1-c1cccc(F)c1 745748663 TXDKINWBSRBSRI-VLIAUNLRSA-N 416.449 2.235 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN3Cc3ccccn3)cc2)C1 746147459 PBKAYZAABRKPMT-UGKGYDQZSA-N 421.545 2.064 10 20 HECD CCCCCC(=O)NC1CCN(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)CC1 748312847 ZUJYVRLLDDXVGM-UHFFFAOYSA-N 417.510 2.273 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751042161 CAOBJHIPWSIQCF-INIZCTEOSA-N 418.515 2.490 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnnc3CCCc3ccccc3)CC2)cc1 751126645 NLCPOVVULLDQID-UHFFFAOYSA-N 420.517 2.206 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc3c2oc(=O)n3C)C2CC2)cc1 753388270 KGMUTLUMUBASQN-UHFFFAOYSA-N 408.458 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H](C)C(=O)N3CCCC[C@H]3C)CC2)cc1F 753894002 QXQTXUPPLABZHK-CVEARBPZSA-N 406.502 2.455 10 20 HECD CCCO[C@@H]1CCCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754028698 BQPGYVWBCOTVLC-JTHBVZDNSA-N 405.583 2.459 10 20 HECD CC(C)Oc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 755167177 OAGZNGICPDDKSZ-UHFFFAOYSA-N 403.504 2.034 10 20 HECD COC(=O)Nc1ccccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758234229 ZXFYNQRBLYZENF-SFHVURJKSA-N 415.490 2.435 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1S(C)(=O)=O 759037409 XSDCVJVHZDUBDG-UHFFFAOYSA-N 413.546 2.092 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(c3nc(F)c(F)cc3F)CC2)cc1 759970958 PYLCYTLIUQLVTB-UHFFFAOYSA-N 407.440 2.003 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4ccccc4F)C3=O)cc2)C1 761116626 BKZBHOYEVSREBC-KXBFYZLASA-N 410.449 2.321 10 20 HECD COc1ccc(C[C@H](C)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 763224863 WJNDRKTUOVMELH-ZDUSSCGKSA-N 422.503 2.390 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1 765116517 TYJXKJSPWYUBPT-GFCCVEGCSA-N 402.472 2.276 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765732537 QIVXZLKPTOFWQV-UHFFFAOYSA-N 409.236 2.427 10 20 HECD C[C@@H]1NC(C(=O)NCc2cccc(Br)c2O)=NN(c2ccccc2)C1=O 765763416 BCZVJIZWZFSRBQ-NSHDSACASA-N 417.263 2.109 10 20 HECD COCCc1cc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)n(C)n1 768703721 UTSMQSGSMDOQHE-UHFFFAOYSA-N 423.517 2.314 10 20 HECD CC1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 769687396 DARJJBOAKGOPFE-UHFFFAOYSA-N 413.440 2.417 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCC(=O)[C@@H](C)C4)n3)CC2)cc1 771055669 IVGIBPCYKWJWQH-HOTGVXAUSA-N 412.490 2.442 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)CCCO2 771736641 ZBTKEKMJRFKHAQ-UHFFFAOYSA-N 406.479 2.466 10 20 HECD C[C@@H](NC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(N(C)C)cc1 775405264 SBESBIPYWXCQOF-MRXNPFEDSA-N 416.547 2.426 10 20 HECD C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 775836545 NADVBDYDWKNGAN-XHSDSOJGSA-N 418.563 2.317 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCNC(=O)OC(C)(C)C 777826828 RUQZUFMZIIUPRC-UHFFFAOYSA-N 400.859 2.462 10 20 HECD CCc1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 777898509 HPZNTFZNAOHHHC-SFHVURJKSA-N 401.532 2.429 10 20 HECD COc1ccc(S(=O)(=O)N2CC(NCc3cc(Cl)cc(F)c3O)C2)cc1 779170584 CPWZXMVNHOCVLQ-UHFFFAOYSA-N 400.859 2.356 10 20 HECD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)/C=C/c3ccc(O)c(O)c3)c2)C1 779516040 WIOCMJSRGBAXLU-XSBJJCPUSA-N 409.486 2.125 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 781476721 CGJRHCCNHOMPQW-UHFFFAOYSA-N 411.458 2.119 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccnc2OCC(F)(F)F)cc1 785426458 ZPPCUCRRMOUKRL-UHFFFAOYSA-N 410.396 2.021 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 785440627 AUODVQIYNYZCMO-GOSISDBHSA-N 409.534 2.308 10 20 HECD CCCN1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 788278230 FHYKRWLIKYNGBH-UHFFFAOYSA-N 419.481 2.345 10 20 HECD CC1(C)NC(=O)N(c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)C1=O 788499162 SJMQTLXNFXLOCX-UHFFFAOYSA-N 417.472 2.327 10 20 HECD CC(C)(C)OC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788929500 KLWDWGISKIVVJJ-QGZVFWFLSA-N 401.507 2.093 10 20 HECD CS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789833190 FGWMEVBARDJPEB-KRWDZBQOSA-N 423.554 2.147 10 20 HECD CCO[C@H](CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)C 789855500 SLUWYDVFBUCITK-LJQANCHMSA-N 407.580 2.423 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 790220537 YCFAQNINWVPHGY-SOLBZPMBSA-N 418.513 2.346 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(OC)ccc2Br)c(O)c1 797390811 TTWMHNBCLOBVJG-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)cc1F 804975123 FOYRSZQUIOBJFK-UHFFFAOYSA-N 422.450 2.367 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCN(C)C[C@@H]3C)cc2)CC1 805025666 SVVOAEKRLGXKNN-RXVVDRJESA-N 400.567 2.338 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1C1CC1 806539041 DTVAUPRTMBKVLJ-KRWDZBQOSA-N 408.502 2.123 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3nc(C)c(C)c(CO)c3=O)c2C)cc1 806579799 SCIOSRUIBQIOEG-UHFFFAOYSA-N 423.469 2.429 10 20 HECD C[C@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 807291246 VFVLZRLIOXNNRB-RXVVDRJESA-N 407.514 2.350 10 20 HECD COCCOc1ncccc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807511694 BVTKMEXBFHXFCN-UHFFFAOYSA-N 414.245 2.374 10 20 HECD CN(C)S(=O)(=O)c1ccc(NNC(=S)Nc2ccc3c(c2)OCCO3)cc1 812260820 GPXVEQGQJKOJAI-UHFFFAOYSA-N 408.505 2.022 10 20 HECD CS(=O)(=O)C[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 816891411 RTQQCKHHEZUBMN-GOSISDBHSA-N 420.506 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C/c3ccccc3)n3nnnc3C)CC2)cc1 872035029 MHLKYDPZVUDECM-PGMHBOJBSA-N 404.474 2.337 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 917356445 RXNLWVFMBGZLFX-UHFFFAOYSA-N 404.488 2.245 10 20 HECD CC(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224992 YXEWNPIHSNVUIL-UHFFFAOYSA-N 420.529 2.356 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(Br)c1 1116645924 STVUPGAXYZFLHC-LBPRGKRZSA-N 409.236 2.160 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]4OCCC[C@@H]4C3)CC2)cc1 1319263012 QAPOFYVOAKHFOU-KNQAVFIVSA-N 416.566 2.418 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCn1cnc2sccc2c1=O 9975505 AIUXSQJSIUNIEX-UHFFFAOYSA-N 412.515 2.343 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 109310586 YLOVPADZRZNNTQ-UHFFFAOYSA-N 400.504 2.466 10 20 HECD O=C(CN1CCC[C@H](C2OCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 726375895 KXGOIBSITCZCJH-HNNXBMFYSA-N 420.465 2.485 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731121087 LRMGPVCOYADOJB-UHFFFAOYSA-N 408.568 2.100 10 20 HECD COc1ccc(N2CCN(C(=O)c3nn(-c4ccc(F)cc4)ccc3=O)CC2)cc1 731571361 QYIPAUKOSAQEMX-UHFFFAOYSA-N 408.433 2.343 10 20 HECD COC(=O)CCCS(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 734090430 ZAIBAQPNPKUSBD-UHFFFAOYSA-N 408.476 2.116 10 20 HECD CN(CCOc1cccc(S(C)(=O)=O)c1)Cc1ccc(N2CCOCC2)cc1 738300831 YVJAIZDNDMCPNS-UHFFFAOYSA-N 404.532 2.438 10 20 HECD CCN1CCN(CCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 743734826 AGXWUIJSYROHRL-QGZVFWFLSA-N 410.509 2.401 10 20 HECD CN1CCCc2cc(CNC(=O)c3ccc(CCNS(C)(=O)=O)cc3)ccc21 746812691 GQHZVXYMYOMGMR-UHFFFAOYSA-N 401.532 2.091 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F 748480732 BKHHBFIYWIQBPN-UHFFFAOYSA-N 405.336 2.247 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 749009351 LCXJKRMZHBTWGW-HXUWFJFHSA-N 412.465 2.045 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C(C)(C)C)C3)cc2F)CC1 750640134 CECZMEPCNMFPLY-KRWDZBQOSA-N 419.545 2.166 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)s1 753643290 HMQWDCRHOUXIGP-IUODEOHRSA-N 424.544 2.368 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cn(C)c(=O)cc3C)cc2F)CC1 760051225 WHNNQZMMVHTBFV-UHFFFAOYSA-N 401.486 2.296 10 20 HECD CCc1noc(CCCC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 760084662 ORMONWVJKGCLQI-UHFFFAOYSA-N 418.494 2.329 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3OCC(F)F)nc12 760646557 DAWOPYHRWPVEMC-UHFFFAOYSA-N 422.344 2.008 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC[C@H]21 766880258 KYPIOZASHYSTEN-SVFBPWRDSA-N 413.566 2.014 10 20 HECD CN1CCCc2cc(CNC(=O)c3nccc4c(S(N)(=O)=O)cccc34)ccc21 768481351 LBXLGCOIHRSPJP-UHFFFAOYSA-N 410.499 2.195 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCO4)c2)CC1 771606404 GTYWCTZWUBJBOE-UHFFFAOYSA-N 422.528 2.047 10 20 HECD CS(=O)(=O)NCc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 772043565 OTYLGNZMRLOAGR-UHFFFAOYSA-N 423.878 2.064 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1(C(N)=O)CCCC1 772231317 HAZYXVKWJYJNHE-UHFFFAOYSA-N 405.454 2.130 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 778767087 KTAJPPQNYYKTEG-UHFFFAOYSA-N 413.430 2.462 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c(OC)c1 782107600 LRUCGJWPRMSVCZ-LLVKDONJSA-N 402.403 2.012 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(-n3nccn3)nc2)cc1 784109990 AEWWARUEPBSWID-UHFFFAOYSA-N 405.462 2.406 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)Cc3c(C)nn(C)c3C)cc2)CC1 786260071 VXWOOCGLGSREJA-MRXNPFEDSA-N 411.550 2.200 10 20 HECD O=C(NCCC1CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 788443129 YPZYQMTXWLHTGQ-UHFFFAOYSA-N 405.514 2.490 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(Cn3cccn3)cc2)cc1F 788461819 KWOKMNALCMBATP-UHFFFAOYSA-N 409.465 2.069 10 20 HECD C[C@H](Cn1ccnc1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 789750878 BBTJSONXOULWGF-QGZVFWFLSA-N 409.490 2.276 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(N4CCC4=O)c3)CC2)cc1 790918551 UZDLTAZNCXGCQU-UHFFFAOYSA-N 422.485 2.109 10 20 HECD COc1ccc(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(F)cc2)c(O)c1 794369070 AOIAPHIELOAVKF-UHFFFAOYSA-N 410.467 2.257 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1C 795172302 DXGKLIVTVOTSHL-AWEZNQCLSA-N 411.549 2.009 10 20 HECD Cc1nccnc1N1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 799366135 WWGAZPRWJUFBKJ-QGZVFWFLSA-N 410.522 2.214 10 20 HECD CCOC1CC(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803315135 IPLDNAHEZFOEBV-ZRZPHAQCSA-N 403.523 2.022 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(CC(F)F)CC2)cc1F 803650207 BBIJMKSYKOIVHU-UHFFFAOYSA-N 414.472 2.134 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)CN3CCCC3)CC2)cc1 804318290 GWNCSJCANFQSKB-UHFFFAOYSA-N 416.566 2.018 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nncn1C 805766267 FAPVIDDSFLUKOB-GOSISDBHSA-N 404.490 2.112 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1 809457846 KIOPWUFDQQVFPW-KRWDZBQOSA-N 405.564 2.272 10 20 HECD C[C@@H](Sc1nnc(N)n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 913193982 ISKPVVOPSHCZGA-SNVBAGLBSA-N 407.455 2.292 10 20 HECD CCS(=O)(=O)N1CCC(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 915228876 CTJRVFWSDFDNOB-UHFFFAOYSA-N 410.540 2.489 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(N4CCCC4)nc3)CC2)cc1 918462621 YNBRZDVSNRKGAB-UHFFFAOYSA-N 423.517 2.368 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(Br)ccc1C 1116742148 HNJOVEFEWSGPQK-LBPRGKRZSA-N 423.263 2.468 10 20 HECD CNC(=O)c1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 1323920593 DBELVRISQIUGNU-KBPBESRZSA-N 400.454 2.124 10 20 HECD Cc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)n1 1792543504 KSVGKTHSTOURQB-KXXXJKOBSA-N 408.458 2.161 10 20 HECD Cn1c(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc2ccccc21 1847460412 ANCWRCMMMWYHDY-OALUTQOASA-N 420.469 2.043 10 20 HECD O=S(=O)(c1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 25286236 COXUMQOUEHNIFM-UHFFFAOYSA-N 410.879 2.281 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCO[C@]3(CCSC3)C2)n(C)c2ccccc12 673315435 CWULAHBGTFVTEZ-YCRPNKLZSA-N 401.532 2.274 10 20 HECD O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NCc1ccccc1O 726251465 YZDSZNVPFFLLIH-UHFFFAOYSA-N 402.882 2.194 10 20 HECD CC(C)[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 734269231 JMZCNFWELJUCJD-ZRGWGRIASA-N 406.502 2.105 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(C)c4c(O)nc(O)nc4n3)CC2)cc1 740740972 IBWNAPDDWVHXGT-UHFFFAOYSA-N 409.446 2.106 10 20 HECD COc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1N1CCNC1=O 742040209 DWILJZSDIDKGTF-UHFFFAOYSA-N 424.501 2.334 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1C[C@H]2CC[C@H]1C2 742280147 LLQUZWPKKCTUNJ-BBRMVZONSA-N 419.469 2.361 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1O 745690773 DKBCPVGZDYRBKY-QGZVFWFLSA-N 412.490 2.102 10 20 HECD CN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCS(=O)(=O)C1 745905825 NVPXZNZTZCBCKZ-ZFWWWQNUSA-N 417.478 2.085 10 20 HECD COC[C@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 746756624 ZJJYIRNCILVNTF-FQEVSTJZSA-N 416.522 2.406 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCc2ccccc21 746878240 SZDQEMTWBAHTHU-PXNSSMCTSA-N 406.530 2.456 10 20 HECD COCCc1nc2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2o1 753339522 UWAUERDLNKMYIV-UHFFFAOYSA-N 405.432 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(Cl)ccc3-n3cnnn3)CC2)cc1F 753739516 GGQGFCMWGKXEGH-UHFFFAOYSA-N 416.844 2.426 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@](C)(CO)C3CCCCC3)CC2)cc1 754043554 SHZDYEPMRLMMPF-GMAHTHKFSA-N 405.583 2.099 10 20 HECD CCC1CCC(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)(C(=O)OC)CC1 755988899 LZUYBBFRNJBKMH-UHFFFAOYSA-N 417.550 2.445 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756710843 FOZRYIIZXSNKHL-IAGOWNOFSA-N 413.522 2.347 10 20 HECD C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758348280 UACKTDGCHKPZPM-BLLLJJGKSA-N 421.544 2.467 10 20 HECD COCCS(=O)(=O)c1ccc(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 759258657 JZOXHGGDHZYZQW-AWEZNQCLSA-N 422.503 2.381 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)CC2)cc(OC)c1OC 759293938 OYWUYHFHPLVECL-HOTGVXAUSA-N 418.538 2.169 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCC[C@@H]1N1CCOCC1 763660806 UVOSGTFOSWCDOB-YADHBBJMSA-N 416.566 2.308 10 20 HECD Cc1cc(CC(=O)NCCCN2CCNC(=O)C2)c(C)n1-c1ccc(Cl)cc1 765143736 WCWSVKDWNMJDCI-UHFFFAOYSA-N 402.926 2.228 10 20 HECD CNC(=O)COc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cc1 771996098 DRBOANRCNPHIOK-UHFFFAOYSA-N 403.822 2.139 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 772701035 NJQBYEWWFGCQTA-LMMKCTJWSA-N 411.520 2.435 10 20 HECD CCOCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 772892893 ULLADBQVFJLWHP-UHFFFAOYSA-N 423.447 2.210 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=N)C(F)(F)F)cc2F)C[C@@H](C)O1 773180325 ORMKNPDDKDCDDO-GHMZBOCLSA-N 406.380 2.116 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C)c1ccc(N(C)C)cc1 773854935 YCSXRSGJEAJKJX-CYBMUJFWSA-N 400.454 2.409 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccccc3OC)CC2)cc1 775050738 DNNPVCZUVNSARZ-UHFFFAOYSA-N 411.502 2.101 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 776916758 QYJGDYSHQYXYBJ-UHFFFAOYSA-N 420.579 2.312 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnn(CC(F)F)c3)CC2)cc1 777896679 BVWNBRZBJNGJHA-UHFFFAOYSA-N 400.451 2.058 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c(OC)c1 782104350 CTRWVQHDBQGFTB-UHFFFAOYSA-N 411.458 2.337 10 20 HECD COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 784317538 JHQURRGGPCLSSM-JTQLQIEISA-N 410.404 2.135 10 20 HECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785428795 RUUDPEMJYPEQST-OAHLLOKOSA-N 406.527 2.131 10 20 HECD CCN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)CC(F)(F)F 785429052 WHPYTEXERCNBPE-INIZCTEOSA-N 414.472 2.102 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nn(-c4ccccc4)cc3O)cc2)CC1 787321955 KQZBDQIDWNRZQC-UHFFFAOYSA-N 419.485 2.176 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3sc(S)nc3C)cc2)CC1 787326056 HXSHUTAVKOYNSR-UHFFFAOYSA-N 404.561 2.268 10 20 HECD CCOCCCCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 787894948 OPFLCUJHJRLHCH-UHFFFAOYSA-N 401.301 2.436 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@]1(N(C)C)CCSC1 788240574 CVLRYWHTGAKREU-NRFANRHFSA-N 406.596 2.043 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@]2(CCO[C@H](C)C2)O1 788940674 YEHOCNPEEPVYQS-STSQHVNTSA-N 415.534 2.088 10 20 HECD O=C(c1ccccc1OC(F)F)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 790069127 KMMRNGLIENYCPU-UHFFFAOYSA-N 410.348 2.437 10 20 HECD CN(C)c1ccc(CNCCS(=O)(=O)NC[C@H]2CCCCO2)c(C(F)(F)F)c1 792989734 KUTIDLDZWCUUBU-MRXNPFEDSA-N 423.501 2.350 10 20 HECD CS(=O)(=O)C1(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCC1 793100310 BSQCHJUVNJRMGS-UHFFFAOYSA-N 420.453 2.126 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)ccc21 803686037 TYNFQUNIALGOKD-KBAYOESNSA-N 405.589 2.181 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1 804105855 FQWVCIRKNHYEHA-UHFFFAOYSA-N 405.502 2.222 10 20 HECD CCO[C@H]1C[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1(C)C 804314891 BUHWVLXCDKUKBT-PMACEKPBSA-N 417.550 2.442 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 804842616 MHFBDTUSLRJPLN-KRWDZBQOSA-N 416.472 2.384 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCCc2c[nH]nc21 806430231 JLIZGLOAEGULEZ-AWEZNQCLSA-N 421.295 2.420 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(Cl)n1 807386562 ARYZNESTDAWTOA-UHFFFAOYSA-N 414.643 2.467 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@H]1CO 807952720 KCTJRNXJOQTTRG-VCBZYWHSSA-N 407.942 2.422 10 20 HECD O=S(=O)(Nc1cc(Cl)c(O)cc1F)c1ccccc1S(=O)(=O)NC1CC1 808113964 OHVPHSAFSMMRMW-UHFFFAOYSA-N 420.871 2.426 10 20 HECD CC(C)(C)OC(=O)NC1CC(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 809619079 OZEVPSOCGSHBKI-UHFFFAOYSA-N 409.552 2.067 10 20 HECD C[C@H]1CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H](C)N1C 818626021 CQJFSUBCDIPSTP-BETUJISGSA-N 409.533 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(S(C)(=O)=O)ccc3C)CC2)cc1 840951367 XBEABARTSVPLEN-UHFFFAOYSA-N 417.531 2.168 10 20 HECD CCn1cnnc1SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917198477 BLOKUNIBEGSGSI-ZIAGYGMSSA-N 407.515 2.459 10 20 HECD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1ccc(N2CCOCC2)c(F)c1 917709525 ZXRYPJRZVGMEHM-UHFFFAOYSA-N 413.409 2.237 10 20 HECD O=C(Cn1cc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cn1)NC1CC1 918212980 DADFDKAGNMTXTD-UHFFFAOYSA-N 414.535 2.037 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1 918780786 REAPQSYIZGXTET-UHFFFAOYSA-N 402.539 2.313 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H](C)n3nc(C)cc3C)CC2)cc1 919312442 XLIBQPOPMIUQNX-SFHVURJKSA-N 414.506 2.352 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 1323192142 FELIQULPBNTTRV-MRXNPFEDSA-N 421.501 2.429 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1cccc(OC)c1 1342435539 VUIYFZUGRBHAOJ-INIZCTEOSA-N 405.472 2.489 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c[nH]1 1808774852 HFAQZTYGECWNSD-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(C1=COCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429029 NQZHPQPYDBEFFO-KRWDZBQOSA-N 401.463 2.030 10 20 HECD CCOCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832358951 NLNCJJDYTQXNBC-KRWDZBQOSA-N 405.495 2.153 10 20 HECD CCN(CC)C(=O)CN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 7591162 KXIVWXKMVAPQLE-UHFFFAOYSA-N 407.470 2.201 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC(=O)N(Cc2ccco2)C1 302963203 GVCHGWFRRNZJAJ-INIZCTEOSA-N 415.465 2.045 10 20 HECD CCN1CCCC[C@H]1CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 303446807 HGOWONSEUIXBEX-NRFANRHFSA-N 417.598 2.381 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccco3)cc2F)CC1 730133535 XWWZNJHTPNNHSZ-GOSISDBHSA-N 418.513 2.211 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(CC(=O)Nc3nncs3)CC2)cc1 733958077 BKKHKHIVIRUAJX-UHFFFAOYSA-N 424.530 2.342 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 741096724 DHZSPNACSQDILX-UHFFFAOYSA-N 405.458 2.061 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCC[C@]34NC(=O)NC4=O)c2C)cc1 744623930 AUMBGTJNZTWZQB-QRQCRPRQSA-N 410.474 2.211 10 20 HECD COC[C@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 746756036 UHIQPABRZAFSPG-IBGZPJMESA-N 402.495 2.097 10 20 HECD CCN(C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1)CC(F)(F)F 747943390 HUJSIOZVBFVZMG-GFCCVEGCSA-N 423.457 2.110 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCS3)cc2F)C[C@@H](C)O1 750900754 IAFFNVIWNVCIMB-IYOUNJFTSA-N 410.511 2.494 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC(Cn2ccnn2)CC1 753042047 IXEUFCUVXWFEFB-UHFFFAOYSA-N 400.552 2.453 10 20 HECD CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 755328118 CVGBPGWECXRSDV-DOMZBBRYSA-N 410.517 2.488 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(OC)c(OC)c3)CC2)cc1 758226714 ZFNANBMPKHYQDJ-GOSISDBHSA-N 402.491 2.274 10 20 HECD COc1cc(N2CCN(C(=S)NCCc3ccccn3)CC2)cc(OC)c1OC 758920919 VVRJCRZRDDZNMK-UHFFFAOYSA-N 416.547 2.347 10 20 HECD CCOc1ccc(C(=O)NCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1OCC 763284883 XNATVICTZSKOAK-AWEZNQCLSA-N 416.474 2.372 10 20 HECD Cc1ccc([C@H](C)[C@H](O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 764861985 JHYRAHSBFPJHRK-UWJYYQICSA-N 416.543 2.011 10 20 HECD O=C(CCn1nc(O)c2ccccc2c1=O)NCc1cccc(Br)c1O 765754304 VMJHDVCLRNOOPM-UHFFFAOYSA-N 418.247 2.277 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(-c2ncon2)cc1 765925186 FLUKDEBYKYZIHK-UHFFFAOYSA-N 417.219 2.460 10 20 HECD C[C@@H](c1ccccc1)[C@H](CO)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 766979236 GMQQAXOSNMFTCP-UWJYYQICSA-N 415.509 2.033 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)COc3ccc(OC)c(C)c3)nc12 768150224 HLQPZDRVKOLDID-UHFFFAOYSA-N 415.402 2.051 10 20 HECD C[C@@H](O)C[C@@H]1COCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 768328580 VZBJYHDXMUQETH-RHSMWYFYSA-N 413.465 2.438 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773856521 ITONDAHBVCFYKY-MRXNPFEDSA-N 412.538 2.422 10 20 HECD COCCO[C@H]1C[C@H](CO)CN(Cc2cc(Br)cc(OC)c2O)C1 775203547 LUAWLOJFZYIJPM-WFASDCNBSA-N 404.301 2.009 10 20 HECD CCCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CCS(=O)(=O)C1 776039934 YVXAOUOCDLPQNQ-APWZRJJASA-N 409.552 2.193 10 20 HECD CCCC(O)(CCC)CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778288384 YCSNCVCGYKSUTM-KHPPLWFESA-N 417.550 2.348 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(CCC(C)(C)C)CC3)CC2)cc1 779221843 QEANKQNBKLGCCH-JOCHJYFZSA-N 418.626 2.232 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1 785423977 JGDKDSXZZWXWIO-UHFFFAOYSA-N 424.423 2.064 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CC1 786256590 GNWFVZQGQVVEHO-UHFFFAOYSA-N 400.410 2.332 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)cc2)CC1 786257501 PWJRPDXNQFRGPE-HXUWFJFHSA-N 420.513 2.024 10 20 HECD C[C@H]1C[C@@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1C 789844402 HAZXPBXRPKMQAB-PMPSAXMXSA-N 405.514 2.296 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 791153751 GWBSCRGXVLUACY-SQUSKLHYSA-N 415.534 2.174 10 20 HECD O=S(=O)(C[C@@H]1CCCOC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 792757503 MMXRXOYVSKGERO-RHSMWYFYSA-N 402.944 2.356 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3cnccn3)cc2Cl)C1 793497979 NEFUFJSWACJIHD-HNNXBMFYSA-N 415.925 2.341 10 20 HECD COc1ccccc1CCNC(=O)CNC(=O)NCc1ccc(N(C)C)c(F)c1 798108455 XEZXRBMENMJIBY-UHFFFAOYSA-N 402.470 2.058 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(OC(F)F)nc1 802575231 LBBSFCNMHPHNSI-UHFFFAOYSA-N 416.178 2.406 10 20 HECD CC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C1CCOCC1 803304942 FSRXLHBEZHMFNU-UZLBHIALSA-N 403.523 2.022 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cc(F)ccc3F)CC2)cc1 805823245 DWXJEOQXHKBIPC-UHFFFAOYSA-N 417.456 2.371 10 20 HECD COc1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 810355376 ZZFJLPSKHRVXMW-UHFFFAOYSA-N 405.401 2.065 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](O)c3ccc(Cl)cc3)CC2)cc1 813426648 MQEQNIMODIJPKD-HXUWFJFHSA-N 403.910 2.320 10 20 HECD CCN1C(=O)C(=CNc2cc(C)nn2-c2nc3ccccc3[nH]2)C(=O)N(CC)C1=S 814318203 FESSWJOAIIJWDJ-UHFFFAOYSA-N 423.502 2.348 10 20 HECD CC(C)C(=O)Nc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccn1 815074621 ZOCJUVOTAPNWPW-GOSISDBHSA-N 423.517 2.308 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2cc[nH]n2)s1 1116788250 FQSDIQIQVQHRFP-ZDUSSCGKSA-N 401.444 2.454 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(-c2ccc(F)cc2)n1 1337825997 DXLOYOKBHHDRGN-KRWDZBQOSA-N 413.405 2.327 10 20 HECD C[C@@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC=CCC1 1803283220 FYTHBQXESDUBIA-IGMJJTELSA-N 421.588 2.231 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1CCCC1 1806179513 GEOBCRHDWHJDBB-UZLBHIALSA-N 410.474 2.398 10 20 HECD COCCCNC(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 6460333 RKSZFSCNBPQTOA-UHFFFAOYSA-N 415.829 2.425 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(C)ccc(OC)c3N)CC2)cc1 727006789 PIGSRWAQCCUBCQ-UHFFFAOYSA-N 413.474 2.100 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 729598742 JTVYJKNDPNLPPU-VQTJNVASSA-N 415.582 2.308 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)NCc2cc(OC)ccc2O)cc1OC 734006081 JBLLUVPCRXCIRZ-UHFFFAOYSA-N 409.464 2.493 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)c1ccc(F)cc1 734943281 XIBSWHIBCXXRGA-IBGZPJMESA-N 405.445 2.459 10 20 HECD CS(=O)(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 740908734 ZNMYSUZCNGUHSG-UHFFFAOYSA-N 400.504 2.434 10 20 HECD CCN(CC)[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 743867063 JYUSNQNKDRZKGX-WSTZPKSXSA-N 420.573 2.472 10 20 HECD CN1CCCc2cc(CNC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)ccc21 746880047 WIEVMWPRAKSPTI-UHFFFAOYSA-N 405.495 2.388 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C3(S(C)(=O)=O)CCCC3)cc2F)C[C@@H](C)O1 749794475 NRNYBAMJAZKDFN-HUUCEWRRSA-N 412.527 2.413 10 20 HECD CN(C)c1ccc(CNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1 750713481 QHQIKIRINYNMNH-UHFFFAOYSA-N 419.532 2.278 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751240617 UDMWRONFWPBMMY-UHFFFAOYSA-N 405.476 2.282 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)ccc1F 752727931 ZPYZMIQSPFNVBA-UHFFFAOYSA-N 412.465 2.383 10 20 HECD COC(=O)[C@]1(C)CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 752819161 IRPRBPYROJSASL-JOCHJYFZSA-N 422.393 2.395 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 753782239 ODYNUUZUBPPGMM-VJUNAUMWSA-N 423.435 2.354 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1cnns1 755334228 JLHXUXZXCLSNCU-UHFFFAOYSA-N 414.470 2.116 10 20 HECD C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)cc(F)c1O 756564308 SFVZJDCSWVGHLA-LLVKDONJSA-N 423.348 2.453 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnnc3C(C)(C)C)cc2F)C[C@@H](C)O1 768523218 YQCQUWGMFWNHKN-ZIAGYGMSSA-N 404.490 2.040 10 20 HECD Cc1ccnc2nc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nn12 768914472 DCKKVOWHFALNBY-OAHLLOKOSA-N 400.870 2.186 10 20 HECD COCCCS(=O)(=O)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 770729303 TZAVDOGOONNQHU-UHFFFAOYSA-N 419.547 2.218 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 771953555 QQWZUWRAVKPVGC-GHTZIAJQSA-N 404.555 2.320 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](CC(=O)N(C)C)c3ccccc3)CC2)cc1 775217839 PHLDNAHVVVUZQX-QFIPXVFZSA-N 424.545 2.153 10 20 HECD CN(OCc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 779626019 FOBGHOHFLPHHRN-UHFFFAOYSA-N 403.504 2.195 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3[nH]2)cc1F 779627772 NPCLMMIYRKRQJC-RBUKOAKNSA-N 400.454 2.259 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)CC2)cc1 781560050 ZEWWZXHSSDNEHC-HXUWFJFHSA-N 410.430 2.445 10 20 HECD Cc1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc(S(=O)(=O)N(C)C)c1C 782522092 UWHYMICSSNXAOF-UHFFFAOYSA-N 407.444 2.005 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296513 FZPIIBNJFWKUMO-JTQLQIEISA-N 422.384 2.239 10 20 HECD CCC(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)c(S(N)(=O)=O)c1 786583057 LJXFZLQLXIXUOT-UHFFFAOYSA-N 403.504 2.375 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)cc1C 788338956 WCDQCBWHMGKUDD-CYBMUJFWSA-N 400.431 2.187 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(cnn3C(C)C)c2)cc1 797431571 SCZOEGBZYWGGDG-UHFFFAOYSA-N 423.520 2.294 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOc4cccc(F)c4C3)CC2)cc1 801583856 QPMQJTDPHCEQCL-IBGZPJMESA-N 415.509 2.212 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](Oc3ncccc3F)C2)cc1F 803664934 UDIUULNSPSQGBZ-HNNXBMFYSA-N 418.444 2.112 10 20 HECD O=C(COC(=O)c1occ2c1CCC2)NCc1ccc(N2CCOCC2)c(F)c1 803882315 TWIDQCRROPRPJV-UHFFFAOYSA-N 402.422 2.217 10 20 HECD O=C(NCCCOC1CCCC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804019352 HIAHZXCEXRLHHK-LJQANCHMSA-N 404.507 2.365 10 20 HECD CC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 805006653 AIWIQUIWPRQKQY-QGZVFWFLSA-N 404.530 2.232 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H](c2ccccc2)C1 807290274 GUYWQURSYZYDHO-JOCHJYFZSA-N 404.514 2.194 10 20 HECD COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 807290631 LSONYHDIAJIZHF-KRWDZBQOSA-N 409.486 2.271 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)NC1CCC2(CC1)NC(=O)NC2=O 807544896 HXPXLYPOPVTGOO-UHFFFAOYSA-N 401.250 2.019 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807676425 GKDJCRYIEAOBLR-GJZGRUSLSA-N 406.527 2.301 10 20 HECD C[C@@H]1COCCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768344 HKZCSHYKOQBGEX-CABCVRRESA-N 411.449 2.010 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCCN2CCCO[C@H](C)C2)cc1 807927903 BYRMBULWLNKVMX-LJQANCHMSA-N 418.582 2.108 10 20 HECD CCN1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 807953508 VGMPCOPMVUPDMR-INIZCTEOSA-N 406.958 2.357 10 20 HECD COc1ccc(CN2CC[C@@H](NCc3cc4c(cc3O)OCO4)C2=O)c(OC)c1 808423951 LSIMTVWHKABXGB-MRXNPFEDSA-N 400.431 2.029 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc2c1OCC(=O)N2 810392702 ZEXXEYCCCBJFFO-UHFFFAOYSA-N 410.474 2.459 10 20 HECD CN(C)c1noc(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 812068036 VRWSNOXTRMDRBY-GFCCVEGCSA-N 410.425 2.205 10 20 HECD CC[C@H]1CN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H](C)S1(=O)=O 813058710 MEDYQHJHKBELMK-BEFAXECRSA-N 409.552 2.271 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCSC3)CC2)cc1 813715146 GDIJOEDUPSKZIZ-KBOKABMXSA-N 403.548 2.159 10 20 HECD CN(C)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1 915829279 XPQSSBRBUYOGML-AWEZNQCLSA-N 400.410 2.469 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1C 917833622 DAGQYCDIBANQNY-QGZVFWFLSA-N 424.501 2.198 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCOCC3)cc2F)C[C@@H](C)O1 918179795 GOAQNDJCFFLWIO-IAGOWNOFSA-N 422.545 2.349 10 20 HECD CS(=O)(=O)N1CCN(c2ccc(NCc3ccc(N4CCCC4)cc3)cn2)CC1 1254238316 QFICDCHABXXEDB-UHFFFAOYSA-N 415.563 2.376 10 20 HECD C[C@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N(C)Cc1ccc(N2CCCCC2)cc1 16386872 YPRPZLXRNHKTKR-YLJYHZDGSA-N 407.580 2.143 10 20 HECD CS(=O)(=O)c1c(F)cc(NS(=O)(=O)c2cccc3nsnc23)cc1F 608955617 FLWRRXHMINOOBO-UHFFFAOYSA-N 405.429 2.174 10 20 HECD COc1ccc(N2CCC(NC(=O)CS(=O)(=O)NC3CCC(C)CC3)CC2)cc1 728078280 XIFRNQUGHUTHGQ-UHFFFAOYSA-N 423.579 2.278 10 20 HECD COCCOc1ncccc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 728142250 KBOULYODUQRRJI-UHFFFAOYSA-N 412.490 2.303 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCOC[C@@H]3CCCO3)cc2F)CC1 730114805 FFBITYCVOJVLMZ-IBGZPJMESA-N 422.545 2.353 10 20 HECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NCCCSc1nccs1 733880939 SUVMCVDZBVHDBZ-UHFFFAOYSA-N 408.461 2.075 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1 737208462 YBLJFEBECRCAFP-UHFFFAOYSA-N 414.458 2.461 10 20 HECD CN(c1ccc(CNC(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)cc1)C1CCCCC1 742822764 PXPISJCZLXXXSR-HXUWFJFHSA-N 407.580 2.191 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCCC[C@@H]3CCNS(C)(=O)=O)ccc21 746982646 HCIMZNSWUQROKD-GOSISDBHSA-N 408.568 2.072 10 20 HECD Cc1nc(C(=O)NCc2ccc(N3CCCC3)cc2)nn1-c1n[nH]c(C(F)(F)F)n1 747206389 FZKGWTRVHISUAE-UHFFFAOYSA-N 420.399 2.243 10 20 HECD COc1ccc(N2CCN(CC(=O)NC(=O)N[C@H]3CCCC[C@@H]3C)CC2)cc1F 753856650 DNSPFEOXAKNXKP-YJBOKZPZSA-N 406.502 2.361 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)Nc1cccc(Cn2nc3ccccn3c2=O)c1 755011455 IMZVLYJRGNPSRQ-UHFFFAOYSA-N 419.441 2.320 10 20 HECD CN(C[C@@H](O)C1CC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 757623292 MFMBBVBLQMUKOG-QGZVFWFLSA-N 401.429 2.454 10 20 HECD Cc1cc(CC(=O)N2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccc(Cl)cc1 758744425 QNKVJVMTYMCCAZ-UHFFFAOYSA-N 409.939 2.394 10 20 HECD COc1cc(N2CCN(CN3C(=O)CC4(CCCC4)C3=O)CC2)cc(OC)c1OC 758966609 YJQUZDBRCIOJAH-UHFFFAOYSA-N 417.506 2.111 10 20 HECD CCn1c(=O)c2ccccc2n2c(COC(=O)/C=C/c3ccc(O)c(O)c3)nnc12 759596112 MRPXFYPEOYJECG-CSKARUKUSA-N 406.398 2.232 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2coc(C(N)=O)c2)NC(=O)OC(C)(C)C)cc1 759900318 FQUVGJKQONPYDF-INIZCTEOSA-N 416.478 2.440 10 20 HECD C[C@@H](OC(=O)C[C@H]1COC(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767602524 RDBDLVIOOGVSGI-OLZOCXBDSA-N 421.405 2.285 10 20 HECD CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCOCC2)cc1 767685786 KDVDHZIAQTVMBS-GOSISDBHSA-N 407.511 2.069 10 20 HECD O=C(CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1)NCc1ccccc1 768233946 CGMKFSPFDKLWFC-UHFFFAOYSA-N 418.881 2.388 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3nc(-c4nccn4C)cs3)ccc21 768722838 VCUYKQRTHRBZKL-UHFFFAOYSA-N 410.503 2.181 10 20 HECD CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769958227 QOZXSXLXXDVMFT-UHFFFAOYSA-N 421.475 2.117 10 20 HECD CCN1CCN(c2ccc(CN[C@H](C)c3cccc(S(N)(=O)=O)c3)cc2F)CC1 774408361 IHHBOKPNOVFUCY-MRXNPFEDSA-N 420.554 2.466 10 20 HECD CCN(CC)S(=O)(=O)N1CCN(Cc2cc(Br)cc(C)c2O)CC1 775644238 BFYKZMDURNBYBJ-UHFFFAOYSA-N 420.373 2.167 10 20 HECD Cc1cccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1O 775646830 OOMCCINDUBQUCR-UHFFFAOYSA-N 404.517 2.212 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C(C)=O)cc3F)nc12 777199629 LCLRQQFVNCBZKR-UHFFFAOYSA-N 401.350 2.310 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccccc3)CC2)cc1 778225752 OCQPJOUBZCMCFO-QXMHVHEDSA-N 409.486 2.095 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4oc(O)nc4c3)CC2)cc1 778238869 QQJWZHDDLLQLCO-CMDGGOBGSA-N 422.441 2.386 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c(C)s1 779502854 HRPCEPWDHVYQCZ-XQRVVYSFSA-N 422.528 2.322 10 20 HECD COCCN=c1nc(N(C)Cc2ccccc2O)[nH]c(N(C)Cc2ccccc2O)n1 786792532 DKWLLUQIVJRZIX-UHFFFAOYSA-N 424.505 2.036 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CN(C)C(=O)c2ccccc21 787493951 MWTBCSNRRFSKIU-KRWDZBQOSA-N 416.861 2.417 10 20 HECD CN(Cc1nc2ccccc2s1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788310821 MQTVQVFSYXBJOX-UHFFFAOYSA-N 424.526 2.408 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cn1c(=O)n(CC)c(=O)c2ccccc21 789863653 ZTSWMDUOVPHQSH-UHFFFAOYSA-N 408.502 2.298 10 20 HECD COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 804083472 RDJWYIKHDUOQJF-GOSISDBHSA-N 424.545 2.329 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cnn(C)c1 805733294 QEPBCDUBQDDXJL-INIZCTEOSA-N 409.490 2.485 10 20 HECD CC(C)(C)CCCS(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 809814484 NRFPMXFKDZZXRZ-UHFFFAOYSA-N 402.582 2.167 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cn3nc(C(F)(F)F)cc3C)cc2)CC1 810695984 LSIWUYVXFWJPNP-UHFFFAOYSA-N 423.439 2.195 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](O)c3ccc(Cl)cc3F)CC2)cc1 813426563 ISJUUFQJMKGKSU-HXUWFJFHSA-N 421.900 2.460 10 20 HECD CN(C)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncn1C 857472351 LDYJLNPGWGGQML-APWZRJJASA-N 405.930 2.163 10 20 HECD O=S1(=O)N=C(N2CCN(Cc3c(O)ccc4ccncc34)CC2)c2ccccc21 917472429 QESBBPPPSCVXSR-UHFFFAOYSA-N 408.483 2.207 10 20 HECD NC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cccs1 919969127 ORYLXIWKUWYIMX-SFHVURJKSA-N 416.547 2.373 10 20 HECD Cc1cc(CC(=O)NC[C@@H](O)CN2CCCC2=O)c(C)n1-c1ccc(Cl)cc1 1319394787 RCFRRJPNDHPILO-LJQANCHMSA-N 403.910 2.390 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncc(OCC(F)F)c3)nc12 1344663780 HSNOTUHBUPWJPW-UHFFFAOYSA-N 422.344 2.008 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1 1798783214 QFYHQNJTFLETPX-JLVBRIDZSA-N 416.861 2.268 10 20 HECD Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808752159 VSMAXDVMGBBWFZ-MGPUTAFESA-N 421.457 2.158 10 20 HECD O=C([C@H]1C[C@@]1(F)Cl)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502418 VCJXURMFRTWJBP-QGHHPUGFSA-N 403.237 2.493 10 20 HECD COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847779545 XWGCTLKRBFMTDB-RDGPPVDQSA-N 423.469 2.121 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)NCc3sccc3C)nnc2n1 54366397 KQKOQSJNTXHCEF-UHFFFAOYSA-N 406.541 2.161 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21 302899597 PMFZICICJZCTCR-UHFFFAOYSA-N 414.531 2.306 10 20 HECD Cc1noc(C)c1S(=O)(=O)Nc1nc(-c2cccc(-n3cnnn3)c2)cs1 727248998 OLTOLVPRAGKODT-UHFFFAOYSA-N 403.449 2.191 10 20 HECD Cc1nc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1-c1ccccc1 731744620 UDUBFUQTLGHVRU-UHFFFAOYSA-N 407.474 2.457 10 20 HECD COc1ccc(O)c(CNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 734071076 QHWLTCGZHPPQIG-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc1 734416213 ONASEZOAYORHGQ-UHFFFAOYSA-N 423.516 2.158 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 735388395 JPMCTNPBKQWRQH-UHFFFAOYSA-N 410.474 2.398 10 20 HECD CN(C)c1ccc(CNC(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1F 741406553 JOKWEKUOXOZZEE-JOCHJYFZSA-N 400.498 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSCc3cccnc3)CC2)cc1 742917259 VMDQDOUMELYCJZ-UHFFFAOYSA-N 400.548 2.262 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1 743639605 WULBXHSOOKZXFL-HZPDHXFCSA-N 413.474 2.441 10 20 HECD CC1(C)[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]2CCCO[C@H]21 743649411 UKSPSHJZRHTGJT-IJXRJRJASA-N 414.550 2.391 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CC(N)=O)C3)cc2F)C[C@@H](C)O1 746758147 KVSFJNMOBIILQM-HLLBOEOZSA-N 406.502 2.236 10 20 HECD O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NCc1ccc(N2CCOCC2)cc1 747212501 DJIFXKYOMFGZDU-UHFFFAOYSA-N 412.881 2.147 10 20 HECD CN(Cc1ccccc1O)C(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1 748027713 QNUVKBAARLXDGZ-UHFFFAOYSA-N 405.407 2.160 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1 748856672 QEILEDLDPBHXSW-LBPRGKRZSA-N 407.268 2.279 10 20 HECD COc1ccc(N2CCN(C[C@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1F 753861595 STDOVOTYELMFSW-IBGZPJMESA-N 408.495 2.093 10 20 HECD CC[C@H](C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(=O)OC 754678245 ALEDWXDVBXAXQS-OSAWLIQMSA-N 423.529 2.233 10 20 HECD C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)c(F)cc1O 756417241 LXQPMDZXWCASRT-SNVBAGLBSA-N 424.270 2.360 10 20 HECD CC1CCC2(CC1)NC(=O)N(NC(=O)CN(C)c1ccc(OC(C)C)cc1)C2=O 759933037 ICFCCSVYGSLRNU-UHFFFAOYSA-N 402.495 2.442 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C 761996013 QUZODQVEASEWMF-UHFFFAOYSA-N 414.505 2.231 10 20 HECD CC(C)NS(=O)(=O)c1cccnc1N(C)Cc1ccc(N2CCOCC2)cc1 763010918 BJMLSNXLSKQKOY-UHFFFAOYSA-N 404.536 2.241 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)n(-c2ncccn2)n1 768033991 KPECMZIKNMYMOW-UHFFFAOYSA-N 419.489 2.166 10 20 HECD COc1cc(Br)cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362559 ATDHGGJPHNZJIQ-UHFFFAOYSA-N 409.236 2.166 10 20 HECD CCOC(=O)[C@H]1CCCCN1C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775260811 QBGXXCKHLXKJSR-FXAWDEMLSA-N 403.523 2.118 10 20 HECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2cccc(Cl)c2O)CC1 775644246 BOWQBAMVLRYWJN-UHFFFAOYSA-N 422.894 2.134 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3C3CCOCC3)cc2)C1 777719240 ANRXEXQRFLTJOF-CTNGQTDRSA-N 414.550 2.489 10 20 HECD NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779493260 LUAOCFNZICSAEV-KLDFUXOTSA-N 415.877 2.135 10 20 HECD CCCN(CCCN(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 786712143 LLIJSSNOOKBRET-IBGZPJMESA-N 403.571 2.262 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O 792035635 NVZQCYHXPVAXCE-IBGZPJMESA-N 411.424 2.343 10 20 HECD CN(C)c1ccc(CNCCNS(=O)(=O)c2cccnc2)c(C(F)(F)F)c1 793029043 OGLHCFCKKSLOFR-UHFFFAOYSA-N 402.442 2.235 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCC(NC(=O)C2CC2)CC1 793119806 FQPHQUUOJNXANZ-UHFFFAOYSA-N 403.498 2.364 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c(O)c1 797387798 PQRIYMSZDUXQFD-UHFFFAOYSA-N 413.474 2.445 10 20 HECD Cc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)co1 801393259 KMKIUZQZJNAFMW-UHFFFAOYSA-N 417.443 2.078 10 20 HECD COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 803688256 NXUIDIPMDZNMGI-MRXNPFEDSA-N 411.502 2.278 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CC2 804363226 WQMKLQLTICOTJP-KRWDZBQOSA-N 411.506 2.085 10 20 HECD COc1cc(N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)c([N+](=O)[O-])cc1OC 804701513 GUFMFKCDPKNAKO-UHFFFAOYSA-N 421.475 2.425 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCC(C3CC3)C3CC3)cc2F)CC1 805006818 HJPSYBXBBXMIRS-UHFFFAOYSA-N 416.541 2.136 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3COC4(CCCC4)O3)cc2)CC1 805024347 ITKZPDLFCCJBFH-FQEVSTJZSA-N 415.534 2.341 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](C4OCCO4)C3)cc2)CC1 805024384 DNTUXEVMZFMIAL-IBGZPJMESA-N 415.534 2.151 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](O)C(C)(C)C3)CC2)cc1 806334431 OMBWYMCHLIPUOH-HXUWFJFHSA-N 404.555 2.010 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncc(C(F)(F)F)c3)nc12 808619939 JZJRNYWVNPKPAH-UHFFFAOYSA-N 410.308 2.382 10 20 HECD COC(=O)C1(CS(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCC1 809806538 PIBANJOQNLTNOI-UHFFFAOYSA-N 410.536 2.018 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1 1000750716 XGKORWINOMXCBK-ZXLDYLNASA-N 411.462 2.278 10 20 HECD CC1=c2c(=N)nc(C)[nH]c2=S=C1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 1639624889 NZHRIZRYBYFUFP-UHFFFAOYSA-N 415.544 2.070 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1799368414 DGSARDSTWWICKF-CLLJXQQHSA-N 404.854 2.348 10 20 HECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1cccn1 1800719276 GDJDGTAKDCWHJM-REBRKWNGSA-N 418.881 2.461 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2ccco2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992360 XBLMQRRXQBTUJV-KUHUBIRLSA-N 408.414 2.114 10 20 HECD O=C(Cc1ccncc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428412 XGEZVEVDBDAGOS-IBGZPJMESA-N 424.501 2.364 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)/C=C/c2ccco2)C1 1842079682 JEEGKECEDPKNPY-XVYDYJIPSA-N 410.426 2.326 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1 725849716 VQGIMMCAGGJDSW-QGZVFWFLSA-N 421.475 2.048 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc3c(c2)OCCO3)c(O)c1O 727005196 JZOHPSGUSOEJCF-CYBMUJFWSA-N 401.415 2.082 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1O 729859294 LVJMMNLJNDXMLY-MRXNPFEDSA-N 408.458 2.446 10 20 HECD C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc2c(c1)CCCN2C 735518852 MVEYQFRHYDOKCI-LJQANCHMSA-N 422.577 2.474 10 20 HECD Cn1cc(C(=O)COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cn1 741307585 UHDQIDXEUNQJFW-UHFFFAOYSA-N 419.349 2.143 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(N2CCNC2=O)c1 743958320 RESKAIGKROCFGX-UHFFFAOYSA-N 408.458 2.056 10 20 HECD CCCCn1c(=O)nc(O)c2c1nc(CN1CCOc3cc(N(C)C)ccc31)n2C 746492299 IBFLBXJDIZXRIU-UHFFFAOYSA-N 412.494 2.101 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(-c4ncccn4)s3)cc2)C1 749499509 RNXAIUZUNWKCCH-OAHLLOKOSA-N 422.514 2.232 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H]1[C@@H](O)C(F)(F)F 750636923 IQIAKGWRPYVOLH-JKSUJKDBSA-N 405.392 2.260 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 753871267 IEANEGIUUROTMS-RBUKOAKNSA-N 410.536 2.017 10 20 HECD COc1ccc(N2CCN(CCNc3ncc(Br)c(OC)n3)CC2)cc1 754471473 OYLAJPMQDRQUIS-UHFFFAOYSA-N 422.327 2.490 10 20 HECD CCc1cc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)on1 759268683 ZDZBOASGNKOTTJ-UHFFFAOYSA-N 404.467 2.295 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)[C@@H]3CCCOC3)CC2)cc(OC)c1OC 759295969 CDAYFBUBCSXJRK-HZPDHXFCSA-N 407.511 2.359 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCc1ccccc1CN1CCCC1=O 759592951 HQOBIVPWDAOIIB-CSKARUKUSA-N 424.453 2.093 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)cc2C1=O 761026787 VTPIJBXGDUROIY-UHFFFAOYSA-N 406.486 2.170 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@@H](Cc4ccncc4)C3=O)cc2F)CC1 761275105 DEECZDBNOOBRSL-IBGZPJMESA-N 411.481 2.026 10 20 HECD COCc1nc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n[nH]1 761868175 UZRNETBSGMDZAV-BETUJISGSA-N 423.514 2.112 10 20 HECD CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 763421101 KTMLRQHCKLQZPI-UHFFFAOYSA-N 408.476 2.443 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCC[C@@H]1N1CCOCC1 763660802 UVOSGTFOSWCDOB-VXKWHMMOSA-N 416.566 2.308 10 20 HECD O=C(NCc1ccncc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774118235 TYNZFCNPDYYJJZ-OAHLLOKOSA-N 404.417 2.084 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCc2cccnc2)cc1 774356857 NZIFPQLECOEAGU-UHFFFAOYSA-N 407.426 2.369 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCNC(=O)c3ccccc3)cc2)CC1 786261312 ANILKDAKCGRBAP-UHFFFAOYSA-N 422.529 2.182 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)cc1 788938287 DAEUIWPHTLCAGO-UHFFFAOYSA-N 424.461 2.250 10 20 HECD CCCCCN(CCO)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822430 AUULPHIQJSBWRY-IAGOWNOFSA-N 423.529 2.067 10 20 HECD CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 798166437 ZMCFBGUVCMFZRU-FQEVSTJZSA-N 416.566 2.478 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3O[C@H](C)C[C@H]3C)cc2F)C[C@@H](C)O1 800296895 ZWKMJCXAASRUOH-FPBPVBFYSA-N 422.497 2.412 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC2CC(NS(C)(=O)=O)C2)cc1 802422098 KJJWDHWPNFZUJB-UHFFFAOYSA-N 420.535 2.138 10 20 HECD COCC[C@@H]1CCCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803301254 OBJKSZNPTCXVPU-OALUTQOASA-N 417.550 2.366 10 20 HECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 804881159 OMMGNKGMCBFPCM-HEWZJLJBSA-N 420.462 2.122 10 20 HECD CCCNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)cc1 808108942 UGWKZGNWGSMBQV-UHFFFAOYSA-N 412.489 2.084 10 20 HECD O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1cc(Cl)cc(Cl)c1O 811528174 ALOKYCRSMSJBJG-UHFFFAOYSA-N 407.250 2.433 10 20 HECD COc1cccc(C(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c1 912886325 CDNWLGZEEDGTIJ-UHFFFAOYSA-N 424.545 2.178 10 20 HECD CC(=O)Nc1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 917833881 USJGCNUCAKYENQ-LJQANCHMSA-N 408.502 2.206 10 20 HECD Cc1c[nH]cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934907 YSIFFQDPXSDVPJ-VBUUOAMHSA-N 419.485 2.368 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)/C=C/c2ccco2)C1 1842077829 PCAIREAQFUWTJS-MDZDMXLPSA-N 418.453 2.289 10 20 HECD O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502111 PWVUEXHBMCGTCJ-SGIREYDYSA-N 406.891 2.443 10 20 HECD C[C@@H](NCc1nnc2n(C)c(=O)c3ccccc3n12)c1ccc(N2CCOCC2)cc1 65278424 GVBIBOMBXSYOEM-MRXNPFEDSA-N 418.501 2.269 10 20 HECD COc1ccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1NC(C)=O 552656556 OFBSYOZIYNOHTI-UHFFFAOYSA-N 422.485 2.386 10 20 HECD COC(=O)N1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726720632 YKDGMCSRHJSBDT-UHFFFAOYSA-N 412.437 2.350 10 20 HECD CCOC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730194478 JCXCNAUDBMYEEH-SFHVURJKSA-N 420.529 2.452 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C4CCC4)CC3)cc2F)C[C@@H](C)O1 733614287 JYYNJKGMURKESL-HDICACEKSA-N 418.557 2.226 10 20 HECD CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 741181451 XNICZYUTAFDUQB-GOSISDBHSA-N 420.529 2.356 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 743160886 ITSXJAFFRKRPAO-UHFFFAOYSA-N 418.519 2.348 10 20 HECD COc1ccc2c(c1)OC[C@H](C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 747375935 UREGTCWUASOOSX-RTBURBONSA-N 423.513 2.264 10 20 HECD O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748481699 LREWAQLKRYGCJQ-UHFFFAOYSA-N 424.501 2.462 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 753611258 PRTWWEJMMDREQO-UHFFFAOYSA-N 419.494 2.333 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](C4CCOCC4)C3)CC2)cc1 754842104 OWURKSIPYKMUFO-HXUWFJFHSA-N 416.566 2.275 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCCO[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 756924780 PVXLCYQNLBZVEH-JFIYKMOQSA-N 409.502 2.434 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(OCCO)CC3)cc2F)C[C@@H](C)O1 757626932 FTZDRTGXVZTSJE-IYBDPMFKSA-N 409.502 2.122 10 20 HECD COc1cc(N2CCN(Cn3nnn(C(C)(C)C)c3=S)CC2)cc(OC)c1OC 758953896 HPJCOEBRJAFLCN-UHFFFAOYSA-N 422.555 2.370 10 20 HECD CCCN1CCC(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 759210560 BCQIULLMTWZNOB-UHFFFAOYSA-N 420.554 2.418 10 20 HECD Cc1c(NC(=O)NCCc2ccc(O)c(O)c2)cccc1S(=O)(=O)NC1CC1 761644811 CHVGBMNHYSRRTN-UHFFFAOYSA-N 405.476 2.211 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1 766317428 DAGNXKCFXVUSAH-UHFFFAOYSA-N 415.449 2.171 10 20 HECD Cc1ccc(S(N)(=O)=O)c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 767854529 ZWVKIEXAXGCBNY-INIZCTEOSA-N 404.488 2.169 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCCS(=O)(=O)CC1 768061940 WFTZIZAHHZFDGC-UHFFFAOYSA-N 417.478 2.087 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCOC4(CCC4)C3)cc2)C1 769037947 PINOQPVSXHSYBV-ROUUACIJSA-N 400.523 2.289 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1F 776038646 KEYPZWNYLBCAPR-INIZCTEOSA-N 412.465 2.091 10 20 HECD CN(C)c1ccc([C@@H](CN[C@@H]2CCCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 777302439 PPCLDQXUYBBQHW-SJLPKXTDSA-N 411.568 2.485 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)[C@@H]4c5ccccc5CCN4C3=O)cc2)C1 777609249 BWCGRMHAMNETAA-RXVVDRJESA-N 418.497 2.450 10 20 HECD C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ncn2nccc2c1=O 777822743 KIRIRTLMWCDPMD-MRXNPFEDSA-N 403.442 2.387 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 779476224 ZCBQQVHMHQLAHW-UITAMQMPSA-N 416.499 2.389 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccc(F)cc3F)cc2)C1 779878123 ZORHWCQYEQFGEQ-HNNXBMFYSA-N 423.485 2.286 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1 784106741 NGONFTUWVNSEQC-UHFFFAOYSA-N 405.462 2.406 10 20 HECD C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785438671 DUBJKRUSFGUNCC-NVXWUHKLSA-N 418.538 2.131 10 20 HECD CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 786693445 ZBSPPPCLENFHED-KRWDZBQOSA-N 411.502 2.416 10 20 HECD C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331263 ILGLJAIKWJFFDN-HOCLYGCPSA-N 413.440 2.329 10 20 HECD CCO[C@@H]1C[C@@](O)(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 788744683 YENQWHIOHGMFRU-WIYYLYMNSA-N 409.502 2.028 10 20 HECD CCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789825612 NAJRHDDBQWRJJF-SOLBZPMBSA-N 421.513 2.083 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CS(=O)(=O)CC(C)C 791251082 YWLGDFCMIALEMV-UHFFFAOYSA-N 412.552 2.446 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1cccc(N(C)C)c1)c1ccc(N2CCOCC2)cc1 803298680 WIBUFLQGQPKHBP-GOSISDBHSA-N 424.545 2.425 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@H]1C 803310479 KLXUPOQGMLLRGX-LQWHRVPQSA-N 416.566 2.032 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCC3CCN(C)CC3)cc2)CC1 803375377 DGIBMVZMKUEAKL-UHFFFAOYSA-N 400.567 2.387 10 20 HECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809885564 IORVARYUDJPFME-MRXNPFEDSA-N 420.554 2.473 10 20 HECD O=C(CN1CC[C@@H](n2cc(Cl)cn2)C1)NCc1ccc(N2CCOCC2)c(F)c1 810131092 GNIIMJHYFHJVSM-QGZVFWFLSA-N 421.904 2.075 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 810630195 GVWVGNMYJNUSAN-XJKSGUPXSA-N 403.914 2.060 10 20 HECD C[C@H](NC(=O)N(C)CCCN(C)CCN(C)C)c1ccc(N2CCOCC2)cc1 812014051 FVBRQIQOCRUFHH-IBGZPJMESA-N 405.587 2.109 10 20 HECD COc1ccc(N2CCN(C(=O)NCCC(=O)N3CCC[C@H](C)C3)CC2)cc1F 1343742265 GGKZMKGQEXXBGY-INIZCTEOSA-N 406.502 2.315 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1CC1(F)F 1804286418 VAFOKARNLPCLKF-LSIKNRGBSA-N 408.401 2.110 10 20 HECD Cn1cc(F)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501235 PTBYWFURVXONJD-UHFFFAOYSA-N 407.829 2.360 10 20 HECD Cc1cc(F)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1F 1846822203 NWNOBOPTZFKPBM-UHFFFAOYSA-N 403.385 2.210 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2nnc3n(C)c(=O)c4ccccc4n23)cc1 16323330 NLUYNAOBNBGXFF-UHFFFAOYSA-N 422.514 2.056 10 20 HECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 60749835 FASKAOWBSNLLGW-UHFFFAOYSA-N 408.502 2.462 10 20 HECD Cc1ccncc1N1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 570959445 BXKPUNOPBVOKQO-UHFFFAOYSA-N 405.502 2.155 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(N4CCCC4)nc3)CC2)cc1 727208409 STZVNXQTIHSMPJ-UHFFFAOYSA-N 424.501 2.196 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c1 739697035 VCSHFTNMRMAYJU-KRWDZBQOSA-N 404.536 2.048 10 20 HECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743958488 ZVSYGZULWMNBBY-UHFFFAOYSA-N 405.458 2.321 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C)CC34CCCCC4)CC2)cc1 746493181 PJHNSXDLDJDDDE-UHFFFAOYSA-N 400.567 2.294 10 20 HECD O=C(NCc1ccccc1O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 748347339 ZYIXERICLZWBJJ-KRWDZBQOSA-N 419.459 2.160 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)cc1 757017352 IKVLZUGKQBKBSO-QHCPKHFHSA-N 423.561 2.303 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)cc(OC)c1OC 760087009 YIKIXSAADDXXGS-UHFFFAOYSA-N 417.418 2.289 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](CCO)C3CCCCC3)CC2)cc1 760863598 OOPNQSFLOVSKBD-GGAORHGYSA-N 405.583 2.099 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3csc4nccn34)CC2)cc1 764605882 FFYJRJAFZDPMGR-UHFFFAOYSA-N 413.547 2.275 10 20 HECD COc1ccccc1OC[C@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 765403527 OQFVRRHDENHPOI-CYBMUJFWSA-N 408.476 2.217 10 20 HECD O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NCc1c(O)ccc2c1CCCC2 768159700 QDCIMQFXJSTERR-UHFFFAOYSA-N 422.529 2.411 10 20 HECD C[C@@H](CN1CCOCC1)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 771185116 CTMIFRVRTGLMQJ-ZDUSSCGKSA-N 424.409 2.248 10 20 HECD CC(C)CN1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)[C@@H](C)C1=O 777470946 XEXLHMMFSSYSDA-MSOLQXFVSA-N 402.539 2.483 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 781484860 WHHLDNAOWNCLCP-UHFFFAOYSA-N 411.458 2.206 10 20 HECD COC(=O)c1cc(Cl)cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785294012 JFPVUHUNPJUVQW-JTQLQIEISA-N 406.822 2.224 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1cccc(C(N)=O)c1 787855945 MSBILVSAQUQDBD-UHFFFAOYSA-N 408.502 2.051 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)N1CCOCC1 791250456 QXFRWNUYPSPTQQ-UHFFFAOYSA-N 419.522 2.014 10 20 HECD CC(=O)OC(C)(C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792355781 FZTWYBDDOVSMNV-UHFFFAOYSA-N 409.394 2.285 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1OC 796790852 PLCHTEOOLHYVRF-LLVKDONJSA-N 402.403 2.012 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccncc1C(F)(F)F 800689152 FTEVXOQMTMXFQW-UHFFFAOYSA-N 413.421 2.265 10 20 HECD Cc1cc(Cl)nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803306466 VNAWYASGVKKXFC-OAHLLOKOSA-N 416.909 2.374 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](CN(C)CC3CC3)C2)cc1F 804852089 YTSNHNRDVUDGMJ-LJQANCHMSA-N 418.557 2.478 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 808237796 GMERIJNXLXPFDW-GASCZTMLSA-N 415.531 2.062 10 20 HECD CS(=O)(=O)c1ccc(-c2csc(CC(=O)NCc3ccc(O)c(O)c3)n2)cc1 815835784 FJTCNJHKHBPRFE-UHFFFAOYSA-N 418.496 2.484 10 20 HECD CC[C@@H](C)[C@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)OC 914905475 IKIPMCGIRCEFJY-YJYMSZOUSA-N 401.463 2.350 10 20 HECD CSc1ncc(Cl)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 918370742 BFZSIKCIQBWHFX-CYBMUJFWSA-N 419.938 2.484 10 20 HECD Cn1c(=O)cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 1317901712 ZLCGHHIBSMBXPK-KRWDZBQOSA-N 418.497 2.170 10 20 HECD Cn1cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794951976 TVBDITSODQLMSF-VBUUOAMHSA-N 419.485 2.070 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccc2nsnc12 19096753 MCOOURAKTHIHKU-UHFFFAOYSA-N 404.517 2.349 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)CN(C)C4)CC2)cc1 726728734 ZLNYOIOBAOKTHI-UHFFFAOYSA-N 408.502 2.364 10 20 HECD Cc1ccc(CN(Cc2cc(=O)n(C)c(=O)n2C)c2ccc3c(c2)OCCO3)s1 727149842 BETCGBKFZYNBTH-UHFFFAOYSA-N 413.499 2.432 10 20 HECD CCO[C@H]1C[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 740887209 QUHDUZXCFPRESF-UXHICEINSA-N 407.530 2.414 10 20 HECD CN1CCN(c2ncccc2CNC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740910784 VLIAQCKBGIREFM-UHFFFAOYSA-N 406.534 2.209 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1 743915875 OZUFATRSRNWYLS-UHFFFAOYSA-N 400.431 2.106 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)ccc3[N+](=O)[O-])nc12 745388821 IHZALQRCRVPIOH-UHFFFAOYSA-N 400.347 2.185 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 753340344 CEUFVOVFDQLUBW-MRXNPFEDSA-N 422.503 2.365 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1 753640248 MSQBLKFGCBOZIK-JSGCOSHPSA-N 410.517 2.060 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(Cc4ccco4)C3)CC2)cc1F 753737876 GEVYGISXKDNCEK-HNNXBMFYSA-N 401.438 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnc(OC(C)C)c3)CC2)cc1 759964569 BZWSEAIDFWDKHI-UHFFFAOYSA-N 413.474 2.383 10 20 HECD C[C@H](NC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(N(C)C)cc1 776127995 HLNVWXPNPANNRA-FPTDNZKUSA-N 409.490 2.368 10 20 HECD Nc1ccc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc1 776460854 LDVYMLKPMFCGDG-UHFFFAOYSA-N 401.378 2.235 10 20 HECD NC(=O)C1CCN(CCc2ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)cc2)CC1 779512960 ZGOPRYRHFBOTKV-YWEYNIOJSA-N 409.486 2.490 10 20 HECD Cc1cc(O)cc(=O)n1CCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 783567277 WNAQTMSVTWXFJI-HZPDHXFCSA-N 417.481 2.322 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C(F)(F)c3ncccc3C)cc2)CC1 785031836 LMGHZOVDDGQEMA-UHFFFAOYSA-N 402.445 2.467 10 20 HECD CC(C)COCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 785550657 LTNDGYKJOVBYHH-CALCHBBNSA-N 423.529 2.234 10 20 HECD COc1cccc2c1OCC(C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)=C2 786263059 SIADIPHWUAJXAY-UHFFFAOYSA-N 421.497 2.456 10 20 HECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cccc1N1CCNC1=O 787454754 IDDVYVVYUCUKFQ-UHFFFAOYSA-N 409.490 2.188 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(Br)nc2OC)c1 789562532 JGJDKDGACCSPRL-VIFPVBQESA-N 424.251 2.383 10 20 HECD CN(C)C(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 799773614 OFRYAUAKWLAKOJ-GOSISDBHSA-N 418.515 2.464 10 20 HECD COC(=O)[C@@H](CNC(=O)c1cccc(O)c1O)Oc1ccc(Br)cc1 803766498 IEJYSUPAAZCQPS-CQSZACIVSA-N 410.220 2.211 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccco3)CC2)cc1F 804851437 CDHBJDLITNLNKI-UHFFFAOYSA-N 416.497 2.226 10 20 HECD OCc1cn(CCCNCc2cc(Br)cc(Br)c2O)nn1 811511438 IRALNOWPALXHSX-UHFFFAOYSA-N 420.105 2.181 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)C(=O)OC4)CC2)cc1 813872260 ZYFDDZKUQDBAPJ-CMDGGOBGSA-N 421.453 2.209 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCC(=O)NCCN2CCCCCC2)cc1F 814299248 WDKLDYULUZJTLI-UHFFFAOYSA-N 421.561 2.463 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCn2ncn(C)c2=O)cc1 815548311 SVDDYQLYZZDMDP-UHFFFAOYSA-N 409.490 2.280 10 20 HECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](c1ccccc1)c1ncc[nH]1 817489363 ZQPSIYTVBHOOBK-QGZVFWFLSA-N 400.460 2.348 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 920635644 JESKBZXVURMMRN-SMSYFYOWSA-N 424.519 2.250 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccnc2)CC1 1827202102 QPIKUKCXGKZLFG-IBGZPJMESA-N 424.501 2.364 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3ncnn3C)C2)cc1 1842342762 GSPUTTRDBKGQKG-UHFFFAOYSA-N 418.501 2.353 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 110466272 NJMOTJOITQNTNY-UHFFFAOYSA-N 424.544 2.046 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN(C(=O)C3CCCCC3)CC2)n(C)c2ccccc12 570476778 MRAADOPPJKJANW-UHFFFAOYSA-N 424.545 2.354 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC(=O)N1CCc2ccccc21 726190666 RUNHZUGUNDUNAA-UHFFFAOYSA-N 408.502 2.254 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CCN(C[C@H]2CCCO2)CC1 734269020 GOHKACPTKALDQB-LJQANCHMSA-N 420.529 2.105 10 20 HECD COc1cccc(CNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1O 741072708 DLJZXYNKIPVXBI-UHFFFAOYSA-N 405.476 2.472 10 20 HECD CCc1ccccc1NC(=O)CNC(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 741795941 VDRZNMRRFIPTQU-UHFFFAOYSA-N 415.490 2.466 10 20 HECD CN1CCCN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cc(Cl)ccc21 741964086 GRFFOUPUZQGHHG-UHFFFAOYSA-N 406.895 2.011 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)ncn2C 743890358 XMHOCOFEGVWMBW-UHFFFAOYSA-N 407.474 2.007 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O 743914665 VQTOEQFQESQPBO-UHFFFAOYSA-N 423.922 2.373 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3Cc3ccccn3)cc2)C1 746147445 PBKAYZAABRKPMT-DENIHFKCSA-N 421.545 2.064 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1C(=O)N(C)C 751818155 MGJVAJNLYCNJOS-UHFFFAOYSA-N 408.502 2.334 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N(C)C)cc1C 752669964 LZMLMQXQXSVMEK-NRFANRHFSA-N 412.534 2.234 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](C)S(=O)(=O)c3ccc(F)cc3)CC2)cc1F 753737746 DCYWSVKPPAEUMD-CQSZACIVSA-N 424.469 2.484 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)N(C)Cc1ccccc1O 753834603 MBGOHHIHJYEPBK-JMGFVUJMSA-N 410.392 2.336 10 20 HECD COC(=O)c1ccccc1NC(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 753857154 LZFHXEILPKFBSZ-UHFFFAOYSA-N 401.438 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)NCCn3c(=O)oc4ccccc43)CC2)cc1F 753909772 UPGVSWACTNJBTR-UHFFFAOYSA-N 414.437 2.274 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)C(C)(C)CN(C)C)CC2)cc1 754355753 RPSYIHAEWZODFW-GOSISDBHSA-N 405.587 2.093 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(C(=O)NC4CC4)cc3)CC2)cc1 756945997 JFQKTLHBVGOBMP-UHFFFAOYSA-N 422.529 2.139 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(C)ccc3S(N)(=O)=O)CC2)cc1 758003456 MZEBYWAHLFZGJD-UHFFFAOYSA-N 403.504 2.004 10 20 HECD COc1cc(N2CCN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 759871642 CUIALLTWIMUBDX-SFHVURJKSA-N 417.462 2.476 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@@H](C4CCOCC4)C3=O)cc2F)C[C@@H](C)O1 761090010 HQIUNFYCMPVDOY-KSMMKXTCSA-N 405.470 2.286 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@]4(CCc5ccccc54)C3=O)CC2)cc1 761186618 SHNJHYGCFWZNIJ-DEOSSOPVSA-N 420.513 2.211 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc([N+](=O)[O-])c1 761597295 YRPQOAOYGGRFAL-HNNXBMFYSA-N 417.487 2.250 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)c1 761973556 RKPURWMYMMBFQB-LLVKDONJSA-N 404.375 2.386 10 20 HECD C[C@@H](NC(=O)N1CCC(C)(C)S(=O)(=O)CC1)c1ccc(N2CCOCC2)cc1 774797774 UQWNQYDIVNPDGU-MRXNPFEDSA-N 409.552 2.193 10 20 HECD C[C@H](NCC(=O)NCCCN1CCCCCC1=O)c1ccc(N2CCOCC2)cc1 775259012 DVEOIEAJNLLLQP-IBGZPJMESA-N 416.566 2.083 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)c3c(C)n[nH]c3C)CC2)cc1 776289854 RCSQPEYQHBTDJV-AWEZNQCLSA-N 400.479 2.031 10 20 HECD COc1cc(N2CCN(C(=O)c3cc4nn[nH]c4cc3F)CC2)cc(OC)c1OC 781981281 JQWYXGVCFMFWDC-UHFFFAOYSA-N 415.425 2.085 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(N(C)C)cc1 785572741 AAXVXSWHSHASJG-PGRDOPGGSA-N 424.545 2.120 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C(=O)Nc3c(C)cccc3C)cc2)CC1 786428380 REKJFWSZOHAIAS-UHFFFAOYSA-N 408.502 2.227 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1ccncc1 786792668 MWNIKHYULCEEJV-UHFFFAOYSA-N 406.280 2.257 10 20 HECD COC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1C 787323248 VDSXMTHLGRGAIQ-UHFFFAOYSA-N 412.490 2.017 10 20 HECD CC(=O)Nc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788931415 FMQFEBBBEQYATB-UHFFFAOYSA-N 408.502 2.220 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 788931980 KZQOPXVPPLPRGM-OAHLLOKOSA-N 415.494 2.042 10 20 HECD CC[C@@H](C)NC(=O)CCNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 793664456 GYQLPJOPQYMXNO-MRXNPFEDSA-N 403.523 2.475 10 20 HECD CC[C@@H]1CCCCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793716322 CEDLQTYOPAKVEQ-RBUKOAKNSA-N 414.550 2.186 10 20 HECD C[C@H](NC(=O)C(=O)NCCN1CCc2sccc2C1)c1ccc(N(C)C)cc1 793856701 CLJYGPCEXCJZAA-HNNXBMFYSA-N 400.548 2.166 10 20 HECD CC[C@@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(C)cc1O 794795113 GOBIJMBMTLWZRL-LJQANCHMSA-N 418.563 2.288 10 20 HECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c1OC 795344194 FMNKUBIWUVFDNN-UHFFFAOYSA-N 412.851 2.417 10 20 HECD COc1c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cccc1[N+](=O)[O-] 796305590 CICNHYASDVSDDK-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CNC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCO1 799994156 NSAFBLIQKQSTBF-RDTXWAMCSA-N 408.930 2.233 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(OC(F)F)nc1)c1ccc(N2CCOCC2)cc1 802552736 LGIQXLOFUXBZFX-CYBMUJFWSA-N 420.416 2.336 10 20 HECD CCc1nc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 803310523 HPNJNXQEHNDCSA-HNNXBMFYSA-N 416.547 2.378 10 20 HECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688698 YZVUHTQIMGTUPQ-SFHVURJKSA-N 409.486 2.334 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H](C4CCC4)C3)cc2)C1 813593836 DDIMOGMUVPRINY-PMACEKPBSA-N 414.550 2.346 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O 814211919 VICLTDPFOITJPU-UHFFFAOYSA-N 416.455 2.413 10 20 HECD Cc1nc(N(C)C)sc1S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccn2)c1C 821615259 PETZKEWXUFWMBA-UHFFFAOYSA-N 419.532 2.439 10 20 HECD Cn1c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc2ccccc21 918117836 KQBAAFKVGZIQNE-QGZVFWFLSA-N 420.517 2.274 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccncc3)cc2)C1 918372803 PVPKQLFEFPWRPE-QGZVFWFLSA-N 404.474 2.103 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCNS(=O)(=O)c1cccnc1 918657438 CUZASSMLUSXJKF-UHFFFAOYSA-N 404.536 2.253 10 20 HECD O=C1Cc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)c(Cl)cc2N1 1318912489 CSLSSAKCJRCFTE-UHFFFAOYSA-N 419.890 2.322 10 20 HECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 1319334831 ODPXQXUOHYSYLJ-UHFFFAOYSA-N 415.465 2.486 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)C)CCO3)C2)cc1 1781752919 BUXJTIKHYYXCAV-DEOSSOPVSA-N 424.545 2.099 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2CCC(F)(F)C2)C1 1841017137 IYNDPJLEENSUEA-KQIUPUNMSA-N 422.428 2.455 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccs2)C1 1842371247 RFNPYZHOYNLYCC-UHFFFAOYSA-N 408.483 2.358 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)ccc1F 486442948 CXBOJHNPNRVQQY-UHFFFAOYSA-N 408.455 2.231 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccc(Cl)nc3)cc2)C1 725825507 OOGXMEBOBSRXQO-MRXNPFEDSA-N 422.938 2.056 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)[C@H]3CCS(=O)(=O)C3)c2C)cc1 727056755 BEZHOSNYWSKXAE-SFHVURJKSA-N 418.515 2.182 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1 729066642 OCFOJJZESYSKQN-NSHDSACASA-N 404.419 2.243 10 20 HECD CCOC(=O)c1c(NC(=O)CN(C)Cc2ccccc2O)sc(C(N)=O)c1C 731843717 TVTPAPMLVVWDNQ-UHFFFAOYSA-N 405.476 2.108 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)cc1 734075366 YKDPBAGHSWELNS-UHFFFAOYSA-N 417.531 2.500 10 20 HECD CC(C)[C@H](NC1CCOCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 743315703 ZJILRZXKJOYBRR-NRFANRHFSA-N 407.530 2.196 10 20 HECD CNS(=O)(=O)[C@@H]1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 749805459 DDHMIRILRPZTIS-LJQANCHMSA-N 408.568 2.289 10 20 HECD C[C@@H](CC[S@@](C)=O)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069280 HLALANIYAOTSEV-JPQMIFPKSA-N 416.546 2.141 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCc2ccccc2C1 751227953 NYLYDVCLNYVVTG-UHFFFAOYSA-N 419.522 2.180 10 20 HECD Cc1nnccc1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753509599 HWTPRSSHEIPGOG-UHFFFAOYSA-N 401.378 2.356 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)cc2F)CC1 753926833 YBQRUWKDCARGHI-SJLPKXTDSA-N 403.546 2.392 10 20 HECD CC(=O)N1CC[C@H](CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 754843634 ZZPLEYMROOMFBF-TXPKVOOTSA-N 420.529 2.449 10 20 HECD O=C(O)c1ccc(Br)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 757653685 CJVLMRJWQRNBBK-UHFFFAOYSA-N 416.205 2.352 10 20 HECD CC[C@@H](C)N(C)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759268737 WSRZGXFQPGBZQF-MRXNPFEDSA-N 408.543 2.274 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1CC(F)(F)F 762553430 SOSNKKDYUIYTQQ-AWEZNQCLSA-N 418.435 2.440 10 20 HECD COC(=O)C1(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 766832815 RIVBPSKJBRANKF-GFCCVEGCSA-N 421.405 2.285 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC4(CCCC4)C3)cc2)C1 766880164 KBZRVUZIZYOMCO-GOSISDBHSA-N 400.523 2.243 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c(C)s1 768441180 WWMQDANSGVAEQJ-KRWDZBQOSA-N 424.544 2.003 10 20 HECD COC(=O)CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769779009 RROLGXQXXXOJKK-MRXNPFEDSA-N 406.460 2.188 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H]3CC(=O)OC)cc2F)CC1 772601782 OXWPYCXYZHUBSH-KRWDZBQOSA-N 406.502 2.205 10 20 HECD COC(=O)Cc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772903960 GNGNHUGOWFLDCQ-UHFFFAOYSA-N 415.465 2.106 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)N1CCN(c2ccccc2)CC1 773751027 ZUSXZHXQBRATES-QGZVFWFLSA-N 411.502 2.274 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC(c4cn[nH]c4)CC3)CC2)cc1 774693306 SNFSTUYKLKZLSU-UHFFFAOYSA-N 412.538 2.130 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@H](C(=O)N(C)C)O3)cc2)CC1 774715895 LTQFHISMZRCGHN-VQTJNVASSA-N 402.539 2.358 10 20 HECD Cc1nc(N)nc(C)c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 777849082 MJFFWVGUCMBENH-UHFFFAOYSA-N 409.412 2.461 10 20 HECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1C 779476910 YFYWHDRDYIJELH-YVMONPNESA-N 416.499 2.261 10 20 HECD CCO[C@@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 788744681 YENQWHIOHGMFRU-NQIIRXRSSA-N 409.502 2.028 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797390627 KLPPGEIJJLMNHH-UHFFFAOYSA-N 400.431 2.106 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1 806281181 PSGPTWHKNUOWSO-LLVKDONJSA-N 411.471 2.311 10 20 HECD CC(C)c1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)on1 806430919 FMRNEBFGLMUWAZ-MRXNPFEDSA-N 401.463 2.328 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(c2nc(C)c(C)s2)CC1 807096753 IMTKZWGFORSJPC-UHFFFAOYSA-N 415.563 2.099 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)c1 810448200 XWTMZJJEHLXHED-UHFFFAOYSA-N 416.499 2.068 10 20 HECD COc1ccc(N2CCN(CCN[C@@H](c3ccc(F)cc3)c3nc[nH]n3)CC2)cc1 815569196 KJEQYEMHNKIESM-NRFANRHFSA-N 410.497 2.454 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NCc1ccc(OC)cc1O 816550951 JICZNQKYTSMTSO-QHCPKHFHSA-N 423.469 2.406 10 20 HECD C[C@@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 916834471 QEUHQCPEXWMWIX-HXUWFJFHSA-N 400.567 2.042 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1 918308844 ALIQPBBNYNNSFP-UHFFFAOYSA-N 400.454 2.368 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H]3NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1 1006585190 XGKORWINOMXCBK-WJQMWINMSA-N 411.462 2.278 10 20 HECD CCOC(=O)C1=S=c2nc(/C(Cl)=C\c3cccc4nccn34)nc(O)c2=C1C 1319829467 WSGDHOIELSANLU-FMIVXFBMSA-N 414.874 2.471 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(=O)oc1)c1cc(O)c(O)c(Cl)c1 1795376145 JBPJPBGSZPSKRC-BTTYYORXSA-N 418.833 2.270 10 20 HECD C[C@@H](Cc1ccncc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1801248565 JADJAVDIDCUQAV-RUGDWHBFSA-N 410.474 2.018 10 20 HECD CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824134532 QLYGQJZCDJCLTQ-VQIMIIECSA-N 419.522 2.133 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CC1)CC2 1828200021 IWGOXQXZJBZJJI-GXWOQWCDSA-N 415.471 2.295 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2ccoc2)C1 1846675169 QYDACKHXLCAIIJ-UHFFFAOYSA-N 420.469 2.209 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)cc2F)CC1 730235203 OIBKLWHDPUWGBU-HNNXBMFYSA-N 408.518 2.497 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC[C@@H](NS(C)(=O)=O)C3)cc2)CC1 731049015 WNJLXWUUABPESD-GOSISDBHSA-N 408.568 2.146 10 20 HECD O=C(NCCNC(=O)c1c(F)cccc1F)NCc1ccc(N2CCOCC2)cc1 732996212 CUYRXNGGCKSHDJ-UHFFFAOYSA-N 418.444 2.031 10 20 HECD CCN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H](C)CS(=O)(=O)CC 733341839 FOOAPKWDWCSZSN-OAHLLOKOSA-N 415.531 2.017 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)COc3cc(Br)ccc32)c1 734016394 OMNVDVCSBOFGQH-UHFFFAOYSA-N 421.247 2.205 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)cc1 735633544 DBSOUCQULQAIPO-UHFFFAOYSA-N 422.529 2.488 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](CN3CCCC3)C2)c1 739874072 AMSPYYGGAZBRQN-IBGZPJMESA-N 401.551 2.345 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N(C)C)cc2)cc1OC 740776431 AYGJKMRONFBDBD-UHFFFAOYSA-N 406.504 2.250 10 20 HECD O=C1CC[C@]2(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)SCCN12 742800433 KAPJTYFSJNFJGW-ORAYPTAESA-N 411.474 2.439 10 20 HECD C[C@@H](NC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 746168805 QUBXIOGLAODHGQ-NTKDMRAZSA-N 409.530 2.337 10 20 HECD COc1ccc2c(c1)OC[C@@H](C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 747375928 UREGTCWUASOOSX-MOPGFXCFSA-N 423.513 2.264 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccnc3NC(C)C)CC2)cc1 748452800 IGZCRRTXGFAHAX-UHFFFAOYSA-N 412.490 2.416 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC 751227055 BORAXPGTGCBDRG-UHFFFAOYSA-N 424.494 2.283 10 20 HECD COCc1nc2n(n1)C[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)CC2 757786718 HOVACNAMGLPKBZ-MRXNPFEDSA-N 411.462 2.450 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 758222849 KZNCIFRJKXKRFY-QGZVFWFLSA-N 405.426 2.304 10 20 HECD O=C(COc1cccc2c1OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 760563079 YUXBVNJNWHTBKY-UHFFFAOYSA-N 402.422 2.129 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NOC1CCOCC1 773236283 KDKZLUNBJGUART-UHFFFAOYSA-N 403.401 2.452 10 20 HECD Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc12 773764037 UERKKASGVKYDKN-PWSUYJOCSA-N 416.503 2.220 10 20 HECD COC(=O)[C@H](C)SCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 777504227 RGDUQUIEZMPBMS-ZDUSSCGKSA-N 410.517 2.219 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](Cc4ccccc4)C3=O)cc2)C1 777610386 JSSBWSDVNFSOEG-ICSRJNTNSA-N 406.486 2.051 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)cc1 778388672 JWDOSLCEYDXCLT-IENJSVCTSA-N 423.513 2.353 10 20 HECD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)/C=C/c1ccc(O)c(O)c1 779483364 YSUFEQXGJNFQHV-CSKARUKUSA-N 404.488 2.255 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1 787107503 MSCIKDQPOWWKQQ-FQEVSTJZSA-N 417.550 2.281 10 20 HECD COC(=O)[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]1C 787505986 XALAJANNYSWJEV-DGCLKSJQSA-N 424.500 2.278 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H](c2ccccc2)C1 788913248 WDTWSBPTTOLCEZ-QFIPXVFZSA-N 406.530 2.418 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H](Oc1ccccc1)C(C)(C)O 795749389 WEUMJMLVLLMSMT-NRFANRHFSA-N 414.502 2.473 10 20 HECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cccc(OC)c1O 796392172 RHMAOEBBSVNAPA-UHFFFAOYSA-N 408.476 2.042 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1F 796680894 RJVICMFNHKINTE-UHFFFAOYSA-N 405.401 2.415 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298468 UHVMFUDGVHVCMS-UYAOXDASSA-N 416.566 2.081 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccnc3OCC(F)F)ccc21 803687989 JJYSNVWUQSLARI-UHFFFAOYSA-N 418.444 2.041 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3cc(F)cc(F)c3)CC2)cc1 804030137 RDPPISHAVQSIRZ-UHFFFAOYSA-N 417.456 2.371 10 20 HECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H](C)C1 806457241 HBPRJMGOLSZUCL-XSLAGTTESA-N 422.545 2.036 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cn2cccc(C)c2n1 806537293 JBAWTGUQLUKEBD-UHFFFAOYSA-N 407.518 2.416 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cnn(CC(F)(F)F)c1 808396483 ZHMCQPBVWMGITK-UHFFFAOYSA-N 411.428 2.176 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cn(C)nc3C)ccc21 809033023 BWYXGSSATWKWLG-UHFFFAOYSA-N 404.492 2.065 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 814994692 WGLCZEMLGJEYKW-XHSDSOJGSA-N 400.516 2.285 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCCN3C3CCCC3)nc12 815444637 GQPDGISMZBAOHS-QGZVFWFLSA-N 416.478 2.452 10 20 HECD Cc1ccc(F)c(N)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 920577810 MRQZIJJVBAXELW-UHFFFAOYSA-N 419.428 2.165 10 20 HECD COCC(=O)NCCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 1317892473 QPGANMLOSINSJC-UHFFFAOYSA-N 404.438 2.420 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2)[nH]n1)c1cc(O)nc(O)c1 1817844360 YPXSHGWRYYOYHE-OAHLLOKOSA-N 408.418 2.231 10 20 HECD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCc1ccc(N(C)C)cc1 8171397 KHHYNNNVJCIHOW-IBGZPJMESA-N 421.588 2.469 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 726561478 ZPPGPKZJEJKUMU-CQSZACIVSA-N 423.560 2.209 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(C(=O)OC)CC3)cc2F)CC1 734275527 NHWIFTIJSXHXNN-UHFFFAOYSA-N 406.502 2.062 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 742283953 YERMIIQPDJJZAI-UHFFFAOYSA-N 424.906 2.442 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)Cc2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 742752146 YZWOUQNVTQNKIR-GOSISDBHSA-N 401.511 2.411 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4[nH]ncc4c3)cc2F)CC1 743907621 VYENFVUBCYJLGQ-UHFFFAOYSA-N 424.480 2.099 10 20 HECD Cc1ccc(N2CCC[C@@H](OC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2=O)cc1 744854620 LTHIZQLZLXZLIN-GOSISDBHSA-N 418.471 2.425 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CSCc3cscn3)cc2)C1 746826827 RICCRTWHCMYZBR-OAHLLOKOSA-N 404.561 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)CC2)cc1F 753741218 DIOVNTKVAYWCPT-QFIPXVFZSA-N 413.493 2.384 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cc(-n4cnnn4)ccc3C)CC2)cc1F 753841239 RCYGMMMAWLAXJC-UHFFFAOYSA-N 411.441 2.473 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 754022010 MSVDSMKTEGNQOH-UHFFFAOYSA-N 424.542 2.124 10 20 HECD COC[C@H](CCO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 755994854 YIABLIJAUZBVCV-LQELWAHVSA-N 414.574 2.243 10 20 HECD Cc1cc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1F 762608323 QSZHRKPJCJUQLQ-UHFFFAOYSA-N 420.415 2.144 10 20 HECD Cc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)c1 766879580 RSXZBXZWXSAJDV-UHFFFAOYSA-N 413.497 2.398 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N(C)C)cc2C)s1 772606172 VDCRTLFPMAVIIR-UHFFFAOYSA-N 410.565 2.209 10 20 HECD COc1ccc([C@H](CCO)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 774848970 URARPVXZVQTEDE-QFIPXVFZSA-N 413.518 2.066 10 20 HECD COC(=O)[C@@H](Cc1ccc(F)cc1)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 783569635 NLVKYMKDRCDIHO-GHTZIAJQSA-N 413.493 2.401 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ncnn1-c1ccccc1 787348472 AEBDQNLIRQCTGA-UHFFFAOYSA-N 406.490 2.446 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c1 787485129 KMHKWMPQUQXRNJ-ZDUSSCGKSA-N 412.446 2.055 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN2CCC[C@H]2C1 788584774 QIBWMOSOYRPODA-HOTGVXAUSA-N 424.339 2.246 10 20 HECD Cc1cc(C(=O)CN(C)CCCCCO)c(C)n1-c1ccc(S(N)(=O)=O)cc1 789341020 POIGZTMFHBTFOW-UHFFFAOYSA-N 407.536 2.019 10 20 HECD COc1ccccc1CONC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789861644 QVCVBWOSPPDOAI-UHFFFAOYSA-N 415.515 2.113 10 20 HECD C[C@@H](O)[C@@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)Cc1ccccc1 791417246 KIBKQECZZHCKJW-JLTOFOAXSA-N 406.504 2.123 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c(O)c1 797630960 VBCCJXDSCALFTB-UHFFFAOYSA-N 405.476 2.411 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(-c4cccnc4)noc3C)nc12 803822967 XTNCHCWRLWCRSU-UHFFFAOYSA-N 423.385 2.327 10 20 HECD CN(C[C@@H]1CCCO1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769361 TXHNSQLNPCZRNQ-YOEHRIQHSA-N 411.449 2.010 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN4c5ccccc5C[C@H]4C3)nc12 810050920 SYSIDAZCFKFMOQ-KRWDZBQOSA-N 407.474 2.249 10 20 HECD CN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1cccc(Br)c1O 816625044 PHSWYAQSMOGCFE-UHFFFAOYSA-N 415.309 2.313 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)N3CCc4ccccc43)CC2)cc1 915927738 XEBPQTIWRWZTLF-UHFFFAOYSA-N 421.545 2.169 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 917712121 HEMZVOJXUXQOGC-IYBDPMFKSA-N 424.480 2.274 10 20 HECD CCOc1ccc(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918338228 MAXDGEGEEYMHLY-UHFFFAOYSA-N 402.516 2.179 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1 918463210 JBLDTGPUGXCWIY-SFHVURJKSA-N 408.502 2.260 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC[C@H]3CCCC[C@H]32)c1 920637052 YGKQKWSCSHNGLD-CZUORRHYSA-N 410.492 2.102 10 20 HECD Cc1cc(OCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)no1 921159081 IYHCPBDXZPSOPL-UHFFFAOYSA-N 420.377 2.319 10 20 HECD COC(=O)N1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1319925424 HZOWPQGWAIVDHP-UHFFFAOYSA-N 421.453 2.175 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2)c1cc(O)nc(O)c1 1794101441 VWFJEANPEJBSNH-ACDBMABISA-N 421.497 2.476 10 20 HECD O=C(CC1CCC1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1814115958 POGBIULTGCZQLR-HRAATJIYSA-N 410.474 2.398 10 20 HECD COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc(F)cc3)CC2)cc1 8028407 IZNDQPREAJLPGC-UHFFFAOYSA-N 406.479 2.347 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2F)CC1 730268675 BXKYMTIBXXITLY-UHFFFAOYSA-N 422.482 2.354 10 20 HECD CC1CCN(c2ccc(CNC(=O)C3=CC=CN4CCS(=O)(=O)N=C34)cc2)CC1 731014852 MLFGJQVRYDKVCY-UHFFFAOYSA-N 414.531 2.037 10 20 HECD CCOc1ccccc1OCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742917503 YQAJBVYLFLESHP-UHFFFAOYSA-N 413.518 2.411 10 20 HECD CNS(=O)(=O)c1ccc(CCC(=O)NCc2ccc3c(c2)CCCN3C)cc1 746811996 WCGXMOCASUZJOT-UHFFFAOYSA-N 401.532 2.226 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1 752022971 JBKROOFTUPAACQ-VGSWGCGISA-N 415.538 2.395 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C4CCOCC4)C3)cc2)C1 755060432 YKOIGQALZDEWPU-UXHICEINSA-N 414.550 2.346 10 20 HECD COC(=O)c1cccc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 758575102 CJVWERXOWMZXQA-LJQANCHMSA-N 409.486 2.034 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)CC2)nn1 759205178 UNNWMBIXRQJQBI-UHFFFAOYSA-N 408.462 2.345 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cnn(CCO)c1-c1ccccc1 764383734 VVVSARZVTSQSTA-UHFFFAOYSA-N 424.476 2.448 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cc(C)cn(C)c3=O)cc2F)CC1 766194116 PJIWOUCXDCPNCI-UHFFFAOYSA-N 401.486 2.296 10 20 HECD CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 766330096 RVFLNTMFOOJOOC-RTBURBONSA-N 423.579 2.457 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 766403308 PIBOQECGLHPQAI-UHFFFAOYSA-N 413.474 2.350 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccccc1S(=O)(=O)CCN(C)C 767535540 CWVNPEUDMUICAH-UHFFFAOYSA-N 403.548 2.326 10 20 HECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)CN1C 768769258 FWEYXHITBMUPRI-WNRNVDISSA-N 406.546 2.080 10 20 HECD C[C@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 769320449 PKWSKUXKDAJKLT-UNMCSNQZSA-N 414.594 2.336 10 20 HECD Cn1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc(Br)c1=O 772438363 OSRVQEYUJIUBKI-UHFFFAOYSA-N 421.295 2.306 10 20 HECD COCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 772955356 SHDVQVKPPRRQLV-UHFFFAOYSA-N 415.465 2.188 10 20 HECD COC(=O)CCCN1C(=O)/C(=C\c2cc(Br)nn2C)SC1=S 778243664 CIAUFMOTUMOVRJ-RMKNXTFCSA-N 404.311 2.337 10 20 HECD Cc1cc(N(C)C)ccc1CNC1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1 779346558 IIFJUQYQCIJLAJ-UHFFFAOYSA-N 405.568 2.344 10 20 HECD CCCCCN(CC(N)=O)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 780338949 QQKMAEILWJFBTA-UHFFFAOYSA-N 407.470 2.378 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)c2ccc(C)c(O)c2O)s1 780931538 ZJTHIJHHDNHZIN-UHFFFAOYSA-N 412.533 2.471 10 20 HECD COCCO[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 781962932 DYBCOUAUNHJTCG-HNNXBMFYSA-N 408.454 2.138 10 20 HECD O=C(OCC(=O)c1ccc(O)c(O)c1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 783026214 QQHMOTNEXMQWTH-UHFFFAOYSA-N 400.362 2.141 10 20 HECD Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 786223142 AYRIAVZGXWBFRI-SFTDATJTSA-N 424.545 2.100 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccnc3OCC(F)F)cc2)CC1 786661646 VHHQSKQSZDMDEV-UHFFFAOYSA-N 418.444 2.324 10 20 HECD C[C@@H]1C[C@@]2(CCO1)CN(C(=O)C(=O)NCc1ccc(N3CCCC3)cc1)C[C@@H](C)O2 788940669 YEHOCNPEEPVYQS-PNCHPQGNSA-N 415.534 2.088 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cccc(O)c3)CC2)cc1 788977870 NNEATURYLZVIRB-UHFFFAOYSA-N 410.518 2.203 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NOC3CCCCC3)cc2F)C[C@H](C)O1 789816621 DSGVJVMGXHTRIR-GJZGRUSLSA-N 407.486 2.436 10 20 HECD COC(=O)c1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OC 790285923 NPUZLDJSLLRGBL-UHFFFAOYSA-N 414.458 2.218 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 796770049 YEGVCQHJBDHTMM-UHFFFAOYSA-N 423.517 2.490 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)CC3CCCC3)cc2)C1 798382989 FXQQHPHVIPXABP-WOJBJXKFSA-N 416.566 2.376 10 20 HECD COc1ccc(O)c(CNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1 800519497 RBRYITJWJYIIRE-UHFFFAOYSA-N 400.410 2.449 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccc(F)c(F)c1 803659371 QPAFMEZLMUWAPG-QGZVFWFLSA-N 409.408 2.290 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)c3ccncc3OC)CC2)cc1 807175709 PZKJQJSMORLOEX-INIZCTEOSA-N 412.490 2.015 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@@]2(CCOC2)C1 807769528 GXXNKJGYALQUND-QVKFZJNVSA-N 423.460 2.012 10 20 HECD CCc1cnc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 807770689 RQXPQLFEHIOYAZ-OAHLLOKOSA-N 403.504 2.235 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CC2(C(=O)OC)CCCC2)cc1C 811683631 VIEGRKIZJYPNIY-UHFFFAOYSA-N 418.537 2.232 10 20 HECD Cc1cnc(Br)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 812988622 HCVOTGWIEIGMJU-SNVBAGLBSA-N 408.252 2.250 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cnc1C 813671424 NIUBHRNLVHZZKY-INIZCTEOSA-N 420.487 2.252 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NCc1cccc(OC)c1O 815834533 MVLQBCUWJUCHOM-HSZRJFAPSA-N 423.469 2.406 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)O)c2)cc1C 917757996 FTTJURNAWSVQFX-UHFFFAOYSA-N 404.491 2.317 10 20 HECD C[C@H](Oc1cccc(F)c1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339174 BXCFINQVHYXIEA-HNNXBMFYSA-N 406.479 2.144 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccccc2)nc1C 1321048607 KVMMBRGQKZPOPU-SFHVURJKSA-N 409.442 2.496 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1C(=O)NC(C)(C)C1=O 1346271740 JQGFOUZFBDFEHK-UHFFFAOYSA-N 403.527 2.393 10 20 HECD C[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1nnnn1C 1518425706 UIMVMXQYALWFET-LZAIMSLLSA-N 422.561 2.130 10 20 HECD CCO/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832049344 TXQWHFFYTJEZOH-UEICXMAYSA-N 403.479 2.276 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@H]32)C1 1844271666 JWBAGNGVVZXKMK-FHWLQOOXSA-N 423.494 2.198 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1ccccn1 1847036755 AWPUGKJBFFIATE-LOWQCSRCSA-N 423.469 2.219 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 27787103 REJLSHHGLRJYFH-UHFFFAOYSA-N 415.402 2.205 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1 47455146 GPFXCOGBQSKRJN-UHFFFAOYSA-N 404.536 2.196 10 20 HECD C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 145478291 ZEWOLDJCONRZMV-INIZCTEOSA-N 417.531 2.265 10 20 HECD O=C(c1cccc(NS(=O)(=O)c2cccc3nsnc23)c1)N1CCC(O)CC1 569375665 YBGNLNRGDPAGNQ-UHFFFAOYSA-N 418.500 2.089 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(NC(C)=O)c(OC)c2)c1 729063297 INCZUVNCKITNDA-NSHDSACASA-N 401.419 2.184 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)c1 729064658 UMISFJBHZJDJMV-AWEZNQCLSA-N 411.458 2.453 10 20 HECD CC(C)C[C@@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 733846896 AGFANPCOZHPKJY-AZUAARDMSA-N 402.539 2.345 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2cc(OC)ccc2O)ccc1Cl 734075167 ZUWLVNNSDJWFSF-UHFFFAOYSA-N 406.822 2.486 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCN2CCCC2=O)NC(=O)OC(C)(C)C)cc1 742755069 VHNFCELCHFEBSV-SFHVURJKSA-N 418.538 2.447 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(N4CCCC4=O)cc3)CC2)cc1 742916488 JOSNGHNERZWKGG-UHFFFAOYSA-N 422.529 2.374 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C3CC3)[C@H](C)O)c2C)c1 745739615 JGOSFAGVIXFOGU-KKSFZXQISA-N 412.486 2.404 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n(C2CCOCC2)n1 746379379 LCXNVPJTQSCQHM-UHFFFAOYSA-N 411.506 2.180 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(=O)NC3CCCC3)cc2F)C[C@@H](C)O1 746725257 DIHKRJPFOCVHOO-HUUCEWRRSA-N 406.502 2.297 10 20 HECD O=C(CSc1nnc(S)s1)NCc1ccc(N2CCC(CO)CC2)cc1 747396294 QINCZIKZGHGJIR-UHFFFAOYSA-N 410.590 2.444 10 20 HECD CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 750275051 ATOIYKCASALGBM-QGZVFWFLSA-N 415.475 2.191 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCN(Cc4ccccc4)C3)CC2)cc1 758184105 DSLVXEQXMJIHGJ-LADGPHEKSA-N 424.589 2.042 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@]12CCCO2 759319698 PPLYOFFWKCRSLU-KCZVDYSFSA-N 403.523 2.391 10 20 HECD COC(=O)C1CCN(C(=O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C(C)C)CC1 759597858 TULJUFVJWXHQJN-XZXOBPBMSA-N 405.447 2.090 10 20 HECD O=C1COc2ncc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2N1 770790793 GLISWPOMNBYOEJ-OAHLLOKOSA-N 416.865 2.166 10 20 HECD O=S(=O)(CC1CCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 771732144 PCNGEZKLVMBILA-UHFFFAOYSA-N 419.526 2.162 10 20 HECD C[C@@H](NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccc(N(C)C)cc1 773023837 KSWJBLDYBZEZOT-CMJOXMDJSA-N 406.486 2.323 10 20 HECD COCCNC(=O)Cn1cc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cn1 773421318 PBMHKRQLFFHLNK-UHFFFAOYSA-N 416.482 2.156 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccccc3)cc2F)C[C@@H](C)O1 774458155 KGYUESDEGXTSRZ-IAGOWNOFSA-N 413.493 2.414 10 20 HECD Cn1c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2cccc(Cl)c21 774762715 YSKMZYOUERYBTJ-UHFFFAOYSA-N 408.867 2.234 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(C)(OC)CC3)CC2)cc1 775409557 NXQPHISKMVJTCY-UHFFFAOYSA-N 404.555 2.418 10 20 HECD CC(C)Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(O)n1 777361906 TTZKCPNDRSHYAT-UHFFFAOYSA-N 417.531 2.151 10 20 HECD COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1cc(Br)cc(C)c1O 780784030 NUUCVCXIZMOQJZ-RISCZKNCSA-N 400.269 2.390 10 20 HECD Cc1ccc(C(=O)N2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c(O)c1O 780931451 JPLLXXCKGNICQH-CQSZACIVSA-N 408.451 2.128 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C3=CCN(C)CC3)CC2)cc1 781355869 HCPWBJCADFQRBF-IBGZPJMESA-N 415.582 2.157 10 20 HECD Cc1cnc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 782104377 FHOHLJBUYZSQQX-TXEJJXNPSA-N 406.483 2.459 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC([C@H]4CCCO4)CC3)CC2)cc1 784361103 FQLWSXAJEKDTTQ-FYYLOGMGSA-N 403.567 2.069 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(Cl)cc3)cc2)CC1 786121567 HPQHNTTVNGETHS-UHFFFAOYSA-N 407.923 2.487 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(N2CCCC2)c1 786500543 PTALMIUUARPEEA-UHFFFAOYSA-N 409.534 2.413 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(F)(F)CC3)cc2F)C[C@H](C)O1 789818378 JOQQHEYFSJCDGJ-KBPBESRZSA-N 413.440 2.313 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncccc3Br)nc12 796095490 QVAFQZPYMKCPJO-UHFFFAOYSA-N 421.207 2.126 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@@]13CCOC3)c2[N+](=O)[O-] 799428702 BHDXCBJELYRPQW-QFIPXVFZSA-N 422.393 2.002 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)CCn3cc[nH]c(=O)c3=O)cc2Cl)C1 800571564 KGQCAZLUMCZHSQ-AWEZNQCLSA-N 404.898 2.133 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H]1C 803450751 PCKAWCBSWWLPDN-KBPBESRZSA-N 411.449 2.009 10 20 HECD CN(C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCSC1 803451457 LJLHJYQRYLEAKA-OAHLLOKOSA-N 413.490 2.337 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 804975380 MLTHTJWNJJBJKK-LJQANCHMSA-N 415.538 2.003 10 20 HECD CN(C)c1ccc(CNC(=O)c2cnn(C)c2I)cc1F 815151436 OHBXYAAJRUCCEL-UHFFFAOYSA-N 402.211 2.160 10 20 HECD CN(C)c1noc(CCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 857455307 AANUCSBBGFDKBR-CYBMUJFWSA-N 409.437 2.455 10 20 HECD C[C@H](Oc1ccc(F)cc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335043 LBOLSYXAOUKITK-HNNXBMFYSA-N 406.479 2.144 10 20 HECD CC[S@@](=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918372611 NGHANRRBGYMAEY-CQGGRAHPSA-N 413.543 2.446 10 20 HECD CCOc1ccc(N2CCN(C(=O)COCCNC(=O)OC(C)(C)C)CC2)cc1 1319624479 LWUHDQCSNXTSHJ-UHFFFAOYSA-N 407.511 2.275 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 1320180088 HFQMYPGOEHEEKI-OKEUPSHZSA-N 403.460 2.183 10 20 HECD CN1CCN(c2ccc(CN3CCNC(=O)[C@@H]3c3ccccc3F)cc2F)CC1 1320379278 RSMPDVMCNOBRDU-NRFANRHFSA-N 400.473 2.390 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2ccc(F)cn2)C1 1843048400 IDDUCKLVFGLBEV-UHFFFAOYSA-N 419.840 2.345 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)n(C)c2ccccc12 472779135 ZDRIMCDJFFQLSF-UHFFFAOYSA-N 406.421 2.461 10 20 HECD CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 729305512 MRSLVQPGXXPMAR-HSZRJFAPSA-N 407.514 2.455 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)CC3CCN(C)CC3)cc2F)CC1 730133494 VXYXBDOYHBCMSS-UHFFFAOYSA-N 405.562 2.451 10 20 HECD C[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 737037778 MHMYUEVDUMWEEA-LJQANCHMSA-N 416.566 2.338 10 20 HECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1 737277969 AYROSNUQXBOBCE-UHFFFAOYSA-N 401.419 2.248 10 20 HECD COC(=O)CN(Cc1csc(CS(C)(=O)=O)n1)Cc1cc(Cl)ccc1O 744403357 YHFAXPDRUKBMIO-UHFFFAOYSA-N 418.924 2.222 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(C)noc3C(F)F)CC2)cc1 746081325 CRASJHQLTZLZAN-UHFFFAOYSA-N 409.389 2.435 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1 746133665 HTWWRFPGJNAPLR-IBGZPJMESA-N 411.506 2.340 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)nc3)cc2)C1 746513816 WCNHTKKQMNJVRM-HNNXBMFYSA-N 417.307 2.476 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H](O)Cc1ccccc1 747387163 FTYBIETYCACHFR-XJABCFGWSA-N 424.545 2.180 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc1 751269617 HLNPHGLGFSUFEX-UHFFFAOYSA-N 420.516 2.494 10 20 HECD CS(=O)(=O)N1CCC[C@@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 753689851 RUTJTEWUSIDOQN-MRXNPFEDSA-N 407.492 2.121 10 20 HECD CCOc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1cccc2nonc12 753923895 NGLJKDYLESXVMB-UHFFFAOYSA-N 417.491 2.174 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3c3noc(C)n3)CC2)cc1 754015062 ZAEHMMOLOVIXMD-TZIWHRDSSA-N 415.538 2.097 10 20 HECD CN(C)c1ccc(CNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1F 755645697 XZQSAFUNBVWCHC-UHFFFAOYSA-N 414.547 2.284 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(CC(=O)Nc3ccc(F)cc3)no2)c1 758283190 JXSKFCBLHMRAQE-UHFFFAOYSA-N 406.395 2.134 10 20 HECD C[C@@H](NC(=O)NC1CCN(c2cccnn2)CC1)c1ccc(N2CCOCC2)cc1 758495704 QVAKQWWOXQRIQD-QGZVFWFLSA-N 410.522 2.342 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(F)c3)cc2F)C[C@H](C)O1 759428785 CMLGYEKUAAXTCG-KBPBESRZSA-N 419.428 2.447 10 20 HECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCCCSc2nccs2)C1 759589492 JHLWXJJVILRIHE-KGLIPLIRSA-N 400.570 2.198 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccn(C)c3)cc2F)C[C@@H](C)O1 764117103 DZTRHCWOTNTURQ-GASCZTMLSA-N 403.454 2.251 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNc3ccccc3C(N)=O)cc2F)C[C@H](C)O1 764384211 WEEPDONITMXFFQ-GJZGRUSLSA-N 414.481 2.267 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCOC2(CCOCC2)C1 769201909 WRHCTLWLFLPJJI-IBGZPJMESA-N 403.523 2.393 10 20 HECD Cc1ccn(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(=O)c1 772125410 UMRDJQBHFJREAD-UHFFFAOYSA-N 409.408 2.329 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccnc(N(C)C)n3)cc2F)C[C@H](C)O1 775727479 SUJVMBLSOFXVRY-GJZGRUSLSA-N 416.501 2.295 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CC(C)(C)OC)CC2)cc1 778287996 CHTUWYKNQIKDFH-MQNTZWLQSA-N 403.523 2.220 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1 782538291 CXSVYLGBHFOBOH-UHFFFAOYSA-N 404.536 2.345 10 20 HECD COCCOc1cc(C)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785297652 RBHAVCGFVOMFID-CQSZACIVSA-N 402.447 2.117 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(-n2cncn2)cc1 785402040 ZHPSEFBHOYWLDS-MRXNPFEDSA-N 418.501 2.143 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCNC(=O)C3CCCCC3)cc2)CC1 786256698 JJCOYDOSVMOWIY-UHFFFAOYSA-N 414.550 2.058 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3[nH]c4c(c3C)C(=O)CCC4)cc2)CC1 787321006 YWHLVTXCTIJROH-UHFFFAOYSA-N 408.502 2.441 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(N2CCCC2=O)c1)c1ccc(N(C)C)cc1 788226038 RUQBNARFNLRRQB-MRXNPFEDSA-N 408.502 2.373 10 20 HECD CC(C)C[C@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 788745372 GFFAWMKSWREJHB-XXBNENTESA-N 416.566 2.471 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC(=O)N(CC2CC2)C1 789377112 GUOHKJKDBOTWGX-AWEZNQCLSA-N 417.465 2.301 10 20 HECD Cc1cc(C(=O)NCc2ccc(S(=O)(=O)CCO)cc2)c(C)n1-c1ccccn1 791967643 FSLNWGQDBJSEIH-UHFFFAOYSA-N 413.499 2.185 10 20 HECD COc1ccc(N2CCCN(C(=O)c3nnn(Cc4cc(C)no4)c3C)CC2)cc1 794241447 GOSADXIFVMDUSZ-UHFFFAOYSA-N 410.478 2.292 10 20 HECD C[C@H]1CCCN(c2ccc(CNS(=O)(=O)CCS(C)(=O)=O)cc2Cl)C1 800149246 XENYUOFCGXTXNC-ZDUSSCGKSA-N 408.973 2.040 10 20 HECD COCCCn1nccc1CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802649594 MDFVJHPHCBAFTJ-UHFFFAOYSA-N 404.511 2.268 10 20 HECD Cc1nc(C)c(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803301374 ZWZGDVGEOXJZDB-CYBMUJFWSA-N 402.520 2.090 10 20 HECD C[C@@H]1CN(c2ccccc2F)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662837 HKXNUDVULUVPSX-OAHLLOKOSA-N 416.472 2.384 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@@H]2CCn3ccnc3C2)cc1)C1CCCCC1 803677127 GOTPPZJYNSXWGK-GOSISDBHSA-N 409.534 2.399 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)c3nc(C)cs3)CC2)cc1 804317062 RVNCULQEEUBKCN-AWEZNQCLSA-N 416.547 2.465 10 20 HECD COc1ccc2c(c1)nc(CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)n2C 806667977 QVJPDPUMDNIRLR-AWEZNQCLSA-N 409.490 2.142 10 20 HECD Cc1cc(Cl)cnc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 812957522 MIXLYGONDATUQV-UHFFFAOYSA-N 402.882 2.477 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 917355449 DKWDAWCSOGXKSE-HRAATJIYSA-N 416.474 2.486 10 20 HECD CC(C)C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 917355975 PPKUQKOMRAFJCK-YESZJQIVSA-N 400.475 2.122 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cc1 917762647 UAOCAPJMNXVDFY-UHFFFAOYSA-N 420.487 2.266 10 20 HECD Cc1nc([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)no1 1116580612 WNTKNNZXUGUCHJ-MCIONIFRSA-N 405.474 2.098 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCCC[C@H]3N(C)C)CC2)cc(OC)c1OC 1116594741 NAMBYDVAXDRVCA-ZWKOTPCHSA-N 420.554 2.417 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3cc(Cl)ccn3)CC2)cc1 1317912738 XMBBHXAXSSLPMV-UHFFFAOYSA-N 402.882 2.212 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3csnn3)cc2)CCC1)c1cc(O)nc(O)c1 1786477763 ASOSDPVXXQFDFA-UHFFFAOYSA-N 411.443 2.406 10 20 HECD Cc1ccnc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810552481 ZTHNEEVXFJFJNK-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817845083 XTMUCNLNAQIGIC-MRXNPFEDSA-N 424.461 2.483 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccn1 1846668496 PZSMQDWPJSGFBI-HEWZJLJBSA-N 423.469 2.219 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccccc3C)CC2)cc1 12069558 BQSZAUAZTADQBD-UHFFFAOYSA-N 410.518 2.271 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3ccc4c(c3)OCCO4)CC2)cc1 57878502 QWDIUAVZHNMKNM-UHFFFAOYSA-N 411.502 2.247 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCC(NC(=O)c3ccsc3)CC2)cc1 115819363 MQWITWOWYMEIDQ-UHFFFAOYSA-N 400.548 2.325 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cccs3)cc2F)CC1 303302949 MZCWZYRUXSYRML-UHFFFAOYSA-N 404.511 2.075 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cccc(C(=O)NCC(N)=O)c3)ccc21 482985749 CAZMIBRIRRNIIS-UHFFFAOYSA-N 422.485 2.372 10 20 HECD CCCN1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 730578465 SEPRJOVEHJLQGC-SFHVURJKSA-N 401.555 2.062 10 20 HECD CC1CCN(c2ccc(CNC(=O)CCNS(=O)(=O)c3cccnc3)cc2)CC1 731017149 YMZNEWKVOYZNSO-UHFFFAOYSA-N 416.547 2.303 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(N2CCCC2=O)c1 741096739 FIJUHMNCQZQKAS-UHFFFAOYSA-N 404.470 2.445 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN3Cc3ccccn3)cc2)C1 746147450 PBKAYZAABRKPMT-KNQAVFIVSA-N 421.545 2.064 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CC(=O)NC)CC3)cc2F)CC1 746416827 AFGIKNWOIDEZJE-UHFFFAOYSA-N 419.545 2.025 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3cc(OC)ccc3O)C2=O)c1 747958369 ZYJWFNPKPLUITC-GOSISDBHSA-N 415.446 2.023 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C[C@H]4CCOC4)CC3)CC2)cc1 749567443 XHAALBNFERDLLB-GOSISDBHSA-N 402.539 2.028 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H]1[C@H](O)C(F)(F)F 750636906 IQIAKGWRPYVOLH-CVEARBPZSA-N 405.392 2.260 10 20 HECD O=C(CN1CCC(c2nc[nH]n2)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 751500311 YOJWZEKZYLZBNS-UHFFFAOYSA-N 415.453 2.398 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CSCCS3)cc2)C1 752880383 ITHFEZJESBHPCV-WBVHZDCISA-N 408.593 2.036 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 753640274 NEXUSQWJFBASNJ-RNRVQEDPSA-N 418.490 2.127 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(O[C@@H]2CCOC2)c1 755889020 KFYRVEJNXCQETJ-MRXNPFEDSA-N 420.849 2.424 10 20 HECD COCCNS(=O)(=O)c1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)cc1 756483497 ORADJBIREZRUGD-ZDUSSCGKSA-N 409.464 2.076 10 20 HECD COC(=O)c1cc(NC(=O)NCc2ccc(N(C)C)c(F)c2)cc(S(C)(=O)=O)c1 758654872 YXYHBWFTSFLHPO-UHFFFAOYSA-N 423.466 2.404 10 20 HECD COc1cc(N2CCN(Cc3nc(-c4ccccn4)no3)CC2)cc(OC)c1OC 759886736 QGYPNHMVLZRHNB-UHFFFAOYSA-N 411.462 2.480 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cn(CC2(C)COC2)nn1 759930742 FNXNUEAFHHLZFC-UHFFFAOYSA-N 409.284 2.445 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2sccc2OC)cc1OC 760343182 DDPDKNSXFJLFOR-UHFFFAOYSA-N 406.507 2.328 10 20 HECD CC(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)c(S(N)(=O)=O)c1 770444976 LTVGHUPNGZIVOT-UHFFFAOYSA-N 407.467 2.124 10 20 HECD COc1cc2c(cc1OC)CN(C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1)CC2 772768897 LHEHNZDPWCMNQN-XQRVVYSFSA-N 413.426 2.256 10 20 HECD O=C(NCc1ccc(OC(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 775233167 PYFSMAIYBQHZKI-UHFFFAOYSA-N 419.428 2.057 10 20 HECD O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NCc1ccc(O)c(O)c1 778928837 CPNHJTCLNSUAHZ-UHFFFAOYSA-N 404.488 2.131 10 20 HECD CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc(S(C)(=O)=O)c1 779529378 PHIFDCNIDFYAGF-FNORWQNLSA-N 405.428 2.330 10 20 HECD CCCn1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784767558 PPQCMZJDBMWNOS-INIZCTEOSA-N 419.913 2.371 10 20 HECD CN(Cc1ccc(Cl)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317932 BIUZBSNXHAZNCY-UHFFFAOYSA-N 401.894 2.451 10 20 HECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931848 HVYCCHVAXVXFIT-KRWDZBQOSA-N 411.502 2.495 10 20 HECD C[C@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800842 QJHBXLJJXUVFES-INIZCTEOSA-N 411.477 2.252 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C4CC4)O[C@H](C)C3)CC2)cc1 792056907 ITXNUYKHARCHQL-DYESRHJHSA-N 402.539 2.026 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)cc1 792326163 NNMHOMOJSXHZLB-UHFFFAOYSA-N 408.458 2.051 10 20 HECD CC(C)[C@@H](C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N(C)C 803497795 XNZUXQKICOSKRQ-ZOCZFRKYSA-N 423.529 2.185 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 803644666 OHNCPJGLZUWAFF-QFIPXVFZSA-N 422.573 2.392 10 20 HECD COCCCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686397 JYJVZYIIPLMVOB-UHFFFAOYSA-N 410.518 2.146 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 806280214 BJSSWYXRRFYNEP-HNNXBMFYSA-N 409.508 2.481 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1 807097097 KBBHEPSUGXCFOH-HKUYNNGSSA-N 400.567 2.446 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@]2(CCc3ccccc32)C1 807099669 CAJGFPBRKGXQHJ-XMMPIXPASA-N 407.514 2.378 10 20 HECD CS(=O)(=O)C1(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCCC1 807538112 XQKALXRQGWMOJT-QGZVFWFLSA-N 410.536 2.440 10 20 HECD CCOC(=O)c1ccc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)cc1 811276534 NRRZUVLTNDBAKL-UHFFFAOYSA-N 413.386 2.145 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4cncs4)n3)CC2)cc1 815685103 KOZRSJJCXNTCIV-UHFFFAOYSA-N 413.503 2.211 10 20 HECD CN(C)[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cncn1C 857456520 OLWIZTAKCVXBJT-RDTXWAMCSA-N 407.465 2.409 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccccc3)cc2)C1 918116886 BUUIPYKGFJRVHG-NHCUHLMSSA-N 424.545 2.039 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(-n2ccnc2)nc1 918439119 SLHOJMKBHSGRSF-UHFFFAOYSA-N 422.514 2.075 10 20 HECD O=C(Cn1cc(Br)cn1)NCc1ccc(N2CCC(CO)CC2)cc1 919969930 IREYVHXJJXMWEU-UHFFFAOYSA-N 407.312 2.171 10 20 HECD COCCN1CCC(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 920814322 VHLCWBGCAXZQIQ-IAGOWNOFSA-N 422.545 2.349 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 1337827312 ZWKJLDHENGZOHF-GJZGRUSLSA-N 422.478 2.088 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933134 RLGJMJJZSQBKRN-OTRUCEAGSA-N 408.502 2.464 10 20 HECD O=C(c1cnco1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424526 ZWUMDRVMYBRZIN-HNNXBMFYSA-N 400.435 2.028 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1 1828375736 YPBBBTYMJHMLOT-CABCVRRESA-N 409.433 2.381 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831801315 LQUNPSDFPIDQFI-KDOFPFPSSA-N 417.506 2.341 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(=O)n(-c2ccc(F)cc2)n1 54284206 SRDSMPHCCNFJFH-UHFFFAOYSA-N 408.433 2.138 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1 248011631 DZMXMAZZSDCZDC-UHFFFAOYSA-N 403.442 2.292 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(C#N)c3)cc2F)CC1 303264602 DQWZOLJZUISMFW-UHFFFAOYSA-N 402.495 2.318 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCN(S(C)(=O)=O)C3)ccc21 486750382 FVQJABIKLQPCKZ-QGZVFWFLSA-N 407.536 2.058 10 20 HECD COc1ccc(CN2C[C@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)cc1 726527775 JPDKKUBOZQPXKY-HXUWFJFHSA-N 423.513 2.197 10 20 HECD COc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 726795460 RCYJYVZWPLJWLB-UHFFFAOYSA-N 416.421 2.428 10 20 HECD O=[N+]([O-])c1c(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc2sccn12 726967931 JBIPUQZIUURYQF-UHFFFAOYSA-N 407.477 2.151 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C(=O)OCc3ccccc3)nc12 731668211 HXSGZVKOWQKTLM-SFHVURJKSA-N 424.457 2.319 10 20 HECD CCC(CC)N1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 731808115 GQLWOQNRWAJMEP-MRXNPFEDSA-N 405.514 2.440 10 20 HECD COC(=O)CN(CC(=O)NC(=O)NC1CCCCC1)Cc1cc(Cl)ccc1O 731845212 RTBKEDVIKVYQGZ-UHFFFAOYSA-N 411.886 2.179 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](N4CCCC4=O)C3)CC2)cc1 732459383 PWOUBYSASLUEHB-LJQANCHMSA-N 400.523 2.460 10 20 HECD O=C(COC(=O)COC[C@@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 733593961 FEWLXWBWDLCXHW-AWEZNQCLSA-N 423.421 2.139 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C4CCC4)CC3)CC2)cc1 733642020 TVQGTKVGSWXMGE-UHFFFAOYSA-N 415.582 2.087 10 20 HECD CCOC(=O)CCS(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 734742840 NJVHFHGXYLSHAZ-UHFFFAOYSA-N 406.451 2.129 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](c4nncn4C(C)C)C3)nc12 735872352 BUAXRXKZZPUNHC-CQSZACIVSA-N 413.482 2.164 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(C)c(NC(C)=O)c3)CC2)cc1 736321420 ULJNNSUZRPFAAK-UHFFFAOYSA-N 403.504 2.473 10 20 HECD COc1ccc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1-n1cnnn1 743193040 IKMMCBDARMWKNE-HNNXBMFYSA-N 423.477 2.390 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1 743254961 VXQIZSVVEDKQMA-UHFFFAOYSA-N 402.425 2.086 10 20 HECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743718719 RAPCAGUZHNVZID-UHFFFAOYSA-N 402.516 2.293 10 20 HECD COC1CCN(CCNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 751086374 YRVYWYNUAQOREH-IAGOWNOFSA-N 422.545 2.349 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC[C@H]1COc2ccccc2O1 756336810 QTJLKBPUOOSTEA-MOPGFXCFSA-N 412.486 2.329 10 20 HECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 756888445 CMBABTXFEYFSAI-HZPDHXFCSA-N 400.523 2.458 10 20 HECD COc1ccccc1NC(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 758274776 FGUNAGAAVCJBCP-UHFFFAOYSA-N 418.431 2.004 10 20 HECD COCC1(O)CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 759368366 KVSKHDGDYZVBSR-UHFFFAOYSA-N 413.465 2.440 10 20 HECD CCn1c(=O)c2ccccc2n2c(COC(=O)/C=C\c3ccc(O)c(O)c3)nnc12 759596113 MRPXFYPEOYJECG-NTMALXAHSA-N 406.398 2.232 10 20 HECD COC(=O)c1ncsc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 765115536 RYKQKUKNHMSICE-ZDUSSCGKSA-N 412.489 2.005 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)cc1F 766974443 UTKREJUYGBRSCC-HXUWFJFHSA-N 419.545 2.120 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(C(=O)CCOC)CC2)cc1F 767944270 CTRKIJMTMAIRAZ-UHFFFAOYSA-N 408.518 2.499 10 20 HECD COC[C@H]1CCCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 768297770 YACRVHPNNUJFBU-IBGZPJMESA-N 404.555 2.275 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ncc1Br 773721667 JUOAICKELJKCDQ-SNVBAGLBSA-N 408.252 2.250 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CCCOCC(F)(F)F)CC2)c1O 774856966 JKVLHXONXHOTAB-UHFFFAOYSA-N 407.389 2.396 10 20 HECD C[C@@H](NCc1nnc2n(C)c(=O)c3sccc3n12)c1ccc(N2CCOCC2)cc1 775259199 HAAQYHYTLYWOIZ-CQSZACIVSA-N 424.530 2.330 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(S(C)(=O)=O)[C@@H](C)C3)cc2)CC1 776322683 QWZYDPJZENQVFP-KRWDZBQOSA-N 408.568 2.098 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)Cc3ccncc3)CC2)cc1 778305516 ARHFRZQGBLURSO-LKGOPFMKSA-N 408.502 2.042 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)cc1 778458263 UTJOWPBZUUNAAY-GNISGLHKSA-N 415.534 2.362 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H](CO)C1CCOCC1 782731937 FUCXSXGVGMYTQD-YJBOKZPZSA-N 413.465 2.344 10 20 HECD O=C(NCCCc1ccccc1F)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789811155 CMVYFQCADAVINV-UHFFFAOYSA-N 417.456 2.167 10 20 HECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793715749 ABCFVHQAJOPYNV-QRQLOZEOSA-N 414.550 2.090 10 20 HECD Cn1nccc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 802013180 WFBIYWOSWKEYGR-OALUTQOASA-N 424.549 2.211 10 20 HECD Cn1[nH]cc2c(=NC(=O)C(=O)N(Cc3ccccc3O)C3CCCCC3)ccnc1-2 806993209 UFDONKYBLBJNKS-UHFFFAOYSA-N 407.474 2.347 10 20 HECD COCCOc1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807386925 QQLMCDUVROTZTH-UHFFFAOYSA-N 423.263 2.435 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)COc3cc(F)cc(F)c3)cc2)C1 810183064 RJTZHBKKAKZXMJ-OAHLLOKOSA-N 403.429 2.362 10 20 HECD Cc1nnnn1/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917706685 HPEIXEDCTLHRIV-KGENOOAVSA-N 422.464 2.272 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(-c4ccncc4)c3C)cc2)CC1 1326849520 RCQCERPIWVOGDL-UHFFFAOYSA-N 418.501 2.174 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccncc1 1799888653 FWVDUUGZRZSUOF-YBXVHQAYSA-N 423.469 2.093 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)C(F)(F)C(F)F)C2)CC1 1806497820 CSGVFAGIDONLCM-UHFFFAOYSA-N 419.375 2.238 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)C1 1810550134 AEJPGTCUCGHSJS-ORAYPTAESA-N 411.861 2.262 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1cc(O)nc(O)c1 1817843876 FMHWMMWWDFBMFG-LBPRGKRZSA-N 414.447 2.292 10 20 HECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c[nH]1 1818327862 BDLPBSJPMAYVDI-OAHLLOKOSA-N 410.434 2.472 10 20 HECD CC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290883 MBBJLWSOZMURJX-CYBMUJFWSA-N 406.826 2.369 10 20 HECD CCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496602 MTIOCYYTEVYWOZ-LBPRGKRZSA-N 409.537 2.062 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnc4ccc(C)cn4c3=O)cc2F)CC1 303306912 NXXIHFHTLTUXGE-UHFFFAOYSA-N 423.492 2.214 10 20 HECD COc1ccc(C(=O)NC2=S=C(C(=O)Nc3cc([N+](=O)[O-])ccc3O)C=C2)cc1 537768917 OAZDSRIRYYXCTG-UHFFFAOYSA-N 413.411 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)c(F)cc3N)CC2)cc1 727191026 ULLCYAFODLQKFA-UHFFFAOYSA-N 405.401 2.061 10 20 HECD CCN(CC)c1ccc(CNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1F 731347001 HEUTYJZNIYFZHS-FQEVSTJZSA-N 411.481 2.408 10 20 HECD Cc1cc(C(=O)Cn2cnnc2[S@@](C)=O)c(C)n1-c1ccc2c(c1)OCCO2 732717280 DPFGCIXRXVJCLG-MUUNZHRXSA-N 400.460 2.077 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3OCCc4ccccc43)CC2)cc1 733345832 PIPFCRYMVPWWAV-HSZRJFAPSA-N 424.545 2.430 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)C(=O)NCc2ccc(N(C)C)cc2C)cc1 745828324 RSRIGDUDSPKOKV-UHFFFAOYSA-N 418.563 2.489 10 20 HECD CCOc1ccc(N(CC)CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1 746158666 DDWWSNUTRHKAHX-UHFFFAOYSA-N 403.504 2.148 10 20 HECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)cc1 748685929 MJBYNKTXCWJQIL-UHFFFAOYSA-N 424.529 2.256 10 20 HECD CCCN(Cc1ccccc1O)C(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C 750423138 DXRVPVCTKKLAIC-UHFFFAOYSA-N 420.477 2.009 10 20 HECD Cc1nccn1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060387 KTFNNLAATMYVIR-UHFFFAOYSA-N 406.489 2.189 10 20 HECD O=S(=O)(c1cnc2nc(O)nc(O)c2c1)N(Cc1ccccc1O)C1CCCC1 751355609 GLTLBDRSXIBHJI-UHFFFAOYSA-N 416.459 2.275 10 20 HECD O=C(CN1CCO[C@H]([C@H]2CCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 756898827 ZHJSLUGOUDHBKM-UXHICEINSA-N 420.465 2.280 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCc4ccc(OC)cc43)nc12 763452666 PUMHNUUFXCHADA-OAHLLOKOSA-N 411.414 2.393 10 20 HECD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1cccc(Br)c1O 765904809 XBLKGKOESZFAKQ-UHFFFAOYSA-N 424.207 2.326 10 20 HECD CCN1C[C@H](C)N(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H]1C 766250381 LCMOJYGIYWONEM-LNLFQRSKSA-N 401.555 2.012 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773084908 UKOZRLBVKHRQBK-MRXNPFEDSA-N 417.531 2.265 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1O 774262603 SEXZNOFKPZRSKU-MUUNZHRXSA-N 416.377 2.283 10 20 HECD CCO[C@@H](C)c1noc(CN2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)n1 774903194 ISYAFPMZJIZFMF-ZDUSSCGKSA-N 421.454 2.107 10 20 HECD C[C@@H](NC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 776107419 HDWLEXTXUACGFX-UTKZUKDTSA-N 409.534 2.367 10 20 HECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 783189599 FNGYYCCAOSNOSD-UHFFFAOYSA-N 424.544 2.481 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C 785597730 GZLPYKGCBDOJNA-HXUWFJFHSA-N 405.502 2.350 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1)c1ccc(N(C)C)cc1 787143133 DULMPVYQTZJJBJ-KRWDZBQOSA-N 409.534 2.106 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1nc(-c2cccc(F)c2)no1 788910362 KAAGKARIVPCAOK-UHFFFAOYSA-N 423.448 2.409 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1COC2(CCCCCC2)O1 788938582 SRPYTCGKTKRDQE-FQEVSTJZSA-N 415.534 2.485 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2ccc(F)cc2C1 789798004 FHLDKOBVMXDQLF-UHFFFAOYSA-N 415.440 2.003 10 20 HECD Cc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 789822376 WGUXVTCUFQHFPA-BETUJISGSA-N 420.510 2.137 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccnn1-c1ccc(C)nn1 802610466 AUBMHDJVPKZGHT-UHFFFAOYSA-N 408.462 2.444 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(c2nccs2)CC1 803176026 HRJSLOZWNCJWHN-UHFFFAOYSA-N 402.520 2.373 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(-n4ccnc4)cc3)ccc21 803353084 YLMMEVFYTIFGOV-UHFFFAOYSA-N 403.486 2.187 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 806280217 BJSSWYXRRFYNEP-OAHLLOKOSA-N 409.508 2.481 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOC[C@@H]3[C@@H]3CCCO3)cc2F)CC1 806749838 GHHMUOFQBIPXBR-RTWAWAEBSA-N 420.529 2.057 10 20 HECD CC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C1CCOCC1 807982581 GBDCIUINTSNZFQ-RTBURBONSA-N 404.507 2.221 10 20 HECD CCO[C@H](CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 809136754 MUOGYOFXSIPGHY-HXUWFJFHSA-N 405.539 2.301 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cccc(Br)c1 810156586 MLBQFZQRZMISTJ-UHFFFAOYSA-N 413.293 2.092 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)c3ccc(Cl)cc3)nc12 811281631 ISMDLNUWDRPJNZ-OAHLLOKOSA-N 405.794 2.042 10 20 HECD COC[C@@H](C)[C@@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 812811645 YTMBXCMYUIEOTE-HZPDHXFCSA-N 402.495 2.356 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1 813673016 PBOBJJOIWPONQI-GFCCVEGCSA-N 409.460 2.373 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C3CC3)C(F)(F)F)CC2)cc1 813837978 CHVKUFJPJPFCHI-OLHLWXQYSA-N 411.424 2.357 10 20 HECD CC(=O)NCC1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918219832 OVIXZWFKIUSXMT-HZPDHXFCSA-N 420.529 2.497 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc1 918369168 NMYLXLXKXCASFF-UHFFFAOYSA-N 403.429 2.442 10 20 HECD COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 920870330 QRXMGHYIMMJNTJ-CQSZACIVSA-N 421.475 2.480 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 1320273225 AOBLVKPHMZVYEQ-UHFFFAOYSA-N 419.572 2.007 10 20 HECD O=C(/C=C/C1CC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003143 DBXVMELJVGVYBZ-WUUFJKRQSA-N 406.866 2.161 10 20 HECD Cc1ncsc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842474783 PHWVNQYSDQOSBQ-GQCTYLIASA-N 415.471 2.099 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)NCCOC)c1 60349108 SYUNGLRENFTHKW-UHFFFAOYSA-N 406.504 2.369 10 20 HECD C[C@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 140958800 LXYAXGQETDICCX-INIZCTEOSA-N 417.531 2.487 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3c4ccccc4C[C@H]3O)cc2F)CC1 303271933 GGHKWCAXZBSDPP-YADHBBJMSA-N 412.509 2.425 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cc1 303723539 BNDBTZNVQHGWNZ-UHFFFAOYSA-N 414.937 2.367 10 20 HECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CCCC3)cc2)C1 726097115 DVRXCESZSILIPU-PKOBYXMFSA-N 402.539 2.360 10 20 HECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCc1ccc(N2CCCC2)cc1 726277913 RINKYNBRLIFRNG-FQEVSTJZSA-N 401.555 2.029 10 20 HECD O=S(=O)(Nc1nc2c(s1)COc1ccccc1-2)c1ccc(-n2cnnn2)cc1 727246183 JKSHWPMEOGEYEY-UHFFFAOYSA-N 412.456 2.479 10 20 HECD O=C(c1ccccc1)c1ccc(O)c(CN2CCC(C(=O)N3CCOCC3)CC2)c1O 728194520 MOUKIRQOIRMGKB-UHFFFAOYSA-N 424.497 2.400 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3ccn(CCOC)n3)cc2F)CC1 730132960 JTAHZTUSCCQNGI-UHFFFAOYSA-N 404.490 2.132 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](N4CCCCC4)C3)cc2)C1 730905405 XJZDQOYZGIAGRI-FPOVZHCZSA-N 413.566 2.158 10 20 HECD CCOC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 733848692 QEPGEISPMAPUOU-OALUTQOASA-N 402.539 2.346 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1 743905086 ASJWDEYZYWBJMG-ZDUSSCGKSA-N 413.430 2.482 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(Cl)c(-c3nn[nH]n3)c2)cc1 745465503 SECAZYVCRAAVOS-UHFFFAOYSA-N 406.899 2.407 10 20 HECD CCN1CCO[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 746315747 DAPDVNQUZDDOJR-OALUTQOASA-N 420.554 2.155 10 20 HECD CS(=O)(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 746772693 LQLKHBFREUMDHJ-UHFFFAOYSA-N 403.504 2.390 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)N[C@@H](C)c3cc(OC)ccc3O)ccc2O1 752003336 ZSSOJEHONQZHBD-HXPMCKFVSA-N 421.471 2.307 10 20 HECD COc1ccc(N2CCN(CC(=O)NCc3ccc(OC)c(OC)c3)CC2)cc1F 753857490 MPIROMHLRCRQLN-UHFFFAOYSA-N 417.481 2.290 10 20 HECD C[C@@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cc([N+](=O)[O-])ccc1O 756857496 OYAZJEVECQQSAW-BEFAXECRSA-N 400.479 2.240 10 20 HECD COC(=O)c1cccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759222117 XVXZEDISYJPYPK-UHFFFAOYSA-N 414.458 2.461 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@H](N(C)C)C3)CC2)cc(OC)c1OC 759293355 KHRKTDAMECKNND-IRXDYDNUSA-N 420.554 2.417 10 20 HECD CCC1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 764353979 ZSLKJVKICXOURJ-SFHVURJKSA-N 402.539 2.082 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](O)C(F)(F)F 766251334 NPBVYHBIRYPLFP-ZBFHGGJFSA-N 407.408 2.288 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C 768402173 YOEYSYPYSVJOCS-IBGZPJMESA-N 420.554 2.343 10 20 HECD CCc1nc(CC)n(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 768518062 MCGUMQOTTYSKOD-GASCZTMLSA-N 403.502 2.472 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)CC2)cc1 769157648 XRGREONCMCHGHJ-YADHBBJMSA-N 416.566 2.295 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NCc1ccccc1O 771003300 CSUVYRRPYYEDEB-LLVKDONJSA-N 402.394 2.394 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)N(C)C)c1 774951574 VUBHHSUFBBSMNQ-JOCHJYFZSA-N 424.545 2.113 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccccc2N2CCN(C(C)=O)CC2)c1O 774988654 GQGRFLMEOUOHDD-UHFFFAOYSA-N 414.462 2.267 10 20 HECD COc1cc(OC)c(CNC(=O)CN[C@@H](C)c2cc(OC)ccc2O)c(OC)c1 775369141 KSUINUFSSCJVFZ-ZDUSSCGKSA-N 404.463 2.394 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(F)cc1F 785294403 MJPJGIOMQGUNIF-VIFPVBQESA-N 407.373 2.020 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)N1C(=O)OC(C)(C)C 785440337 YKCRFATZNXRMST-HZPDHXFCSA-N 418.538 2.225 10 20 HECD COCCOc1ccc(F)cc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 786834951 VTGQDTSFXKEJFU-UHFFFAOYSA-N 424.494 2.370 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(Cn2cccn2)cc1)c1ccc(N(C)C)cc1 788465436 XOTXGDGBXRFEKA-KRWDZBQOSA-N 405.502 2.491 10 20 HECD CCOc1cccc(CNc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1O 796432625 RYPRKKOXANJQCB-UHFFFAOYSA-N 405.520 2.339 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCN3CCCC3)cc2F)C[C@@H](C)O1 799174009 IJZBUHUJKXKYPP-KDURUIRLSA-N 420.573 2.473 10 20 HECD CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccccc2O)c1 799833055 JVXVQXDSMYTASF-UHFFFAOYSA-N 419.503 2.034 10 20 HECD CCc1nc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 803296454 CSKJNHVYSFAEJW-HNNXBMFYSA-N 416.547 2.078 10 20 HECD COC(=O)c1ccc2c(=O)n(Cc3ccco3)c(SCC(=O)C(C)=O)nc2c1 808015778 XNBOUKCQVNXZLT-UHFFFAOYSA-N 400.412 2.075 10 20 HECD O=S(=O)(c1ccc(Cl)c2nonc12)N(CCN1CCOCC1)c1ccccc1 814383272 SLPQGBZNZHRPKC-UHFFFAOYSA-N 422.894 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]43)CC2)cc1 921302281 ZNYSJHPQQGPGCK-HBFSDRIKSA-N 418.563 2.070 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CC)c([N+](=O)[O-])c1 1320150716 ZGDVIVMVLBFIHP-HNNXBMFYSA-N 402.403 2.473 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)Oc1cccc(C(C)=O)c1 1320153338 MGFLGOPRTPOYBZ-KSSFIOAISA-N 415.442 2.358 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3n[nH]cc3Br)cc2F)CC1 1350993312 GDIDNIMQQHVBNP-UHFFFAOYSA-N 410.291 2.383 10 20 HECD Cn1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c1 1800715629 WWIFEUKBPKCOFY-CLLJXQQHSA-N 404.854 2.050 10 20 HECD CC1=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)CCO1 1817845024 UWAYUXMYKJIHSN-HNNXBMFYSA-N 413.434 2.216 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc4ccccc4n3)CC2)cc1 24866529 UVPGYISTIYKNEL-UHFFFAOYSA-N 406.442 2.144 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCOCC4)cc3)ccc21 138482018 WRTFMAOBMKFWSB-UHFFFAOYSA-N 408.502 2.161 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 543883123 YVTMAJCHBDEACG-OAHLLOKOSA-N 408.458 2.389 10 20 HECD Cc1cccc(CS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 725826094 ZEFGLQIOEZFDMB-IBGZPJMESA-N 401.532 2.316 10 20 HECD CCOC(=O)N1CCN(S(=O)(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731039154 WMSOVEHCTGDATM-UHFFFAOYSA-N 424.567 2.031 10 20 HECD COc1ccc(O)c(CNC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 734064261 AXXGSYIOIKNEIG-UHFFFAOYSA-N 405.407 2.368 10 20 HECD COC(=O)[C@H]1CCC[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 742241672 TVFSPSZNBAMESZ-OALUTQOASA-N 417.550 2.303 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1c(O)ccc2c1CCCC2 743716980 DYEMXVIYTYIWBZ-UHFFFAOYSA-N 421.501 2.278 10 20 HECD CS(=O)(=O)CCOCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 743927957 JDGCRXRNWNXYKO-UHFFFAOYSA-N 418.475 2.218 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccccc3)[C@@H](C)C(=O)OC)nc12 751033076 KZHBRAKXSQTWGC-ACJLOTCBSA-N 412.446 2.252 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2cc3ccccc3s2)c1 758320276 ZQRAUGARTWJIQC-OAHLLOKOSA-N 406.485 2.442 10 20 HECD C[C@H](CCS(C)(=O)=O)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762090558 ADOQWQOOBYGAQQ-KGLIPLIRSA-N 419.494 2.379 10 20 HECD NC(=O)[C@H]1CCC[C@@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 768130133 OBIQQYNXYHZUSR-NWDGAFQWSA-N 421.409 2.144 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1 769027678 NJGJMLIRCTVESL-YEJXKQKISA-N 403.479 2.469 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCOC2(CCOCC2)C1 769031768 BINODMZRSBXNNQ-HXUWFJFHSA-N 417.550 2.423 10 20 HECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 773089674 UAZFUPLVORVING-CQSZACIVSA-N 405.520 2.437 10 20 HECD C[C@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCN1c1nccn2cnnc12 773613424 QSGKMXVHFZWCGK-JKSUJKDBSA-N 408.510 2.172 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@@H](C)c3ccccc3)CC2)cc1 774359765 JMEWIGPWCVVPQH-IBGZPJMESA-N 424.545 2.153 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc4n[nH]c(C)c4c3)CC2)cc1 778245947 NCVGHOVNZSHCPV-BQYQJAHWSA-N 420.473 2.118 10 20 HECD CC[C@H]1C(=O)N(CC)CCN1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 779558006 KYIAOYLNZOIVJU-IBGZPJMESA-N 419.545 2.120 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCCN(C(=O)C4CC4)CC3)CC2)cc1 780386775 DFUUEAIIQNWBGS-UHFFFAOYSA-N 400.523 2.318 10 20 HECD COc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1-n1cnnn1 782017751 CAZNXVZDGZSTBJ-QGZVFWFLSA-N 409.446 2.198 10 20 HECD Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 784760282 UYTOXMUNVQZDNR-UHFFFAOYSA-N 417.487 2.464 10 20 HECD COCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2CCOCC2)cc1 788501946 NTZGNXOGLOEVCO-UHFFFAOYSA-N 400.475 2.487 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@@H]1c1ccccn1 789799691 KKFWXAZUWBAZMC-HXUWFJFHSA-N 412.465 2.037 10 20 HECD CC(C)N(Cc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813262 RHIBJYCWVZXTQL-UHFFFAOYSA-N 414.481 2.111 10 20 HECD CC1(C)CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734970 WERFJPZWAYCPAG-ZWKOTPCHSA-N 414.550 2.090 10 20 HECD CCCN(CC)C[C@@H](C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 794216985 ALRJUYKQYYHTEO-YAINUAMHSA-N 416.566 2.137 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@]3(CCCOC3)C2)c1 794890329 OABPFMQXKCMFKK-GAJHUEQPSA-N 418.534 2.197 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1 796322908 LQBQLSIBBQBYAD-GOSISDBHSA-N 406.548 2.406 10 20 HECD C[C@@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccc(N3CCCCC3)cc2)n1C 800770501 KZJBMBHJRJCBAN-OAHLLOKOSA-N 406.556 2.052 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 804319311 NTTFCMUFCZNBGR-YLJYHZDGSA-N 417.550 2.490 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(c4ccncc4)CC3)cc2)CC1 805023195 CRIHVHHYWQXMOX-UHFFFAOYSA-N 421.545 2.283 10 20 HECD O=C(NC[C@H]1CCC=CO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805512604 ZWXIWZXTLDULTK-WMLDXEAASA-N 409.433 2.182 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807103601 RRWIYAJQYBYNQZ-PKOBYXMFSA-N 416.566 2.221 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807672310 XNOYBCPIDQBZQD-AOMKIAJQSA-N 403.523 2.368 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cn2ccnc12 815647199 BVIMVWHMEBQALI-UHFFFAOYSA-N 403.236 2.366 10 20 HECD Cc1cc(C)c(O)c(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 915798455 FJZLIFRRYGOIIS-UHFFFAOYSA-N 405.476 2.424 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442224 BVSZGRZTCWAGJO-UHFFFAOYSA-N 424.501 2.109 10 20 HECD C[C@H](NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920889265 RACNHZJUEVVVIZ-ZDUSSCGKSA-N 423.922 2.315 10 20 HECD CN(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)nc1 1317945046 BKLWAYYKSZBVIU-UHFFFAOYSA-N 404.536 2.153 10 20 HECD COc1cc(N2CCN(C(=O)CCc3cn(C)nc3C)CC2)cc(OC)c1OC 1342444544 COEKXVGHBVVFFQ-UHFFFAOYSA-N 402.495 2.036 10 20 HECD C[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CC=CCC1 1804339982 FDIAPWGFFMIGPC-IGMJJTELSA-N 421.588 2.231 10 20 HECD CC(C)O[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546398 DPIRUMIAPMWECV-HNNXBMFYSA-N 405.495 2.151 10 20 HECD O=C(CC1CCC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1814115961 POGBIULTGCZQLR-IERDGZPVSA-N 410.474 2.398 10 20 HECD O=C(c1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427249 SVPUTWHUDAJHFJ-GOSISDBHSA-N 410.474 2.435 10 20 HECD CN(C)c1ccc(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 15135049 OAQISUIVVBJDHL-UHFFFAOYSA-N 404.488 2.004 10 20 HECD CCc1nnc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 20843024 NNNAVWDPSTVLKM-UHFFFAOYSA-N 407.455 2.061 10 20 HECD COc1ccc(N(C)CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc1OC 109100965 SIYCVTCFZZLAPO-UHFFFAOYSA-N 401.419 2.260 10 20 HECD CCCc1cc(NC(=O)C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)n(C)n1 438819156 NRQHYNBTHZEVCX-UHFFFAOYSA-N 411.487 2.166 10 20 HECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734703334 NAKNRSRNMNMCLA-HNNXBMFYSA-N 412.490 2.289 10 20 HECD O=S(=O)(Cc1ccccc1)N1CCC(NCc2cc3c(cc2O)OCO3)CC1 735508650 JKPQXBHFZWPLCQ-UHFFFAOYSA-N 404.488 2.205 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c1O 737286214 SKSSAAOTHCZXIH-HUUCEWRRSA-N 413.474 2.269 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(O)c(F)c3)CC2)cc1 738992005 XQAUHBFIQHYHFZ-UHFFFAOYSA-N 402.470 2.161 10 20 HECD CCN(CC)[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 743867061 JYUSNQNKDRZKGX-NSHGMRRFSA-N 420.573 2.472 10 20 HECD O=C(COC(=O)CCC1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 745659859 YUFYJSQXNYVIGJ-UHFFFAOYSA-N 408.470 2.029 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@@H](O)c3ccccc3)cc2)C1 745692595 XSBHMENTJWFLQW-TZIWHRDSSA-N 410.518 2.311 10 20 HECD C[C@H](CS(C)(=O)=O)N(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905603 OYGRJRUAGJHHOX-KGLIPLIRSA-N 419.494 2.331 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)c1c(F)cccc1Cl 748396452 OMHKOMIITNIZFE-JDNHERCYSA-N 416.858 2.408 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@@H](N(C)C)C3)CC2)cc1 749543526 RMONKRCVXNEBQB-PZJWPPBQSA-N 417.598 2.379 10 20 HECD CC(C)(C)OC(=O)N1CC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 751779960 BDSHPAGVZHLEBE-UHFFFAOYSA-N 422.501 2.205 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(-n4cccn4)c3)CC2)cc1 758232881 UGXUARTYQWKMFC-OAQYLSRUSA-N 408.502 2.443 10 20 HECD CN1CCN(c2cc(CNC(=O)NCCCSc3nccs3)ccn2)CC1 759552074 XDSJBBYAOXVJDI-UHFFFAOYSA-N 406.581 2.272 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 759590904 BKHHKGCVYUSOLP-XNCADYQUSA-N 401.390 2.393 10 20 HECD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1F 760340072 YBZIGVXMURPILW-UHFFFAOYSA-N 403.413 2.215 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3cc(C)ccn3)CC2)c1 765139931 KZQMRDHREMGHAJ-UHFFFAOYSA-N 424.545 2.453 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NCc1cccc(Br)c1O 765731715 KSLABDHGTHUIBS-AWEZNQCLSA-N 419.341 2.365 10 20 HECD CCN1C[C@@H](C)N(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 766245147 YVVQKBSDYATAGG-VQTJNVASSA-N 417.598 2.331 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)ccc1O 767468374 DMEPPNWMLWQLMD-LLVKDONJSA-N 411.407 2.446 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1 768900753 PZSJZRJRRRRCOQ-SFHVURJKSA-N 412.486 2.464 10 20 HECD NC(=O)c1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 770010173 ZHYHRYUTGKGYIK-UHFFFAOYSA-N 418.456 2.001 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCO[C@@]2(CCOC2)C1 771421732 NLZUJIYHUUBLCL-KNQAVFIVSA-N 403.523 2.033 10 20 HECD CN(Cc1ccncc1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774177111 FCADYHASZXREIJ-UHFFFAOYSA-N 418.444 2.427 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3ccc4c(c3)CC(=O)N4C)CC2)cc1 775352777 RKAMKCJBNLVGGP-QGZVFWFLSA-N 422.529 2.214 10 20 HECD Cc1sc2ncc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c(=O)n2c1C 775647008 QPHXGIWZYBUUDN-UHFFFAOYSA-N 412.515 2.482 10 20 HECD CCn1nc(C)c(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778287656 CKTNXHWVIWEQHP-KHPPLWFESA-N 411.506 2.372 10 20 HECD CCn1cc(-c2n[nH]cc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 778937028 IXBAVLKBHBKIBH-UHFFFAOYSA-N 412.469 2.323 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 784676995 XVKVEPVEHUZHCT-UHFFFAOYSA-N 417.487 2.221 10 20 HECD COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)CO2 786254632 GFWKFMBBTRQKAJ-FQEVSTJZSA-N 423.513 2.231 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)CC1 786256171 ANMIPLWRINTZSQ-UHFFFAOYSA-N 400.410 2.332 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnc(C(F)(F)F)nc3)cc2)CC1 786259291 NOIGTGGIDKLHEA-UHFFFAOYSA-N 407.396 2.094 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(OC)c(O)c2)cc1F 787307268 YHLQWJWJEMQQTJ-UHFFFAOYSA-N 403.454 2.319 10 20 HECD CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCOCC1 788282586 JTHNTDXTXHLPSU-UHFFFAOYSA-N 415.456 2.269 10 20 HECD COc1nn(C)cc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 789557503 DKWXFXVFMUKUGL-UHFFFAOYSA-N 411.462 2.255 10 20 HECD CCN(CC)S(=O)(=O)N1CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)CC1 792778893 UMTMZZICWDFDSW-UHFFFAOYSA-N 422.517 2.476 10 20 HECD COc1ccc(NCc2c(O)cccc2OC)cc1S(=O)(=O)N1CCOCC1 796402744 LOHYABBDMFBKLZ-UHFFFAOYSA-N 408.476 2.042 10 20 HECD O=C(NC[C@@H](CO)[C@@H]1CCOC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797445271 SHZDLZURAVSZFV-CABCVRRESA-N 413.465 2.201 10 20 HECD COc1ccc(CNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c(O)c1 797633066 VJZRERYCOTYOJT-CQSZACIVSA-N 420.491 2.156 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c(O)c1 797647386 DUQRBVYTZUNXLG-UHFFFAOYSA-N 408.480 2.194 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCc2c(F)cccc2C1)c1ccc(N2CCOCC2)cc1 803297771 GOMOIULLGQPMJV-MRXNPFEDSA-N 411.477 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCCN(Cc4ccccc4)CC3)ccc21 803686351 IFLQSTFSZBGQHK-UHFFFAOYSA-N 420.557 2.420 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CC[C@H](C(=O)N4CCCC4)C3)CC2)cc1 806683371 HKGZXAAYEWPITQ-KRWDZBQOSA-N 400.523 2.318 10 20 HECD COc1ccc(N2CCC(NC(=O)N3C[C@@H](N4CCOCC4)C[C@H]3C)CC2)cc1 806683790 MSGOMNDIPRRYQR-XLIONFOSSA-N 402.539 2.169 10 20 HECD Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807672913 KFKLUXPBWHCQKV-DYESRHJHSA-N 422.529 2.156 10 20 HECD CC(C)[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852380 TWMGGIVNZNVCEF-QFIPXVFZSA-N 412.578 2.482 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)CC2)cc1 808921653 ZTKUVPNAHBWXMS-UHFFFAOYSA-N 409.442 2.043 10 20 HECD COC(=O)C1(CS(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCCC1 809809378 OHSIHHLXYOMINK-UHFFFAOYSA-N 410.536 2.271 10 20 HECD CO[C@@H](C)c1nsc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 809924661 RORGIBVBJVIBOL-JSGCOSHPSA-N 418.523 2.269 10 20 HECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1O 811304680 XFOVZMIPZROREP-UHFFFAOYSA-N 416.449 2.404 10 20 HECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 915197958 ODJIOBSYRHZCMJ-HSZRJFAPSA-N 406.486 2.370 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 917365146 WOCWEQOSSHAHLS-SFHVURJKSA-N 418.515 2.187 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc2c(c1)OCCO2 918778144 ZZDIABARYZDHSC-UHFFFAOYSA-N 417.487 2.014 10 20 HECD CC/C=C(\C)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1784902863 QHMGHEGKSSBIDM-OLILSUDDSA-N 416.474 2.003 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)C(=O)CC2)c1cc(O)nc(O)c1 1800972481 RPKHFCDFPGVJIJ-BJWYYQGGSA-N 421.453 2.187 10 20 HECD Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991349 OYABEVYQUHNBSV-YWZLYKJASA-N 422.441 2.423 10 20 HECD O=C(CCc1cccnc1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810544014 VJMAZZJCNJVTBE-UHFFFAOYSA-N 424.501 2.365 10 20 HECD CN1CCCc2cc(CNc3ccc(S(C)(=O)=O)cc3S(C)(=O)=O)ccc21 58555520 JTCSXHWLYCZVSZ-UHFFFAOYSA-N 408.545 2.488 10 20 HECD CC(C)C(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 726235876 ICBYXPAWRHSDSA-LJQANCHMSA-N 402.539 2.217 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1 729061578 IJSQAHZTRDQMGK-GFCCVEGCSA-N 415.421 2.483 10 20 HECD CCN1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 729542483 IIUINYBTKJQXIS-QZTJIDSGSA-N 406.546 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(OCC(N)=O)c(OC)c2)cc1F 731346105 RFTMTFVQODSGNM-UHFFFAOYSA-N 403.454 2.475 10 20 HECD CNC(=O)CCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 733167077 SOWRTQJEBLJHOK-QBFSEMIESA-N 411.574 2.372 10 20 HECD C[C@@H](NC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 740037702 DZAQOZAKSXCAMV-CYBMUJFWSA-N 424.427 2.420 10 20 HECD Cc1cc2c(cc1C)O[C@@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)C2 742560762 KPBVEKDAMGPKFM-OAQYLSRUSA-N 414.527 2.158 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(N)cc3)CC2)cc1OC 746478974 GLGGBWIEPNRMDE-UHFFFAOYSA-N 419.503 2.325 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](c3ccccc3)n3cccn3)CC2)cc1 748727921 KTLHWMFRBATSCD-HSZRJFAPSA-N 419.529 2.420 10 20 HECD Cn1c(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnc1Cl 751359970 MIBQTZMZCPWMTM-CYBMUJFWSA-N 419.334 2.375 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(-c4ccccc4)n3)cc2)C1 757855218 NFEUAESQACCCBS-QGZVFWFLSA-N 419.489 2.291 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3ccccn3)CC2)cc(OC)c1OC 758830061 NGGDFPBNKMGPJH-UHFFFAOYSA-N 400.479 2.182 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C3(C)C)CC2)cc(OC)c1OC 759268415 WJHIZKFYAFCCHL-CWFSZBLJSA-N 419.522 2.358 10 20 HECD Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)OC(=O)/C=C/c1ccc(O)c(O)c1 759595770 LYIOSFRGRQUCOT-HQPKTYMTSA-N 412.442 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCC[C@@H]3CCCCO3)CC2)cc1 761009240 AYZMOQRUXABMKX-GMGKOPGTSA-N 415.534 2.366 10 20 HECD O=S(=O)(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccc2nonc12 765013563 SZAYUEWDJUNKRZ-UHFFFAOYSA-N 422.488 2.198 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO[C@@H]1C1CC1 767955932 QKNJWCACJBQLGP-JXHRLWIKSA-N 414.550 2.393 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1 768144203 KCGYLXIFNPOSSC-LLVKDONJSA-N 403.410 2.058 10 20 HECD O=C(Nc1cncnc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 768626351 YLMORNKJBPLGEU-UHFFFAOYSA-N 415.387 2.144 10 20 HECD CC1(C)OC[C@@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)O1 769222723 KVEGZJKQGXNTQT-GFCCVEGCSA-N 412.489 2.136 10 20 HECD COc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(Cl)n1 774311795 KRVQZOZGSQHKAL-UHFFFAOYSA-N 422.844 2.179 10 20 HECD COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 775372449 BIVPTFYARZKTGA-UONOGXRCSA-N 421.519 2.329 10 20 HECD O=C(CN1CCC[C@H](OCC2CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 778177151 PJDMRJUZMSIANG-IBGZPJMESA-N 405.514 2.170 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)cc1 785433275 LSVUMOYVHFVXSW-UHFFFAOYSA-N 418.538 2.321 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](OC)c3ccccc3)CC2)cc1 786659428 ZHQWMWPISKTZBW-OAQYLSRUSA-N 411.502 2.284 10 20 HECD CCC(=O)Nc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 787076442 BNKKDFYDMKCABI-UHFFFAOYSA-N 400.454 2.173 10 20 HECD COCc1ccccc1CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 787502967 CSBWEBILWYLIBL-UHFFFAOYSA-N 411.502 2.197 10 20 HECD Cc1cnc([C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)s1 788312064 BWDMDGWFFBSPCE-GOSISDBHSA-N 414.531 2.172 10 20 HECD COc1ccc(CNC(=O)[C@H](C)[C@@H](C)C(=O)NCc2ccc(OC)cc2O)c(O)c1 794389738 CTPIQFOOSWLTLS-ZIAGYGMSSA-N 416.474 2.320 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)CN2CCCc3cc(OC)ccc32)ccc1C 796323887 JLPLJXFAIIJWHX-UHFFFAOYSA-N 403.504 2.303 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1c(OC)ncnc1N(C)C 802609562 DEUCUUOYEINSQQ-UHFFFAOYSA-N 401.467 2.024 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)C(C)(C)C)cc2F)CC1 805009089 GJAHUGWRXRKXOZ-MRXNPFEDSA-N 406.546 2.477 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@@H](C)CC2(C)OCCO2)cc1 807423228 OSBYLUGNVVPWNQ-KRWDZBQOSA-N 405.539 2.397 10 20 HECD C[C@H]1C[C@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808855258 VJCDSENLPDEHKD-OALUTQOASA-N 412.578 2.339 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809378288 YQSVRFJKINQNTF-MRXNPFEDSA-N 415.490 2.329 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C 810400395 JBYCSLVVTCAEEE-SNVBAGLBSA-N 404.394 2.018 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)s2)cc1 812270978 AWLXOOXSPQQHRM-UHFFFAOYSA-N 415.440 2.444 10 20 HECD Cc1sc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 871822331 WMLFIUUWLBAABB-UHFFFAOYSA-N 414.480 2.209 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918692247 ZCUFZCTZGJWGQR-HXUWFJFHSA-N 423.579 2.076 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(-c2ccccc2)nc1 921203910 UUYDGSAMWMFNCC-UHFFFAOYSA-N 422.510 2.308 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1116419781 RWFXDYCAHYAGBU-HXUWFJFHSA-N 423.579 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ncoc3C(C)C)CC2)cc1 1116452699 ONHXMVWBRNYKCL-UHFFFAOYSA-N 421.519 2.070 10 20 HECD CC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)CCCC1 1777846509 KRDXJRTZNZDCFS-OPAMFIHVSA-N 417.506 2.201 10 20 HECD C/C=C(\C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821894475 IHLIJQUTAVMPPH-LXRBDXNZSA-N 421.548 2.228 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826841853 NVKFYANBGQYFRL-VHFSOBRXSA-N 418.538 2.100 10 20 HECD C[C@@H](Cn1ccnc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502325 LDVSLUSKXFYLSU-ZDUSSCGKSA-N 418.881 2.101 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccccc2CN2CCNC2=O)n(C)c2ccccc12 472790643 QWWWIERVLFVMPC-UHFFFAOYSA-N 419.485 2.267 10 20 HECD O=C(CNC(=O)c1ccncc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726625295 FIWQYFBMFXFRTI-UHFFFAOYSA-N 404.417 2.198 10 20 HECD C[C@@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 729473252 UDGHBNLRSJFJNN-QGZVFWFLSA-N 407.530 2.294 10 20 HECD Cc1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1S(N)(=O)=O 735751959 QFWSPVWLLVITSQ-OAHLLOKOSA-N 418.519 2.362 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN(C[C@H]4CCOC4)CC3)CC2)cc1 736392867 RVQQVOYLUSHAFB-LJQANCHMSA-N 416.566 2.418 10 20 HECD C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 741015517 BZBGFQKWRSYXPT-BBWFWOEESA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 741084483 FUOCMYGEGIOSKG-VQIMIIECSA-N 409.552 2.319 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1N1CCOC1=O 741097382 POULGPSXUAJGEE-UHFFFAOYSA-N 406.442 2.274 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C 742272007 UJDZWNBZQGSGKD-UHFFFAOYSA-N 418.515 2.439 10 20 HECD C[C@@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 751066702 AQBGQZQUNAEQOB-CHWSQXEVSA-N 409.533 2.467 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1 757875856 WSCHQAHPUXAXSC-UHFFFAOYSA-N 405.476 2.472 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CC(C)(C)O)CC3)cc2F)C[C@H](C)O1 760158235 GKXOOFIYFHYVAV-IRXDYDNUSA-N 422.545 2.037 10 20 HECD COC(=O)CC[C@H]1NC(=O)N([C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 761634175 AZWGAIMYKJBMFG-DZGCQCFKSA-N 411.405 2.130 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@H](O)C(F)(F)F 766248824 PRDYNNIQLYDVQZ-RDJZCZTQSA-N 420.451 2.469 10 20 HECD CCS(=O)(=O)N(C)C1CCN(Cc2cc(Br)cc(OC)c2O)CC1 769389465 OSCRRHDMYJJSFX-UHFFFAOYSA-N 421.357 2.409 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@]4(C3)OCc3ccccc34)CC2)cc1 770687302 DYAWPULIRWLTFV-DHLKQENFSA-N 423.557 2.310 10 20 HECD C[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)cc1 773003276 CPDKSWLASFRZPI-TZIWHRDSSA-N 400.567 2.261 10 20 HECD COC(=O)c1cccc(CSCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 773486450 KCCCRZNYAOWWLN-UHFFFAOYSA-N 415.515 2.459 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3C3CCOCC3)cc2)C1 777719249 ANRXEXQRFLTJOF-TZIWHRDSSA-N 414.550 2.489 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 777826104 HJXWTRRLSJQHMJ-CQSZACIVSA-N 408.882 2.338 10 20 HECD Cc1n[nH]cc1CCCNC(=O)CCNC(=O)c1cc(C)n(-c2ccccn2)c1C 778277305 WZGTVTOCBOCBQI-UHFFFAOYSA-N 408.506 2.390 10 20 HECD COCC[C@@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 779987964 JECRSEDNPMZZFX-HXUWFJFHSA-N 416.522 2.487 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C[C@@H](C)O4)c2)CC1 780408143 AYXPJCPWTLYPTH-OAHLLOKOSA-N 415.515 2.479 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(C(=O)N(C)C)c1 787853952 CIWVVARWNOHCIA-UHFFFAOYSA-N 410.518 2.119 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)[C@H](C)S(C)(=O)=O 788289441 VIDJQHJDFCLHDV-TUVASFSCSA-N 400.516 2.125 10 20 HECD O=C(NCCc1ccc2[nH]ccc2c1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800158 MGOPQYZFKNDJGP-UHFFFAOYSA-N 424.476 2.119 10 20 HECD Cc1ncsc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822512 WXLKVXXKIXCRGO-BETUJISGSA-N 420.510 2.137 10 20 HECD CSC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823048 YDRIOKVPXOLNCJ-INMHGKMJSA-N 423.554 2.410 10 20 HECD Cc1cnn(C)c1S(=O)(=O)Nc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1 795551089 ZIRACXURIPRBBD-UHFFFAOYSA-N 412.518 2.056 10 20 HECD CCCN(CCN1CCCC1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796378530 LXNNOZRNVBRAMY-UHFFFAOYSA-N 406.546 2.086 10 20 HECD CC[C@@](C)(OC)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 796408230 CJQRDLQXJRDIRV-HXUWFJFHSA-N 422.503 2.283 10 20 HECD CC(=O)NCCN(Cc1ccsc1)C(=O)NCc1ccc(N2CCOCC2)cc1 801001079 YXHLFLWSHPSKKH-UHFFFAOYSA-N 416.547 2.433 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCCO1 803447937 CDMMXTJEPNYSJK-CQSZACIVSA-N 411.449 2.010 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1F 803663444 OYVJZCUUZZRVSL-LJQANCHMSA-N 403.429 2.247 10 20 HECD CN(C)CCc1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 803688283 XCEPHXSNOLUJFS-UHFFFAOYSA-N 408.546 2.106 10 20 HECD CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1(C)C 804314893 BUHWVLXCDKUKBT-VQTJNVASSA-N 417.550 2.442 10 20 HECD O=C(N[C@@H]1CCN(c2ccccn2)C1)C(=O)N(Cc1ccco1)Cc1ccccc1O 807693259 HKVGZXGBPDXSTO-GOSISDBHSA-N 420.469 2.304 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3C[C@@H](OC(C)C)C3(C)C)CC2)cc1 809438421 RIELFRAYBXBHOF-WOJBJXKFSA-N 417.550 2.442 10 20 HECD COc1cccc(CN2CCS(=O)(=NS(=O)(=O)c3ccc(C)cc3)CC2)c1O 813332299 UPXNKYHHCGTEDH-UHFFFAOYSA-N 424.544 2.382 10 20 HECD COCc1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc(C(=O)OC)c1 815471177 YIDDLICJQGCCPT-GFCCVEGCSA-N 416.430 2.150 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CCC(=O)O)cc2)cc1 917752434 ZBQMPRRMNALKAZ-UHFFFAOYSA-N 412.489 2.266 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1N(C)C 918284027 UXUAMEKIWYPVTA-UHFFFAOYSA-N 414.481 2.292 10 20 HECD C[C@H]1CN(CCCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 920921007 OKVQZFMJQRWEHM-CEXWTWQISA-N 404.555 2.383 10 20 HECD CCCCC[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1783225440 OJQZLVOSZDOEKV-BTYIYWSLSA-N 405.495 2.153 10 20 HECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccn1 1803008444 MGNRKWCINNFZOR-REBRKWNGSA-N 418.881 2.461 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccccc1O 1804283573 DUCDDTGRPOWZFL-XFLCEESOSA-N 424.453 2.474 10 20 HECD Cc1n[nH]cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428134 PIHNSCMYTOGWQD-QGZVFWFLSA-N 413.478 2.071 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3Oc4ccccc4O[C@@H]3C)CC2)cc1 106213106 JWNCZEZKMCZATK-VGSWGCGISA-N 411.502 2.162 10 20 HECD Cc1c(CNC(=O)C(=O)NCCc2nn(C)c3ccccc23)n(C)c2ccccc12 571594632 UFWQGLJVCFGXGO-UHFFFAOYSA-N 403.486 2.349 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(c3ncccc3F)C2)n(C)c2ccccc12 583653835 MNYPYODWINXFIR-HNNXBMFYSA-N 409.465 2.032 10 20 HECD COc1ccc(Cl)cc1/C=C1\SC(=S)N(CCNS(C)(=O)=O)C1=O 727175904 CLGNYKYSAWDUCE-WQLSENKSSA-N 406.938 2.099 10 20 HECD C[C@H](NC(=O)CCc1nc(-c2ncccn2)no1)c1ccc(N2CCOCC2)cc1 727710332 IGQDUNHLKHYUSZ-HNNXBMFYSA-N 408.462 2.173 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1O 732284174 NASGVHIGKWOBIC-GFCCVEGCSA-N 405.432 2.292 10 20 HECD O=C(CCc1ccccc1)NC1CCN(C(=O)COC(=O)c2cc(O)cs2)CC1 732354891 VPPAIMUDIMFKPI-UHFFFAOYSA-N 416.499 2.351 10 20 HECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NCCCSc1nccs1 733878680 CPJNGEKYUFMTAY-LJQANCHMSA-N 416.528 2.135 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(N4CCNC4=O)cc3)c2)CC1 739764659 BYCXZPAXQCJHEW-UHFFFAOYSA-N 407.474 2.170 10 20 HECD CCN1CC[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 740883388 OFVSQODQPPOPMP-PKOBYXMFSA-N 406.546 2.083 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(Cn4ccnc4)c3)CC2)cc1 742919948 MIIQTBDBYOOQGZ-UHFFFAOYSA-N 419.529 2.492 10 20 HECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1 748859221 HZVGLTFHOCMSBP-UHFFFAOYSA-N 413.477 2.397 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)nc4[nH]nc(C)c34)CC2)cc1 750621555 SCWHAJQZKLUESR-UHFFFAOYSA-N 423.473 2.089 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3csc(N4CCCC4=O)n3)CC2)cc1F 753737319 FVDOEUASEKVKSG-UHFFFAOYSA-N 418.494 2.309 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1F 754204933 OSBZGQAOYVWTAL-UHFFFAOYSA-N 415.512 2.319 10 20 HECD COCCNS(=O)(=O)c1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)c1 756590637 OMWFCTBYNABTMN-ZDUSSCGKSA-N 409.464 2.076 10 20 HECD CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CN(C)c2ccc(OC)c(F)c2)C1=O 757851090 CBWDKVKPRHWHLW-OAQYLSRUSA-N 414.437 2.159 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3nnnn3C3CCCC3)CC2)cc1 758196167 BYNCFBCMKSMKHB-SFHVURJKSA-N 418.567 2.072 10 20 HECD COc1cc(N2CCN(c3ccc4nnc(C(F)F)n4n3)CC2)cc(OC)c1OC 758933836 BHFMUTGDPKNWEF-UHFFFAOYSA-N 420.420 2.414 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@@]12CCCO2 759323882 UWKLOTRFMOXSOB-XJUOHMSHSA-N 417.550 2.421 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@H](C4CCOCC4)C3=O)cc2F)C[C@@H](C)O1 761090012 HQIUNFYCMPVDOY-PJIJBLCYSA-N 405.470 2.286 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)CC2)cc1 769017594 RXNHMXISPFTMRY-HSZRJFAPSA-N 422.485 2.149 10 20 HECD O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 769156847 UJVAHNPQRHWXGP-SJBKTWHCSA-N 417.550 2.461 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3c(OC)cccc3OC)CC2)cc1F 772829030 GCDAFNLDFPURIB-UHFFFAOYSA-N 410.467 2.362 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1S(C)(=O)=O 773856556 JBVNMKYEYYEJTR-AWEZNQCLSA-N 403.504 2.280 10 20 HECD CCO[C@@H](CCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 778300492 UHJWHVKAZIUEIS-XPTLAUCJSA-N 417.550 2.467 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 779223052 ZQOAECXPKBGTGP-UNWVZKJWSA-N 405.583 2.314 10 20 HECD O=C(COC(=O)C1CCN(C(=O)COc2ccccc2)CC1)c1ccc(O)c(O)c1 782763609 CIJPKAAVJDLFON-UHFFFAOYSA-N 413.426 2.141 10 20 HECD CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)c1ccc(O)c(O)c1 784001744 PYAIBLUIMHAQDZ-QGZVFWFLSA-N 414.389 2.192 10 20 HECD C[C@H](NC(=O)Cc1ccccc1S(C)(=O)=O)c1ccc(N2CCOCC2)cc1 785956557 RZPDLWMUPAMOAB-INIZCTEOSA-N 402.516 2.347 10 20 HECD CCN(CC)CCSCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787322361 PJMKVVZJFRMZPV-UHFFFAOYSA-N 406.596 2.046 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2cccc(C(=O)NC)c2)cc1 787862328 IEDLGLSYBOEDIC-UHFFFAOYSA-N 410.518 2.167 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 788270592 MGAFBWLCHSFLAK-NVXWUHKLSA-N 418.538 2.446 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C 788883929 JQUDPVSUOZIBKP-UHFFFAOYSA-N 406.527 2.050 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H]3[C@@H]3CCCO3)CC2)cc1 790699604 XMLVTEKPLKQKFF-RTWAWAEBSA-N 402.539 2.170 10 20 HECD COc1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1NS(C)(=O)=O 797630095 IVUSWJAAXDDSMA-LLVKDONJSA-N 409.464 2.231 10 20 HECD C[C@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 800684114 NOHBQKSHZSWSSS-CQSZACIVSA-N 419.503 2.055 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncc(OC(C)C)c3)nc12 801406746 VUIGXBRILVZWDA-UHFFFAOYSA-N 400.391 2.151 10 20 HECD Cc1cccnc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804033888 ILWSVJOOFZWDRD-HNNXBMFYSA-N 418.444 2.393 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccn(-c2ccccc2)n1 804107325 PQPJRADVPFGQDY-UHFFFAOYSA-N 405.502 2.256 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O 807102002 WVCSCZVWSOFANU-OAQYLSRUSA-N 422.529 2.331 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@](C)(OC)C4CC4)n3)CC2)cc1 812811287 PTZMMPCOJFPXOS-NRFANRHFSA-N 400.479 2.241 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)cc3)cc2)C1 813419941 GXXHFMRVHBYMII-QFBILLFUSA-N 401.894 2.392 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(C(=O)O)s3)CC2)cc1 862964142 PRSODPRWPBEVCE-UHFFFAOYSA-N 403.504 2.397 10 20 HECD O=C(COC(=O)c1csc([N+](=O)[O-])c1)NCc1ccc(N2CCOCC2)c(F)c1 917283735 SUWPSSPRJOJMNJ-UHFFFAOYSA-N 423.422 2.105 10 20 HECD CS(=O)(=O)Nc1ccccc1CNC(=O)NCc1ccc(N2CC=CC2)cc1 1116114689 ALIQVTLEZZWRGG-UHFFFAOYSA-N 400.504 2.434 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1nnc(C2CCCC2)o1 1254761713 SOGAGTAMRKGAOV-HNNXBMFYSA-N 417.462 2.362 10 20 HECD Cc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1798536779 UVBJCIKUPLFIDI-YOWGUQMCSA-N 418.881 2.277 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccnc(F)c3)C2)CC1 1806303033 SINXSKLNLLMEAU-UHFFFAOYSA-N 414.437 2.186 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)O1 1828403932 NBSWVRYSPVQPKD-ZTFGCOKTSA-N 417.506 2.294 10 20 HECD Cc1nscc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842311877 DANQZBJLYJWYRO-UHFFFAOYSA-N 423.498 2.061 10 20 HECD COc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)[nH]c2c1 1843249454 LUEWDUOYCLPJEX-UHFFFAOYSA-N 422.441 2.114 10 20 HECD CC(=O)O[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(C)C 1844164314 FUIPRRLYHKXYHL-KRWDZBQOSA-N 424.881 2.156 10 20 HECD Cc1nc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1C 727171519 VRFJUMXMFIZUKO-UHFFFAOYSA-N 400.451 2.277 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CC3CCN(C)CC3)CC2)cc1 729042960 LUVPRDSUKJTEHV-UHFFFAOYSA-N 417.598 2.191 10 20 HECD CC(=O)c1csc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 730352763 DVFSGKHGBBRIKI-UHFFFAOYSA-N 420.462 2.400 10 20 HECD COc1ccc(O)c(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(F)cc2)c1 734019113 XSAACKYADSKPME-UHFFFAOYSA-N 410.467 2.257 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1O 737283921 GHXRNXNHMCQJDE-UHFFFAOYSA-N 417.849 2.436 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCCO)C3CC3)cc2F)C[C@H](C)O1 741250140 INFRYKLSGMEMTE-IRXDYDNUSA-N 407.530 2.292 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)NS(=O)(=O)c1ccc(OC)cc1 752655922 IYOQFGBIFZYWGY-INIZCTEOSA-N 419.547 2.477 10 20 HECD C[C@@](O)(CC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 756330721 XRAYRODAMIRWAW-HSZRJFAPSA-N 407.422 2.495 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC)cc3F)CC2)cc1 758718938 OMIQYTPMSRCLOK-UHFFFAOYSA-N 416.497 2.464 10 20 HECD COc1cc(N2CCN(Cc3cc(=O)n4ccccc4n3)CC2)cc(OC)c1OC 759886256 LEURZZBGXSMQIN-UHFFFAOYSA-N 410.474 2.043 10 20 HECD COc1cc(N2CCN(C(=O)Cc3n[nH]c4ccccc34)CC2)cc(OC)c1OC 760088126 SKVMXWYNVDVYMT-UHFFFAOYSA-N 410.474 2.480 10 20 HECD CCC[C@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 770299751 LSURPSVWRWNLNC-XMSQKQJNSA-N 402.539 2.225 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCSC[C@H]3c3nccs3)nc12 770699129 ICMHQKMJBJOPBS-ZDUSSCGKSA-N 405.505 2.358 10 20 HECD COc1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(Cl)cc1C(=O)O 775289145 SHWQXMVJCHJROY-UHFFFAOYSA-N 402.768 2.461 10 20 HECD COC(=O)c1cc2cc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)ccc2o1 785293243 FMYMAGJJYHBGPT-NSHDSACASA-N 412.398 2.317 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(OCC(F)(F)F)nc1 787277800 MGQSCCCUVFNQBT-UHFFFAOYSA-N 424.423 2.330 10 20 HECD CN(C)c1ccc(CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C(F)(F)F)c1 792773189 QHPZZNAHXLXTRE-INIZCTEOSA-N 405.486 2.076 10 20 HECD COCCOc1ccc(-n2nc(C)c(C(=O)NCc3ccc(OC)cc3O)n2)cc1 794379263 KJPIRQAPRVTRGX-UHFFFAOYSA-N 412.446 2.245 10 20 HECD COCC(C)(C)N(C)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 795186887 DLXPYSXPWJRXRY-UHFFFAOYSA-N 407.536 2.281 10 20 HECD COC(=O)[C@@H](C)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 802166495 GLIYDJYTEMKHKD-JSGCOSHPSA-N 410.467 2.490 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCCCSc2nccs2)cc1F 802559927 HKIUCMQPSKXALG-UHFFFAOYSA-N 415.443 2.445 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCOc3ccc(F)cc3F)ccc21 803687402 LTUSWAWKZOFTIH-UHFFFAOYSA-N 403.429 2.159 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)c1 805011998 NGKAOSOKXCBNGI-SNVBAGLBSA-N 421.443 2.437 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](OCc4ccncc4)C3)CC2)cc1 805752256 BKLRTVFRXPVZEN-JOCHJYFZSA-N 410.518 2.030 10 20 HECD NS(=O)(=O)c1ccc(F)c(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 806815642 DNKLYAASIFRITA-UHFFFAOYSA-N 422.265 2.485 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(C)C3)cc2Cl)C1 807955181 PYXUYKJOWYSQMC-RDJZCZTQSA-N 406.958 2.403 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccs1 916996842 XGJFRZDWRZGIQB-UHFFFAOYSA-N 421.538 2.489 10 20 HECD C[C@H](NC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)cc1 920637681 MXSVKCZRHFHPKX-NWDGAFQWSA-N 424.450 2.326 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](c3ccccc3)n3cccn3)nc12 920908475 DLSFPTLIIRRQCB-GOSISDBHSA-N 421.413 2.141 10 20 HECD C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)c1ccc(N2CCOCC2)cc1 1343688449 CDDVDTNEHFMMLT-CRAIPNDOSA-N 421.538 2.365 10 20 HECD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)n1ccnn1 1791099725 AXGLQCMEMCZUME-CYBMUJFWSA-N 422.445 2.093 10 20 HECD O=C(C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)c1ccccc1 1845501071 WDPPDERSSXBZTC-UHFFFAOYSA-N 414.845 2.451 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 7228475 HJWXNTMLNFALNI-QHCPKHFHSA-N 406.486 2.105 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@@H](C)OC(C)(C)C3)CC2)cc1 139317907 FBBAYTQFKWYKNU-GOSISDBHSA-N 404.555 2.416 10 20 HECD O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(C2=S=CC=C2)o1 541186998 XHMQKPMVABPADR-UHFFFAOYSA-N 418.496 2.179 10 20 HECD C[C@H](NC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12)c1ccc(N2CCOCC2)cc1 728209027 CZAZPSTXPIZIBA-JKSUJKDBSA-N 421.501 2.395 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCCCC1 729326196 KBNTZGGRBWWVJA-HXUWFJFHSA-N 407.580 2.048 10 20 HECD Cc1nn(C)c(=O)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1C 730971294 PJYJZGIXZYLCBE-UHFFFAOYSA-N 406.433 2.397 10 20 HECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1C 737166492 HSZPLNYWECXWSY-UHFFFAOYSA-N 405.476 2.107 10 20 HECD CC(C)NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741097107 KSLOSLPBJHAPJK-UHFFFAOYSA-N 406.486 2.456 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)C(=O)N(C)c4ccccc43)nc12 745985539 MMXMMZZQEHDEEZ-ZDUSSCGKSA-N 409.446 2.231 10 20 HECD C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 747364109 NAMWKEYFGNIDHY-HTAPYJJXSA-N 416.543 2.092 10 20 HECD CN(C(=O)CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C1CCCCC1 748666904 SSEBWXPJWZYGAQ-UHFFFAOYSA-N 416.566 2.486 10 20 HECD O=C(NCc1nc(C2CC2)no1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060936 RGOINRHSVMGHJR-UHFFFAOYSA-N 420.472 2.445 10 20 HECD CCOc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 751212467 GPGJSPVYYWELRF-UHFFFAOYSA-N 424.544 2.429 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCc4ccccc43)cc2)C1 752656060 ZRBQIUOONPKFEU-CYFREDJKSA-N 422.529 2.022 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(C)(C)CN(C)C 754357572 RWHOOIVWKJDBFH-AEFFLSMTSA-N 403.571 2.164 10 20 HECD Cn1cc([C@H](CO)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757652956 ARBBGQBVPSREQJ-PBHICJAKSA-N 409.437 2.023 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(NC(C)=O)cc3F)CC2)cc1 758231878 ORBFGEKZNBPXSX-IBGZPJMESA-N 417.481 2.355 10 20 HECD COc1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCOCC4)c(F)c3)C2=O)cc1O 761090023 HWGPKTLNGIZQAJ-LJQANCHMSA-N 415.421 2.170 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[S@@](=O)C[C@H](C)C1 763878062 LOSNMFIOTAPBST-FIXAZDJUSA-N 424.522 2.489 10 20 HECD Oc1ccccc1CNc1nc(NCc2ccccc2O)nc(N2CCOCC2)n1 774524596 VPSPBRMFVRPATA-UHFFFAOYSA-N 408.462 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccs3)cc2F)C[C@H](C)O1 774787286 LBGGASFIHMYNFI-KBPBESRZSA-N 405.495 2.433 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(C)CC3(O)CCOCC3)cc2F)C[C@@H](C)O1 780311178 GIFQKRYXTYFUFO-HZPDHXFCSA-N 409.502 2.122 10 20 HECD COCCNC(=O)Cn1cc(NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cn1 782785837 FFXZLUIDPXWDCH-UHFFFAOYSA-N 416.526 2.154 10 20 HECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(CC1CCCC1)c1ccc(N)cc1 784109634 WJOYLNWJDKNODF-UHFFFAOYSA-N 413.478 2.341 10 20 HECD Cc1ccc(Cn2nccc2NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)s1 785297469 PJLFGDBJCKOOHC-LBPRGKRZSA-N 414.487 2.398 10 20 HECD CC(C)CN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 786330420 LASPEPXTSDJOAL-UHFFFAOYSA-N 400.567 2.480 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3noc(-c4cccc(F)c4)n3)cc2)CC1 787319081 JRAVXXXBOLMHRK-UHFFFAOYSA-N 423.448 2.474 10 20 HECD C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789836761 WENADCOQZZHHBR-NVXWUHKLSA-N 405.514 2.346 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793902235 QPCVKKRPJILPNT-HBFSDRIKSA-N 417.550 2.136 10 20 HECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 793910201 ITJAOIILXIWDER-KSZLIROESA-N 400.567 2.168 10 20 HECD CCn1ncc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c(C)nc21 799319205 CLZCLQRBFFFFSF-KRWDZBQOSA-N 420.517 2.391 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc2n1CCCCC2 804103952 ZOXZTENXEKEHST-IBGZPJMESA-N 422.533 2.264 10 20 HECD COC(=O)N1CCC(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 805832797 MCRDFPPWJDEORR-UHFFFAOYSA-N 408.474 2.144 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)C[C@@H]1CCOC1 807602541 FGCXWYXXTQYWQC-OLZOCXBDSA-N 413.312 2.435 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)C[C@@H]1CCOC1 807602544 FGCXWYXXTQYWQC-STQMWFEESA-N 413.312 2.435 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N(C)C)c1ccc(N(C)C)cc1 807670200 BSTJHTDFKFUVHG-FOIQADDNSA-N 400.498 2.488 10 20 HECD CC(C)OCc1cc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)ccc1O 811706069 WDMSIULNVYZKQD-UHFFFAOYSA-N 405.476 2.308 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1cccc(N2CCOCC2)c1 814363814 RDNRTNCFGUTMND-UHFFFAOYSA-N 410.518 2.359 10 20 HECD O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1ccc(N2CCC(CO)CC2)cc1 919970308 UQNSJRABCCYQGR-UHFFFAOYSA-N 417.456 2.220 10 20 HECD CC(=O)Nc1c[nH]nc1[C@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1116504916 CYTKDDBROHGWJI-SFHVURJKSA-N 412.538 2.272 10 20 HECD Cc1ncncc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1317947299 UGMOFEPEARJSHW-OKILXGFUSA-N 416.453 2.011 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995008 WUUVABVPXLRVEE-SJCJKPOMSA-N 424.379 2.160 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3coc(Cl)n3)CC2)C1 1810542922 FKRDCPOCMHQONQ-UHFFFAOYSA-N 420.853 2.293 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2c(F)cccc2Cl)C1 1844862984 SHIPDKAYVPRQDG-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccccc2OC(F)F)C1 1846856702 SNZXUSMEQQIGAN-UHFFFAOYSA-N 419.384 2.225 10 20 HECD CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 6460351 JVVZZIXMLMJLQD-VIFPVBQESA-N 414.801 2.116 10 20 HECD CC(=O)NCCc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)s1 409527811 NICJULKGCRFDSN-UHFFFAOYSA-N 409.533 2.080 10 20 HECD CC1=CC(NC(=O)c2cccc(F)c2)=S=C1C(=O)Nc1nc(-c2ccncc2)n[nH]1 433111410 UOQQOGMTEMBPRO-UHFFFAOYSA-N 422.445 2.370 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C[C@@H]4CCCO4)CC3)CC2)cc1 726714925 BKXDIFMEEYWEKL-NRFANRHFSA-N 402.539 2.170 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(N4CCCC4=O)CC3)CC2)cc1 729610926 KLGNYVOBBBQILJ-UHFFFAOYSA-N 400.523 2.460 10 20 HECD COCCS(=O)(=O)CCCOC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 733385165 CCAXORYCWPRVIE-UHFFFAOYSA-N 416.451 2.070 10 20 HECD Cc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 733527009 WTRAHMCXHDGPER-BETUJISGSA-N 405.426 2.209 10 20 HECD O=C(COC(=O)c1ccc(Cl)cn1)NCc1ccc(N2CCOCC2)c(F)c1 736863181 IYQBJCQWDXSAAA-UHFFFAOYSA-N 407.829 2.184 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccn(C(C)C)n3)CC2)cc1 738461788 PMTHWHQBFNOXAL-UHFFFAOYSA-N 400.527 2.094 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1OC 739670326 IGJACAONSNWZGO-STQMWFEESA-N 405.542 2.091 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@]3(N(C)C)CCSC3)cc2F)CC1 748626633 FXUOZTGGEXHRDX-NRFANRHFSA-N 423.602 2.204 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(N4CCCNC4=O)CC3)CC2)cc1 749189456 WKIVBLPCECZLMU-UHFFFAOYSA-N 415.538 2.253 10 20 HECD C[C@@H](CC[S@](C)=O)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069279 HLALANIYAOTSEV-FTJNGKRUSA-N 416.546 2.141 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)cc2)C1 754127474 JVKXVCMWMTYILE-GSEOLPGOSA-N 412.534 2.145 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cc(Cl)ccc2O)C1=O 757908225 ZSWZIOQHYMLOMM-UHFFFAOYSA-N 402.838 2.151 10 20 HECD O=C(CN1CCc2c1cccc2[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 759851767 PGNLIXYDPNPEBL-UHFFFAOYSA-N 414.437 2.249 10 20 HECD C[C@]1(c2ccccc2)NC(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 761126845 UVPVHKKIBNSNTI-UZUQRXQVSA-N 406.486 2.356 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)C2)nn1 762728103 NZORPQVIUQDGOM-INIZCTEOSA-N 408.462 2.345 10 20 HECD C[C@@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1Cl 766021843 DUOLATKNRRPMKK-RTBURBONSA-N 423.001 2.234 10 20 HECD COC(=O)CCCN(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 770036169 IIWKISYLMUKAOV-UHFFFAOYSA-N 420.487 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnn4C(C)C)n3)CC2)cc1 771054687 CXISBSJJUHZTHH-UHFFFAOYSA-N 410.478 2.414 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@@H](O)c3cccc(F)c3)CC2)cc1 772612911 QESFUDRIIDMULE-OAQYLSRUSA-N 401.482 2.196 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)sc1C 773293188 SDNWLGJWALMQHI-UHFFFAOYSA-N 414.574 2.078 10 20 HECD CN(Cc1ccccc1)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 775984589 XBHJIQRIYJCKMR-LJQANCHMSA-N 417.531 2.404 10 20 HECD C[C@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N(C)C)cc1 776243562 DUQGIXVNBCTOOT-WMLDXEAASA-N 401.463 2.281 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCO3)cc1Cl 777916670 OZBYKMRJSCELJF-UHFFFAOYSA-N 404.853 2.241 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3nccs3)CC2)cc1 778304986 SYIKWHBOGDYIQW-FPLPWBNLSA-N 400.504 2.015 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2)CC1 780409329 VRHVWYAAIXJIEI-UHFFFAOYSA-N 418.475 2.373 10 20 HECD CN(C[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 785444232 PSTWYIMMAPLXKN-GOSISDBHSA-N 418.538 2.227 10 20 HECD CN(C)[C@@]1(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CCSC1 788242531 JMBHHZTWLYGAAT-OAQYLSRUSA-N 417.531 2.068 10 20 HECD COC(=O)CCNC(=O)c1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 789834185 DIONBLSYVLFRBO-ZDUSSCGKSA-N 415.446 2.143 10 20 HECD O=S(=O)(c1cccc(NCc2cc3c(cc2O)OCO3)c1)N1CCC(CO)CC1 796446195 ZXMPOFUNPQFTPW-UHFFFAOYSA-N 420.487 2.126 10 20 HECD C[C@H](NC(=O)N1CCC[C@@H](CN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1 799892848 PRTSXMZZTDBLBX-PMACEKPBSA-N 416.566 2.338 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3c3cccn3C)CC2)cc1 804316777 IZEAXMXDGUPLAA-NRFANRHFSA-N 410.518 2.482 10 20 HECD O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 804419214 HBWVQFLYVJPSAU-UHFFFAOYSA-N 406.420 2.350 10 20 HECD CC(=O)N1CCC(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 804715387 PVDJNTXWYNZXLD-UHFFFAOYSA-N 415.534 2.428 10 20 HECD C[C@H]1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807008776 HPSYISIEYNMQOR-RXVVDRJESA-N 412.578 2.387 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1(N(C)C)Cc2ccccc2C1)c1ccc(N(C)C)cc1 807298010 QHXCYIGBUAVJHL-QGZVFWFLSA-N 408.546 2.145 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 815579313 KFFAGULCMSVWIC-AWEZNQCLSA-N 404.492 2.263 10 20 HECD O=S1(=O)CCN(c2ccc(CN[C@@H](c3ccc(F)cc3)c3nc[nH]n3)cc2)CC1 815579598 QXFLJBSXWLREOM-IBGZPJMESA-N 415.494 2.058 10 20 HECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1F 918311467 RMPNNRZNJQLGGF-UHFFFAOYSA-N 401.438 2.268 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCCN(C)S(C)(=O)=O)cc1 919655355 VYARRVZHRJRQMH-UHFFFAOYSA-N 422.551 2.339 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-c2cnn(C)c2)c1 1320519459 FBYIIEZWJQWXLU-SFHVURJKSA-N 409.442 2.403 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1noc(-c2cccc(F)c2)n1 1338287030 IKCQAUYYDDFGOT-AWEZNQCLSA-N 415.377 2.191 10 20 HECD CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813693156 JKHQOAMETHXYDD-YONMQOAISA-N 410.474 2.420 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2nccs2)CC1 1826110985 UFRYPDWFZQIXQB-OAHLLOKOSA-N 416.503 2.496 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429194 QODJMBNWBBKTSP-KDOFPFPSSA-N 417.506 2.341 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 437022130 GSESVILCOSWBJT-KRWDZBQOSA-N 423.469 2.302 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1 542018717 UFFXJBOHLBFULK-UHFFFAOYSA-N 409.446 2.235 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCc3nc(C)no3)cc2F)CC1 730126603 BVALVJOYASHWNY-UHFFFAOYSA-N 404.490 2.091 10 20 HECD CN(C)c1ccc(CNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1F 730540357 XUFCZEDWJTVGCQ-MRXNPFEDSA-N 413.449 2.332 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](OC)C(F)(F)F)CC2)cc1 733354045 CTTGJFZONCXQRW-QGZVFWFLSA-N 418.460 2.084 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1 734701843 KWOZGKHBAGQMPP-UHFFFAOYSA-N 414.481 2.292 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(C(=O)c2ccccc2O)CC1 740919722 JQBCWSXEAKDXSI-UHFFFAOYSA-N 406.486 2.436 10 20 HECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741097006 ILSYVYOVVKZACW-UHFFFAOYSA-N 406.486 2.328 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nnc(-c3cccc(F)c3)o2)c1 744854272 HFUZJJWAQZEQDI-UHFFFAOYSA-N 407.379 2.310 10 20 HECD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 748296182 MCROFFIKCRYARH-OAQYLSRUSA-N 407.486 2.489 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1 748482125 QFQFTNCMUUKDTC-UHFFFAOYSA-N 402.472 2.363 10 20 HECD Cc1ncoc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 750932915 ZYJWTNMUHPRNQU-UHFFFAOYSA-N 417.443 2.078 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)N3CCc4cc(F)c(F)cc43)CC2)cc1F 754213230 PVQGBRRQDUMLHU-UHFFFAOYSA-N 419.403 2.350 10 20 HECD CN1CCN(c2ccc(CN[C@@H](CC(=O)OCc3ccccc3)C(=O)O)cc2)CC1 756340607 TZNYXLGQZVJMFJ-NRFANRHFSA-N 411.502 2.115 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](c4ccccc4F)C3=O)CC2)cc1 761182666 GIESPJCZHHXFMA-FQEVSTJZSA-N 412.465 2.249 10 20 HECD Cc1ccc(S(N)(=O)=O)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 767289898 FXNYLXDSYRGMQU-UHFFFAOYSA-N 405.545 2.126 10 20 HECD C[C@@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768299938 OEVQOEGZIHRAIK-LJQANCHMSA-N 418.557 2.181 10 20 HECD CCOc1ccc(CN2CCN(CCNC(=O)c3ccccc3F)CC2)c(O)c1 769342381 LWRCWHGBEXKQRH-UHFFFAOYSA-N 401.482 2.478 10 20 HECD COc1ccc(O)c(CNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1 769529682 LONCKINOYZYEBT-UHFFFAOYSA-N 412.414 2.050 10 20 HECD CCCCNC(=O)C1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCCC1 769749224 LZKLHCZEGHXIFM-UHFFFAOYSA-N 411.524 2.113 10 20 HECD CN(C(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1)C1CCCCC1 771381593 GIQJGVJPQSHECE-UHFFFAOYSA-N 408.480 2.147 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 772317697 GCWBERIKRFCPDC-ZRGWGRIASA-N 408.470 2.168 10 20 HECD C[C@H](Cn1cccn1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 774150301 UICNYYQNACRKLL-QGZVFWFLSA-N 409.490 2.276 10 20 HECD Cc1nc([C@H]2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)n[nH]1 776118178 MOWIZHIVLGHTCB-INIZCTEOSA-N 402.474 2.178 10 20 HECD CCO[C@@H]1COCC[C@@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 776482485 OODOEBNGPBGYBN-PKOBYXMFSA-N 408.454 2.184 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)O)C3CC3)cc2F)C[C@@H](C)O1 778215949 HCFDKSUDSDGAEZ-HZPDHXFCSA-N 407.530 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(F)cc3F)CC2)cc1 778233473 GVNMLDDWZPUDCV-HJWRWDBZSA-N 415.440 2.495 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc4c3O[C@H](C)C(=O)N4)c2)CC1 781279026 WBYWPNSNLIDIBL-CQSZACIVSA-N 408.458 2.327 10 20 HECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1Br 785422059 GTPPXXSRYFBOOS-UHFFFAOYSA-N 420.307 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C)cnc3Cl)CC2)cc1F 787892650 MARXMKCVMJKUMO-UHFFFAOYSA-N 406.845 2.478 10 20 HECD O=C(NCc1ccc(C(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 788310234 JPFCFEKZVOWBEP-UHFFFAOYSA-N 403.429 2.393 10 20 HECD Cc1cccnc1[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C(C)C 788333998 UWOJRVFRBLKEPP-HXUWFJFHSA-N 410.518 2.356 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@H]3CCOC3)CC2)cc1 788978767 RKSKUVNKNLHAJM-IBGZPJMESA-N 417.550 2.193 10 20 HECD O=C(NCc1nccs1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793545382 BZTNFIRSORRCQF-GFCCVEGCSA-N 410.446 2.146 10 20 HECD COc1cc(Br)cc(CNC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c1O 796480350 CZNZWAVINUWCNG-RISCZKNCSA-N 421.357 2.361 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@]2(CCCOC2)O1 796523536 FAVQJPRHCMXAKP-KKSFZXQISA-N 407.486 2.142 10 20 HECD C[C@@H](CN1CCCC1=O)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 803120065 JIGXCJGRNWYFEC-INIZCTEOSA-N 401.507 2.181 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CC(=O)N2C 804569413 HJJJDGBPEPETIT-OAHLLOKOSA-N 408.502 2.107 10 20 HECD COC(=O)CNS(=O)(=O)c1cccc(NCc2cc(Cl)cc(OC)c2O)c1 809683284 XTIBUIXGKFNHQA-UHFFFAOYSA-N 414.867 2.118 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(=O)n3c(nc2c1)CCC3 917706746 MAWKKXFIOLCGCB-UHFFFAOYSA-N 422.460 2.248 10 20 HECD NC(=O)c1cn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc12 918138448 NOOCCDYFPINREH-UHFFFAOYSA-N 410.449 2.032 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(CN4C(=O)CNC4=O)cc3)CC2)cc1 918369926 XNBFMFNLAYAETD-UHFFFAOYSA-N 422.485 2.100 10 20 HECD CN1C(=O)c2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2C1=O 919968595 JESZARCTSDULRU-UHFFFAOYSA-N 407.470 2.051 10 20 HECD Cc1cc(CC(=O)N[C@H]2CCCN(CC(N)=O)C2)c(C)n1-c1ccc(Cl)cc1 1116049599 CMFCHSSAUUVAPR-SFHVURJKSA-N 402.926 2.356 10 20 HECD COC(=O)[C@@H]1CCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1323170469 XOMGIYIBRQNGJF-CZUORRHYSA-N 422.393 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ncoc3[C@H]3CCCO3)CC2)cc1 1328473536 UHAFOVXOTBJJMM-QGZVFWFLSA-N 415.446 2.040 10 20 HECD COc1ccc([C@H](C)C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843248782 MPPJOWQSXBRDMX-AWEZNQCLSA-N 411.458 2.122 10 20 HECD Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)cnc1C 1848298112 PHSWVEIDWLRILE-LWLUOKNMSA-N 423.469 2.344 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H](CN1CCOCC1)c1ccccc1 216032775 MXNLKEMMUGLWMM-HSZRJFAPSA-N 410.562 2.374 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1 610316349 JFDZCRVBJAFWIV-UHFFFAOYSA-N 420.487 2.282 10 20 HECD COc1cccc(O)c1CNCc1ccccc1OCC(=O)NC[C@@H]1CCCO1 725848492 WOVWVVROYOZDFF-KRWDZBQOSA-N 400.475 2.365 10 20 HECD COc1cccc(CNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1O 727762223 FTVXXSQBJYUZJN-UHFFFAOYSA-N 416.455 2.402 10 20 HECD Cc1cccc2nc(CNC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cn12 731756778 OHQOWHAMAJLWMF-SFHVURJKSA-N 420.517 2.344 10 20 HECD COC(=O)CN(CC(=O)Nc1ccc(C(=O)OC)cc1)Cc1cc(Cl)ccc1O 731845411 XCGMPTGLXZFLRX-UHFFFAOYSA-N 420.849 2.446 10 20 HECD Cc1ocnc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 733522740 CNGQHSOPLIPCDO-UHFFFAOYSA-N 417.443 2.078 10 20 HECD O=C(NCCCSc1nccs1)Nc1cccc(CN2C(=O)CNC2=O)c1 734513236 WGYSWWMBJXBJQZ-UHFFFAOYSA-N 405.505 2.499 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cn(C)c(=O)n(C)c3=O)c2C)cc1C 735151333 HGVPZEYKTAVYJJ-UHFFFAOYSA-N 423.469 2.148 10 20 HECD COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 735393539 NOJXVQGTVIDJBZ-UHFFFAOYSA-N 416.453 2.345 10 20 HECD CCc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(N)(=O)=O 735752006 RQMMYWFCMZPOII-UHFFFAOYSA-N 418.519 2.055 10 20 HECD COCCN(CC1=Nc2ccccc2S(=O)(=O)N1)c1ccc(OC)c(OC)c1 746474847 MXWFWMDHCWFAQQ-UHFFFAOYSA-N 405.476 2.179 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)cc1 747741069 MPBMEPOWLBRLHG-UHFFFAOYSA-N 423.517 2.059 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NC1CCN(S(=O)(=O)C2CC2)CC1 753864159 ZGXOXUSLJYUXOR-UHFFFAOYSA-N 406.552 2.043 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c(C)n1-c1ccccn1 755491546 XUVWTBKPEVDWMX-FVCZOJIISA-N 404.470 2.026 10 20 HECD O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756142500 SRMXEKOHKIKXLJ-ZCLUNYJNSA-N 424.501 2.482 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2coc(C(N)=O)c2)NC(=O)OC(C)(C)C)cc1 759900320 FQUVGJKQONPYDF-MRXNPFEDSA-N 416.478 2.440 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](CO)OC[C@@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 766944077 GLARCXDETIYCME-YJBOKZPZSA-N 400.475 2.130 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc([N+](=O)[O-])c3O)CC2)cc1 768926742 XPDRJQUWWGWFJR-UHFFFAOYSA-N 414.462 2.251 10 20 HECD CC1(C)OC[C@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)O1 769222724 KVEGZJKQGXNTQT-LBPRGKRZSA-N 412.489 2.136 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)c1 773741634 LZJSUKHTQDNNMT-INIZCTEOSA-N 420.531 2.439 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 775031642 BOVLFHPJPGWZKP-NRFANRHFSA-N 406.530 2.294 10 20 HECD C[C@H](c1ccccc1)N(Cc1nc2c(=O)n(C)c(=O)n(C)c2[nH]1)Cc1ccccc1O 776010882 QBLKTXJSDYQZSZ-OAHLLOKOSA-N 419.485 2.429 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1 784558641 BUQVBZWJTIXHKH-FQEVSTJZSA-N 416.449 2.414 10 20 HECD C[C@H]1COCCN1c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785293720 AHAONSLEMVIVHN-CABCVRRESA-N 413.474 2.009 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1 785526652 GJAUDISZIRYMMR-OALUTQOASA-N 416.566 2.018 10 20 HECD Cc1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 785967634 BUULQBCLDVZKDC-GJZGRUSLSA-N 419.453 2.138 10 20 HECD CCCN(CC(C)(C)O)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789828926 ZENDTESXWLYDTN-HOTGVXAUSA-N 423.529 2.065 10 20 HECD C[C@@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789841241 VOHGDCKAYFGBSF-CVEARBPZSA-N 405.514 2.346 10 20 HECD COCCC1(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 792793584 WRZIHARNOXBNCF-UHFFFAOYSA-N 404.555 2.466 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCS(=O)(=O)c2ccccc21 793457287 HPNNCOARMYMRBR-FQEVSTJZSA-N 414.527 2.443 10 20 HECD CC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793733254 LVQCQOJLISUFSK-PKOBYXMFSA-N 414.550 2.043 10 20 HECD COc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 803308928 MZBWEIHYTDFNKF-KRWDZBQOSA-N 411.502 2.334 10 20 HECD Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCCCSc1nccs1 806278930 ZRSBRNPCQRJBSV-CABCVRRESA-N 417.560 2.322 10 20 HECD NS(=O)(=O)CCCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 815828720 TYDZGINRCLRBFI-UHFFFAOYSA-N 403.464 2.225 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1c(O)cccc1Br 877845983 NYVACZSFUBPBKT-QGZVFWFLSA-N 404.264 2.492 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 920635641 JESKBZXVURMMRN-BLDNINTCSA-N 424.519 2.250 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 1003573676 FQBCYGWYZVHZNY-LIEHMFRQSA-N 423.473 2.134 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnn(CC(F)(F)F)c3)CC2)cc1 1116665984 XRAMYITYJVIBNK-UHFFFAOYSA-N 418.441 2.355 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3cnc4c(C)cccc4c3=O)CC2)cc1 1253443362 UQQMGXMNUFTEQQ-UHFFFAOYSA-N 406.486 2.452 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1ccc(Cl)cc1F 1324063753 YMTPSDQHLOUOKR-WMLDXEAASA-N 411.813 2.214 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NC(=O)NCc3cccs3)CC2)cc1 1335574092 UNSOLNXZKHKFGP-UHFFFAOYSA-N 402.520 2.295 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc(C)c1O 1803570608 FHEKZIILSWEHPZ-BJWYYQGGSA-N 411.458 2.381 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cscn3)CC2)C1 1810543008 IHEUQXJAWYIMTI-UHFFFAOYSA-N 402.476 2.108 10 20 HECD Cc1cccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)[nH]c12 1843249565 ZEOUUMHUQBKKST-UHFFFAOYSA-N 406.442 2.413 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)n(C)c2ccccc12 564787822 HKQSTDKKLLSEBF-UHFFFAOYSA-N 402.458 2.381 10 20 HECD CCOc1cc(/C=C2/SC(=S)N(CC(N)=O)C2=O)cc(Br)c1O 727176394 QUBPIJVBIIGNCL-BJMVGYQFSA-N 417.306 2.240 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 727226623 DPPGXXNQCROBPD-OAHLLOKOSA-N 420.464 2.471 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1 728946067 XXHXWENEJWNRLA-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)[C@@H](CCSC)NC3=S)cc2F)CC1 730273431 QYIRLGGHIDZJMB-MRXNPFEDSA-N 410.584 2.306 10 20 HECD CN1CCCC[C@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732276771 QEOBGQJGOKXPMR-FQEVSTJZSA-N 412.513 2.043 10 20 HECD COc1ccc(N(CC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)CC(C)C)cc1 746170003 LCUMKLTZWLBYBH-UHFFFAOYSA-N 418.582 2.217 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cnn(Cc2ccncc2)c1 746432661 IRNQYBONQRHHKR-UHFFFAOYSA-N 402.505 2.020 10 20 HECD CCN(C)C[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 749198991 VAHWRXCVUYXKBJ-FQEVSTJZSA-N 417.598 2.191 10 20 HECD C[C@H](N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1)C(F)(F)F 749552851 CHAMLESVIHHDRP-AWEZNQCLSA-N 418.435 2.440 10 20 HECD O=C(c1cccc(CN2C(=O)CNC2=O)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 752150041 QSVVPKCDKXFHCC-IBGZPJMESA-N 423.469 2.265 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3C[C@H](C)O[C@H](C)C3)CC2)cc1F 753835082 ZJSVPUZDXSPOBO-CALCHBBNSA-N 408.518 2.165 10 20 HECD Cn1cc([C@@H](CO)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757652958 ARBBGQBVPSREQJ-RHSMWYFYSA-N 409.437 2.023 10 20 HECD CCS(=O)(=O)N1CCC(CNCc2cc(Br)cc(OC)c2O)CC1 758057496 QHCRKCVCBXMVKR-UHFFFAOYSA-N 421.357 2.315 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)cc2)C1 761116345 AENWGFJBXPKDCV-MHECFPHRSA-N 418.497 2.282 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 764864523 OJXIXJOLIBZHEW-HXUWFJFHSA-N 401.463 2.303 10 20 HECD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1cccc(Br)c1O 765770257 NOQADTXXPXTRIJ-SNVBAGLBSA-N 417.263 2.466 10 20 HECD CCC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1CCOC 766775026 GAAKKOMJHGIQIB-OAQYLSRUSA-N 404.555 2.166 10 20 HECD CN1CCC2(CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 768930721 OUUOXYBNHOATKX-LJQANCHMSA-N 413.566 2.158 10 20 HECD Cc1cn2c(=O)c(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cnc2s1 772690336 LGBPUFZQAUYQEC-UHFFFAOYSA-N 412.515 2.203 10 20 HECD C[C@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 773105290 VIMPTPWLNUJJDJ-GJZGRUSLSA-N 401.960 2.109 10 20 HECD Cc1cc(NC(=O)CN2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)no1 773626469 UPNRPGFDNBWOGK-INIZCTEOSA-N 414.510 2.076 10 20 HECD CCCc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 777127925 JGWLUBGDSSQLDN-UHFFFAOYSA-N 402.520 2.496 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@@H]3CC(C)C)CC2)cc1 778277456 HPCGZSHCLOOJQW-IBDYFIJFSA-N 415.534 2.174 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC3(O)CCCCCC3)CC2)cc1 778286489 OZHIFQOROZYBBV-OAQYLSRUSA-N 405.583 2.195 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](C)S[C@@H](C)C3)CC2)cc1 778287699 CRUZFUWHOUTNDC-JIPXFFRKSA-N 403.548 2.252 10 20 HECD COCCC1(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 778327859 HJSSOGCDRXEBIC-CMDGGOBGSA-N 415.534 2.223 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 778328899 QXAPBTNHVMLPLG-UHFFFAOYSA-N 408.506 2.412 10 20 HECD CCN(CC)C(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785294024 JWQIEODMLKZNAZ-AWEZNQCLSA-N 413.474 2.266 10 20 HECD CN1C(=O)Cc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 789370725 PSUXWLDDRSSLAW-GOSISDBHSA-N 423.469 2.057 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)cc1 793827258 VWBSHSQTGQFDFR-INIZCTEOSA-N 411.502 2.233 10 20 HECD CNC(=O)C1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 800743226 AARQTAVSWGADDL-CQSZACIVSA-N 419.481 2.247 10 20 HECD COCC[C@H]1CCCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803301255 OBJKSZNPTCXVPU-RBUKOAKNSA-N 417.550 2.366 10 20 HECD Cc1ccnc(OC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c1 803662684 FXTGFUJIZGXMFT-UHFFFAOYSA-N 414.481 2.281 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(C)C[C@@H]3C(C)C)cc2)CC1 805025533 UAMPVZLNYKQOSY-OAQYLSRUSA-N 400.567 2.338 10 20 HECD C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806495575 IAYPCKSQKFIMNV-LMNJBCLMSA-N 413.566 2.157 10 20 HECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)n2C 807287886 NIEVLTLALYOOSH-UHFFFAOYSA-N 403.486 2.191 10 20 HECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 808932467 OBPNKZIHZKOIKL-SFHVURJKSA-N 423.561 2.448 10 20 HECD COCCC1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCC1 809295195 LSNPUVRDXWJKMY-SFHVURJKSA-N 404.507 2.223 10 20 HECD CNS(=O)(=O)c1c[nH]c(C(=O)OCC(=O)c2cc(C)n(-c3ccccc3)c2C)c1 915423790 VUJUNVYDMLJZSV-UHFFFAOYSA-N 415.471 2.370 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC(=O)N(C2CCCCC2)C1 917709301 SXXYVNRQWGORIH-KRWDZBQOSA-N 403.498 2.460 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc4ccccc4nc3O)nc12 919159757 JMSLPOBJHWNALC-UHFFFAOYSA-N 422.397 2.151 10 20 HECD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919877787 BNRCVYOQSWJCAN-UHFFFAOYSA-N 405.432 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(NC(N)=O)cc3)CC2)cc1 920254803 NEXCWCAZBKSBIK-ZHACJKMWSA-N 423.473 2.029 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(C)o1 1795064304 QEMOPKLEPOHENH-BTTYYORXSA-N 421.544 2.009 10 20 HECD CC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877597 SWVRBNVBHZRUNB-JKNJVXJCSA-N 416.474 2.025 10 20 HECD CCOc1ccsc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248854 SWFPEDMKGZWUMH-UHFFFAOYSA-N 403.460 2.084 10 20 HECD Cc1cc(C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1-c1ccc(C#N)cc1 303694030 MUSNSLLBNOZEJA-HXUWFJFHSA-N 402.458 2.235 10 20 HECD COCCCN(C(=O)NCc1c(C)c2ccccc2n1C)[C@@H]1CCS(=O)(=O)C1 472243769 WVVRAZZABZRFPU-MRXNPFEDSA-N 407.536 2.222 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726568056 ZWGNJKPXDRJWCG-UHFFFAOYSA-N 409.393 2.486 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1C 726597509 RXLUGSHUAJHLPO-IBGZPJMESA-N 415.559 2.347 10 20 HECD COCCCN1CCC(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 727033294 SJPHLHFATUMLHI-SFHVURJKSA-N 404.555 2.384 10 20 HECD CCOc1cc(/C=C2\C(=O)NN(c3ccccc3)C2=O)ccc1O[C@H](C)C(=O)N(C)C 728697098 CPFUKXBXZVSYHI-COYFKBPASA-N 423.469 2.402 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1 729053564 NHEOJFFBKSTJQQ-GTJPDFRWSA-N 412.446 2.016 10 20 HECD CNC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 732207613 ZTKZHMSHWNDGBA-LSDHHAIUSA-N 419.481 2.247 10 20 HECD COC(=O)Nc1ccccc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 733141856 JKLNTUYEFCGYRN-UHFFFAOYSA-N 412.490 2.426 10 20 HECD COC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 733196318 APTJWEHSSOQTIN-ZIFCJYIRSA-N 407.530 2.414 10 20 HECD COCCOc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)ccc1OC 734703269 LFTUUHIRKYZQEZ-UHFFFAOYSA-N 415.490 2.350 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOc2ccc(OC)cc2)cc1 742027835 JMFOZJWDKUAAHC-UHFFFAOYSA-N 414.505 2.278 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCN2CCOC2=O)NC(=O)OC(C)(C)C)cc1 742751994 YRBUNXJBNSQZNA-KRWDZBQOSA-N 420.510 2.277 10 20 HECD COC(=O)c1cccc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 742928496 UIARFWSNMZURMZ-UHFFFAOYSA-N 412.490 2.426 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 743268886 OTNGGUJRUSZIGS-UHFFFAOYSA-N 408.392 2.157 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)nc12 745986949 UNXWEOVMMOCSPZ-CQSZACIVSA-N 419.482 2.053 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN(C)c2ncnc3[nH]cnc23)cc1 751406460 PVXVWQZKNBWCHH-SFHVURJKSA-N 423.521 2.063 10 20 HECD COCCOC1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 753106293 BDNONTJPHFEFQK-UHFFFAOYSA-N 417.428 2.099 10 20 HECD CCc1cnc(CN(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1 754048822 GPQCVAWNEFRCPF-SFHVURJKSA-N 404.580 2.329 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H](CO)C[C@H](O)c3ccccc3)CC2)cc1 754642547 NVLNXBYZONOLPO-KNQAVFIVSA-N 413.518 2.448 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)cc1 757017351 IKVLZUGKQBKBSO-HSZRJFAPSA-N 423.561 2.303 10 20 HECD CN1CCN(CC2(C)CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)CC1 758430009 SOHQWKNXDQSZBF-UHFFFAOYSA-N 405.562 2.451 10 20 HECD COc1ccc(CCNC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 759588097 IDWNUKVBESUCJE-VMPITWQZSA-N 401.415 2.030 10 20 HECD COc1cc(N2CCN(Cc3nnnn3-c3ccccc3)CC2)cc(OC)c1OC 759885224 ASNLCRTVRLJCHV-UHFFFAOYSA-N 410.478 2.010 10 20 HECD C[C@@H](CCS(C)(=O)=O)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 762014052 ZDRXQBJMSCUUHP-SOUVJXGZSA-N 415.531 2.062 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@@H]2C1 766268647 FJVRDLNYMFRCRR-GOEBONIOSA-N 417.465 2.096 10 20 HECD COc1cc(C(=O)NCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1OC(F)F 773739472 IAAHAHRGKDRSTD-LLVKDONJSA-N 424.400 2.185 10 20 HECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3cc(OC)ccc3O)ccc21 774245430 CQHZMRVHADKYLK-UHFFFAOYSA-N 411.458 2.345 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)c3cc(O)cs3)C2)C(=O)C1 777208726 RZDGFFIVKNQFQB-CYBMUJFWSA-N 409.508 2.138 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1=O 777459842 RVQVDVVCVFDARX-IAGOWNOFSA-N 420.529 2.449 10 20 HECD COC(=O)c1cc(F)cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 782404161 HCEYQMTYFPFOCH-UHFFFAOYSA-N 422.478 2.270 10 20 HECD CN(C)CCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 787173706 COORVIKJJNIOPL-UHFFFAOYSA-N 424.545 2.160 10 20 HECD CN(C)c1ccc(N=Nc2ccccc2C(=O)OCC(=O)N2CCNC(=O)C2)cc1 795213439 SVDDABSMEBMACS-UHFFFAOYSA-N 409.446 2.283 10 20 HECD CNC(=O)C1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 800743225 AARQTAVSWGADDL-AWEZNQCLSA-N 419.481 2.247 10 20 HECD COCCn1c(C2CC2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 802377737 OFJPYXCEIRCRCZ-UHFFFAOYSA-N 417.510 2.154 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687997 JOQNDKOBDOPRFH-GCJKJVERSA-N 420.557 2.322 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O 807653345 BQCBIMJXQQTTGW-QFBILLFUSA-N 409.486 2.441 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 809677512 QBLNIQFERNHHNZ-LJQANCHMSA-N 403.523 2.293 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](c4ccccc4)OC3=O)cc2)CC1 809793285 BNLFFYRYUDCVRT-YADHBBJMSA-N 421.497 2.276 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)cc2)C1 917833965 FDRRUHYRBVJUCY-BEFAXECRSA-N 424.476 2.270 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cccc(N(C)C)c1 1256303148 XNXLIPKECMZHRQ-SFHVURJKSA-N 400.475 2.387 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)CCc3ccc(C)cc3)CC2)cc1 1321366504 KKBPRNJIQXSLTL-UHFFFAOYSA-N 417.575 2.288 10 20 HECD O=C(Cn1ccnc1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426842 XDNOOPYBMJPXFK-UHFFFAOYSA-N 407.430 2.137 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)cc(F)c1F 1796603432 LBLJRZKRTRFHPQ-CLLJXQQHSA-N 421.375 2.476 10 20 HECD CCc1ncsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799497011 VUXYHKOLGIPFAB-CLLJXQQHSA-N 402.476 2.077 10 20 HECD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1ccc(O)cc1 1800102868 SBMHZNXSQOXZBS-SJWGOKEGSA-N 411.458 2.254 10 20 HECD CC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426539 YZENZLKYLZZVIS-QGZVFWFLSA-N 403.479 2.095 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1 1832867064 BISREYOOOZRVLD-AEFFLSMTSA-N 417.506 2.153 10 20 HECD CCn1cc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)ccc1=O 145625049 ZABGZKKYNZRKCY-UHFFFAOYSA-N 413.522 2.211 10 20 HECD NS(=O)(=O)c1cnc(NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 726594231 KIWGXUCCKYPYQE-UHFFFAOYSA-N 404.464 2.473 10 20 HECD CCN(CC(=O)NC(C)C)C(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N 728720990 QUXCIUPQWOFDGG-UHFFFAOYSA-N 406.508 2.025 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1 729033790 RHFVUEUVOSNLPE-QWHCGFSZSA-N 408.480 2.148 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3ccc(-n4nccn4)nc3)cc2F)CC1 730135308 UDRIDAIRQDPXPN-UHFFFAOYSA-N 424.484 2.265 10 20 HECD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733881045 YVPPXBGEPSHPDW-GOSISDBHSA-N 422.507 2.348 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@](C)(O)Cc3ccccc3)CC2)cc1 742241053 KYWSHOGFJLBYCM-XMMPIXPASA-N 411.546 2.317 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)cn1 743045894 DOIBFHWHRBFYJP-UHFFFAOYSA-N 418.500 2.469 10 20 HECD Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NCc1ccc(N(C)C)c(F)c1 746018304 AMFNLDPYYCISAZ-UHFFFAOYSA-N 416.497 2.125 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)ccc21 746813105 RSEVVDCTGVVSHV-DEOSSOPVSA-N 418.497 2.079 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)c3c(C)nn(C)c3C)CC2)cc1 746931021 AESQLFLNZSAZEN-HNNXBMFYSA-N 414.506 2.041 10 20 HECD O=C(NCCNS(=O)(=O)c1cccs1)NCc1c(O)ccc2c1CCCC2 747438409 UBJVDPXTVDUURV-UHFFFAOYSA-N 409.533 2.110 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1 749220209 KGBGBZPNFIOYTN-UHFFFAOYSA-N 409.534 2.243 10 20 HECD CCOC(=O)c1c(NC(=O)CCN2C[C@H](O)[C@H](O)C2)sc(C)c1-c1ccccc1 750838964 VCEPFWFLIBTSSE-IYBDPMFKSA-N 418.515 2.266 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC(=O)NCc3ccco3)cs2)cc1 751931943 QMYPRSSQHNKLGX-UHFFFAOYSA-N 414.443 2.092 10 20 HECD O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756142498 SRMXEKOHKIKXLJ-IDPBPBMLSA-N 424.501 2.482 10 20 HECD C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)cc(F)c1O 756417260 MPMCHAZBPFGSSO-SNVBAGLBSA-N 424.270 2.360 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@]12CCCO2 759221407 PXNVUUAGRFVVDL-SBHAEUEKSA-N 407.486 2.188 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN(C[C@H]2CCOC2)CC1 764786056 YQYGIMIYAFUYJN-CYBMUJFWSA-N 412.328 2.455 10 20 HECD CCOC1CC(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)(N2CCOCC2)C1 767861865 SYMQZLZBQIUODI-RYHLMMNBSA-N 404.555 2.383 10 20 HECD O=S1(=O)CC[C@H](N(Cc2cc3c(cc2O)OC[C@H]3O)Cc2ccccc2F)C1 768463476 JOMBKXJNCSOZSQ-HNAYVOBHSA-N 407.463 2.146 10 20 HECD COCCN1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 768715651 OYMQXMZNKFXPBL-UHFFFAOYSA-N 402.539 2.456 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3c(O)cccc3Cl)CC2)cc1 769379797 NBJLNJVFKBLMEB-UHFFFAOYSA-N 423.966 2.450 10 20 HECD Cn1ccnc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 770302475 WHAOYRVWCRXNMJ-RBUKOAKNSA-N 424.549 2.211 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccccc3NS(C)(=O)=O)c2)CC1 771636907 LKFJUROJTPFSBT-UHFFFAOYSA-N 402.520 2.452 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 772896458 CSHHUYSYQJDHFT-UHFFFAOYSA-N 404.438 2.375 10 20 HECD C[C@@H](NC[C@H]1CCCN1S(C)(=O)=O)c1ccc(N2CCOCC2)cc1Cl 773107427 ZETHBUDDLVGRQF-GDBMZVCRSA-N 401.960 2.251 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1 773740486 PIVUKUMRSYEATI-WMZOPIPTSA-N 412.486 2.463 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O 773745043 ISVNRRUBPYDUCQ-ASSNKEHSSA-N 403.479 2.036 10 20 HECD CC(C)(C)OC(=O)NC[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 776017469 NVMUQGLSUZFTHY-QGZVFWFLSA-N 409.502 2.388 10 20 HECD COC(=O)c1ccc2c(c1)C(=O)N(CN(C)Cc1ccc(N3CCOCC3)cc1)C2 776752395 LZVODPZSSQDRGV-UHFFFAOYSA-N 409.486 2.355 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C2CC2)cc1 785499262 FOZHHQXTPKLMEP-UHFFFAOYSA-N 409.486 2.331 10 20 HECD O=C(NCCSC(F)(F)F)C(=O)NCc1ccc(N2CCSCC2)cc1 788529061 QGCOTJKAIAYHCE-UHFFFAOYSA-N 407.483 2.225 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H]1CCCO1 789832621 BLQQSLVMBCUJOC-BPQOCRPUSA-N 421.513 2.129 10 20 HECD CCC[C@]1(CO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860178 IVGVGIWQKICJPH-OAQYLSRUSA-N 405.564 2.010 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H](C2CC2)O1 792043470 GBUBBRAZQLSCDN-MOXGXCLJSA-N 400.523 2.097 10 20 HECD COc1ccc(CNC(=O)CCCC(=O)NCc2ccc(OC)cc2O)c(O)c1 794378964 HVGCFVXSMMUHPD-UHFFFAOYSA-N 402.447 2.218 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 796559901 FZVSVMAZPQWMDP-OWJWWREXSA-N 420.465 2.280 10 20 HECD Cc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)co1 801390828 PPSRBQCRYMAIEB-BETUJISGSA-N 405.426 2.209 10 20 HECD COc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 803661329 XGUKHJXKHOWRFP-UHFFFAOYSA-N 403.454 2.054 10 20 HECD C[C@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccccc1 803665066 WFBDVUVXTICBDM-MAUKXSAKSA-N 401.482 2.179 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806282640 OVFTXYJNDNPOKW-UHFFFAOYSA-N 420.560 2.099 10 20 HECD Cc1cncc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 806489067 VSXJOJJKQNQMEE-MRXNPFEDSA-N 418.444 2.393 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)C2CC2)cc1 806700238 SQSSIDFTFNCVIY-HXUWFJFHSA-N 415.534 2.436 10 20 HECD COCC[C@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccco1 807902664 WKLFRFBSSFMGQF-IBGZPJMESA-N 415.490 2.221 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(CCOC(C)C)CC1 808521103 HTKWHLLMFFSCMD-UHFFFAOYSA-N 405.539 2.136 10 20 HECD COCc1nc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 811946144 RICOMVKWBPRXME-UHFFFAOYSA-N 408.499 2.389 10 20 HECD O=C(CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)OCC(=O)c1ccc(O)c(O)c1 916617428 QDWVTJQYVQUATP-UHFFFAOYSA-N 424.192 2.427 10 20 HECD COc1ccc(N2CCCN(C[C@@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 917016968 GWYOOYDLXMKMLV-OAQYLSRUSA-N 404.532 2.344 10 20 HECD COCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442442 HVPJGECHLREMSO-UHFFFAOYSA-N 411.502 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(NC(N)=O)c3)CC2)cc1 920255888 YRDYGFNDCKDVGA-MDZDMXLPSA-N 423.473 2.029 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cc(Cl)ccn1 1318681339 IXDUXZOULDANQK-MRXNPFEDSA-N 403.866 2.378 10 20 HECD C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319684597 YKZNLAMFXVCGDA-MRXNPFEDSA-N 420.554 2.418 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=CCCS1)C1=NN(c2ccccc2)C(=O)C1 1793641190 DPGMGZVFWMNOOO-ACHSLPGTSA-N 424.526 2.438 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c[nH]c2ccccc12)c1cc(O)nc(O)c1 1799901601 OSZYDFYZMCXHKE-BJWYYQGGSA-N 420.469 2.469 10 20 HECD CC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497196 SCTCQOWWMYBVTF-LBPRGKRZSA-N 423.564 2.308 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3cc(F)ccc3[nH]2)C1 1844013522 REPBZMJUXMUKDC-UHFFFAOYSA-N 410.405 2.244 10 20 HECD COCc1c[nH]c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1 1845501550 AWPNGNXCWFTZNC-UHFFFAOYSA-N 419.865 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccc(F)cc4)CC3)CC2)cc1 69148955 PWHFZGUDLWKZFE-UHFFFAOYSA-N 412.509 2.305 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCCS(=O)(=O)CC3)c2C)cc1 732212320 MGMPXHHGTUCTPP-UHFFFAOYSA-N 418.515 2.184 10 20 HECD CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 741181453 XNICZYUTAFDUQB-SFHVURJKSA-N 420.529 2.356 10 20 HECD CCC1(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1 745784588 YJSHOMPDCOSCLM-UHFFFAOYSA-N 404.555 2.323 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCOc4cc(N(C)C)ccc43)CC2)cc1 746493562 ZKKNGIHBZMAJOU-UHFFFAOYSA-N 410.518 2.309 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 750861252 ALPZTCVYFSTQLZ-UHFFFAOYSA-N 418.515 2.466 10 20 HECD CCN(C(=O)CN(Cc1ccco1)Cc1ccccc1O)[C@H]1CCS(=O)(=O)C1 756327980 YBJQVYJOQMHSKI-KRWDZBQOSA-N 406.504 2.023 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C[C@H]3CCOC3)CC2)cc1 759767719 WVQCPZNJNSHEQJ-RTBURBONSA-N 404.555 2.322 10 20 HECD CCN1CCC[C@H]1CN1C[C@@H](C(=O)NCc2cccc(Br)c2O)CC1=O 765728335 HVLUZRNOXZNUBH-GJZGRUSLSA-N 424.339 2.104 10 20 HECD CC(C)CCn1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 766135827 OPRVPJNTAZUGHH-UHFFFAOYSA-N 419.551 2.486 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)CC2)cc1 769017595 RXNHMXISPFTMRY-QHCPKHFHSA-N 422.485 2.149 10 20 HECD COC1(CO)CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 770701071 PILUJMMNDSIBCH-HNNXBMFYSA-N 413.465 2.440 10 20 HECD O=C(OCc1ccon1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397454 JZXWFGZFNOMCGV-UHFFFAOYSA-N 419.371 2.446 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)C(C)(C)C)cc2)CC1 786655557 FQGBZLPYIXBLHC-FQEVSTJZSA-N 414.550 2.008 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccnc3)cc2)CC1 787321740 IUVDAWQDJPLZSS-UHFFFAOYSA-N 404.474 2.070 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)cc1 787756490 ZVOPNVZNXOPTMH-UHFFFAOYSA-N 424.545 2.266 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 787836054 YKXVBBQHZFJFBA-UHFFFAOYSA-N 410.518 2.133 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)CCN1CC(F)F 788973936 ATDLJILUOIAQIZ-QGZVFWFLSA-N 410.509 2.337 10 20 HECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819199 MKPSYERGIXFHMK-YFHUEUNASA-N 421.513 2.081 10 20 HECD CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C12CCC2 789854908 HGGDMZJAPGUOQR-OALUTQOASA-N 417.575 2.320 10 20 HECD COCCC1(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCC1 789855883 ZLVMKWHSYBDASS-UHFFFAOYSA-N 405.564 2.179 10 20 HECD COC(=O)[C@@]1(C(F)(F)F)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 796289784 XSLXFZIFWCUWNA-GOSISDBHSA-N 401.429 2.138 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCSC[C@H]3C(=O)O)cc2F)C[C@@H](C)O1 797710457 YYOZVXGBWLWMDC-AHIWAGSCSA-N 411.499 2.151 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CCN(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 803305681 ODEWVYKMFTZYFG-LJQANCHMSA-N 424.545 2.295 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCOC1CCCCCC1 806331331 JPVNMKYQMKXOBX-UHFFFAOYSA-N 417.550 2.337 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)ccn1 807512674 CWHJVBRQHOXZDB-UHFFFAOYSA-N 411.245 2.051 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H](OCC(F)(F)F)C1)c1ccc(N(C)C)cc1 807674435 KVTDQZZRYMZQLN-BBRMVZONSA-N 401.429 2.500 10 20 HECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 808353888 BBHZOZFOVVNAND-KSEOMHKRSA-N 414.550 2.312 10 20 HECD O=C(NC[C@H]1CCCCN1C1CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809821887 ACMNRUQXGXVPJH-WOJBJXKFSA-N 415.534 2.033 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O 815797352 MFWKHJTZQSGYQQ-GASCZTMLSA-N 421.291 2.454 10 20 HECD CCc1nc(C)c(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 817066076 PMTHDCHFSUMFLG-KTKRTIGZSA-N 412.490 2.075 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccc(-n2nccn2)nc1 916684175 FBYYUSZNNQVXFO-UHFFFAOYSA-N 407.478 2.193 10 20 HECD COc1ccc(C(=O)N2CCN(Cc3cc4c(cc3O)OCO4)CC2)cc1OC 921048169 LMEFIZFWTUVYSR-UHFFFAOYSA-N 400.431 2.096 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2 1782003970 QMFUMBMFQHQWMJ-MHJFOBGBSA-N 424.856 2.087 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cn1)c1cc(O)nc(O)c1 1798747022 OALPZJYMZISRGW-BTTYYORXSA-N 402.838 2.107 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc(O)nc1 1800716364 FUEVTLSFSMIQID-BTTYYORXSA-N 417.849 2.417 10 20 HECD O=C(c1ccno1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426754 FMAZOCQFFUCWJI-OAHLLOKOSA-N 400.435 2.028 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2cccnc2)C1 1843094781 QHIZMOWBDFUGAP-RMKNXTFCSA-N 423.469 2.048 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)ccc21 108579265 FVYNWTHFHAGGCJ-UHFFFAOYSA-N 422.485 2.071 10 20 HECD CCN1C[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)Oc2ccccc21 115731091 GTDIKQKQIMSPLZ-OAHLLOKOSA-N 419.503 2.123 10 20 HECD C[C@H](NC(=O)NC[C@@H](O)COc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 139993916 TYYZWZVVDALQGM-OXJNMPFZSA-N 417.481 2.462 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 248052195 NPQOILKMUVTZGP-GPHNJDIKSA-N 407.514 2.442 10 20 HECD Cc1cc(-c2nc(CC(=O)Nc3ncccn3)no2)ccc1NC(=O)C1=S=CC=C1 445827836 RHRFDQKTGYDLFW-UHFFFAOYSA-N 420.454 2.232 10 20 HECD Cc1cccc2c(O)nc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)nc12 728730185 YVWLSLZRXHZYOI-UHFFFAOYSA-N 403.416 2.078 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)c1 728981428 ZIWDGWMHWGVZBH-ZDUSSCGKSA-N 420.487 2.149 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(N2CCCC2=O)CC1 729596621 LSNLLYHAVKDVKA-UHFFFAOYSA-N 418.513 2.083 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H](N2CCCCC2=O)C1 732823775 AWHOXWNKBQGOEL-HXUWFJFHSA-N 400.523 2.210 10 20 HECD CC(C)N1CC[C@@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 734167661 YWQVLAXTAJRNLH-IIDMSEBBSA-N 406.502 2.248 10 20 HECD CN1CCC[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 748582247 QXEOWEJLPPGRBR-MBFWDRTGSA-N 423.585 2.467 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 751237155 OPBFEMDDPQHNRF-UHFFFAOYSA-N 424.544 2.222 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)N(C)Cc3ccc(N(C)C)cc3)ccc2O1 751969017 SKNGMQKVPFYKLI-HXUWFJFHSA-N 418.515 2.440 10 20 HECD CN1CCN(c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2Cl)CC1 753923550 LSEJDUUTFNJMOY-UHFFFAOYSA-N 407.883 2.429 10 20 HECD CCCN1CC[C@H](CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759280819 CSWFYAUALGTMDP-QGZVFWFLSA-N 420.554 2.276 10 20 HECD COc1ccc(C(=O)NCc2cccc(Br)c2O)cc1-n1cnnn1 765765862 SYAQCOZQYGHITP-UHFFFAOYSA-N 404.224 2.069 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 767887182 GDWAUSZNHKLCKB-GOSISDBHSA-N 411.502 2.401 10 20 HECD CC(=O)CCCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 772370122 FAMNSWNFKZPKFF-HOTGVXAUSA-N 408.470 2.358 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(Br)cn1 773327781 QVFWPGTXQFKFSL-UHFFFAOYSA-N 401.264 2.475 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O 773739343 FOBCIDGYCJKMPQ-STQMWFEESA-N 404.488 2.169 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 773740188 OHOXRZYNXLSAPO-BBRMVZONSA-N 412.442 2.179 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)N1CCN(c2ccccc2)CC1 773751026 ZUSXZHXQBRATES-KRWDZBQOSA-N 411.502 2.274 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773859033 UPHXPAWDIXDGGC-CYBMUJFWSA-N 421.494 2.252 10 20 HECD C[C@H](NC(=O)C(=O)NCC(C)(C)N1CCCCC1)c1ccc(N2CCOCC2)cc1 774889607 LCJZNSICMOHOKW-SFHVURJKSA-N 416.566 2.081 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cnn(-c4ccccc4)c3)cc2)CC1 786255178 KPXRILXALVATGU-UHFFFAOYSA-N 417.513 2.400 10 20 HECD COC(=O)CCc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 786304650 VQXGXUVRCKVHFK-UHFFFAOYSA-N 409.486 2.430 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 787832386 NHXONRVGRJUYAU-UHFFFAOYSA-N 410.518 2.167 10 20 HECD O=C(NCCOCC(F)F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788539726 VOUAZLWYNDRCAS-UHFFFAOYSA-N 406.432 2.266 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCN(c2nccs2)CC1 788931180 XURDJECLGLSLGG-UHFFFAOYSA-N 413.547 2.098 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]1C 789863842 JZJNENUGXZGSPV-YLJYHZDGSA-N 418.607 2.187 10 20 HECD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)c1c(F)ccc(O)c1O 789956892 KCFLVQUSYFBYKT-UHFFFAOYSA-N 417.437 2.174 10 20 HECD C[C@@H]1C[C@@H](C)[C@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)O1 799915973 DXQUNCDAYVELBQ-JXXFODFXSA-N 413.497 2.372 10 20 HECD C[C@@H]1CCCN(c2ccc(CNS(=O)(=O)[C@H](C)C(=O)N(C)C)cc2Cl)C1 800148487 MJVPAAGNXUICNB-ZIAGYGMSSA-N 401.960 2.472 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 803310836 KDDJLUFVBRWYMP-QRFRQXIXSA-N 417.550 2.410 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCC(=O)OC(C)(C)C 804904624 QNFNMHPSPPLQCC-UHFFFAOYSA-N 403.523 2.483 10 20 HECD NC(=O)[C@@H]1CC(C(=O)Nc2c(Cl)ccc3nonc23)=NN1c1ccc(F)cc1 1116851011 YJDGJZVYHTVSRF-ZDUSSCGKSA-N 402.773 2.074 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3cc(Br)ccc3=O)CC2)cc1 1320023416 GKLVFHTZNFPGHH-UHFFFAOYSA-N 420.307 2.358 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@](C)(CO)C3)cc2F)C[C@@H](C)O1 1322912742 WPJXTXBNQJYCHT-HYFFOGBASA-N 407.530 2.150 10 20 HECD Cc1cccc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)n[nH]c12 1796604187 MUACEBNSODGLSJ-QDMKHBRRSA-N 421.457 2.243 10 20 HECD C[C@H](NC(=O)NCC(=O)N1CCc2ccccc21)c1ccc(N2CCOCC2)cc1 726244715 FLLKONMFBJXBRD-KRWDZBQOSA-N 408.502 2.473 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCCCN3CCC[C@@H](C(N)=O)C3)cc2)CC1 731049813 PWFBCGGFEQLTPP-HXUWFJFHSA-N 415.582 2.310 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1F 731356396 FVFPHQIQLPOQJY-UHFFFAOYSA-N 404.471 2.126 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCc3nc(C4CC4)no3)cc2)C1 739701632 WJQOWCFMPYYLJP-QGZVFWFLSA-N 411.506 2.288 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc2ccsc2c1 742051651 YHMBAMDDJXJRKU-UHFFFAOYSA-N 401.513 2.461 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 743956383 SHAOTOHBBQBLDB-UHFFFAOYSA-N 407.470 2.418 10 20 HECD Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)c(F)c3)C2=O)cc1 746864712 UQTPPNMWWCWFJX-QFIPXVFZSA-N 412.465 2.284 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)CCc2ccccc2)cc1)C1=S=CC=C1 748502035 XAPHBZSYGVJRNS-UHFFFAOYSA-N 414.508 2.205 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCC4)c2)CC1 748673824 LMIOXFNTPPFRSS-UHFFFAOYSA-N 406.529 2.211 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1 751112661 ZLKBCQCZQCYVEY-OAHLLOKOSA-N 420.554 2.388 10 20 HECD CC[C@H](C)OCC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 751875963 RVYPZDVLSRJRKE-ARFHVFGLSA-N 410.486 2.414 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C\c2scnc2C)cc1 753063668 QUOJBZHBILYLFU-KTKRTIGZSA-N 409.533 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@H](NC(N)=O)c3ccccc3)CC2)cc1F 753740593 SPSSKDKEMKTWNL-SFHVURJKSA-N 400.454 2.283 10 20 HECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccccc4OC)C3=O)CC2)cc1F 753976882 DIVGOASELMBRJJ-SFHVURJKSA-N 413.449 2.297 10 20 HECD CC(C)OCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 754172846 ZXFJHIMHGDYTAV-UHFFFAOYSA-N 416.501 2.167 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC3CC(C)(C)NC(C)(C)C3)CC2)cc1 758185110 IFLDAVNDZIZIRF-HXUWFJFHSA-N 404.599 2.077 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccccc3-n3ccnc3)CC2)cc1 758233321 VZWDJPIMDKHDRR-FQEVSTJZSA-N 408.502 2.443 10 20 HECD COc1cc(NS(=O)(=O)c2cccc3nonc23)c(C(=O)O)cc1OC(F)F 765061422 NDFAQDXKHBJWNP-UHFFFAOYSA-N 415.330 2.332 10 20 HECD CCOc1ccnc(N2CCCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)n1 774913298 RXQBXUPSMGUMLD-UHFFFAOYSA-N 403.439 2.210 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)c1 775370043 KGLRECNYGYMQCE-MRXNPFEDSA-N 412.490 2.428 10 20 HECD COc1ccc(N2CCN(CCCN[C@H](C)C3CCS(=O)(=O)CC3)CC2)cc1 779003962 ALDYUDXFPRYTBN-GOSISDBHSA-N 409.596 2.010 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1CC(C)(C)O 780300818 KNCHANHQWGVSEW-KRWDZBQOSA-N 406.596 2.226 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 785440374 ZCHRZMJIYUYTPZ-QGZVFWFLSA-N 418.538 2.132 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(N(C)C)cc1 788320927 RQBQHSJJRJRBEH-QGZVFWFLSA-N 410.518 2.083 10 20 HECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819165 MHGTXIVQWQLVHA-NUJGCVRESA-N 421.513 2.083 10 20 HECD CCOC(=O)c1n[nH]c(-c2cccc(CNC(=O)/C=C/c3ccc(O)c(O)c3)c2)n1 790157009 DDIZGESTEPMDDL-VQHVLOKHSA-N 408.414 2.389 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCc2sccc2C1 793861352 HMOCNKJKHCRVSQ-UHFFFAOYSA-N 401.532 2.367 10 20 HECD COc1ccc(CNC(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)c(O)c1 797618438 HTWDOZPLZHTDDN-UHFFFAOYSA-N 415.446 2.204 10 20 HECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCc2c(O)ccc3c2CCCC3)nc1 797652924 WIOCOGXPPQRQAT-UHFFFAOYSA-N 404.492 2.238 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CN1Cc1ccccc1 803688322 OTRSAVSHUDIKOG-GCJKJVERSA-N 420.557 2.464 10 20 HECD CC[C@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@H](C)S1(=O)=O 805396655 PNLAOEPCHHXZER-HOTGVXAUSA-N 424.588 2.439 10 20 HECD CC[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(Cl)cc(Cl)c1O 806137176 HMHSHELUOVZGPH-HNNXBMFYSA-N 410.367 2.317 10 20 HECD CCOCCCN1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)[C@@H](C)C1 806225565 RHLLSHSFFKXGDR-WFXMLNOXSA-N 418.582 2.183 10 20 HECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)N(C)Cc1ccccc1O 806736334 LHZFQLLPFHKHPC-UHFFFAOYSA-N 408.476 2.485 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CSc3nccnc3N)cc2F)C[C@@H](C)O1 812251540 WOCVRRFCAHEMES-CHWSQXEVSA-N 405.499 2.220 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CCC3=O)c2C)cc1F 844174973 AAXDDMKOVJRXCC-UHFFFAOYSA-N 400.406 2.417 10 20 HECD C=CC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 917836466 NYZBPLGNQLOUSI-SFHVURJKSA-N 406.486 2.443 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(C(N)=O)cc3)cc2F)C[C@@H](C)O1 917918848 UDYLHVCIEVPTEL-ZIAGYGMSSA-N 421.494 2.017 10 20 HECD CCOC(=O)N1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 918220202 ICLLBUANXRLVJD-HOTGVXAUSA-N 422.501 2.423 10 20 HECD CC(C)Oc1ncccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918311550 TVZUGSXMNFOFBV-UHFFFAOYSA-N 412.490 2.303 10 20 HECD O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 921266000 DTRPGAOGMLJIFB-UHFFFAOYSA-N 407.373 2.405 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccc2C)c1 1320385379 IHTBENOOXVONDC-KRWDZBQOSA-N 409.442 2.496 10 20 HECD CCOc1ccc(N2CCN(CC(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)CC2)cc1 1341375887 FZEAMSMNGDDSLT-UHFFFAOYSA-N 422.485 2.072 10 20 HECD CCN(C)[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1801222989 PQKPNHVKNOMXAP-MHEUCROKSA-N 409.914 2.343 10 20 HECD Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805006933 FEZTVFUDCSQTQV-MGPUTAFESA-N 421.457 2.158 10 20 HECD Cc1onc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1C 1806348519 JVDPRJKJJDEOHT-UHFFFAOYSA-N 414.462 2.256 10 20 HECD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)CC1 1816665788 QANVTXYVHHBVQA-GFCCVEGCSA-N 421.548 2.062 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](c4ccc(F)c(F)c4)C3)nc12 727436207 AWAZVMKMEFXTBZ-QGZVFWFLSA-N 418.400 2.463 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1 727752851 DCYWGXICWJRDPX-FQEVSTJZSA-N 414.531 2.365 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)NC3CCCCC3)CC2)cc1F 728748165 QPVZLZNRZYMWPJ-UHFFFAOYSA-N 419.545 2.168 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC3(O)CCCC3)cc2F)C[C@@H](C)O1 740984937 MJRHEJRUMOXZML-IYBDPMFKSA-N 422.497 2.294 10 20 HECD C[C@H](O)CN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 741404166 JVQXIKDAESQTGJ-GHTZIAJQSA-N 424.545 2.481 10 20 HECD Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742346091 GZPOIHXMYOGFRA-UHFFFAOYSA-N 403.460 2.068 10 20 HECD COC(=O)c1ccsc1N1CC[C@H](NC(=O)N(C)Cc2ccccc2O)C1=O 746782899 ZEWCNZWUZHPTMU-AWEZNQCLSA-N 403.460 2.187 10 20 HECD Cc1cc(F)cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 747249929 DWRMNBXXFWNOBA-MRXNPFEDSA-N 405.495 2.314 10 20 HECD O=C1NCCc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc21 751137689 UVKLFEZKGVCNIV-KRWDZBQOSA-N 416.499 2.048 10 20 HECD CN(C)c1ccc(CNC(=O)c2c3c(cc([N+](=O)[O-])c2[N+](=O)[O-])OCCO3)cc1F 751247674 PJYIWLYXOUPGKG-UHFFFAOYSA-N 420.353 2.409 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCCCS1(=O)=O 753486193 LSRZSVCFNUSDQH-INIZCTEOSA-N 402.463 2.340 10 20 HECD COC(=O)C[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 754511614 CSUORGNJLSALAQ-GOSISDBHSA-N 406.438 2.332 10 20 HECD COCc1nc(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 758578859 XFONHMBGPKRDNF-HNNXBMFYSA-N 402.520 2.230 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)c1ccc(Cl)s1 760146867 CSMNPDQJNLFVIV-UHFFFAOYSA-N 412.920 2.135 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(OCC(F)F)n3)cc2)C1 760391138 VTWAEPBYLIVADO-HNNXBMFYSA-N 418.444 2.357 10 20 HECD C[C@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 765735004 BVMZZHSJRBKKDJ-RAIGVLPGSA-N 409.280 2.335 10 20 HECD Cc1cc(CC(=O)N2CCN(C(=O)[C@@H](C)O)CC2)c(C)n1-c1ccc(Cl)cc1 766022505 FEFPZALOCRKAQX-MRXNPFEDSA-N 403.910 2.342 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(CC)nn(C)c2CC)cc1 766317947 GXNZDDFQXMBQRT-UHFFFAOYSA-N 414.553 2.497 10 20 HECD COC(=O)C1(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 766832820 RIVBPSKJBRANKF-LBPRGKRZSA-N 421.405 2.285 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768385945 WDFHWLWAGFBPCX-YQQAZPJKSA-N 413.465 2.438 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cc(Br)c(=O)n(C)c1)c1ccc(N(C)C)cc1 773847750 OORALZMEGUAJLL-NSHDSACASA-N 421.295 2.030 10 20 HECD CC[C@]1(CO)CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 779520847 VYNBSXINNUYMQY-QHCPKHFHSA-N 418.582 2.401 10 20 HECD Cc1nc(Br)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296117 BRNIBLZVVYSTHY-SECBINFHSA-N 408.252 2.250 10 20 HECD COC(=O)c1ccc(CCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786262440 LTAWPXKZZVTGEF-UHFFFAOYSA-N 423.513 2.391 10 20 HECD CC(C)Cc1nnc(NC(=O)CCC(=O)OCC(=O)c2ccc(O)c(O)c2)s1 786791470 YOGHTHWGRSHTDG-UHFFFAOYSA-N 407.448 2.293 10 20 HECD O=C([C@H](CNCc1cc([N+](=O)[O-])ccc1O)Cc1cccc(F)c1)N1CCOCC1 788530382 ZLJLBOPSHDYYOH-KRWDZBQOSA-N 417.437 2.247 10 20 HECD COc1ccc(Cn2cc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)cn2)cc1 792978487 IAXUIBRHORRZHH-AWEZNQCLSA-N 424.457 2.470 10 20 HECD CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)[C@H](CNC(=O)OC(C)(C)C)C1 793603366 HPHTZKRRKPERET-GOSISDBHSA-N 422.545 2.303 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 797639471 AGWFEFGAUXAZNE-NSHDSACASA-N 423.466 2.430 10 20 HECD C[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN(Cc2ccccc2)C1 799013125 MXBKGOAUSSMUTK-NRFANRHFSA-N 417.531 2.406 10 20 HECD CC[C@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC(=O)OC 799169413 IXQRYUUGCKDANO-YESZJQIVSA-N 423.529 2.329 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(CCCO)[C@H]2CCc3ccccc32)cc1F 803662069 GQMVHSMBIQVDME-FQEVSTJZSA-N 413.493 2.406 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCOc2cccnc2)cc1 804073050 RKPYOZPVYGZDLD-UHFFFAOYSA-N 422.485 2.465 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 806254598 OMMHMYJXLAKDMS-LJQANCHMSA-N 416.566 2.115 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCOC2(CCSCC2)C1 806279775 ZIORPFNFYPSJHK-ZDUSSCGKSA-N 415.606 2.303 10 20 HECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290209 DZBNINYHRXGQEL-LJQANCHMSA-N 407.470 2.328 10 20 HECD O=C(CN1CCOCC(F)(F)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808784419 FFFQMIJRRQYAML-UHFFFAOYSA-N 400.381 2.368 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(CN2CCCC2)on1 813508916 QPFWEZBSWBBDFT-UHFFFAOYSA-N 407.854 2.445 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCNC(=O)[C@H]1Cc1ccccc1 815140736 HYNMJOKWDSPECT-JOCHJYFZSA-N 408.546 2.144 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 918199440 AMVSFZJSSSDXOL-SXGZJXTBSA-N 414.481 2.465 10 20 HECD CNC(=O)c1cccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 1319153666 NXNGLYSCXKUIKT-UHFFFAOYSA-N 422.407 2.227 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](CC(N)=O)C1 1319326777 NJVOJLZECZMDAN-HUUCEWRRSA-N 419.481 2.376 10 20 HECD CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1835202829 CVHPNWQTTHCQPA-QHCPKHFHSA-N 411.502 2.184 10 20 HECD Cc1ncsc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441163 AZDWJRCQTLLFBT-UHFFFAOYSA-N 423.498 2.061 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)COc3ccccc3OC)CC2)cc1 11853471 SNYVLPOZWSVYCL-UHFFFAOYSA-N 413.518 2.411 10 20 HECD CNS(=O)(=O)c1ccc(C)c(NC(=O)N2CCOc3cc(N(C)C)ccc32)c1 542023547 BHXKIEGTWYVZEY-UHFFFAOYSA-N 404.492 2.400 10 20 HECD Cc1cc(C(=O)CN2CCC(C(=O)NCCO)CC2)c(C)n1-c1cccc(F)c1 728916157 WBLVEUWZZVQLMN-UHFFFAOYSA-N 401.482 2.236 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1Cl 729061905 LIPLFUFDYZABLH-JTQLQIEISA-N 405.838 2.230 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1 729062398 RMGOHRWJTNJBPU-LLVKDONJSA-N 415.837 2.451 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729067972 ZJIJZXWFBCCLBY-ZDUSSCGKSA-N 409.446 2.495 10 20 HECD CCN1CCC[C@H](CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 729586574 JMACAELQYYIHCD-HXUWFJFHSA-N 417.598 2.238 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(C(=O)OC)nc3)cc2F)CC1 730236217 YQVHNACYTUWUGP-UHFFFAOYSA-N 400.454 2.079 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)cc1F 731363903 PMIRXTLKCMJUAO-QGZVFWFLSA-N 407.534 2.059 10 20 HECD CCOC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 733848693 QEPGEISPMAPUOU-RBUKOAKNSA-N 402.539 2.346 10 20 HECD CCOC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 733848694 QEPGEISPMAPUOU-RTBURBONSA-N 402.539 2.346 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 734406265 UKTJNJRMTSWGTL-UHFFFAOYSA-N 423.560 2.073 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C 742282374 GOHVWUQMDRRPML-UHFFFAOYSA-N 404.488 2.097 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC4(CCOCC4)C3)CC2)cc1 743566893 KWEHTJJOSYDCQK-UHFFFAOYSA-N 402.539 2.029 10 20 HECD Cc1c(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nnn1C 745165599 VTCQOLKQHAZWNK-GFCCVEGCSA-N 418.409 2.083 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1(C)C 745694570 HXTBMXVFUTXWRR-TVTNDZMWSA-N 402.539 2.391 10 20 HECD CCOC(=O)c1c(S(=O)(=O)NCc2ccc(N(CC)CC)c(F)c2)n[nH]c1C 751088408 OKIMTFCMLWLAKB-UHFFFAOYSA-N 412.487 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)N3C[C@H](C)Oc4ccccc43)CC2)cc1F 754212565 LHSQXQWFQGXYCH-HNNXBMFYSA-N 413.449 2.297 10 20 HECD C[C@@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1cc(Cl)ccc1O 756442837 QPMHQSYXRLTRCB-OAHLLOKOSA-N 424.954 2.243 10 20 HECD C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Br)ccc1O 756707322 UZKYGXBJPDVLCF-TZMCWYRMSA-N 421.357 2.294 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cc(Cl)cn1C 757840335 MHVYIJMKABVJMB-UHFFFAOYSA-N 408.905 2.402 10 20 HECD CN(CCC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758708063 HAXBOWZZBMQZBU-QGZVFWFLSA-N 418.538 2.262 10 20 HECD COc1cc(N2CCN(C(=O)NC3CCC(C)(O)CC3)CC2)cc(OC)c1OC 759283429 KDXJANPSWCUNCT-UHFFFAOYSA-N 407.511 2.238 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@](C)(c4ccccc4)C3=O)CC2)cc1 761181549 CFCWCRCBNYGKNM-HSZRJFAPSA-N 408.502 2.284 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCC[C@]1(C)NC(=O)NC1=O 764456072 GATOKWILYZRTJI-KRWDZBQOSA-N 412.284 2.272 10 20 HECD CN(C)c1ccc(CN2CCN(Cc3cc(=O)n4ccsc4n3)CC2)cc1F 768215328 SPVRUZIUUOZHMO-UHFFFAOYSA-N 401.511 2.279 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC(F)(F)CO 768644634 HITHQNZMZBOGQY-XFFZJAGNSA-N 406.501 2.473 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)c2cccc(O)c2)cc1 769691666 QIVASMPBUVWTSD-OAQYLSRUSA-N 411.502 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C(C)=O)c(C)nc3C)nc12 777099972 FUBRLHCNAKILLO-UHFFFAOYSA-N 412.402 2.183 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1 777741907 XZHLSYYLYOBAGZ-UHFFFAOYSA-N 410.584 2.310 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn3c(n2)CCCC3)cc1Cl 779831075 XHCZVWQNCRXBRO-UHFFFAOYSA-N 404.901 2.045 10 20 HECD C[C@H](NC(=O)N1CCN(CC(C)(C)O)C[C@@H]1C)c1ccc(N2CCOCC2)cc1 780338127 JHUQEBGNSIYUQK-ROUUACIJSA-N 404.555 2.071 10 20 HECD O=C(COC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)c1ccc(O)c(O)c1 782618211 HOEDUZJEQOEPAH-UHFFFAOYSA-N 410.831 2.484 10 20 HECD CC(C)(NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCOCC1 787012821 DZYKHJGWGBNICR-KRWDZBQOSA-N 402.539 2.393 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)[C@H](C)c3ccc(C)cc3)cc2)CC1 787318412 DOJJVYVMQWVEHM-WZONZLPQSA-N 409.530 2.444 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccccc1CN1CCCC1=O 787429154 CLIGPXUYTXEJIZ-UHFFFAOYSA-N 422.529 2.116 10 20 HECD C[C@H]1CN(CCN(C)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 788910312 WGTYPYCETGNQIY-CEXWTWQISA-N 404.555 2.335 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(CN3CCCC3)CC2)cc1 788953851 DGTKLIRYDMHZLP-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COc1ccc(CNC(=O)NCCNC(=O)c2ccc(Br)cc2)c(O)c1 792894846 GBKMJEHSRXBURH-UHFFFAOYSA-N 422.279 2.393 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)c1O 793605380 GYFLBUKHQLAGMA-UHFFFAOYSA-N 421.475 2.118 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCN(c3ccccn3)C2)C2CC2)cc1 807694335 KRYCQZBYXPVJRD-SFHVURJKSA-N 407.518 2.034 10 20 HECD COc1ccc(O)c(CNc2cccc(S(=O)(=O)N3CCC(CO)CC3)c2)c1 809685079 YMAUSECJLXQFME-UHFFFAOYSA-N 406.504 2.406 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3nn(C)cc3Br)cc2F)CC1 815493528 JSPGLJUKGHRAEF-UHFFFAOYSA-N 424.318 2.394 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCc4c(C(=O)OC)cccc43)nc12 917139982 ZWEUIGBFUASUFZ-UHFFFAOYSA-N 410.430 2.351 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 918463187 IGPXOAXKQVVNNA-INIZCTEOSA-N 412.465 2.091 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1c2ccccc2C[C@@H]1C 920637582 KIBFCTISAFGNHG-STQMWFEESA-N 418.471 2.287 10 20 HECD COc1ccc(N2CCN(C(=O)CSCc3nnc4n3CCCC4)CC2)cc1 1320880553 YZSZFDFCORRGAV-UHFFFAOYSA-N 401.536 2.205 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3nc4ccccc4n3C)CC2)cc1 1335880494 CMQUOBBFNMPDPT-QUCCMNQESA-N 423.561 2.416 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccco1)c1cc(O)c(O)c(Cl)c1 1794197485 RXXDNWDAGDOOFY-CLLJXQQHSA-N 418.833 2.479 10 20 HECD CC1=CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CC1 1804333247 KAYAWPBHBJANKD-JONQDZQNSA-N 421.588 2.231 10 20 HECD Cc1occc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842434502 HFZYGRNRCXXPAL-UHFFFAOYSA-N 406.442 2.198 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(N4CCCC4)nc3)CC2)cc1 727103903 OMVVFQFAIFFXNX-UHFFFAOYSA-N 409.534 2.242 10 20 HECD CNC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 728516099 OAUVYGOKJBESSL-ZIAGYGMSSA-N 400.454 2.124 10 20 HECD CCc1ccc(N)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 733015530 WGJSTTVDPKVLGQ-UHFFFAOYSA-N 415.465 2.280 10 20 HECD O=C(NCCCSc1nccs1)C1CCN(c2ccc3nncn3n2)CC1 733973500 MLBUMMUNIGTRLI-UHFFFAOYSA-N 403.537 2.096 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c1 734074538 RITQDJAIDZTJMU-UHFFFAOYSA-N 413.474 2.350 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@H](OCCO)C1 734485158 BLLATDVBAVFFGT-HOTGVXAUSA-N 422.481 2.262 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1O 737285538 FVSNGOLWNAKKFQ-HNNXBMFYSA-N 418.421 2.353 10 20 HECD CCC(=O)N[C@H](C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742752984 IEYFPUBZBSTSCF-RHSMWYFYSA-N 406.527 2.349 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cc[n+]([O-])cc2)NC(=O)OC(C)(C)C)cc1 742755414 WJXHMOIQAHRMOF-GOSISDBHSA-N 400.479 2.382 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1F 746805350 VDYCJJFYJDITRI-NRFANRHFSA-N 416.428 2.114 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2F)C[C@@H](C)O1 748482729 YBDVTMSWKYFICU-ZIAGYGMSSA-N 401.438 2.400 10 20 HECD COC1CCN(CCNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 751086375 YRVYWYNUAQOREH-IRXDYDNUSA-N 422.545 2.349 10 20 HECD C[C@H](NCCN1C(=O)CNC1=O)c1cc(Br)cc(Br)c1O 761500584 WVJZKDTYUXJZHT-ZETCQYMHSA-N 421.089 2.120 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 770073950 QDGIQVPUFKLOPY-UHFFFAOYSA-N 405.432 2.477 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@]4(CCOC4)C3)cc2F)CC1 771435749 XYWWWMIUGOUWPA-GCJKJVERSA-N 420.529 2.105 10 20 HECD C[C@H](NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(N(C)C)cc1 773981963 HWUJRQJHDKWSAF-LBPRGKRZSA-N 406.460 2.262 10 20 HECD NC(=O)c1ccc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)nc1Cl 774407010 XTSIZDYKDJUIOF-UHFFFAOYSA-N 400.847 2.302 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)c2)CC1 781273147 OSXUELIEWHHWSB-UHFFFAOYSA-N 401.398 2.237 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(CN2CCCC2=O)cc1)c1ccc(N(C)C)cc1 787435457 YFKYSKDQRRORIT-KRWDZBQOSA-N 422.529 2.369 10 20 HECD CC(C)(C)OC1CC(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321878 DAYRKHJHFSGDTC-UHFFFAOYSA-N 417.550 2.239 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1ccccc1 789800721 NYDKFHYMJCNACH-HRAATJIYSA-N 411.477 2.498 10 20 HECD CN1CCN(c2ccc(CNc3cc(S(=O)(=O)N4CCCC4)ccn3)cc2)CC1 794967611 GOAYXQFSPUGJIZ-UHFFFAOYSA-N 415.563 2.230 10 20 HECD CCC[C@@]1(C2CC2)NC(=O)N(CN(C)Cc2ccc(N3CCOCC3)cc2)C1=O 802724248 OSEVTJMMYQGSCP-QFIPXVFZSA-N 400.523 2.413 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3COC4(CCCCCC4)O3)ccc21 803689095 JUJAARWFYXHHCR-IBGZPJMESA-N 415.534 2.267 10 20 HECD CN(Cc1nccn1CC(F)(F)F)C(=O)C(=O)NCCCSc1nccs1 806277988 MNWGPQURXWWZFJ-UHFFFAOYSA-N 421.470 2.159 10 20 HECD Cc1cccn2cc(CCNC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)nc12 806536973 DXVKCHXLHUTXLJ-UHFFFAOYSA-N 405.502 2.218 10 20 HECD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)c1 808489308 LOHNTQZREGJWPE-ZDUSSCGKSA-N 401.440 2.141 10 20 HECD CC(C)[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCN(C)CC1 916258182 MUHCEAWNICRKKV-LEWJYISDSA-N 418.582 2.355 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(C[C@H]3CCOC3)C3CC3)cc2)C1 918117686 PVSLGBYRMAWYDZ-QZTJIDSGSA-N 400.523 2.099 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 920195642 XMMSARKUCFTGOO-UHFFFAOYSA-N 410.474 2.045 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccn(-c2ccccc2)n1 1321362116 XWLBOVKXXGVXLT-SFHVURJKSA-N 409.442 2.117 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cc3c(C)nc4cc(O)nn4c3C)CC2)cc1 1323192668 IVOKXXXBEPSFSB-UHFFFAOYSA-N 409.490 2.342 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3COc4ccc(F)cc4C3)CC2)cc1 1336104824 IXQJDROWPAMGRB-SFHVURJKSA-N 413.493 2.324 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(-c2cccnc2)noc1C 1345434279 XIXPNKOTXWESLN-HNNXBMFYSA-N 411.414 2.360 10 20 HECD Cc1nccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1797138337 HJGFLRODRFGRAC-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1C[C@@]1(F)Cl 1822502397 RCGSGLGXWRNQLU-RSNWOKGLSA-N 423.832 2.446 10 20 HECD O=C(CCN1CCCCC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500890 AHYDBXBWFLSKOG-UHFFFAOYSA-N 421.925 2.444 10 20 HECD COc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1846854548 GXQAWIPXLYBTEY-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1c(CNC(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)n(C)c2ccccc12 472239369 LQEPHWPXFKDLBB-HNNXBMFYSA-N 411.458 2.455 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3cn4cccc(C)c4n3)CC2)cc1 726770845 JHTUIVQHOZCXBZ-UHFFFAOYSA-N 407.518 2.132 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3cccc(F)c3)cc2F)CC1 730286852 ZPEIBYMUNVSYKB-UHFFFAOYSA-N 416.472 2.153 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1O 730589926 YDFLJDMLAYTLKN-SFHVURJKSA-N 418.515 2.259 10 20 HECD Cc1cc(C(=O)Cn2cnnc2[S@](C)=O)c(C)n1-c1ccc2c(c1)OCCO2 732717281 DPFGCIXRXVJCLG-NDEPHWFRSA-N 400.460 2.077 10 20 HECD Cc1cc(C(=O)CN(C)CC(F)(F)F)c(C)n1-c1ccc(S(N)(=O)=O)cc1 732808435 RCUHBVGAOOXORQ-UHFFFAOYSA-N 403.426 2.418 10 20 HECD COC(=O)[C@@H]1CC12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 733848320 MFTYHHRUHFQPNM-INIZCTEOSA-N 405.470 2.147 10 20 HECD C[S@@](=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 737110497 BPTPWMHWIUKORM-CQGGRAHPSA-N 416.499 2.276 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccnc3-n3cncn3)cc2)CC1 737191417 QSPRSXGVYBKRSR-UHFFFAOYSA-N 419.489 2.154 10 20 HECD C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cnn(C)c1 754772044 KFVKHQOPPPCNTH-OAGGEKHMSA-N 403.502 2.140 10 20 HECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 756186858 KVJGCZBARHTWFJ-GOSISDBHSA-N 417.893 2.180 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCSc3ccccn3)nc12 756740182 YQZGCZIHAJFMSX-UHFFFAOYSA-N 402.432 2.232 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](C)N(C)C3CC3)CC2)cc(OC)c1OC 759281586 IIZKVSYJASMUSC-HNNXBMFYSA-N 406.527 2.027 10 20 HECD CC1CCN(c2ccc(CNC(=O)N(C)C3CCN(S(C)(=O)=O)CC3)cc2)CC1 759578576 FXICBNPUVBVAGA-UHFFFAOYSA-N 422.595 2.488 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cnc(Cl)c(F)c3)c2)CC1 761977627 ULXPMVBZRODHHG-UHFFFAOYSA-N 412.874 2.343 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN(C[C@@H]2CCOC2)CC1 764786057 YQYGIMIYAFUYJN-ZDUSSCGKSA-N 412.328 2.455 10 20 HECD CC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 764798802 VNELQSLHQOPZDJ-KRWDZBQOSA-N 412.465 2.416 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCO[C@H](C4CC4)C3)CC2)cc1 765320167 GEGBYNYDPPUEAH-UGKGYDQZSA-N 416.566 2.464 10 20 HECD COc1cc(CN2CCOc3cc(N(C)C)ccc32)cc(OC)c1OCC(N)=O 765659073 UWXYTCJDOFSRNR-UHFFFAOYSA-N 401.463 2.033 10 20 HECD O=C(Cc1ccccc1Cl)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768444809 YMRWEMKZPLPTNV-IBGZPJMESA-N 402.878 2.358 10 20 HECD CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 768498536 QZXJSYYZKRJGJF-SFHVURJKSA-N 405.543 2.103 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2n(c1=O)CCS2 768913425 ZUFHFZGMTFSOTQ-CQSZACIVSA-N 420.922 2.102 10 20 HECD CCN(CC)c1ccc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1F 769529862 HBTBQRUYLRAZSY-UHFFFAOYSA-N 423.558 2.220 10 20 HECD COC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cn1 769672057 MTBZPRPVPSAOAA-UHFFFAOYSA-N 418.519 2.199 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1)c1ccc(N(C)C)cc1 773844134 CINLECDMQIYJEG-KRWDZBQOSA-N 409.534 2.320 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccncc3)C3CC3)CC2)cc1 778246954 UJJKPIBLVFMALS-CMDGGOBGSA-N 420.513 2.486 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOC3CCCCC3)CC2)cc1 778248053 ZZVIOYIZRYWXQJ-QXMHVHEDSA-N 415.534 2.366 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)n(-c2ncccn2)n1 783317256 PAVQPBFYHNEOHF-UHFFFAOYSA-N 421.505 2.412 10 20 HECD C[C@@H]1CCCCN1C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785423289 VPYWLJXYVIRHRR-QUCCMNQESA-N 400.567 2.482 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)cc1 785424734 TYCNAGPGTHOJIX-KRWDZBQOSA-N 418.538 2.275 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(C)cccc3F)cc2)CC1 786121554 HASPRRYVOVQCFC-UHFFFAOYSA-N 405.495 2.281 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc(N(C)C)cc1 787299468 VWHPTZBRLBJQEK-KRWDZBQOSA-N 405.502 2.491 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)c1ccc(F)cc1 787641501 SPLFKMSBLDXTDK-HNNXBMFYSA-N 410.540 2.300 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCSCC3)cc2F)C[C@@H](C)O1 789816120 BVNUPZYJEWJQLI-GASCZTMLSA-N 423.554 2.315 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)N1CCN(C)CC1 791250271 OWQYQRVJNIWJAM-KRWDZBQOSA-N 404.555 2.011 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(O)c1 794378359 FAFYZIKYNJUIHA-ZDUSSCGKSA-N 405.432 2.292 10 20 HECD COCCO[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 802005668 RQFQAONUYNITFX-GOSISDBHSA-N 409.502 2.124 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)cc1F 804852794 NSAZNYWQYCRXJM-INIZCTEOSA-N 421.513 2.478 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COCCN1CC(F)F 806951036 ZHFCRMXIBSDSBC-CZUORRHYSA-N 419.419 2.339 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807676358 FHDLUBICLDHGCJ-FUHWJXTLSA-N 410.518 2.334 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 810695904 KBSCWQBHAMHXGH-UHFFFAOYSA-N 409.486 2.462 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)CN(C)C(C)C)CC2)cc(OC)c1OC 811929586 HQLRAHXKGSXCRJ-INIZCTEOSA-N 408.543 2.273 10 20 HECD COC(=O)c1cc(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n(C)c1C 812756944 GCNZISJYUXPFSD-UHFFFAOYSA-N 417.506 2.468 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1cnn([C@@H]2CCOC2)c1 816461660 ULINXHMBZGDWBI-CQSZACIVSA-N 420.516 2.432 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C\c3ccccc3)n3nnnc3C)CC2)cc1 872035027 MHLKYDPZVUDECM-LTGZKZEYSA-N 404.474 2.337 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 917365214 ZODOWSFINMFRAS-GOSISDBHSA-N 418.515 2.464 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3Cc4ccccc4O3)cc2)C1 918008017 FDLLKKLIKSGJPF-UYAOXDASSA-N 408.502 2.191 10 20 HECD CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCCC2)cc1 918208411 FCHLRHCDNVODOA-IBGZPJMESA-N 408.568 2.290 10 20 HECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918464411 VGCXAEGWNDEMLW-SFHVURJKSA-N 408.502 2.206 10 20 HECD Cc1ccccc1CN(C)C(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637508 HPGSCXZSBRSTMQ-AWEZNQCLSA-N 420.487 2.276 10 20 HECD Cc1[nH]ccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005664 UEMFRILIVODYLZ-FQEVSTJZSA-N 419.865 2.145 10 20 HECD Cc1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1795182845 BOVCAUJXCXIADA-ZXRXUGKRSA-N 423.469 2.472 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)[nH]n1)c1cc(O)nc(O)c1 1817848508 NRMNNIDPWQRJNW-KWFDTGPKSA-N 423.832 2.446 10 20 HECD COc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1 1844941010 CAODYXXEBQJLDK-UXBLZVDNSA-N 424.453 2.342 10 20 HECD O=C1c2ccccc2C(=O)N1CCC1=CCN(c2cncc(-n3cccn3)n2)CC1 480823365 FUEMEWPTEWNEGQ-UHFFFAOYSA-N 400.442 2.485 10 20 HECD CCOC(=O)Cn1nc(C)c(/C=C2/CCn3c2nc2cc(C(=O)O)ccc2c3=O)c1C 526080787 DHXSSCIHPSHXJL-ZROIWOOFSA-N 422.441 2.415 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1 732677863 BOZFMBODYCJSGO-UHFFFAOYSA-N 407.423 2.282 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(C)c4c(O)nc(O)nc4n3)CC2)cc1 740701200 ZPIBDNVXEGOUAZ-UHFFFAOYSA-N 409.446 2.152 10 20 HECD COc1cc(N(C)CC(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc(OC)c1OC 741795329 JYCYLRDYXRTKCX-UHFFFAOYSA-N 413.430 2.013 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOc4ccccc4C3)CC2)cc1 742939834 JGFYYTAIKOSUMT-UHFFFAOYSA-N 410.518 2.421 10 20 HECD CC(C)(C)OC(=O)[C@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 748832061 DEULEUXQLBASAQ-LJQANCHMSA-N 421.513 2.085 10 20 HECD Cc1[nH]ccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 750525756 DLBSBEYPUHEQEC-UHFFFAOYSA-N 415.471 2.418 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 753642689 FPRMENCFDBHPHY-CJNGLKHVSA-N 424.453 2.234 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc4c(c3)CCC(=O)N4)CC2)cc1F 753738884 MKPDSPADAKPILT-UHFFFAOYSA-N 413.449 2.447 10 20 HECD COCCOc1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754040019 JBDVSRRXLICHJT-UHFFFAOYSA-N 424.494 2.370 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)C[C@H](C)O)CC2)cc1 754043067 NXIXOKKNPZSKSF-REWPJTCUSA-N 413.562 2.061 10 20 HECD CCCn1c(C)nnc1SCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 760329123 DQABKLQWNGDVNE-UHFFFAOYSA-N 407.515 2.381 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(CC(C)C)c3C)nc12 767022282 HUBQPFNXIBAJHI-UHFFFAOYSA-N 401.423 2.130 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3)CC2)c1 768213314 QDVODPKWIBPLCQ-UHFFFAOYSA-N 423.560 2.107 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 769283379 VDCOHKDUNIKNIO-UHFFFAOYSA-N 402.394 2.348 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1 774364378 YEBZHGOQUDVXOH-UHFFFAOYSA-N 408.458 2.471 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCN2CCN(Cc3ccccc3)CC2)c1O 774942654 PFQQSTNAVABWCD-UHFFFAOYSA-N 400.479 2.216 10 20 HECD CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1ccc(O)c(O)c1 779488961 KAOIEZDYFIVLIO-OQFOIZHKSA-N 411.458 2.045 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 785422374 KHEYTPMTCSYCPX-FQEVSTJZSA-N 411.502 2.282 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@@H](Cc2ccncc2)C1 789867047 CSROWSMTSXSQMQ-FQEVSTJZSA-N 424.570 2.342 10 20 HECD Cc1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N(C)C 797607140 DLZKLFOBHOEJDV-ZDUSSCGKSA-N 407.492 2.409 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OC[C@@H]1CNC(=O)O1 801222397 XAMKWTDOYPQGSZ-QVIVLVACSA-N 412.514 2.381 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2cc(F)ccc21 802551400 UFWVIVZZWCCBOH-UHFFFAOYSA-N 415.440 2.131 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803298061 OBZJUPPOMSBGET-SFHVURJKSA-N 424.545 2.391 10 20 HECD Cc1ccnc(OC2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)c1 803686928 ROCUHPMVBMTRMC-UHFFFAOYSA-N 422.529 2.459 10 20 HECD O=C(NC[C@H]1CCCS1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806917935 RHJBOERVRQIHEE-CZUORRHYSA-N 413.490 2.385 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1 807102384 YOQGUQLDLVTQDE-GOSISDBHSA-N 418.538 2.145 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 810036041 OFINWFIDOGHXOF-UHFFFAOYSA-N 418.515 2.059 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2cccnc2)CCCC1 813416243 NBMRRWPUBMNAHU-UHFFFAOYSA-N 413.543 2.445 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1 819493342 DDILMYKSICDIGY-UHFFFAOYSA-N 419.532 2.025 10 20 HECD Cc1oc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C(=O)O 871821663 HGTNRGUHSXAJDK-UHFFFAOYSA-N 412.439 2.049 10 20 HECD Cn1c(=O)ccn(CC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1=O 915394705 PRNMPIAOLUQHGO-UHFFFAOYSA-N 421.413 2.144 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1CCOCC1 918202751 XWZIKPIRYVZZBH-JOCHJYFZSA-N 418.582 2.051 10 20 HECD COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918776851 BHKINJHYESWTMC-UHFFFAOYSA-N 417.487 2.030 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)N4CCCCC4)CC3)cc2F)CC1 1319924005 BSUGEKYBDNEFOT-UHFFFAOYSA-N 403.546 2.301 10 20 HECD COc1ccc(N2CCN(CCCNCc3c(Cl)nc(OC)n3C)CC2)cc1 1319935263 RBKBRVRUIDQQIC-UHFFFAOYSA-N 407.946 2.393 10 20 HECD CN1CCN(c2ccc(CN[C@@H]3CCCN(C(=O)N4CCCC4)C3)cc2F)CC1 1322444217 CJWUIDWJHJAGMB-LJQANCHMSA-N 403.546 2.347 10 20 HECD Cn1nccc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424238 LMDRTWUXIBDKQE-UHFFFAOYSA-N 407.430 2.288 10 20 HECD CN1CCCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712853 XOTKZDBTSKWVQQ-IVSAIRAKSA-N 421.925 2.487 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)CC2CC2)[nH]n1 1823496270 JUMDXRCOPMPKBC-ZDUSSCGKSA-N 421.548 2.062 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)CC2CC2)CC1 1826610037 GFBGFXVPAQJFHC-MRXNPFEDSA-N 423.604 2.267 10 20 HECD CC1(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)CCCCC1 1846324687 SAGLGUWVPSRUCY-UHFFFAOYSA-N 409.577 2.021 10 20 HECD CCc1nc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cs1 726619475 PORHDYBIPZCFKA-INIZCTEOSA-N 415.563 2.449 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(OC)c(OCCO)c3)CC2)cc1 726631741 AEHACNKJKXAXAK-UHFFFAOYSA-N 400.475 2.474 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1-n1nnnc1C 726701163 AFBIJCDNTXDZLD-UHFFFAOYSA-N 423.477 2.138 10 20 HECD Cn1ccc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)n1 727350910 XMSTYWMLMABEBY-LBPRGKRZSA-N 424.548 2.070 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2)CC1 739775153 TUCXGGYDOJDSTC-UHFFFAOYSA-N 413.390 2.457 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(S(=O)(=O)NC)o1 743809439 WEOMVLHWFIQQPK-UHFFFAOYSA-N 417.281 2.318 10 20 HECD CN(C)c1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2n1 743820349 CKZPYVHMCXIPDU-UHFFFAOYSA-N 414.487 2.308 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1(C)C 745694564 HXTBMXVFUTXWRR-AQOAWAETSA-N 402.539 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)C)n(C)n3)CC2)cc1 747013378 MRSDTWNDBBLZDO-UHFFFAOYSA-N 400.479 2.058 10 20 HECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1Nc2ccccc2S(=O)(=O)N1 749931746 VYPDCNRQTNHJKK-IBGZPJMESA-N 400.504 2.023 10 20 HECD C[C@H](Cn1cccn1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065108 MEHDCPZLSGSQJB-GFCCVEGCSA-N 406.489 2.270 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c1 751415101 JZRNDUNOGRXCSH-UHFFFAOYSA-N 418.393 2.171 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccccc3OCC(=O)N(C)C)CC2)cc1F 753737271 DPMGJPNXYYIYDS-UHFFFAOYSA-N 415.465 2.264 10 20 HECD O=C(NCc1csc(O)n1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760174496 XTNZCERRLLCAKN-UHFFFAOYSA-N 411.486 2.347 10 20 HECD COc1ccc(N2CCC(NCCS(=O)(=O)NCc3ccccc3)CC2)cc1 765346535 BGIYMWKPVQPERM-UHFFFAOYSA-N 403.548 2.373 10 20 HECD CCN1C[C@H](C)N(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 766245143 YVVQKBSDYATAGG-UXHICEINSA-N 417.598 2.331 10 20 HECD CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3O)CC2)c1 769358894 CJXAQGZMSUKMJL-UHFFFAOYSA-N 416.499 2.312 10 20 HECD CCC(CC)n1nccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 770858870 MRSLKPDPIFAPME-UHFFFAOYSA-N 404.536 2.409 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccccc1OCC(=O)N(C)C 773756905 QHGSYUVIGUXSEB-ZDUSSCGKSA-N 422.428 2.404 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 775137104 IDWJFMNTRJBCRT-UHFFFAOYSA-N 412.538 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCc3nccs3)CC2)cc1 778254654 QLVIPBJZDSSDGI-HJWRWDBZSA-N 414.531 2.106 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncn(C)n1 780306260 KHTCZFBNSUBMDQ-LBPRGKRZSA-N 412.416 2.231 10 20 HECD NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 783689111 BQWLCJIXIDELJE-UHFFFAOYSA-N 420.226 2.092 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)no1 784765898 CDGHWNXFBAFNRP-AWEZNQCLSA-N 406.870 2.315 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccccc1Cn1cccn1 785642670 YIESRUJPHRMWBA-UHFFFAOYSA-N 405.502 2.238 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)nc(C(F)(F)F)n3)cc2)CC1 786656537 NIGHGJXBNQEPDH-UHFFFAOYSA-N 421.423 2.402 10 20 HECD CCOc1ccccc1CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 786687505 CSEKASFHPCKPKU-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CCS[C@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324611 WLUGDAASRMFTGQ-MOPGFXCFSA-N 405.564 2.320 10 20 HECD COc1ccc(F)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1OC 788434747 QSIHOQRUWKMDOI-HNNXBMFYSA-N 415.465 2.475 10 20 HECD CN1CCCC(C)(C)[C@H]1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790536889 AHZZKMAEHBAKFV-AZUAARDMSA-N 415.582 2.308 10 20 HECD O=C(Nc1cccc(F)n1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 793052882 ZQLZGIDMMDDHSN-AWEZNQCLSA-N 406.845 2.299 10 20 HECD Cc1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c[n+]1[O-] 794719874 IXNVYLRBUUMVFS-IYBDPMFKSA-N 403.454 2.076 10 20 HECD COC(=O)Cn1ncc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)c1C 797062902 AYVFEJOSKNIZAV-UHFFFAOYSA-N 413.478 2.251 10 20 HECD COC(=O)[C@H](C)S(=O)(=O)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 797291766 PRESWNPEKCTJHI-ZDUSSCGKSA-N 412.895 2.298 10 20 HECD CCc1ccnc(CNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 797793901 ZCGQDTDQGFWHLQ-UHFFFAOYSA-N 420.560 2.152 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCCCNS(=O)(=O)c1ccccc1Cl 799025560 ZKUBNFLKNYYPIH-VQHVLOKHSA-N 410.879 2.249 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 807100609 LHDCURUNOPNEAT-WIYYLYMNSA-N 408.546 2.456 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@H](C)c2nccs2)CC1)c1ccc(N(C)C)cc1 807675666 ZNSIISGAATZEJN-JKSUJKDBSA-N 415.563 2.292 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808296350 OHPJRPKMUYBEBI-HNNXBMFYSA-N 418.943 2.129 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccncc4c3=O)cc2F)C[C@@H](C)O1 810009176 RRGCMFACRRNMNP-HZPDHXFCSA-N 424.476 2.466 10 20 HECD CCNC(=O)[C@@H](NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 814363039 GCJACEWEDYGXPN-CLCXKQKWSA-N 408.518 2.399 10 20 HECD CNS(=O)(=O)c1ccccc1N1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 815035962 HWPBTOYDBLUDEK-UHFFFAOYSA-N 402.564 2.291 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C1CCN(c2ccc3nnnn3n2)CC1 914508104 VPNHEJWRWFMAGC-UHFFFAOYSA-N 422.537 2.239 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3F)C2=O)cc1 915667085 PXDLVABVUFGHNN-NRFANRHFSA-N 416.428 2.114 10 20 HECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(N2CCCS2(=O)=O)cc1 918374423 FAIQBDNNBOMAMW-UHFFFAOYSA-N 401.488 2.315 10 20 HECD CCO[C@H](CC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 920672852 KVGFTVULFONAHQ-ZRGWGRIASA-N 410.486 2.414 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777848388 SHBSCNIMYBRNSM-XCMNSTNTSA-N 417.506 2.057 10 20 HECD Cc1c(CNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)n(C)c2ccccc12 472135482 ZIBOYJGELGTLKZ-QRWLVFNGSA-N 405.520 2.022 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)N3CCC(C)CC3)CC2)cc1 726248490 XIIKWKGVZBGDID-HXUWFJFHSA-N 417.598 2.237 10 20 HECD O=[N+]([O-])c1c(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc2ccccn12 726967821 CJQSXGILKCMMFC-UHFFFAOYSA-N 401.448 2.089 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 728212097 SAKSDXIGRNXUPG-OAHLLOKOSA-N 421.501 2.475 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1 734066692 PQYUFNCAQOBROU-UHFFFAOYSA-N 419.503 2.185 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 735394194 KMFCMKYHCWRVCW-LBPRGKRZSA-N 401.419 2.073 10 20 HECD CC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 740609162 GCFZNTOJYNGRTM-UHFFFAOYSA-N 401.488 2.392 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)c3ccc4c(c3)CCC4)CC2)cc1 742917459 XMHRNLUMACLJNF-UHFFFAOYSA-N 407.514 2.305 10 20 HECD CN(C)c1ccc(CNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1F 743636090 FROSRSAWMRBXQR-KRWDZBQOSA-N 414.481 2.371 10 20 HECD CC(C)(C)OC(=O)CCCCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 743761086 YMXQMTNGVSMXPX-UHFFFAOYSA-N 400.497 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)nn(CC)c3Cl)nc12 745360939 BXMNLLKQDURZSE-UHFFFAOYSA-N 407.814 2.147 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCNS(=O)(=O)c2cccnc2)cc1 746325904 JZMPCTGMMULZLT-UHFFFAOYSA-N 419.551 2.048 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(-c4ncccn4)s3)cc2)C1 749499508 RNXAIUZUNWKCCH-HNNXBMFYSA-N 422.514 2.232 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1 750334830 FBBBCQGCPUSKJJ-INIZCTEOSA-N 424.862 2.379 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccccc3N3CCOCC3)CC2)cc1 751384614 DFWXUKSLVNYZQE-UHFFFAOYSA-N 424.545 2.084 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cn(C)c(=O)c2ccccc12 759087908 ATKNGTCLESEIQM-UHFFFAOYSA-N 407.470 2.420 10 20 HECD CC(=O)[C@@H](Cc1c(F)cccc1F)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 768630738 ISYVIGNMUSZYFI-QGZVFWFLSA-N 413.398 2.399 10 20 HECD Cc1ccc(C(=O)Nc2ccc(F)c(NC(=O)CCN3CCOCC3)c2)c(O)c1O 770478293 WRFORYONMBUIAW-UHFFFAOYSA-N 417.437 2.458 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cc[nH]c34)cc2)C1 773245758 VALINOHLVUFCFN-KRWDZBQOSA-N 419.485 2.125 10 20 HECD COc1cc(C(=O)NCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1OC(F)F 773739474 IAAHAHRGKDRSTD-NSHDSACASA-N 424.400 2.185 10 20 HECD Cc1ccnc(Oc2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)n1 774363949 ZXOBBOCFWIMTNW-UHFFFAOYSA-N 408.414 2.286 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)CCC(C)C)CC2)cc(OC)c1OC 774662625 HEKHRIQONYDLTM-INIZCTEOSA-N 421.538 2.302 10 20 HECD Cc1nn2cc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)cnc2c1Cl 776088279 FTGPQMLJOTYICW-UHFFFAOYSA-N 409.884 2.349 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCc4nnc(O)cc4C3)cc2F)C[C@H](C)O1 776119035 ZNKBKJMCUZURRN-KBPBESRZSA-N 415.469 2.203 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)OCO2 778004428 BLFMUPFJGFSTMH-UHFFFAOYSA-N 404.488 2.103 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 779517845 GNCXMRRHEHPUQH-CLFYSBASSA-N 416.499 2.222 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(C(N)=O)c2OC)cc1 782782968 ZOAMBYUGMWBYND-UHFFFAOYSA-N 412.490 2.237 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(C)c3C(F)(F)F)cc2)CC1 786660657 GTBASCBMGBWHHR-UHFFFAOYSA-N 409.412 2.037 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1N1CCNC1=O 787453172 JYQCWJLITATVHI-UHFFFAOYSA-N 421.501 2.380 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccnc2N(C)C)cc1F 787632834 HJWJMCMVAKYSNP-UHFFFAOYSA-N 401.486 2.066 10 20 HECD CCOC(=O)CC1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788930359 ROGHRYXMEMHYPN-UHFFFAOYSA-N 401.507 2.095 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788938259 QMXCMZLWSOFSBM-IBGZPJMESA-N 422.529 2.307 10 20 HECD C[C@H](O)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789863795 IEKLVLTTYDWCTA-INIZCTEOSA-N 413.543 2.226 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)CCc3nc(-c4ccccc4)no3)nc12 796388725 TXUZXKXIWLOENO-UHFFFAOYSA-N 422.445 2.336 10 20 HECD CC[C@H]1CN(C(=O)c2ccccc2SCC(=O)NC(C)C)C[C@H](C)S1(=O)=O 805392838 NOVNZDUTGQVVCF-GJZGRUSLSA-N 412.577 2.341 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(C(OC)OC)o3)CC2)cc1 806847490 QDALBOOZZLJJFA-UHFFFAOYSA-N 403.479 2.132 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC3CCC(OC)CC3)CC2)cc1 806944196 TWFZOIWBBPKBSV-UHFFFAOYSA-N 403.523 2.055 10 20 HECD Cc1cc(C(=O)Cn2c(=O)ccn(C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 913540781 SSYGNZVMSOUYFQ-UHFFFAOYSA-N 403.385 2.439 10 20 HECD CNC(=O)CN1CCC(NC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 915774977 MSQIJAVKMANZTJ-UHFFFAOYSA-N 422.489 2.367 10 20 HECD Cc1cc(C)cc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 916676292 FORNVLRZULEUBO-UHFFFAOYSA-N 402.516 2.233 10 20 HECD C[C@@H](NC(=O)N1CCN(C(=O)c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 920866778 KZGOUWNFPCTGRV-GOSISDBHSA-N 423.517 2.147 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007295 BOOVITBCZIUZSA-BYYRLHKVSA-N 408.882 2.241 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)no1 1795216913 HWNVXOVBIQCFNK-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Cc1nccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800716650 PQGVRPPHOLQSIW-BTTYYORXSA-N 416.865 2.415 10 20 HECD Cc1c[nH]cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725826 PVDKFLQLSUZTLL-NSHDSACASA-N 413.459 2.125 10 20 HECD O=C(c1ccc2cnccc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249522 SXCDZMIEEWHSKX-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)/C=C/c2cnc[nH]2)C1 1846533512 SCPQLMLYQMLQFP-NSCUHMNNSA-N 402.838 2.005 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 141681093 FKXBMVPYLJXLEO-AWEZNQCLSA-N 401.438 2.487 10 20 HECD COc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1NC(C)=O 608259142 TUTWADNYQDPISD-UHFFFAOYSA-N 405.476 2.307 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CN(C)C)CC3)cc2F)C[C@H](C)O1 727932158 WIDDSZSHCUFYHZ-ROUUACIJSA-N 420.573 2.329 10 20 HECD Cc1nc2nc(N)nn2c(C)c1CCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735516312 OEALEXJMYMXCGF-QGZVFWFLSA-N 424.505 2.169 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2n[nH]c(-c3ccccc3Cl)n2)c1 735688454 VWDSLZDKALGJSX-UHFFFAOYSA-N 407.839 2.455 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C)C[C@@H]3C(C)C)cc2F)CC1 739006807 ZZCQKSKKVVIAIM-OAQYLSRUSA-N 405.562 2.449 10 20 HECD CC(C)[C@@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)N1C[C@@H](C)O[C@H](C)C1 741021293 OTFHNJVVAWEYFG-HMFYCAOWSA-N 419.566 2.388 10 20 HECD CN(C)c1ccc(CNC(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1F 741406554 JOKWEKUOXOZZEE-QFIPXVFZSA-N 400.498 2.328 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 743162039 VRSXARULEQKSDM-OAHLLOKOSA-N 418.519 2.314 10 20 HECD O=C(Cn1ccc(C(F)(F)F)n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 746010548 LVMMCVXRYMWFOS-UHFFFAOYSA-N 400.376 2.319 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccccc3CN3C(=O)CNC3=O)ccc21 746706778 WOOVFEFPGWDTEU-UHFFFAOYSA-N 407.474 2.443 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)CC(C)(C)C)cc2F)C[C@@H](C)O1 751767478 VJHQRMDLFKGIHK-SPYBWZPUSA-N 424.513 2.396 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)C4)cc2F)C[C@H](C)O1 752005804 UUXQQBHUTVVIML-HOTGVXAUSA-N 418.513 2.251 10 20 HECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCC1 752021561 RIHATRLCNLDMPF-UHFFFAOYSA-N 403.523 2.428 10 20 HECD CC(C)(C)OC(=O)N1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 752496633 UBXRYILHXHCZDB-UHFFFAOYSA-N 407.486 2.270 10 20 HECD COC(=O)c1nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)sc1C(C)C 752859986 SPFBENZZCQUOEV-UHFFFAOYSA-N 413.477 2.383 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](CCc3ccccc3)C2)c1 756617373 OIDFAYWIFBXCKP-QGZVFWFLSA-N 404.488 2.238 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C)c(OC)c1 761269722 DWIPVGPHWFCTOF-UHFFFAOYSA-N 400.478 2.272 10 20 HECD CCOC(=O)Cc1csc(NC(=O)CN2CCOc3cc(N(C)C)ccc32)n1 764979131 LBSFKEULDNUUHT-UHFFFAOYSA-N 404.492 2.152 10 20 HECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cccc21 769255126 TUPVFHRXNXPLHQ-UHFFFAOYSA-N 406.486 2.233 10 20 HECD CCO[C@H](C)c1noc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 769507032 JTYYRLMVQFCCMR-GOSISDBHSA-N 415.538 2.322 10 20 HECD O=C(NCCCN1CCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769620895 QYEJLVSHCHUBCZ-UHFFFAOYSA-N 409.533 2.470 10 20 HECD Cc1ccc([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 770299676 KLMDWYFEZKDSSG-TZIWHRDSSA-N 410.518 2.230 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 775197617 NREZNFZTOFUQPQ-NRFANRHFSA-N 411.502 2.416 10 20 HECD Cn1cc(/C=C(\Cl)c2nc3ccc(Br)cc3n2C)c(=O)n(C)c1=O 776724089 OOUQORDNLVPOJK-WDZFZDKYSA-N 409.671 2.470 10 20 HECD C[C@@]1(C2CC2)NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777616623 SKLWMUOSRWYRFH-QFIPXVFZSA-N 424.480 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3Cc4ccccc4O3)CC2)cc1 778237423 PCPWWOXVZFQEKH-KUFMOJEASA-N 421.497 2.020 10 20 HECD O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCOCC2)c(F)c1 778627233 MERUMLFQLNDVDM-AATRIKPKSA-N 423.448 2.350 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c(C)s1 779502853 HRPCEPWDHVYQCZ-GQCTYLIASA-N 422.528 2.322 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@]3(C)CCCOC3)cc2F)C[C@@H](C)O1 781291005 RTWBDVCOUUMLDP-XCGNWRKASA-N 422.497 2.415 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1 785435470 ZVOMHWAXKZFIBT-XMMPIXPASA-N 408.546 2.397 10 20 HECD CCn1c(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nc2ccccc21 785471668 BJFFRBQURJXPJB-UHFFFAOYSA-N 403.486 2.365 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1 789505538 DDIDXVAPOQIYFL-UHFFFAOYSA-N 412.490 2.202 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 789798389 GRMBQOLSYHUUAB-RCCFBDPRSA-N 403.498 2.364 10 20 HECD CCc1cnccc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789799555 JEWADYJNYUZUDL-OAHLLOKOSA-N 414.481 2.113 10 20 HECD O=C(COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cnccn1 792203207 OKRVFKSPZSJXFC-UHFFFAOYSA-N 419.440 2.084 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)Cc2ccon2)NC(=O)OC(C)(C)C)cc1 795249692 VLGOWRNFQMIWMR-QGZVFWFLSA-N 424.523 2.426 10 20 HECD CNC(=O)[C@]1(C)CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 797525219 FTUATLPEALUJDA-JBEBIEQOSA-N 419.481 2.247 10 20 HECD CCN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@H]1CCNC1=O 799445584 PPKPGXHDFXOAAI-UROBUVALSA-N 423.585 2.467 10 20 HECD CO[C@@H](CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 803448543 TYIYRVQBUCIMHB-KRWDZBQOSA-N 413.465 2.160 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21 807286992 GANJMMKSAQUNMT-SQNIBIBYSA-N 403.573 2.175 10 20 HECD CC(C)(C)c1ncc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cn1 807387210 DIIWMFFQFIMHBW-UHFFFAOYSA-N 407.268 2.497 10 20 HECD COc1ccc(C[C@@](C)(O)CNCc2ccc([N+](=O)[O-])c(OC)c2O)cc1OC 811516443 UNZCCMMZCDTDHR-HXUWFJFHSA-N 406.435 2.410 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(CC(=O)OC)c3)c2)CC1 811826696 ZMHJDGXLFGWLFI-UHFFFAOYSA-N 417.531 2.345 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NCCS(=O)(=O)N(C)C)cc2Cl)C1 811914822 UXQOZCXCLVKWTL-CQSZACIVSA-N 416.975 2.267 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](n4cccn4)C3)cc2F)CC1 813062758 HMJZZTZNBCGWFN-SFHVURJKSA-N 400.502 2.321 10 20 HECD O=C(NCCC(=O)N1CCOCC1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 915755201 IYNDAKXEZPRZRD-UHFFFAOYSA-N 409.446 2.406 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)N3CCCCC3)cc2F)C[C@H](C)O1 918213085 NMCXOMOTEVGZMT-HOTGVXAUSA-N 406.502 2.251 10 20 HECD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 919980053 JXIGTAKAWVLMLY-QGZVFWFLSA-N 403.866 2.251 10 20 HECD CN1CCN(Cc2cccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CC1 920189790 NHGDGIBKYNDZQR-UHFFFAOYSA-N 423.561 2.097 10 20 HECD Cc1ccc(CN(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C2CC2)o1 920638142 NYXCGTCRDRCOPF-UHFFFAOYSA-N 422.459 2.013 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(C(F)(F)F)c[nH]1 1796601164 AEMAJKZZBKMRNG-CLLJXQQHSA-N 424.379 2.405 10 20 HECD CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc(C)n1 1797181510 VTMJGJPOCOAAST-BCDXTJNWSA-N 410.474 2.324 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cccnn1 1800718367 WJJLKUDRUREYIS-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1814446465 PULCOWGXZHBHTH-QMMMGPOBSA-N 416.381 2.128 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)COc2ccccc2)C1 1842683640 WLHGKHXFQIQYDB-CSKARUKUSA-N 424.453 2.099 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)n(C)c2ccccc12 472777355 LPVLOWUQIINWHE-UHFFFAOYSA-N 402.458 2.381 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CCN1CC(F)F 571545841 OHTJMJMJVRYSLI-OAHLLOKOSA-N 406.477 2.291 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)CC2)cc1 726715643 UBDCHVXXLGIJNK-MRXNPFEDSA-N 409.552 2.130 10 20 HECD CC(C)N1C(=O)C(=O)N(CN(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 728904396 PKVISNXOKSKCMW-UHFFFAOYSA-N 400.401 2.274 10 20 HECD CCN1CCN(c2ccc(CN/C=C3\C(=O)NC(=O)c4ccccc43)cc2F)CC1 730202824 AAKWZGRHHVITAQ-CYVLTUHYSA-N 408.477 2.368 10 20 HECD COCCN1C(=O)/C(=C\Nc2ccc(-c3csc(C)n3)cc2)C(=O)NC1=S 730984261 ZEQLJYSYULCUMF-ZROIWOOFSA-N 402.501 2.304 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1O 732284175 NASGVHIGKWOBIC-LBPRGKRZSA-N 405.432 2.292 10 20 HECD Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741915036 RDRZVQDGFLHJRS-KXBFYZLASA-N 411.550 2.234 10 20 HECD Cn1c(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc2c1c(O)nc(=O)n2C 742423838 WVOICVXZUTXSNQ-NSHDSACASA-N 420.420 2.055 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1 742497861 LUOIVEKNTWYPOX-UHFFFAOYSA-N 417.531 2.064 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(C)nc4onc(C)c34)CC2)cc1 742921566 UBSNZCHMGOTXAV-UHFFFAOYSA-N 409.490 2.400 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCN(C4CCCC4)CC3)CC2)cc1 743362869 LDVRZELBSHVWJM-UHFFFAOYSA-N 415.582 2.087 10 20 HECD O=C(NCCCN1C(=O)CCC1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743598301 LKNYAWVDODVTGH-CQSZACIVSA-N 424.448 2.095 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 743975192 NWSKDLMHDOEWBW-AWEZNQCLSA-N 420.416 2.415 10 20 HECD CCN(CC)[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 745690508 CHUIPSFUZRZTAH-QUCCMNQESA-N 401.555 2.014 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 746420708 BOTJRKKKBLEWLY-CQSZACIVSA-N 421.448 2.362 10 20 HECD Cc1noc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)n1 746513384 JIDVTDMGSSAYFC-MRXNPFEDSA-N 403.458 2.443 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](C)c2cc(F)cc(F)c2O)c1 756705594 KYUGXTCUOKWGRM-WDEREUQCSA-N 413.446 2.256 10 20 HECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)Nc1ccc(O)cc1F 758168936 HPZWGPKTMNLCKC-UHFFFAOYSA-N 404.441 2.102 10 20 HECD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CN1Cc1ccccc1 764346836 LYEBDBDYKIMHAU-UHFFFAOYSA-N 412.465 2.174 10 20 HECD COc1cc(O)c([C@@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)cc1OC 768265908 HHXVBBBRWNFAOY-GOSISDBHSA-N 411.418 2.417 10 20 HECD COc1cccc(CC(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c1 769137091 VZCJCXUUIKTHBA-UHFFFAOYSA-N 409.530 2.419 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)CC2)cc1 769157647 XRGREONCMCHGHJ-VXKWHMMOSA-N 416.566 2.295 10 20 HECD CCOC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 770347764 YLCFSUPEFUZTPD-UXLLHSPISA-N 422.501 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4cscn4)n3)CC2)cc1 771054773 DYMMWTQXHLTSRL-UHFFFAOYSA-N 413.503 2.211 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2cncn2)nc1 771055788 FDZUMBOIEXYVRH-QGZVFWFLSA-N 412.881 2.416 10 20 HECD CCC1(O)CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 772084300 ZGPOYKDFAZSPFP-PDDLGQBUSA-N 402.539 2.271 10 20 HECD CCC1(CC)CC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(=O)C1 774824671 PHOZXHZNWCAOGD-UHFFFAOYSA-N 419.497 2.234 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCN2CCN(C(=O)C3CCCCC3)CC2)c1O 775016302 QPBBNAKXUHRJEL-UHFFFAOYSA-N 420.510 2.123 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c1 775372446 AYNVVCPAYPQCKX-LBPRGKRZSA-N 401.419 2.171 10 20 HECD CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 776118933 WVDOOYWZTRIOTM-UXHICEINSA-N 421.513 2.124 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCn1ccnn1 782494924 VOMGIUVJVQLOAC-ACCUITESSA-N 407.546 2.137 10 20 HECD CC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[C@H]1O 783757229 VGBNDMIWWQSNEF-OAHLLOKOSA-N 410.517 2.488 10 20 HECD CS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 786203903 RBRHNWCSIHBNHV-UHFFFAOYSA-N 416.543 2.158 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccsc3)cc2F)C[C@@H](C)O1 787329365 SCFWCHGXILZNKK-ZIAGYGMSSA-N 405.495 2.433 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1COC2(CCCCC2)O1 788932584 PDCUGBRPWKNLJK-IBGZPJMESA-N 401.507 2.095 10 20 HECD C[C@H](C1CCN(C)CC1)N(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864427 OFDDTCMWYUNHCQ-QGZVFWFLSA-N 418.607 2.045 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC[C@H](C)C1 792466530 XUKUCNSGMIDNAH-HKUYNNGSSA-N 407.530 2.416 10 20 HECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 793902398 QPCVKKRPJILPNT-QWFCFKBJSA-N 417.550 2.136 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1 794864537 ONXTYCVFRRWDBM-UHFFFAOYSA-N 415.449 2.166 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H]4NC(=O)OC[C@H]4C3)cc2F)C[C@H](C)O1 798373296 VUPLPAWHUZEJDK-KMCQBPLKSA-N 420.485 2.079 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)CCNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 803037026 NUPWZBIZLWUKCL-UHFFFAOYSA-N 422.507 2.073 10 20 HECD CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C1CCOCC1 803304940 FSRXLHBEZHMFNU-OXJNMPFZSA-N 403.523 2.022 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N(C)Cc1ccccc1 803688332 PDSKMCHSTTYWGQ-GOSISDBHSA-N 408.546 2.322 10 20 HECD COCCCOc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 804328017 GBZBUQNHSMLVQW-UHFFFAOYSA-N 424.475 2.440 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3c(C)noc3C)CC2)cc1 806386292 JFZDHWDZCIBTOS-CQSZACIVSA-N 400.479 2.216 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1CCN(C2CCOCC2)C1=O 806904957 SYTPFNMJXDCHLZ-AWEZNQCLSA-N 402.278 2.278 10 20 HECD CS[C@H](C)CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769425 FUCGWPDXSMRADM-OLZOCXBDSA-N 401.479 2.241 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)SCC(=O)N4)cc2)C1 810182289 AYAOXLCENBDURK-MRXNPFEDSA-N 424.526 2.363 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CO)CC3)cc2F)C[C@@H](C)O1 815277120 UJBRHTKDAWEXQI-FGTMMUONSA-N 407.530 2.150 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C(C)C)c3)cc2)CC1 816379103 HGLRUVIRVXZADQ-UHFFFAOYSA-N 423.517 2.275 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)cc1 917371651 NCPRJIZWSMMUCT-UHFFFAOYSA-N 418.515 2.166 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 918618111 XRMOWQMSQFXFSI-MNEFBYGVSA-N 415.559 2.420 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccn1)C1=NN(c2ccccc2)C(=O)C1 1794997862 FHASYLLENHHEQW-VBUUOAMHSA-N 417.469 2.126 10 20 HECD O=C(Cc1cccnc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598925 LSCFKCPFPJKYPO-QDMKHBRRSA-N 416.865 2.036 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC2(CCCN(C(=O)C3CC(O)C3)C2)CC1 1805418785 DLIYRXJMQDWDQM-UHFFFAOYSA-N 422.909 2.367 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cncs2)CC1 1826132688 ZBLSSBVZDSAHFB-OAHLLOKOSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2c(Cl)cncc2Cl)C1 1840996722 HKVFZXTZPZHSRD-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3[C@H]4C[C@H]5[C@H]([C@@H]4O)[C@@H]4C[C@H]5[C@H](O)[C@@H]43)ccc21 555544127 MLOBBGUBEUMCKI-XEZQQDRESA-N 410.514 2.105 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)NCc3ccc(F)cc3)CC2)cc1 726561297 LECYZEZMMBJWPK-UHFFFAOYSA-N 414.481 2.419 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(CNC(C)=O)cc3)CC2)cc1 733665330 QJXXBCNVTBNKND-UHFFFAOYSA-N 424.501 2.055 10 20 HECD CCn1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 734048343 QNXAMFNFTNGBJM-HUUCEWRRSA-N 418.469 2.129 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@](C)(O)c3ccco3)cc2F)CC1 745807551 DPLJGUPTCDSFRO-NRFANRHFSA-N 404.486 2.268 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n(C2CCOCC2)n1 746380135 YMHIFTCBVNRUAD-UHFFFAOYSA-N 403.458 2.003 10 20 HECD COc1cccc(NC(=O)CN(C)C(=O)CN2CCOc3cc(N(C)C)ccc32)c1 746497453 ODOANJBHDSUURI-UHFFFAOYSA-N 412.490 2.057 10 20 HECD CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 747043717 WNILJYSPQBYYQT-IBGZPJMESA-N 420.554 2.377 10 20 HECD CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 748571442 CWZUMDWGGKCBLF-KGENOOAVSA-N 409.486 2.431 10 20 HECD NC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 751373661 VLYVSNMHRCSSPM-INIZCTEOSA-N 423.922 2.087 10 20 HECD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c1 751529497 DCCYPPCQWYJFND-UHFFFAOYSA-N 404.488 2.170 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC3(O)CCCC3)cc2F)C[C@@H](C)O1 752142836 MGXCTTHNAFHLRJ-CALCHBBNSA-N 407.530 2.292 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)C1 757622292 HMNPJZBHWKLOIQ-AWEZNQCLSA-N 400.410 2.366 10 20 HECD CS(=O)(=O)Nc1cccc(CNC(=O)NCCCSc2nccs2)c1 759547546 JVEQFMVZBLDVQG-UHFFFAOYSA-N 400.551 2.496 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3cccc(C)c3)CC2)cc(OC)c1OC 759878198 IOHVEBUZXFYNBT-UHFFFAOYSA-N 413.518 2.459 10 20 HECD COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN1CCOc2cc(N(C)C)ccc21 762335467 XINGFRNPPWDIOP-HXUWFJFHSA-N 409.486 2.078 10 20 HECD CCc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(C)(=O)=O 765668912 JNHODJIEJGNFSZ-UHFFFAOYSA-N 402.516 2.419 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1C(F)(F)F 765903340 JLTLNLDAGFEFNM-UHFFFAOYSA-N 421.173 2.162 10 20 HECD Cn1nccc1NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769741813 NSICYSGWXLLMBB-UHFFFAOYSA-N 417.403 2.087 10 20 HECD COC(=O)CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769779004 RROLGXQXXXOJKK-INIZCTEOSA-N 406.460 2.188 10 20 HECD CCOC(=O)c1c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)sc2c1CCC2 774364345 WMFAHMPLJKSMIX-UHFFFAOYSA-N 418.471 2.122 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](Cc1ccccc1)N(C)C 774917231 GJSWUDLQOVOYQL-QFIPXVFZSA-N 410.562 2.390 10 20 HECD Cc1cccc(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1O 775645785 AESLHLLFFDSJHR-UHFFFAOYSA-N 403.504 2.199 10 20 HECD Cc1c(F)ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1N 781798715 GPJHPUJEHJWLMS-UHFFFAOYSA-N 419.428 2.165 10 20 HECD COc1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1OCC(=O)NC(C)C 783045893 BBRUOCAMDQUBHX-UHFFFAOYSA-N 417.414 2.050 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(Cc2ccccc2)n1 785298756 YRCOKOPQYKKZAM-CQSZACIVSA-N 408.458 2.337 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)cc1 785425204 YDAFJLSOFBZXAM-SFHVURJKSA-N 404.461 2.066 10 20 HECD COC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1C 787318112 CJBHUSXHBBGBDM-UHFFFAOYSA-N 412.490 2.017 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860197 JLHHDWSSDBOBIJ-CQSZACIVSA-N 416.547 2.208 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4nc(C)n(C)c4c3)nc12 796029447 OHFIGJLPMITISJ-UHFFFAOYSA-N 409.402 2.164 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc4c(c3)OCCCO4)ccc21 803634480 VSIJCXOJMIAYAG-UHFFFAOYSA-N 409.486 2.163 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H]3CCO[C@H](C)C3)CC2)cc1 804315916 VLMGSDKWYGPDDO-SJORKVTESA-N 403.523 2.102 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1-c1ccccc1 806862691 PMNYHMTYDVITNM-UHFFFAOYSA-N 419.485 2.179 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(C(=O)C2CC2)CC1 918202890 POUDLKHRKKXXHB-UHFFFAOYSA-N 414.550 2.096 10 20 HECD COc1ccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918211331 JSTASDGKPDJHNT-NRFANRHFSA-N 417.481 2.328 10 20 HECD CC(C)C(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971739 VJBRRZFOGHXPMQ-FQEVSTJZSA-N 405.514 2.440 10 20 HECD O=C(CC(F)(F)F)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002779 VRVXXFYVAISWGJ-INIZCTEOSA-N 422.787 2.147 10 20 HECD C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604233 SRFQIYRVUPKWHC-RUGDWHBFSA-N 410.474 2.018 10 20 HECD Cc1c[nH]cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1797029394 BWQSYIXKURDYDA-NCSLWMNCSA-N 411.458 2.405 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712665 PILPMSDHUCFCGF-RLDUGPAZSA-N 410.898 2.410 10 20 HECD C[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740484 JSHYQJOZLSRBCT-MLGOLLRUSA-N 410.898 2.365 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccncc2F)C1 1843589198 CRPATAZBRZBZPM-UHFFFAOYSA-N 405.813 2.416 10 20 HECD Cc1cc(F)c(F)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1845527847 WXNPGGQHFULXIC-UHFFFAOYSA-N 403.385 2.210 10 20 HECD Cc1nscc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033841 JFAVMJGCCNEMCY-GQCTYLIASA-N 415.471 2.099 10 20 HECD CCCN1CC[C@H](CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 303288344 KJXIZUOPJYBFIZ-LJQANCHMSA-N 405.562 2.499 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 437023594 ITWJHGMKSRGROE-OAHLLOKOSA-N 423.469 2.302 10 20 HECD COc1cccc2c1OC[C@H](NC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 728396499 MNNKEZGYUJQQPA-QGZVFWFLSA-N 415.465 2.474 10 20 HECD CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 729325351 UIVDXGNADZVXLI-JOCHJYFZSA-N 411.477 2.252 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)c3cccc(S(N)(=O)=O)c3)cc2)CC1 731038109 BFKBSXBXECUOCY-UHFFFAOYSA-N 423.560 2.049 10 20 HECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)NCc1ccc(N(CC)CC)c(F)c1 731356397 FWSIRMSKBNJHFY-KRWDZBQOSA-N 401.504 2.034 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(C)(=O)=O)o3)cc2F)C[C@@H](C)O1 733098220 XTTWDGMPYPKVJZ-BETUJISGSA-N 410.467 2.366 10 20 HECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCCCSc1nccs1 733972997 CLSIXYNMAHYHQY-CQSZACIVSA-N 403.537 2.030 10 20 HECD O=C1C[C@H](Cc2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)C(=O)N1 741145867 QNPZAYSSWAKKHS-IBGZPJMESA-N 423.538 2.375 10 20 HECD O=C(CNC(=O)NC1CCCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 746010523 KODCBFBONHVVOQ-UHFFFAOYSA-N 406.502 2.035 10 20 HECD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 746142642 UDAFTYZWXFQGLN-UHFFFAOYSA-N 403.350 2.171 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)cc1 749254546 UNBSGANUMLTLEH-PXNSSMCTSA-N 411.506 2.036 10 20 HECD CN(Cc1nccn1C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751063553 CHPRXMNONDUTJW-UHFFFAOYSA-N 406.489 2.260 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)cc1F 753732166 RAHXGLDNYOQYIP-UHFFFAOYSA-N 417.393 2.476 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(CSC)o3)CC2)cc1 758192391 KWXLKBXDHRJWNN-HNNXBMFYSA-N 410.565 2.216 10 20 HECD COc1cc(N2CCN(C[C@H](O)COCc3ccco3)CC2)cc(OC)c1OC 759879394 URVVOKHMUGXHSW-KRWDZBQOSA-N 406.479 2.005 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCC[C@@H]3CCCCO3)CC2)cc1 761009253 AYZMOQRUXABMKX-VIOKTNGOSA-N 415.534 2.366 10 20 HECD CC(=O)c1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 767447369 ZWNXYPWVLDAWNF-UHFFFAOYSA-N 414.433 2.338 10 20 HECD Cc1noc(CCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 769977759 RYCQVOLWISXFOJ-UHFFFAOYSA-N 419.393 2.268 10 20 HECD C[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)c(F)c1 773008644 WWACHPRWEPCIEO-UYAOXDASSA-N 418.557 2.400 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cncc(C(=O)OC)c3)cc2F)CC1 774305042 STJSBLATTOOLAH-UHFFFAOYSA-N 400.454 2.079 10 20 HECD CCCN(CC(=O)NC)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 774534184 JGBLPRHYQXXDHF-UHFFFAOYSA-N 405.205 2.237 10 20 HECD COCc1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 778612080 ROSYUNNHHQJFTM-KRWDZBQOSA-N 417.531 2.013 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1 779515508 TURUBUFEEZLMET-NTMALXAHSA-N 421.497 2.235 10 20 HECD CN(CCNS(=O)(=O)c1cnn(C)c1)c1ccc(OCc2ccccc2)cc1 781961113 RRNNBFNDYRWHLR-UHFFFAOYSA-N 400.504 2.414 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2ccn(-c3ccccc3F)n2)c1 782263175 ZKOUFYWXIDSDJR-UHFFFAOYSA-N 405.407 2.446 10 20 HECD Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C 785857960 PCKLUTUVPKFALI-LIRRHRJNSA-N 405.520 2.493 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccnc3-c3cnn(C)c3)ccc21 786303287 JDJWDERANWZLQI-UHFFFAOYSA-N 404.474 2.119 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1N1CCNC1=O 787518942 SFPYNYLIECAKSY-UHFFFAOYSA-N 419.532 2.218 10 20 HECD CCS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319167 AZISYPMAHJBTNA-PKOBYXMFSA-N 405.564 2.320 10 20 HECD CN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837559 ZQEZKFYOUIXZFC-UHFFFAOYSA-N 419.522 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)COc3cccc(-c4ncnn4C)c3)CC2)cc1 790519250 CLCSWDKERKQHLD-UHFFFAOYSA-N 407.474 2.218 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3Cc4ccccc43)cc2F)CC1 793670609 CRMSJZOZASBKRH-IBGZPJMESA-N 424.520 2.040 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCCCC1 793717752 HWEXJRUJHCDEBS-GOSISDBHSA-N 414.550 2.186 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1 798426213 VLIFJKIVFSFIKN-UHFFFAOYSA-N 423.922 2.096 10 20 HECD CCNS(=O)(=O)CCNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799925746 UPCFFAQWBRSZRY-CQSZACIVSA-N 416.975 2.315 10 20 HECD Cc1cnc([C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803302932 FZKYWIYDFBZNGI-GOEBONIOSA-N 416.547 2.385 10 20 HECD COC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@@H](C)O1 803677429 OZNYNZILBSLBBD-DYESRHJHSA-N 417.550 2.334 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1cc(F)cc(F)c1 804033262 SSLMJHXIUKKVMS-UHFFFAOYSA-N 417.456 2.119 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCCCSc2nccs2)c(OC)c1 806275319 BUOGOTJVPKTWTC-UHFFFAOYSA-N 409.533 2.417 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCC1CCN(CC(F)(F)F)CC1 806279730 YHTSMVUJDGMSFI-UHFFFAOYSA-N 424.514 2.132 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2C1 807387456 KVSLERTUCWLDSP-UHFFFAOYSA-N 404.264 2.355 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671671 RXBVOSINVRVUII-HZPDHXFCSA-N 418.538 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(C(C)=O)o4)n3)CC2)cc1 809464411 FROHEQBTJAJEBZ-UHFFFAOYSA-N 410.430 2.432 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1F 810371166 WDIQLVITIAUQQP-UHFFFAOYSA-N 411.474 2.406 10 20 HECD O=C(N[C@@H]1CCCC12CCOCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 814181483 AVRGMIVFPIENTH-UYAOXDASSA-N 416.518 2.365 10 20 HECD O=C(COc1ccc([N+](=O)[O-])cc1F)NCc1ccc(N2CCOCC2)c(F)c1 917239906 ICQITDBUJWCSLT-UHFFFAOYSA-N 407.373 2.405 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 917365145 WOCWEQOSSHAHLS-GOSISDBHSA-N 418.515 2.187 10 20 HECD CN(CCO)S(=O)(=O)c1ccccc1CNCc1ccc(N2CCCC2)cc1 1318470950 JDCIQWOEMKTZPL-UHFFFAOYSA-N 403.548 2.189 10 20 HECD Cn1cc([C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2)cn1 1320364399 HQKFFPWAAFXWDO-SFHVURJKSA-N 400.460 2.017 10 20 HECD CCOC(=O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1320610928 BVPAKVLUYNNOSA-INIZCTEOSA-N 407.486 2.414 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2C2CC2)C1 1841270373 DJTGZQGQRCIWCX-ZWKOTPCHSA-N 406.486 2.029 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)C1=NS(=O)(=O)c2ccccc21 52851404 GHBICHUPCMLVGP-UHFFFAOYSA-N 414.531 2.182 10 20 HECD C[C@@H](NC(=O)N1CCC(CN2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 139992155 WBBWNCMCPSSITR-LJQANCHMSA-N 416.566 2.338 10 20 HECD O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 302995147 LVZTWXZOHOBOCU-UHFFFAOYSA-N 421.419 2.111 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)Nc2c(C3=S=CC=C3)nc3ccccn23)cc1 575907656 PRFIAJICUSCHMA-UHFFFAOYSA-N 412.496 2.120 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 728291988 OMOWYODTFDAKNM-UHFFFAOYSA-N 407.448 2.253 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)ccc1Cl 729061519 GQJSOUFTUXNGLF-SNVBAGLBSA-N 405.838 2.230 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3scnc3C)CC2)cc1 729233265 ZOVCPBAEWQBQRJ-UHFFFAOYSA-N 403.552 2.472 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)OCC(F)(F)F)cc2F)C[C@@H](C)O1 732059646 DNQDZFCZOOLGGI-TXEJJXNPSA-N 421.391 2.344 10 20 HECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCCN(c2ccccc2)C1=O 734558402 SSXWYEDTVKEKJB-KRWDZBQOSA-N 417.487 2.031 10 20 HECD C[C@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1C 749911446 QMAKVJITOYRBJH-AWEZNQCLSA-N 412.465 2.369 10 20 HECD C[C@H](CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1 753121156 JMSMSQLJDFRFGN-UYAOXDASSA-N 415.582 2.452 10 20 HECD COc1cc(C[C@@H](NCc2ccc(N3CCN(C)CC3)cc2)C(=O)O)cc(OC)c1 756358761 CQXNPOPJJFLTJU-JOCHJYFZSA-N 413.518 2.241 10 20 HECD COC(=O)c1ccccc1CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758578851 XDLIMKUACLKSAW-LJQANCHMSA-N 423.513 2.424 10 20 HECD COc1ccc(N(CC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)CC(C)C)cc1 759698602 YRDAPZONCYFULH-UHFFFAOYSA-N 421.519 2.452 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](Cc3nc(C)no3)c3ccccc3)nc12 759927097 DKBOAFIBLYVJJQ-KRWDZBQOSA-N 422.445 2.377 10 20 HECD COc1cccc([C@@H](O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 760086317 UFKNTHZSVYVUGD-HXUWFJFHSA-N 416.474 2.103 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)cc(OC)c1OC 760097323 QHABJIMDJBWHRS-IRXDYDNUSA-N 418.538 2.171 10 20 HECD COC(=O)C12CCC(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)(CC1)C2 760200867 OGLMNYZTQXQJNN-UHFFFAOYSA-N 415.534 2.057 10 20 HECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCCc2ccc(O)c(O)c2)c(OC)c1 762261126 HOYINUNBVNOVCI-QGZVFWFLSA-N 414.458 2.079 10 20 HECD COC(=O)c1ccc(OC[C@@H](O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 764862461 BPSOZOWRPPZMSQ-NRFANRHFSA-N 414.502 2.182 10 20 HECD Cc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1ccc(O)nn1 765753693 PBNCSYWUZMAMNB-UHFFFAOYSA-N 404.224 2.074 10 20 HECD COc1cc(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)c([N+](=O)[O-])cc1OC 766923628 CLZWXANHLHFFET-UHFFFAOYSA-N 421.475 2.264 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)COc3cc(C)ccc3F)nc12 767530882 VEFLJUKNHQLJQP-UHFFFAOYSA-N 403.366 2.181 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1c1ccccc1Br 768465682 PQUUCHVVDYDOIG-AEFFLSMTSA-N 419.275 2.254 10 20 HECD C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769937641 SMKVRJCTLIWJCT-MZHQLVBMSA-N 410.517 2.334 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 770254696 NBPPGWAGMMXOSS-HNNXBMFYSA-N 418.471 2.387 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Cc3c(C)n[nH]c3C)CC2)cc1 772079197 GXMQUOGFQRNEFO-OAHLLOKOSA-N 414.506 2.106 10 20 HECD COC(=O)c1ccc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c(F)c1 772552223 XVNDFFITHRCLEO-UHFFFAOYSA-N 402.422 2.494 10 20 HECD C[C@H](NC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773012555 IADWKRDPPKRNIU-AWEZNQCLSA-N 423.560 2.326 10 20 HECD COc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)ccc1Br 774363215 ROBPSLKHVHPPFK-UHFFFAOYSA-N 409.236 2.166 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCc3nc(N(C)C)no3)cc2F)C[C@@H](C)O1 776633611 REZRBMPHZRKOKT-OKILXGFUSA-N 405.474 2.137 10 20 HECD CN(C)c1ccc([C@@H](CN[C@H]2CCCS(=O)(=O)C2)NC(=O)OC(C)(C)C)cc1 777302438 PPCLDQXUYBBQHW-FUHWJXTLSA-N 411.568 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3COc4ccccc4C3)CC2)cc1 778231284 FSXPHVKZZRMEHV-GNISGLHKSA-N 421.497 2.020 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1 785298819 ZRUNSTMYEVQUCY-NSHDSACASA-N 419.865 2.139 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N(C)C)cc1 785401222 WYOOXWHDDLNXPF-JKSUJKDBSA-N 406.490 2.388 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 785438328 CJJOCEJIVCFZFB-QGZVFWFLSA-N 418.538 2.132 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803307524 HIXZVAPIYMOIFH-HUUCEWRRSA-N 414.506 2.053 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@]2(CCCOC2)C1)c1ccc(N2CCOCC2)cc1 803308791 KDTZJIHLGSNXEP-JPYJTQIMSA-N 415.534 2.120 10 20 HECD CN1CCOc2ccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc21 806570616 FKDKGAWRBFVZKI-UHFFFAOYSA-N 401.488 2.002 10 20 HECD CO[C@@H](C)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812348932 GKVDYZSDKSCFQL-NEPJUHHUSA-N 423.447 2.254 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)Cc2ccccc2)c(C)n1-c1ccccn1 915200422 FMKMVZMTMNUKAE-UHFFFAOYSA-N 412.515 2.339 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccnc(SC)c3)CC2)cc1 919736756 GDCNPWZSBNTCFB-UHFFFAOYSA-N 401.488 2.318 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H]3CCN(C)C[C@H]3c3cnn(C)c3)CC2)cc1 1355457614 OSFDBNBCEPPDHZ-VXKWHMMOSA-N 411.550 2.203 10 20 HECD CC(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)on1 1796601517 SLDGZMZXHARGNJ-BTTYYORXSA-N 400.435 2.170 10 20 HECD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)[nH]n1 1798810582 FYDKHAZYVPYIFM-BTTYYORXSA-N 413.478 2.079 10 20 HECD CC[C@H](C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767168 WYLNRGNWRLHFAX-NASWQRNTSA-N 410.898 2.391 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1CCCCO1 1804283010 KKUQTKOEGVDIOK-MXJZGFGZSA-N 416.474 2.024 10 20 HECD C[C@@]1(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)CC1(F)F 1847037193 HEIUXPUKUJECTJ-JXTAAOLFSA-N 408.401 2.065 10 20 HECD CCc1ccc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)[nH]c(=O)c2c1 60797462 IUYJOTAZFVLHRU-UHFFFAOYSA-N 406.486 2.385 10 20 HECD CCOc1cccc(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)c1O 725847789 QIZQEPJRBKQCGA-UHFFFAOYSA-N 420.531 2.243 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](c4cccc(F)c4)C3)nc12 727435891 VZYRYYMVPIOCSI-KRWDZBQOSA-N 400.410 2.324 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(C(N)=O)n(-c2ccccc2)n1 731893289 JCYNHUHGHYIWEP-UHFFFAOYSA-N 419.485 2.080 10 20 HECD COC(=O)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(Cl)c1 733822531 HKXXCXBAPZQVBI-OAHLLOKOSA-N 413.835 2.488 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCCc3nc(C4CC4)no3)CC2)cc1 739714021 ZBTFXRWYZLMGQY-UHFFFAOYSA-N 413.522 2.217 10 20 HECD C[C@@H](OC(=O)c1ncccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741035629 IROARDPGWAATHE-GFCCVEGCSA-N 401.378 2.436 10 20 HECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741099919 NDQOLOSYSFLUJN-UHFFFAOYSA-N 408.502 2.388 10 20 HECD CCN(CC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc(OC)cc1 746109785 WAMHYDBUCDNAOU-UHFFFAOYSA-N 417.531 2.055 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c1 746405789 LQFZZLZWIYAWRN-UHFFFAOYSA-N 400.460 2.270 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(c3nccn4cnnc34)[C@@H](C)C2)c1O 749450034 PHKSNWSZAOQYSS-LBPRGKRZSA-N 400.870 2.397 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@@H](Cc4ccccc4)C3=O)CC2)cc1F 754015811 ZSFOFNQFDHBHSK-IBGZPJMESA-N 412.465 2.077 10 20 HECD COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 755336348 IDAYOTGHIAANPY-HNNXBMFYSA-N 412.446 2.235 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]4(CCOC4)C3)cc2F)C[C@@H](C)O1 756903418 TVDVRXFNWNDCLA-HYFFOGBASA-N 405.514 2.168 10 20 HECD O=C(Cc1cccc(F)c1)NCCNC(=O)NCc1cccc(Br)c1O 765479138 MTIOIJINTIRSPR-UHFFFAOYSA-N 424.270 2.452 10 20 HECD CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774362457 MFRYUCBUYMCITB-UHFFFAOYSA-N 414.458 2.279 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCN(C2CC2)c2ccc(Cl)cc21 776402147 OUKCTXNXJHUFRA-UHFFFAOYSA-N 418.906 2.153 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](n2cncn2)C1 776876864 HJCWLXCWIZHEAR-CABCVRRESA-N 415.453 2.328 10 20 HECD COc1ccc(O)c(CN2CCC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c1 777222917 QIZXPYRQPBOISC-QGZVFWFLSA-N 419.522 2.445 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 777543578 FLRJVXCSZFZPLH-JOCHJYFZSA-N 418.559 2.266 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1 779500038 KRVNGIXZEHXSDN-POHAHGRESA-N 402.472 2.212 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(Br)n1 785302151 BKQKDYCDOYTIQD-SNVBAGLBSA-N 408.252 2.250 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)cc1 785427623 FDLOHGAJYHLCQO-KRWDZBQOSA-N 400.910 2.417 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(-n2cccn2)cc1 788378800 HBGNORGHLGIIKS-UHFFFAOYSA-N 403.486 2.405 10 20 HECD CN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801320 QFDKDUUHPPWXCJ-UHFFFAOYSA-N 405.495 2.041 10 20 HECD CC1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789841214 UQNLNHVNLCFFKX-UHFFFAOYSA-N 405.514 2.442 10 20 HECD C[C@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@H](C)S1(=O)=O 794159645 FNHRIFONBLNALT-GJZGRUSLSA-N 410.561 2.049 10 20 HECD COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c(O)c1 794390089 HLQKQRXSQAXLFZ-UHFFFAOYSA-N 410.879 2.379 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Oc3ccc4c(c3)CC(=O)N4)CC2)cc1 797770458 ZALVBHRNSXGURC-HJWRWDBZSA-N 421.453 2.000 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C)C(=O)N3CCCC3)cc2F)C[C@@H](C)O1 798372406 JXLIEQDLHAGKNX-XHSDSOJGSA-N 406.502 2.249 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1 804279961 VWPUODQVHOVZHX-JOCHJYFZSA-N 418.541 2.317 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C(=O)N1c1ccccc1 807654044 KRSQPVARHYUXTM-JXFKEZNVSA-N 408.502 2.021 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](OC)C(C)C 808378395 MWXDHAOOUZKNTN-HNNXBMFYSA-N 401.301 2.290 10 20 HECD Cc1cc(C(=O)N2CCN([C@H](C(N)=O)c3ccccc3)CC2)c(C)n1-c1ccccn1 916159575 VANGEPSQOZBGFP-QFIPXVFZSA-N 417.513 2.474 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(S(=O)(=O)NC)c1 916486147 ZVLZQVCAYJJZMJ-UHFFFAOYSA-N 404.536 2.392 10 20 HECD O=C(NCCNc1cnccn1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916618828 UCVUBXWGXZTVAP-UHFFFAOYSA-N 424.427 2.243 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C(F)(F)F)c1 1118721749 VVLXUYBFDSXHCV-UHFFFAOYSA-N 415.437 2.209 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)C)CCO3)C2)cc1 1781752922 BUXJTIKHYYXCAV-XMMPIXPASA-N 424.545 2.099 10 20 HECD CC(C)c1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)co1 1796598933 MNFXVAJNFOOOST-BTTYYORXSA-N 400.435 2.170 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1C[C@H]1C1CC1 1796931197 SYOIHEJPXVSAQK-AXDKOMKPSA-N 420.513 2.464 10 20 HECD CC1(C)CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1801061639 JOKOXYZYCRVNHG-XOIINTDNSA-N 422.909 2.391 10 20 HECD Cc1cc(F)cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1802473846 VRGXMJLVBUQLBK-BCDXTJNWSA-N 413.449 2.435 10 20 HECD Cc1ncoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426843 KCJNSMPEEALKJX-INIZCTEOSA-N 414.462 2.336 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NC3CCCCCC3)CC2)cc1 12069530 KZXOAQRRBDQYPY-UHFFFAOYSA-N 416.566 2.163 10 20 HECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)cc1 727249886 CRPCEMHVSCXVOA-UHFFFAOYSA-N 413.477 2.397 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)c1 728981101 SBTOWVLLZORBTK-GFCCVEGCSA-N 408.476 2.151 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCc3c[nH]nc3C)cc2F)CC1 730111614 TXKWDCBUUBVBFA-UHFFFAOYSA-N 402.518 2.431 10 20 HECD CCCCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 730328965 IXGMPJCXFGCZND-GOSISDBHSA-N 421.563 2.346 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1F 731404146 HIFGFUJZHAOUSE-UHFFFAOYSA-N 402.474 2.469 10 20 HECD CCOc1ccc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c(O)c1 732913864 DHWIVYXVUAKNIC-SFHVURJKSA-N 413.522 2.176 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N(C)C)cc2C)c1 734471859 UYSCOLIKNIRRTC-UHFFFAOYSA-N 419.547 2.224 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3nc4c(s3)COCC4)CC2)cc1 735577973 ULTXSJVKXMVOJN-UHFFFAOYSA-N 417.535 2.168 10 20 HECD Oc1ccc2ccccc2c1CN1CCN(c2cc(N3CCOCC3)ncn2)CC1 738289157 LZTPRVXIYCRAAI-UHFFFAOYSA-N 405.502 2.494 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800641 KLNPKEGWJALVDC-CYBMUJFWSA-N 409.393 2.486 10 20 HECD O=C(NC[C@H](O)C1CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904076 LCCSHVZQDMYQDB-QAPCUYQASA-N 413.465 2.344 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(F)c(F)c3)c2)CC1 748675798 UJKAPMJIZOYYMT-UHFFFAOYSA-N 402.444 2.000 10 20 HECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 754920149 GMVDUWZXITZEEH-CQSZACIVSA-N 408.405 2.000 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757267587 RZEUZOVKALLMKQ-UHFFFAOYSA-N 420.391 2.042 10 20 HECD COCCc1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 758225088 SLBJIIICEUQKBY-NRFANRHFSA-N 400.519 2.446 10 20 HECD Cc1cc(C)n2ncc(-c3noc(-c4cc(NS(C)(=O)=O)ccc4O)n3)c2n1 758285546 MZLZDSSCUVLOLO-UHFFFAOYSA-N 400.420 2.140 10 20 HECD NC(=O)c1c(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)sc2c1CCCC2 759593116 IXAYYUFUOIYKSR-SOFGYWHQSA-N 416.455 2.332 10 20 HECD CC(C)OC(=O)[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 759793806 YGBIHJOEMXNWNK-ZACQAIPSSA-N 423.529 2.327 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765783454 OHTBNAWIBURDJG-SJORKVTESA-N 410.465 2.471 10 20 HECD O=S(=O)(c1ccc(F)cc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768156632 PZROSDHYWYIAHL-UHFFFAOYSA-N 419.522 2.169 10 20 HECD Cc1cccc(C)c1NC(=O)CN1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440777 DLOJRGQIUSCGDV-HXUWFJFHSA-N 411.502 2.191 10 20 HECD CC(C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cn(-c2ccccc2)nn1 769974792 BEJVOWGMYTUQPT-UHFFFAOYSA-N 415.475 2.010 10 20 HECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NCc1ccc(N(C)C)c(F)c1 770436009 UQSAXRPKYRRMCY-ZDUSSCGKSA-N 408.499 2.442 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 772998357 JOMGEJDNVXTXAI-GJZGRUSLSA-N 408.518 2.401 10 20 HECD COc1cc(OC)cc(N2C[C@@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)c1 773740776 SWAHVFLHQPHEKB-ZFWWWQNUSA-N 414.458 2.215 10 20 HECD COCCCN(C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H]1CCS(=O)(=O)C1 774166892 FZGFKDBKMQPPHX-LJQANCHMSA-N 409.552 2.022 10 20 HECD CS[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H]1N(C)C 776003452 XGHALLFIOUIJGS-RBUKOAKNSA-N 423.538 2.378 10 20 HECD CC(C)C(=O)COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785395374 BIMCYUOTFBDYFJ-UHFFFAOYSA-N 422.415 2.483 10 20 HECD COc1ccc(N2CCC(NC(=O)N(C)Cc3ncnn3CC(F)F)CC2)cc1 787159798 PDROKEVRVFNZOH-UHFFFAOYSA-N 408.453 2.362 10 20 HECD CCNC(=O)c1ccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 787182553 DMITXDYOTCCYKE-UHFFFAOYSA-N 422.529 2.310 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccc(F)cc2)N(C)C)cc1F 787642984 XGMZYSSVUQXBHI-LJQANCHMSA-N 404.461 2.066 10 20 HECD Cc1occc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789818703 KEHPYVZIRVILTF-ZIAGYGMSSA-N 403.454 2.273 10 20 HECD Cc1ncsc1CN(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856336 SOUNEEIZOUQBJN-UHFFFAOYSA-N 404.561 2.280 10 20 HECD CC(=O)N1CCC[C@@H](CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 792836189 UIAQOLGDIGYVPX-FCEWJHQRSA-N 420.529 2.497 10 20 HECD O=C1CNC(=O)N1c1cc(NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 793358817 IVDAJUNXPNCWPI-UHFFFAOYSA-N 402.401 2.470 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H]2c2nc(C)no2)c1 795754216 HSXPSINVGVUJDT-LJQANCHMSA-N 400.479 2.456 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1 804310551 PDRCZQXSBROLRS-UHFFFAOYSA-N 418.538 2.193 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)cc1F 804854184 ZAYUQIRQXYNVQV-IRXDYDNUSA-N 420.529 2.051 10 20 HECD NC(=O)[C@@H]1CCCN(CCCNC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 805073233 DGXMJVVVHKBKPX-LLVKDONJSA-N 403.310 2.086 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100756 PTGOXMVHWCAEAF-SFHVURJKSA-N 410.518 2.081 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@H](C(C)C)C3)CC2)cc1 808084613 BNOOMIVNKZEPOE-XLIONFOSSA-N 403.523 2.054 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C2CCOCC2)nn1 810630690 BKDKLSXDDNQIJJ-INIZCTEOSA-N 419.913 2.383 10 20 HECD C[C@@H](NC(=O)N1CCC(CS(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 813606795 XFJXQEFLHFRCJV-MRXNPFEDSA-N 409.552 2.050 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 918463557 KQXDIUBNCHZULT-INIZCTEOSA-N 412.465 2.091 10 20 HECD C[C@@H]1NC(C(=O)NCc2ccc(N3CCSCC3)cc2)=NN(c2ccccc2)C1=O 918617344 PXDQSZZEVBTHKN-INIZCTEOSA-N 423.542 2.194 10 20 HECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 1319920446 GGSPJOXGIOQJNA-SOIVGHGOSA-N 420.462 2.122 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1COc2cc(OC)ccc21 1320514639 XNOZUQPWRPJWMV-YOEHRIQHSA-N 415.442 2.263 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007297 BOOVITBCZIUZSA-CFGAKRJMSA-N 408.882 2.241 10 20 HECD O=C(CCC1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804331580 HHDVUXVKQXXVAA-MUJYYYPQSA-N 423.604 2.455 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cscn3)C2)CC1 1808452695 RLXIRQDFLHKXBS-UHFFFAOYSA-N 402.476 2.108 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)C3CCCC3)CC2)CC1 1837605250 LVOMHSCJXPHCMW-UHFFFAOYSA-N 417.506 2.295 10 20 HECD C[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)Oc1ccccc1 1843250759 MFMQSIRKXIQASH-HNNXBMFYSA-N 411.458 2.167 10 20 HECD CS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 13794070 FXHJHTCYCBDWJC-SFHVURJKSA-N 412.467 2.215 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C\c3ccc4c(c3)OCO4)CC2)cc1 214817277 CMCHUFJFPOGGTN-OQFOIZHKSA-N 424.453 2.329 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-c4ncon4)cc3)nc12 730627845 AQRQATPXHMDVSK-UHFFFAOYSA-N 409.358 2.019 10 20 HECD COC(=O)c1c(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)n[nH]c1C 732525495 LEVZPFDGTSUSBB-UHFFFAOYSA-N 423.432 2.337 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1 734072643 LOWGCIAUVCZBCQ-INIZCTEOSA-N 418.421 2.353 10 20 HECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)cc1 744380793 ILOVXCJDHPYHGU-UHFFFAOYSA-N 415.437 2.366 10 20 HECD O=C(CCNS(=O)(=O)c1cccc(Br)c1)NCc1ccccc1O 748349598 HUJJRMUZDQCRJU-UHFFFAOYSA-N 413.293 2.140 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(OCCCOc3ccccc3)C2)c1 748424052 BXBQKNMRHHIMKY-UHFFFAOYSA-N 420.487 2.074 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCC(=O)N1CCN(c2ccccn2)CC1 748465223 MIVJPHKPHYXJLY-UHFFFAOYSA-N 424.549 2.028 10 20 HECD O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 751189612 NYGRQKTWSANNQB-UHFFFAOYSA-N 418.349 2.183 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 752097732 ZHTVIFSEMYTYLB-UHFFFAOYSA-N 412.490 2.060 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1cc(Br)ccc1=O 752929077 NPKKJRVXTNREEA-UHFFFAOYSA-N 420.307 2.106 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 753643298 HRJYRWKDDCRPFS-LBPRGKRZSA-N 415.402 2.442 10 20 HECD COC(=O)COc1cccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753731352 MIAAHWPZRYLFBK-UHFFFAOYSA-N 402.422 2.349 10 20 HECD O=[N+]([O-])c1cccc2ncnc(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c12 754031452 VGMYWQMNEWOHRG-UHFFFAOYSA-N 413.459 2.385 10 20 HECD CCOC(=O)c1c(NC(=O)CNC2(C(N)=O)CC2)sc(C)c1-c1ccccc1 754248845 QAEXFQHMNBUZIE-UHFFFAOYSA-N 401.488 2.446 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(c4ncccc4F)C3)CC2)cc1F 755304447 VQQKXRAPRSMHFK-HNNXBMFYSA-N 417.460 2.479 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3ccn(-c4ccccc4)n3)CC2)cc1 756924292 UOSMJYWPJUEJSL-UHFFFAOYSA-N 419.529 2.362 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN(c4cccnn4)CC3)CC2)cc1 758616021 HBXIFIVPGHPUHM-UHFFFAOYSA-N 410.522 2.422 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 758715096 KXWMBTZQXNCEMK-GJZGRUSLSA-N 415.531 2.015 10 20 HECD CCOC(=O)C1(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCC1 759221227 QETVVSQTPUKNRN-UHFFFAOYSA-N 406.479 2.094 10 20 HECD C[C@@H](OC(=O)c1cncnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 760799243 MJBVAIHQIWSUHS-GFCCVEGCSA-N 401.378 2.436 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cc2)C1 760902802 ACAPYGOSINMFNL-MDNKFWRPSA-N 400.523 2.145 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc4c(c3)CCCNC4=O)CC2)cc1 766302882 YWUNDWDJVWRTTR-UHFFFAOYSA-N 409.486 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc(Cl)cc3C)CC2)cc1F 766519755 XYAZKPWJUGSVBN-UHFFFAOYSA-N 406.845 2.478 10 20 HECD COC(=O)C1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1 768202699 VVSMAXVDYNSFHS-MRXNPFEDSA-N 405.495 2.388 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1nc(C(F)(F)F)n[nH]1 776117853 UITIHLOIHOYUEC-UHFFFAOYSA-N 400.430 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C\c3scnc3C)CC2)cc1 777102435 NBYJKOXRVXDVBL-FPLPWBNLSA-N 401.488 2.365 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(C(=O)O)cc3C)c2)CC1 780409709 ZPDMBWOIMGSKKR-UHFFFAOYSA-N 417.487 2.163 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C 784023735 FNCCPGSPRNDILW-UHFFFAOYSA-N 412.490 2.310 10 20 HECD COC(=O)c1ccccc1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786661060 NJYLYPAMFIOHGX-UHFFFAOYSA-N 409.486 2.001 10 20 HECD Cc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2=O)cc1 788938383 RFWAKUAJFAGXQU-NRFANRHFSA-N 420.513 2.133 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)ccc1C(N)=O 789743855 KNYXZASIPUCQFQ-CQSZACIVSA-N 412.490 2.455 10 20 HECD COCCNS(=O)(=O)c1cccc(CNCc2c(O)ccc(Cl)c2F)c1 790968270 XFWQTSBVGUBXGC-UHFFFAOYSA-N 402.875 2.399 10 20 HECD COc1ccc(CNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)c(O)c1 794377046 LBJKHXUVFAQXNX-UHFFFAOYSA-N 407.474 2.208 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C/c1ncc(I)s1 794696215 CWXMJBWDMMCFMA-FNORWQNLSA-N 407.258 2.050 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@]2(CCCOC2)O1 796523534 FAVQJPRHCMXAKP-IIBYNOLFSA-N 407.486 2.142 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 796769405 SAPXAKHZMNPIGW-UHFFFAOYSA-N 411.458 2.119 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298060 OBZJUPPOMSBGET-GOSISDBHSA-N 424.545 2.391 10 20 HECD O=S(=O)(NCc1cc(Cl)cc(Cl)c1O)c1cccc(-n2cnnn2)c1 805135516 MUPUBVYMNKEYAF-UHFFFAOYSA-N 400.247 2.153 10 20 HECD CCc1cc(N2CCC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)ncn1 806270061 OSQOPWZCLICICV-LPHOPBHVSA-N 424.549 2.067 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccc(C)cc2)C1=O 807590469 QIPYIOGVIJLIGV-IBGZPJMESA-N 409.486 2.361 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3OC)OC)CC2)cc1 810107332 GGIYCJRPBBWZBR-OAQYLSRUSA-N 415.534 2.250 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@](C)(O)c3ccc(Cl)cc3)CC2)cc1 815135248 SGVSGXOHZCBGDS-JOCHJYFZSA-N 417.937 2.495 10 20 HECD COC(=O)c1ccc(C)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 913075298 SUHYIODICJRTSI-UHFFFAOYSA-N 418.515 2.439 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(CC(N)=O)CC1 917132543 SNUYAISWNSKDTF-AWEZNQCLSA-N 419.481 2.376 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)cc1 919728838 KMECFRBRMLRIAN-UHFFFAOYSA-N 420.487 2.481 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc2c1COC2=O)c1ccc(N2CCOCC2)cc1 920866048 UVMNKZSDEYBYSB-CQSZACIVSA-N 402.472 2.233 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1Cc1ccccc1 1325382373 LQGASOCUXWSJIQ-RBUKOAKNSA-N 412.486 2.353 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H](C(=O)NC4CC4)C3)CC2)cc1 1338347283 KLKJKYIQUOGDGU-INIZCTEOSA-N 400.523 2.364 10 20 HECD CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)CC1 1786295939 JPKYTUSQMBARPL-RBOXIYTFSA-N 408.882 2.145 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1 1828892145 GHKDYDZGDXJTSW-ROUUACIJSA-N 415.490 2.419 10 20 HECD C[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830740486 JSHYQJOZLSRBCT-WBMJQRKESA-N 410.898 2.365 10 20 HECD Cc1ccc(OCCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841179786 NLMXUOURKVSONQ-UHFFFAOYSA-N 411.458 2.087 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccncc34)CC2)cc1 28890998 FQEQDIUDNQKGIL-UHFFFAOYSA-N 413.499 2.456 10 20 HECD CCOc1ccc(C#N)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 147102163 YWNLNUQQYPAJBC-UHFFFAOYSA-N 408.458 2.048 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC2(C1)OCCO2 741779594 YNNBYOWCGPAGDE-AWEZNQCLSA-N 406.438 2.238 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745799854 LISDZZKRVLQDAQ-HUUCEWRRSA-N 420.464 2.471 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCN1CCOC[C@H]1C 745803688 WASFQODWIKTUHT-CYBMUJFWSA-N 400.317 2.407 10 20 HECD C[C@@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnn(C)c1 750558028 JLCJGWFSFBXVOB-CYBMUJFWSA-N 417.421 2.481 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC(n2ccnc2)C1 751068229 KEMPAHFGIDUXBT-UHFFFAOYSA-N 404.473 2.148 10 20 HECD COc1ccc(N2CCN([C@@H]3CC(=O)N([C@@H](C)c4cccnc4)C3=O)CC2)cc1F 753976847 BVAGGKHLKQMCIT-HNAYVOBHSA-N 412.465 2.240 10 20 HECD COCC[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccco1 754461305 WIJVPKQZGQFVEC-SFHVURJKSA-N 405.470 2.239 10 20 HECD CC(C)(C)S(=O)(=O)N1CCC(NCc2ccc(N3CCOCC3)c(F)c2)CC1 755219065 CZVKEPOOTVDUOM-UHFFFAOYSA-N 413.559 2.345 10 20 HECD CC1(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc21 755959780 WRIPWKBENFMGOH-UHFFFAOYSA-N 409.489 2.089 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccc(C)cc3)CC2)cc(OC)c1OC 759886899 QTTMYRPODHMQOE-UHFFFAOYSA-N 413.518 2.459 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)OC)c3)c2)CC1 769846615 AHUMODOEMMBADV-UHFFFAOYSA-N 403.504 2.416 10 20 HECD CCOC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 770347775 YLCFSUPEFUZTPD-ZOBUZTSGSA-N 422.501 2.469 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2ccc(CC(=O)N3CCOCC3)cc2)c1O 774916726 XFYADOONLLVSDM-UHFFFAOYSA-N 401.419 2.322 10 20 HECD CCCn1cc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1=O 778243017 OTYOZKRQRWJIPQ-LUAWRHEFSA-N 424.501 2.110 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCSC[C@H]3CO)c2C)cc1 784223111 JLGSDDCPXRUREP-GOSISDBHSA-N 402.516 2.473 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)c1 785296809 IKHIRTBSAJWWTK-CQSZACIVSA-N 402.447 2.117 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3COc4cc(C)c(C)cc43)nc12 786957840 HIFTYIBJALEBSJ-INIZCTEOSA-N 411.414 2.448 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 787499415 PRUWKNKYRBZXQU-UHFFFAOYSA-N 419.485 2.156 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)CCc3ccc4c(c3)CCO4)CC2)cc1F 790033020 ZSIGXJAGNRVJHC-UHFFFAOYSA-N 420.506 2.464 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccc3c(c2)CCN(C(C)=O)CC3)c1 790216503 DPYBNOJZTRNHQN-CQSZACIVSA-N 418.515 2.387 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3CCCc4nn(C)cc43)CC2)cc(OC)c1OC 798497711 YFMHYQNKDCUVMB-INIZCTEOSA-N 414.506 2.215 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3[C@@H]3CCCO3)CC2)cc1 803599976 NKWTWTWMLNJKDN-KGQOZSFESA-N 413.518 2.070 10 20 HECD COc1ccc2c(c1)OCC[C@H]2NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687221 AAGBBLGIVZZSDB-LJQANCHMSA-N 409.486 2.334 10 20 HECD O=C(NCCNS(=O)(=O)c1ccccc1)NCc1cc(Cl)cc(Cl)c1O 806364112 QOHRWLDVGBADKF-UHFFFAOYSA-N 418.302 2.477 10 20 HECD CN1CCOc2ccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 806539198 JTTHLEXFXLXQID-GOSISDBHSA-N 408.502 2.147 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)O2 806708891 AMVPGNOIBNBYAM-WEQDKIBNSA-N 413.518 2.117 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)[C@H]1CCCN(C(=O)OC)C1 808033160 IEAWDKFPKGVZIM-CVEARBPZSA-N 405.495 2.114 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 810161553 OCUQBJNVHFNRBO-UHFFFAOYSA-N 419.572 2.143 10 20 HECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)CC1 812133970 GCKGMPFYTXEFNI-UHFFFAOYSA-N 408.506 2.325 10 20 HECD NS(=O)(=O)c1ccc(F)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 820005808 DQIZXQFCOHREJO-UHFFFAOYSA-N 411.418 2.435 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917709082 DEHQSQSPEWWDIC-BETUJISGSA-N 402.470 2.289 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](CO)Cc1ccco1 918065319 XLHTYUJNSURUEL-MRXNPFEDSA-N 405.470 2.030 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918169044 BWGNDMOSXVFPMY-AZUAARDMSA-N 414.550 2.186 10 20 HECD CCN(CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OC)c(OC)c1 921061495 WWJAPMNBWXRLRE-UHFFFAOYSA-N 421.519 2.419 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808001251 SHHSHLRQFYPHKJ-UUIGLSAGSA-N 410.474 2.254 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 217038510 HSESWVNAUYAPQJ-UHFFFAOYSA-N 420.513 2.173 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc([N+](=O)[O-])cc2c1OCCO2 727308260 ZRZOORYHASTUNC-UHFFFAOYSA-N 417.393 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](c3ccccc3)N3CCN(C)CC3)CC2)cc1 727747768 QUFJOYNWNKXLEH-QHCPKHFHSA-N 408.546 2.333 10 20 HECD Cc1c(C(=O)NCc2ccc(N(C)C)c(F)c2)nnn1-c1ccc2c(c1)OCCO2 731455524 NUVQLTWZIKGNOY-UHFFFAOYSA-N 411.437 2.482 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H]2CN2CCCC2)c1 738106127 VGSHVOHDQOTVEB-JOCHJYFZSA-N 401.551 2.487 10 20 HECD CCc1ocnc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 739524799 MMVNELNXXPZPRB-UHFFFAOYSA-N 410.453 2.423 10 20 HECD C[C@@H](COCC(F)(F)F)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742760097 JHEADKLZYIHJED-DZGCQCFKSA-N 416.444 2.155 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1 743566890 KSOGCZUJHNFOCL-PWRODBHTSA-N 416.566 2.320 10 20 HECD COc1ccc2c(c1)N(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCO2 743858667 AYHLVRVBZBIVMI-UHFFFAOYSA-N 415.465 2.186 10 20 HECD COc1cc2c(cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)O[C@@H](C)C2 746310095 NFSXEJJOBOMFEY-NSHDSACASA-N 406.460 2.026 10 20 HECD CC(C)Cn1cnc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751237037 MCXALUKWYXXCBJ-UHFFFAOYSA-N 406.552 2.226 10 20 HECD COCCN(CC(=O)NC[C@H]1Cc2ccccc2O1)c1ccc(OC)c(OC)c1 751481008 DWYUTRCFZSHEPT-GOSISDBHSA-N 400.475 2.277 10 20 HECD CCc1nc(CN(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cs1 754018427 LXKIYQJSKPHKBP-IBGZPJMESA-N 404.580 2.329 10 20 HECD O=Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 754562660 CUAVMSQATCGIGK-UHFFFAOYSA-N 406.435 2.010 10 20 HECD COc1cc(N2CCN(C(=O)NCCCc3c[nH]nc3C)CC2)cc(OC)c1OC 758830174 PIYPJFYYOSYMKN-UHFFFAOYSA-N 417.510 2.208 10 20 HECD O=C(NCc1ccc(N2CCOCC2)nc1)NCc1cccc(Br)c1O 765445169 HGOPGVDYCACTNL-UHFFFAOYSA-N 421.295 2.386 10 20 HECD COc1cccc(CNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1O 769497961 GMIRTWXMJPTOFS-UHFFFAOYSA-N 412.414 2.050 10 20 HECD CN(CCc1cnccn1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771303222 PUTZGJPWHWAFPB-UHFFFAOYSA-N 418.500 2.359 10 20 HECD CCOC(=O)c1cnc(C)c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 775055542 PGPSTFHOGVLKFL-UHFFFAOYSA-N 413.474 2.448 10 20 HECD C[C@H](OC(=O)c1ccncn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778451350 KIDGZLVWWHXRFL-LBPRGKRZSA-N 401.378 2.436 10 20 HECD CCO[C@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 780311902 LZXNZJVVQICGHC-UGKGYDQZSA-N 423.529 2.152 10 20 HECD COc1c([N+](=O)[O-])cc(N(CCO)C2CCOCC2)c([N+](=O)[O-])c1Br 780639041 QXCHIDJYZAUYBD-UHFFFAOYSA-N 420.216 2.252 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)c1 782078071 QKUOLADOKOXPCH-UHFFFAOYSA-N 412.490 2.387 10 20 HECD C[C@@H](OC(=O)Cc1cc[nH]n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787782313 XQYRDUNAMUWCOX-GFCCVEGCSA-N 403.394 2.298 10 20 HECD Cn1cccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 788343815 RYYOMRRWAKDPPR-UHFFFAOYSA-N 406.433 2.028 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCCO1 789825650 NIRJXRCJNADYLM-SOLBZPMBSA-N 421.513 2.083 10 20 HECD C[C@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789841242 VOHGDCKAYFGBSF-HOTGVXAUSA-N 405.514 2.346 10 20 HECD COCCN(C)c1ccc(/C=C2\SC(=S)N(CCCC(=O)OC)C2=O)cn1 790106689 UZMHCOGACFFUHK-KAMYIIQDSA-N 409.533 2.319 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@](C)(OC)C3)CC2)cc1 792003576 AKQPQBFYXGLQON-JOCHJYFZSA-N 404.555 2.418 10 20 HECD CN(C)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 802376984 XUYAVALZDKIKPG-MRXNPFEDSA-N 411.911 2.450 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc4c3CNC4=O)cc2)CC1 806891554 PBUFFKVFHYEMOP-UHFFFAOYSA-N 406.486 2.421 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](c2ccccc2)C1 807290275 GUYWQURSYZYDHO-QFIPXVFZSA-N 404.514 2.194 10 20 HECD COc1ccccc1CN1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807674465 LESTUXQPNUSBOB-GOSISDBHSA-N 424.545 2.283 10 20 HECD C[C@@H]1CSCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768173 DNSITPLNXUFHHL-KGLIPLIRSA-N 413.490 2.337 10 20 HECD CCN1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 807953511 VGMPCOPMVUPDMR-MRXNPFEDSA-N 406.958 2.357 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1nc(C2CC2)cs1 808302861 JXSKCFKCOYVYQD-UHFFFAOYSA-N 414.531 2.132 10 20 HECD CC[C@@H](C)[C@@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)OC 914905459 IKIPMCGIRCEFJY-BFUOFWGJSA-N 401.463 2.350 10 20 HECD COc1ccc(N2CCN(C(=O)CSCc3cc(=O)n4ccccc4n3)CC2)cc1 916076035 JCKASVGJNAQSAP-UHFFFAOYSA-N 424.526 2.285 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 917355386 AIJZECDDYCKFQH-UHFFFAOYSA-N 404.488 2.245 10 20 HECD CNC(=O)c1ccc(OC)c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 918457885 XVNDXTMYJKNYDH-UHFFFAOYSA-N 424.501 2.251 10 20 HECD C[C@@H](OC(=O)c1cnsn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919483492 CSYJYOVEOKQFIG-SNVBAGLBSA-N 407.407 2.498 10 20 HECD Cc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796599220 HNKFBJDOJFDQFZ-BJWYYQGGSA-N 411.458 2.132 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccc1 1821833939 ITOUTPHOKFMVTM-CYBMUJFWSA-N 410.455 2.489 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccn2)CC1 1827219823 FQKKQLCVNAAZGE-IBGZPJMESA-N 424.501 2.364 10 20 HECD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3ccccc3[N+](=O)[O-])C=C2)cc1 466301814 YNDVDVPECMWJDL-UHFFFAOYSA-N 411.439 2.255 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(-c2ncon2)cc1 727037463 NCHLHXRLOBISLM-UHFFFAOYSA-N 421.457 2.170 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N[C@H](C)c1cc(OC)ccc1O)C2=O 728980618 LQJPQDIGXWINRS-QQKMHPFRSA-N 403.479 2.469 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCNC(=O)OC(C)(C)C)cc2F)CC1 730124613 DFAOSECLLDYJFP-UHFFFAOYSA-N 423.533 2.292 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](c3ccco3)N(C)C)CC2)cc1 743363686 VSYQSPMUKHPXNL-FQEVSTJZSA-N 415.538 2.012 10 20 HECD COc1ccc(C[C@@H](CO)CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1O 745785807 CCBMNSNBTVRPHN-MRXNPFEDSA-N 405.470 2.256 10 20 HECD C[C@@H](NC(=O)N1CCNC(=O)[C@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 749011080 XWUVDOQAPLZMHX-DYESRHJHSA-N 408.502 2.467 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccccc1N1CCOC1=O 749731480 QGEUSWBHOHPAJT-UHFFFAOYSA-N 406.489 2.337 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)N(C)Cc3ccc(N(C)C)cc3)ccc2O1 751969016 SKNGMQKVPFYKLI-FQEVSTJZSA-N 418.515 2.440 10 20 HECD O=C([C@H]1Nc2ccccc2S(=O)(=O)N1)N(Cc1ccco1)Cc1ccccc1O 752088477 KPSURXBEHNVSRX-IBGZPJMESA-N 413.455 2.244 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H]2C[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 752142907 RYDDTCLZOCYLCZ-QAPCUYQASA-N 419.547 2.160 10 20 HECD O=C(CN1CC[C@@H](C2CCOCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 755056144 DAODPWVHCZGXPM-LJQANCHMSA-N 405.514 2.027 10 20 HECD C[C@H](NCc1ccccc1S(=O)(=O)N(C)CCO)c1cc(F)cc(F)c1O 756705683 NOHKPPPIAQUHBB-LBPRGKRZSA-N 400.447 2.134 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cc(Br)cn3C)nc12 758819020 CPSCLTVWWJNCOG-UHFFFAOYSA-N 422.283 2.345 10 20 HECD COc1cc(N2CCN(C(=O)NC3CCN(C(C)C)CC3)CC2)cc(OC)c1OC 759211533 LHGDASCLEUMSFP-UHFFFAOYSA-N 420.554 2.417 10 20 HECD Cc1nn(CC(F)F)c(C)c1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 760849455 WCISHOMKOJUTTD-INIZCTEOSA-N 419.476 2.397 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCCC1 761983003 PFDDFDJVTNKDRB-INIZCTEOSA-N 414.955 2.484 10 20 HECD CN1CCN(c2ccc(CNCc3ccc(N4CCCS4(=O)=O)cc3)cc2)CC1 763471756 YCOLXPACIYGKSC-UHFFFAOYSA-N 414.575 2.268 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1cccc(Br)c1O 766201956 YAZNJBDAYRVRBG-DGCLKSJQSA-N 406.298 2.306 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCCN(Cc2ccc(N(C)C)c(F)c2)CC1 768216237 TYHNNGPVLADPCC-UHFFFAOYSA-N 410.515 2.393 10 20 HECD Cc1cccc(F)c1NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 769763569 MFSXKSAMIMOCDT-UHFFFAOYSA-N 424.523 2.469 10 20 HECD CO[C@@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 769884893 DDBOCPNWVBAHFG-LJQANCHMSA-N 401.486 2.230 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccnc1Cl 774147712 VLCCPNGAZHBGFH-UHFFFAOYSA-N 406.845 2.090 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCC2CCOCC2)cc1 774362660 CEXYFYGFYIEKRY-UHFFFAOYSA-N 414.458 2.201 10 20 HECD O=C(O)CCCOc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1F 775289567 WIRHLMSHRKUQFE-UHFFFAOYSA-N 414.367 2.484 10 20 HECD CCCCn1c(N)c(N(CCC(C)C)C(=O)c2cccc(O)c2O)c(O)nc1=O 776641271 WAPWPPXGCYIIRS-UHFFFAOYSA-N 404.467 2.435 10 20 HECD CNC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCO1 782087099 ZHTZQJPBSVMHJW-KRWDZBQOSA-N 420.307 2.444 10 20 HECD Cc1cc(O)cc(=O)n1CCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 783676094 AVBXWBQACMSJPS-QGZVFWFLSA-N 419.909 2.392 10 20 HECD COCCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 787988598 CMXWAOMJHASGRC-UHFFFAOYSA-N 409.486 2.021 10 20 HECD CN(C)Cc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 788596460 RGLHILOSVCSTIC-UHFFFAOYSA-N 407.511 2.202 10 20 HECD Cc1ncsc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822518 WXLKVXXKIXCRGO-STQMWFEESA-N 420.510 2.137 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nccs1 789843399 KONPFYZEHKZTPP-MRXNPFEDSA-N 420.510 2.127 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1(C)C 789847795 VHUGIKKIDWTXHL-LAUBAEHRSA-N 405.564 2.176 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(OC)cc3O)cc(C3CC3)nc21 794380413 BWCLIJPLAMJXFW-UHFFFAOYSA-N 424.457 2.429 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@]2(CCCOC2)O1 797432513 GZARKDLOXRZANQ-AOMKIAJQSA-N 421.513 2.266 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccoc1C1(O)CCOCC1 798163565 WBJZEDKRXDAJBY-UHFFFAOYSA-N 418.465 2.308 10 20 HECD CCn1c([C@@H](C)OCCOC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802007583 OILJTXGCFMENEU-OAHLLOKOSA-N 407.490 2.496 10 20 HECD CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662323 AUZSIOJOAMGNSQ-RDJZCZTQSA-N 420.529 2.051 10 20 HECD C[C@@H]1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807008777 HPSYISIEYNMQOR-WIYYLYMNSA-N 412.578 2.387 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@H](C)N3CCCCC3)CC2)cc1 807700269 HJKPKCUZAHBSRX-IBGZPJMESA-N 416.566 2.115 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 809363133 PKXGYSOHTPVRDS-SWLSCSKDSA-N 424.339 2.245 10 20 HECD COc1ccc(N2CCCN(CC(=O)NC[C@H]3COc4ccccc4O3)CC2)cc1 917090035 WFSHNSQNIFGCMB-FQEVSTJZSA-N 411.502 2.164 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917181319 XMGZRFLAVWZEPJ-UHFFFAOYSA-N 419.409 2.274 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)s2)cc1C 917758374 TURCYSDYNLSOFA-UHFFFAOYSA-N 418.518 2.406 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 918438619 IRFYOPJBPRRNNM-UHFFFAOYSA-N 419.428 2.189 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCCNCc2ccc(N3CCCC3)cc2)cc1 1322611315 QLGTXJRGECBDSG-UHFFFAOYSA-N 404.492 2.263 10 20 HECD Cc1cnc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1795346362 RAIFAJSHWXQSNS-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1CCC1 1816674362 KJDXQPRBFFUAIY-CYBMUJFWSA-N 421.548 2.062 10 20 HECD O=C(c1cc(Cl)ccc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248859 TXSXBAGIXFQROM-UHFFFAOYSA-N 405.813 2.416 10 20 HECD C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccnc1 1847675404 OOUFFQRBWDAUNX-UGFHNGPFSA-N 404.854 2.024 10 20 HECD C[C@@H](OC(=O)c1nccnc1N)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 10140653 RSTWDDOOUAYFCG-LLVKDONJSA-N 416.393 2.018 10 20 HECD CCOc1ccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 18150335 JMGLVEPDMLHMRA-UHFFFAOYSA-N 419.547 2.478 10 20 HECD O=C1/C(=C/c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1CCCN1CCOCC1 28964360 MTWAQFZKGASODO-PTNGSMBKSA-N 409.489 2.224 10 20 HECD CN(C)CCNC(=O)c1cccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)c1 727479712 NKTCPVMISJPHQC-UHFFFAOYSA-N 411.550 2.386 10 20 HECD COCCNC(=O)C1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728195472 SZHFEQXHDIJMLK-UHFFFAOYSA-N 412.486 2.303 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCCN2CCN(c3ccncc3)CC2)c1 728951417 ATLMMAKZWQMOTJ-KRWDZBQOSA-N 413.522 2.368 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 731407515 XTJRZBKKTHASTN-UHFFFAOYSA-N 409.490 2.483 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC1CCC2(CC1)OCCO2 731844562 JYJVTMKJTKPATM-LJQANCHMSA-N 404.507 2.175 10 20 HECD CCn1cc(CN(C)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cn1 733847135 XZTPECSJPLYOIS-UHFFFAOYSA-N 414.554 2.265 10 20 HECD Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nnn1C 745167688 SIFXQJAGRRJQDG-GFCCVEGCSA-N 418.409 2.083 10 20 HECD O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 746177662 QUYVMDIPSQETCL-UHFFFAOYSA-N 413.402 2.188 10 20 HECD CNS(=O)(=O)C[C@@H]1CCCN1CC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 749852456 GXJCZPYFCUZHHA-SFHVURJKSA-N 407.511 2.430 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 751715382 OSKUIHYGZUXEGA-BRWVUGGUSA-N 422.497 2.415 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H](CO)C[C@@H](O)c3ccccc3)CC2)cc1 754642545 NVLNXBYZONOLPO-DENIHFKCSA-N 413.518 2.448 10 20 HECD COc1cc(CN2CC[C@@H](NC(=O)NCc3cccc(OC)c3O)C2)cc(OC)c1 756105308 ZMQQGTNYBOHGOC-QGZVFWFLSA-N 415.490 2.492 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)ccc1Cl 757472048 LIABKOBJSRFMMG-UHFFFAOYSA-N 418.880 2.299 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(N(C)C(C)=O)cc3)CC2)cc1 758232900 ULLSLQFSYOCPFE-OAQYLSRUSA-N 413.518 2.240 10 20 HECD Cc1nn(C)c(C)c1OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 758423906 VMAYRRQQEDGCMH-ZIAGYGMSSA-N 404.486 2.485 10 20 HECD CCC1(CC)[C@H](NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1OC 759603666 ZLLHWOFJMQAJPE-CEMLEFRQSA-N 405.583 2.361 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)C2CC2)cc1 762423851 MUNCKVOWQONYED-HXUWFJFHSA-N 411.506 2.258 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC[C@@H]21 766878938 KRHXVYCQKGQYMJ-XLIONFOSSA-N 404.530 2.413 10 20 HECD Cc1cn(-c2ccccc2)nc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 771235232 SVGDBVHRHFZRER-UHFFFAOYSA-N 424.526 2.346 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775403118 GMUOERPCBAATDK-ZDUSSCGKSA-N 408.506 2.321 10 20 HECD Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)cnn1CCO[C@H]1CCCCO1 784402271 UFCYLKOJIUDHKC-IBGZPJMESA-N 404.419 2.186 10 20 HECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788932305 JURSHYYNZOKIRD-HXUWFJFHSA-N 400.567 2.387 10 20 HECD CC[C@@H](CSC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818729 KOHDXAJLUXSCFJ-LZWOXQAQSA-N 411.543 2.313 10 20 HECD O=C(NCCc1cc(F)cc(F)c1)C(=O)NCc1ccc(N2CCSCC2)cc1 789854266 GQNVXJWAJAFPIR-UHFFFAOYSA-N 419.497 2.493 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cnc4n3CCCC4)cc2F)CC1 790972593 RICNJAOXDDDTQS-UHFFFAOYSA-N 414.529 2.500 10 20 HECD C[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 792469826 MXOXLBKHWZKFJX-GFCCVEGCSA-N 416.441 2.073 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3Cc4ccccc43)cc2F)CC1 793670611 CRMSJZOZASBKRH-LJQANCHMSA-N 424.520 2.040 10 20 HECD COc1ccc(CNC(=O)c2ccc(OCC(=O)NC(C)C)c(OC)c2)c(O)c1 794379827 XMMIGKFXKSPVJE-UHFFFAOYSA-N 402.447 2.243 10 20 HECD Cc1cc(C(=O)CN(C)[C@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1cccc(F)c1 794786198 NIESZCQEEYDIBQ-SFHVURJKSA-N 407.511 2.382 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](OCCOC)C3)cc2F)CC1 802126360 QZVXOZRITUQGEI-IBGZPJMESA-N 422.545 2.305 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](C)N1CCc2ccccc2C1 803882394 WQAPXRXXPICOBX-GOSISDBHSA-N 408.546 2.240 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](C)NC(=O)OC(C)(C)C 804041810 BEKBLQAEALDRII-OAHLLOKOSA-N 406.527 2.131 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCCc4nc(C)ncc43)CC2)cc1 804319347 OOQGYGJTOQCJBA-OAQYLSRUSA-N 423.517 2.072 10 20 HECD Cc1nc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 804961036 GBTDZCFTSRTDDU-OAHLLOKOSA-N 422.938 2.224 10 20 HECD COCc1cnc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 806843501 JHTSOOAARSYAGI-CQSZACIVSA-N 405.476 2.141 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)cc1 906481148 UBEWVYNNAKNGCE-OALUTQOASA-N 424.611 2.020 10 20 HECD COc1ccc(C(C)=O)cc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917832537 ABXFQSGEZFSCPQ-LJQANCHMSA-N 423.513 2.458 10 20 HECD CCN(CC)[C@@H](CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)c1ccccc1 920980658 UXOIBKYVVAUADN-WQJNHMDYSA-N 402.564 2.442 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 1324626710 GEQTUFSLDBVULP-FFZOFVMBSA-N 413.518 2.298 10 20 HECD CCOc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 1342445106 GJDJAAAAHNQPGE-UHFFFAOYSA-N 401.463 2.469 10 20 HECD Cn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1795158191 MBOBBSROQSWOBK-CLLJXQQHSA-N 404.854 2.050 10 20 HECD CC(C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc2c(c1)OCCO2 116168339 FFJZKDCDORAIQK-UHFFFAOYSA-N 420.487 2.243 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc4c(c3)NC(=O)CC4)CC2)cc1 141964462 LKWFKHWIXZHCTN-LJQANCHMSA-N 411.502 2.142 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)CC3CCCCC3)CC2)cc1 725802940 SSFOEQAAWJSFFZ-UHFFFAOYSA-N 400.567 2.483 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1 729061383 CGCYSXLZJPRWJA-CYBMUJFWSA-N 417.437 2.192 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@@H]1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 733464128 FSKYPCRNXWRZCZ-CYBMUJFWSA-N 414.480 2.320 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCN1CCOCC1 733995419 JPFJQGFOTKYDKH-MRXNPFEDSA-N 421.497 2.053 10 20 HECD C[C@H](OC(=O)c1ncccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741035630 IROARDPGWAATHE-LBPRGKRZSA-N 401.378 2.436 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2Cc2ccc(N3CCOCC3)c(F)c2)cn1 754153948 KYJFLYWHUQEEKZ-MMTVBGGISA-N 406.527 2.184 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3N(C)C)CC2)cc1F 754213976 JNLVMZDVBYFQGR-UHFFFAOYSA-N 400.454 2.188 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSC[C@H](C)C3)CC2)cc1 754746053 SUGUJDJXMWZPNG-ZPUOCTKUSA-N 403.548 2.112 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3cnn(C(C)C)c3)CC2)cc1 754803798 WBAVWSJZQWHONR-WIYYLYMNSA-N 401.555 2.306 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCC[C@H]3O)cc2F)C[C@@H](C)O1 755062699 KXXJUHAXMIRVAX-KALAIVBUSA-N 407.530 2.148 10 20 HECD CS(=O)(=O)N[C@H]1CCC[C@@H]1CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756903027 YRUSCYWXEFFWIG-SJORKVTESA-N 410.540 2.393 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)C[C@@H](O)c3ccco3)CC2)cc1 759575870 QJVLNWROOSIWMQ-FXAWDEMLSA-N 416.522 2.222 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H]3CS(=O)(=O)c4ccccc43)CC2)cc1 763035173 JBAAUGNXWOLALF-IBGZPJMESA-N 415.515 2.492 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNc3ccccc3C(N)=O)cc2F)C[C@@H](C)O1 764384207 WEEPDONITMXFFQ-GASCZTMLSA-N 414.481 2.267 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(C2CCCCC2)C1=O 765689767 LDGNQVXUIZNNPA-FQEVSTJZSA-N 400.523 2.256 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)CNC(=O)OC(C)(C)C 766387210 AIIHQKSHLSEJGC-UHFFFAOYSA-N 406.527 2.131 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnn(CC(C)C)c3C)CC2)cc1 767024077 RSKJJVAFMYIMIP-UHFFFAOYSA-N 414.506 2.362 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO[C@H]1C1CC1 767955936 QKNJWCACJBQLGP-QMHWCDLVSA-N 414.550 2.393 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc(N(C)C)cc1 773858153 OZPIPTXQFKRJQE-MRXNPFEDSA-N 406.490 2.403 10 20 HECD C[C@@H](NC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N(C)C)cc1 775404817 PDCRSIQAYCARHC-MRXNPFEDSA-N 417.531 2.265 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(Cn4cncn4)cc3)c2)CC1 781046330 CZLZOCBYTUHRTP-UHFFFAOYSA-N 404.474 2.247 10 20 HECD Cc1cc(C(=O)CN2CC[C@H](O)C(C)(C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782583517 MAMVQBIEPQTEBH-FQEVSTJZSA-N 419.547 2.017 10 20 HECD CN(CC1(N(C)C)CCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 782946160 JUMZJLDMZDFKHZ-SFHVURJKSA-N 401.555 2.014 10 20 HECD CCN(CC)C(=O)CCC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785427210 ALSAFFJGWGATFH-UHFFFAOYSA-N 416.566 2.256 10 20 HECD CCC(CC)[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)N1CCOCC1 786601189 YPHTZLZZNKZGSV-UWJYYQICSA-N 418.582 2.183 10 20 HECD CN1CCC(n2ccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2)CC1 786692789 BQKDPFBGUMTEPK-UHFFFAOYSA-N 416.501 2.447 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCCC2)nc1 787179943 HYWSJKMSGJIPRH-UHFFFAOYSA-N 409.534 2.413 10 20 HECD C[C@H]1CCCN([C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864179 MYXKFSFDGWHGLP-ZWKOTPCHSA-N 418.607 2.093 10 20 HECD C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NCCCSc1nccs1 792164926 KPXAJAZINOGORF-HNNXBMFYSA-N 421.466 2.373 10 20 HECD CCOC(=O)c1ccc(NC(=S)NNc2ccccc2S(=O)(=O)N(C)C)cc1 793326001 HWIRSPRFBKKWSE-UHFFFAOYSA-N 422.532 2.427 10 20 HECD COc1ccc(CNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c(O)c1 794379565 QHTKESGYSJCQHX-LLVKDONJSA-N 402.476 2.092 10 20 HECD Cc1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c[n+]1[O-] 794719872 IXNVYLRBUUMVFS-HOTGVXAUSA-N 403.454 2.076 10 20 HECD COc1cc(N2CCN(C(=O)NCCCOC(F)F)CC2)cc(OC)c1OC 801071802 WGXSTTLRGDKRFX-UHFFFAOYSA-N 403.426 2.173 10 20 HECD Cc1cc(C(=O)OCC(=O)c2ccc(S(C)(=O)=O)nc2)c(C)n1-c1ccccn1 803274535 MFRDCSGYYCSTDB-UHFFFAOYSA-N 413.455 2.327 10 20 HECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806234400 KZGLSBQGOOIUSH-FXAWDEMLSA-N 424.501 2.192 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H](Oc2ncccc2F)C1 807290457 KERNWLDDRPHMJV-LJQANCHMSA-N 424.476 2.283 10 20 HECD C[C@H](NC(=O)C(=O)NCCN(C)Cc1ccc(F)cc1)c1ccc(N(C)C)cc1 807672905 KDXAGKLYIOXAFC-INIZCTEOSA-N 400.498 2.317 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCN3CCCCC3)cc2)C1 918117264 BJIXCGAXJQJVPR-IBGZPJMESA-N 401.555 2.064 10 20 HECD NC(=O)c1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)ccc1F 918294194 MNWXBJLANSWNPZ-UHFFFAOYSA-N 411.389 2.391 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)NCc3ccco3)cc2F)C[C@H](C)O1 918632960 GBEZLKAFSTYLIC-GJZGRUSLSA-N 418.469 2.148 10 20 HECD COc1ccc(N2CCCN(C(=O)Cc3ccccc3NS(C)(=O)=O)CC2)cc1 1318369872 IGQVPVVRPYYBQD-UHFFFAOYSA-N 417.531 2.348 10 20 HECD Cc1[nH]nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)c1F 1800715698 LVFUWVUOEIYYOJ-ZSBIGDGJSA-N 422.844 2.487 10 20 HECD C/C=C/C(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814165401 FLTKNDZJGCDBRT-ZIRJPHQLSA-N 423.469 2.494 10 20 HECD C[C@@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)c1ccccc1 27993220 IHBUQEFSXXKARP-KRWDZBQOSA-N 411.502 2.463 10 20 HECD CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 727755943 LFFUBTFDCUUBHB-GOSISDBHSA-N 405.564 2.477 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(C(=O)CN3CCCC3)CC2)cc1F 731364796 NVJLYFRSAJIZKN-UHFFFAOYSA-N 419.545 2.122 10 20 HECD CC(C)c1nn(C)c(Cl)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 741675755 UUFCNBREXULWPD-UHFFFAOYSA-N 424.954 2.362 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc3cc(F)ccc3o2)SC1=S 743282204 JQAFXMRRNSCUIA-JYRVWZFOSA-N 400.478 2.322 10 20 HECD CC(C)(C)OC(=O)N1CC(OCC(=O)NCc2ccc(N3CCSCC3)cc2)C1 748024086 MDYGHWFTQKXNBJ-UHFFFAOYSA-N 421.563 2.492 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1Cl 748641067 REGCZYXSVCTZFM-UHFFFAOYSA-N 417.896 2.471 10 20 HECD COCCN(CC(=O)N1CCN(Cc2ccco2)CC1)c1ccc(OC)c(OC)c1 751480308 DFUXLMVTHSYTRC-UHFFFAOYSA-N 417.506 2.094 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCC[C@@]12NC(=O)N(C)C2=O 753020397 IOOJTSIMKQFAGJ-HRAATJIYSA-N 401.511 2.005 10 20 HECD CCc1nc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n[nH]1 754750788 RBCIDRWHUZGSEG-UHFFFAOYSA-N 406.354 2.408 10 20 HECD CN(C)CCN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCC1 758714547 XUAOTXGHNIDZPV-LJQANCHMSA-N 415.582 2.404 10 20 HECD CCn1nc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1C1CC1 759029766 VOUOGUPURKPOQZ-UHFFFAOYSA-N 411.506 2.466 10 20 HECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N1CCN(c2ccccc2O)CC1 759579635 NGIHCIOMPTZHJR-SOIVGHGOSA-N 412.442 2.097 10 20 HECD CCN1CCC[C@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760124146 WITMTUNRAIXUTO-INIZCTEOSA-N 406.527 2.028 10 20 HECD C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cnn(C)c1 764351441 PZRSJBROOUHLIN-NSHDSACASA-N 406.489 2.479 10 20 HECD Cn1ccnc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 767779861 XAPGAUVSYYHIHP-KRWDZBQOSA-N 401.486 2.485 10 20 HECD Cn1ccnc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 770302474 WHAOYRVWCRXNMJ-OALUTQOASA-N 424.549 2.211 10 20 HECD C[C@H](NS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 772485445 MFJTVOOEHSJCEL-ZDUSSCGKSA-N 418.441 2.322 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 774363720 LBMYNKFZJCIFIB-UHFFFAOYSA-N 417.849 2.175 10 20 HECD O=C1[C@@H]2CSCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 777607081 XEBWDWCDBJYIOY-AWEZNQCLSA-N 401.410 2.379 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1O 784713613 GFELHCHAYTVOKY-UHFFFAOYSA-N 424.461 2.063 10 20 HECD CN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1cnn(C)c1 786699820 QNTSNPDPPHAUPN-KRWDZBQOSA-N 419.434 2.165 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)C2CC2)cc1 789382900 SWQJDZGOKXEPGL-UHFFFAOYSA-N 406.486 2.401 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)cc1 793822772 DHGTWVFJIVYEKR-KRWDZBQOSA-N 411.502 2.187 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4nccnc4cc3F)CC2)cc1 795871412 DZNGQQGFLHMNGM-UHFFFAOYSA-N 424.432 2.283 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1 797431470 PTLVNNCABKUXQD-UHFFFAOYSA-N 409.411 2.382 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1cc(Cl)cn1C)c1ccc(N2CCOCC2)cc1 803310528 LEGYTIHUFWKCNI-HNNXBMFYSA-N 418.925 2.351 10 20 HECD CC(C)[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1nnc2ccccn12 804101079 KXBZAZFLQPEKPK-KXBFYZLASA-N 408.506 2.486 10 20 HECD CC[C@@H](C)CN(CC)C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007182 GJURRSIECOTKEZ-QGZVFWFLSA-N 406.546 2.478 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H]2C[C@]2(C)NC(=O)NC2=O)cc1F 806772343 OPOXBYVPXRHOET-BTYIYWSLSA-N 419.501 2.334 10 20 HECD CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N(C)c2ccccc2)ccc1Cl 808486740 XJPJGBFXPSZPAW-UHFFFAOYSA-N 409.847 2.480 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(C1CC1)C1CC1 808854541 ZMUYGMJJIOCBBE-UHFFFAOYSA-N 424.589 2.482 10 20 HECD COc1cc(O)c(CNc2ccc(C(=O)NCCN3CCOCC3)cc2)cc1OC 809659231 LLRJEQGNOXBCLW-UHFFFAOYSA-N 415.490 2.084 10 20 HECD O=C(COc1cccc(-c2nnco2)c1)NCc1ccc(N2CCOCC2)c(F)c1 917214778 ATDABQAFRVGULW-UHFFFAOYSA-N 412.421 2.408 10 20 HECD CC(C)C(=O)NC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918221565 XZJQFHZGHWUPBP-UHFFFAOYSA-N 420.529 2.233 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(F)cc1F 918304365 VQDXGTCFRFANGH-UHFFFAOYSA-N 405.401 2.415 10 20 HECD COc1ccc(C(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(OC)c1 920637077 YWNWGRMMOLCYTR-LLVKDONJSA-N 423.443 2.209 10 20 HECD C/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781123043 OYBJOGFITVJLAD-CCUDJZOASA-N 408.882 2.455 10 20 HECD O=C(CN1CCCC1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1785871487 HUXPZZJDEVAWNZ-UHFFFAOYSA-N 410.474 2.336 10 20 HECD CC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)CCC1 1792448287 CRBRNIABQKAMFD-YWVIFJGQSA-N 408.882 2.145 10 20 HECD Cc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804332150 OUGXZXCVSMRSHM-CLLJXQQHSA-N 423.585 2.169 10 20 HECD Cn1cc(F)cc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810552269 UVXKNHYYBFYACL-UHFFFAOYSA-N 416.453 2.129 10 20 HECD CCOc1ccc(C(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 10907583 FRRGSMMECDGBAP-UHFFFAOYSA-N 411.502 2.310 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc4ccccc4c3=O)cc2F)C[C@@H](C)O1 108164670 RFBZIOATFVFJQQ-IYBDPMFKSA-N 424.476 2.466 10 20 HECD O=C(NCc1ccccc1O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 726250013 PXLBWFDLFDIARO-UHFFFAOYSA-N 403.504 2.292 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc(N(C)C)n3C(C)C)CC2)cc1 728788997 WTDFHCMOHLLSNE-UHFFFAOYSA-N 418.567 2.375 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)OCC(=O)N4)cc2F)CC1 730235585 HEKWHGZHVKXYSA-UHFFFAOYSA-N 412.465 2.229 10 20 HECD CC1CCN(c2ccc(CNS(=O)(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1 731038946 PWSKIWJGTJRRBH-UHFFFAOYSA-N 412.519 2.377 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3CCC(=O)NC3=O)c2C)cc1F 733560989 ZALJUTIMFNSESM-UHFFFAOYSA-N 415.421 2.209 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 744878485 YFZDWMUANBUKSS-QFIPXVFZSA-N 422.529 2.466 10 20 HECD CCCN(CC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 750875207 POWLUYZRQZTLQX-QGZVFWFLSA-N 420.535 2.107 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 752655682 GGCBQJKJAWFSDV-UHFFFAOYSA-N 414.462 2.448 10 20 HECD CCCS(=O)(=O)c1ccccc1C(=O)N1CCS(=O)(=O)C2(CCCCC2)C1 753707462 AJECCXOCJQIMQL-UHFFFAOYSA-N 413.561 2.444 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccnc3N3CCOCC3)CC2)cc1F 753740038 LOWKLXQJZADECY-UHFFFAOYSA-N 400.454 2.028 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)c3nccs3)CC2)cc1 754163976 IGKMITSECBAAHQ-INIZCTEOSA-N 403.552 2.377 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccnc(O[C@H]2CCOC2)c1 755371096 HAJHGDCISPOGKA-NRFANRHFSA-N 411.502 2.388 10 20 HECD O=C(CN1CCO[C@H]([C@@H]2CCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756898428 LVDBQBBUJAWOLU-SFTDATJTSA-N 420.465 2.280 10 20 HECD CC(C)CN1CC[C@@H](CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 756988656 ZENKBTKBTFAXFM-VQTJNVASSA-N 415.582 2.165 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 758994550 WJZWGTNWAJCFKD-UHFFFAOYSA-N 416.441 2.078 10 20 HECD Cc1cccc(Cn2[nH]ccc2=NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)c1 759588230 JWFLNQWFZCKYRI-HSBSRBQESA-N 407.426 2.268 10 20 HECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)NCc1cccc(Br)c1O 765765143 ODTDVYLNHUBDTI-VIFPVBQESA-N 419.322 2.199 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3ccc(CS(N)(=O)=O)cc3)c2)CC1 767931179 NKUQKLXGEUISLR-UHFFFAOYSA-N 416.547 2.258 10 20 HECD C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769937642 SMKVRJCTLIWJCT-QDXKXIGTSA-N 410.517 2.334 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)s1 773616156 ISFNZXNGGBSZNE-AWEZNQCLSA-N 410.565 2.461 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC[C@H]1COC2(CCCC2)O1 773732755 VXLCGPSCXDXUEP-FQEVSTJZSA-N 403.523 2.380 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCc2cc(OC)c(OC)c(OC)c2)c1 775374769 DXSKUXMPORZIQG-CYBMUJFWSA-N 404.463 2.394 10 20 HECD C[C@@H](NC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(N(C)C)cc1 776127997 HLNVWXPNPANNRA-PEBXRYMYSA-N 409.490 2.368 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 777647658 ALDDETPUOIKJTK-UHFFFAOYSA-N 400.340 2.036 10 20 HECD CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)/C=C\c1ccc(O)c(O)c1 779502816 GXKMOIBJMHGCGC-WZUFQYTHSA-N 405.472 2.442 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc(F)c3C)cc2)CC1 786121238 VYSSPGWJQSIUIL-UHFFFAOYSA-N 405.495 2.281 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 787192481 XMUHIYUIJHQDSW-UHFFFAOYSA-N 407.518 2.237 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(CN2CCOCC2)c1)c1ccc(N(C)C)cc1 787289292 FAGIZWQWMVXUGF-SFHVURJKSA-N 424.545 2.078 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccnc3F)cc2F)C[C@H](C)O1 789007009 LDBCHITYQJRKMJ-KBPBESRZSA-N 419.428 2.447 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CC[C@@H](C)C1 792466531 XUKUCNSGMIDNAH-IEBWSBKVSA-N 407.530 2.416 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c1 792495119 JXJNNYNGJCNTJQ-INIZCTEOSA-N 403.504 2.016 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c(O)c1 797390623 KGKJMXMWVGKSED-HUUCEWRRSA-N 413.474 2.269 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC[C@H]4C3)cc2Cl)C1 800721240 YRRJIASRECFJNB-ZBFHGGJFSA-N 405.930 2.495 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1F 801173446 SVXNLHUKGNBCAX-UHFFFAOYSA-N 410.467 2.240 10 20 HECD CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCOC1 802760562 FCGRDWIQWMVRSN-LJQANCHMSA-N 415.538 2.324 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1noc(-c2ccccc2)n1 803662436 BTCYRXDXIYRYFT-CYBMUJFWSA-N 411.437 2.435 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nc2cc(OC)ccc2n1C 806665058 GNVQQOUGHQVTFY-UHFFFAOYSA-N 423.517 2.313 10 20 HECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807100885 NWDPBKXAHAVTAT-INIZCTEOSA-N 418.538 2.050 10 20 HECD O=C(NC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768974 CKSNQXXCXANCHR-KGLIPLIRSA-N 413.490 2.242 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCO[C@H](C(C)(C)C)C1 808080915 KIHQNIVOYRYCSR-QUCCMNQESA-N 417.550 2.192 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cc(F)cc(F)c1F 815356722 ZZHNEYKTHBSUBS-UHFFFAOYSA-N 411.355 2.335 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1)[C@H]1C[C@@H]1C 815550076 BXLLTSMGWSSUTJ-UGSOOPFHSA-N 411.458 2.157 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ccc(OC)c(F)c3)CC2)cc1 914522447 APURMJPMVSWGKS-LJAQVGFWSA-N 420.506 2.440 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cn4ccccc4n3)CC2)cc1 915910156 RHTXXPJMHGAOAM-UHFFFAOYSA-N 422.533 2.354 10 20 HECD CC(=O)NCC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 918219831 OVIXZWFKIUSXMT-HOTGVXAUSA-N 420.529 2.497 10 20 HECD CNc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 918373962 HWFLOFZWLSHTFH-MRXNPFEDSA-N 411.462 2.268 10 20 HECD COC(=O)[C@](C)(NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1319606255 HVBMCQRVRXAOTQ-HSZRJFAPSA-N 411.502 2.022 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)NC(=O)CS2 1320395031 WDJWOJRRSVVKOQ-AWEZNQCLSA-N 416.455 2.046 10 20 HECD O=C(c1cccs1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441375 OYSWSLAPUQUKIS-UHFFFAOYSA-N 408.483 2.358 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 7120321 PFWGPZDSDPGZEY-KRWDZBQOSA-N 401.507 2.045 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 109206955 WWXLGANWWIICRH-UHFFFAOYSA-N 422.576 2.090 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 195561360 YXSBDILSTOXGTM-JOCHJYFZSA-N 418.582 2.051 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)ccc21 726562111 BXBAOCLBQXCVAC-UHFFFAOYSA-N 422.485 2.117 10 20 HECD COc1ccc(C(C)(C)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 730035566 IPULTMVUVBKIHJ-UHFFFAOYSA-N 422.503 2.489 10 20 HECD COc1ccc(O)c(CNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c1 734018419 QDPVUYTUGVIOHG-UHFFFAOYSA-N 422.478 2.257 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1[N+](=O)[O-] 738881282 GEEHNPZCKJHOCJ-UHFFFAOYSA-N 418.475 2.460 10 20 HECD O=C(COC[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 746396267 ZPAKJLYALMECRT-INIZCTEOSA-N 402.413 2.354 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccn(Cc2ccccn2)n1 759034774 GZNGUTLHIPIBGB-UHFFFAOYSA-N 402.505 2.020 10 20 HECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 759570278 RXHDDXIPIPBMMP-WIYYLYMNSA-N 424.549 2.477 10 20 HECD Cc1cc(C(=O)CN2CCOC[C@@H]2C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761121236 FHPGAANAYUHSBO-HXUWFJFHSA-N 417.531 2.035 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(C)(CO)CC3)CC2)cc1 762997617 SWKDRCAIHMBGOY-UHFFFAOYSA-N 404.555 2.011 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 778930637 WGEIDOJSAQGSTO-MGPUTAFESA-N 402.447 2.444 10 20 HECD NS(=O)(=O)[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 783414415 QEPZNAPKUDLLIK-KRWDZBQOSA-N 415.475 2.320 10 20 HECD CC1([C@@H]2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)OCCO1 784217558 BRTRNWUGMNJLML-QGZVFWFLSA-N 407.486 2.347 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCC[C@H](C)C3)cc2F)CC1 787322548 LOUGCCUXJOGCPD-WMZOPIPTSA-N 404.530 2.279 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1)c1ccc(N(C)C)cc1 787435606 ZMHXRRHJEVFTTM-KRWDZBQOSA-N 409.534 2.106 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 788311730 YGPBJBQNDGAYJO-UHFFFAOYSA-N 422.529 2.056 10 20 HECD CN(CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 795396445 JFPDIUYLJFNCJR-KRWDZBQOSA-N 418.538 2.262 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(C3CCCCC3)CC2)cc1F 803662502 CAGDYPAFXDHLRE-UHFFFAOYSA-N 404.530 2.421 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686335 HVKCWPKFFXOHKQ-MWRLGJARSA-N 413.562 2.473 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccncc1 805762096 NHIQFLLLMFGZEJ-LJQANCHMSA-N 411.502 2.389 10 20 HECD NS(=O)(=O)c1ccc(OCC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807838918 COJFAKLXDNTAIV-UHFFFAOYSA-N 405.259 2.042 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3COc4ccccc43)CC2)cc1 808250342 YTBGCNREBJMYMJ-SFHVURJKSA-N 410.518 2.293 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@H]2N(C)CCCC2(C)C)C2CC2)cc1 809867391 QCAVCSDPQMQBRH-HXUWFJFHSA-N 400.567 2.480 10 20 HECD CON(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1 863992934 JWLQLLICOQUVAT-UHFFFAOYSA-N 404.536 2.232 10 20 HECD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)CC1 915732142 VMUAOIITBZFPOE-UHFFFAOYSA-N 409.534 2.149 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3nc4ccccc4o3)nc12 919000795 NZDXASYVFYIYSE-UHFFFAOYSA-N 410.386 2.429 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920881678 KJTZAXTVZAXOBY-YLJYHZDGSA-N 423.579 2.295 10 20 HECD CC(C)CN1C(=O)/C(=C/Nc2cc(Cl)ccc2N2CCOCC2)C(=O)NC1=S 920978561 JJGUVJDLTGADPD-GXDHUFHOSA-N 422.938 2.372 10 20 HECD CC1(C)CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)C1 1782260423 DRRIVTAXVPISGM-OPAMFIHVSA-N 417.506 2.057 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)no1 1804285953 ZYRUMXMPWKHFIG-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817367180 RKSRLJFJFWPVFH-ZDUSSCGKSA-N 423.498 2.258 10 20 HECD C[C@H](NC(=O)Nc1ccc(S(C)(=O)=O)nc1)c1ccc(N2CCOCC2)cc1 65456351 TYPQYNSKLKEILL-AWEZNQCLSA-N 404.492 2.204 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(S(=O)(=O)NCCOC)c1 105816657 RJJFICAFJHDJHI-UHFFFAOYSA-N 419.547 2.340 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 108689457 YUZVLWSOWGEKSY-HNNXBMFYSA-N 423.560 2.162 10 20 HECD CC(C)[C@H](CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)N1CCOCC1 139999639 VVIAWRYXHPRKIW-RXVVDRJESA-N 404.555 2.240 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)c1ccc(Cl)cc1 727101856 MEWKTLOHLWIWJB-UHFFFAOYSA-N 406.891 2.074 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1 734073441 NCTGZHRZLCJUNY-UHFFFAOYSA-N 417.849 2.201 10 20 HECD C[C@@H](NC(=O)NC1CCN(C[C@@H]2CCOC2)CC1)c1ccc(N2CCOCC2)cc1 736379633 IOMKTORXHQILML-MOPGFXCFSA-N 416.566 2.384 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCOc3cccc(F)c3)CC2)cc1 742940816 YWLLGBMZUUKUDV-UHFFFAOYSA-N 416.497 2.335 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@@](C)(c4ccccc4F)C3=O)CC2)cc1 744122093 UILCIEDMXUGQFA-QFIPXVFZSA-N 412.465 2.381 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC[C@H]3c3ccccc3)CC2)cc1 754052707 YBGBWXMCNNJJSD-VWNXMTODSA-N 411.546 2.252 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(=O)N(C)c4ccccc43)CC2)cc1 754070207 XMAGGJGCAYWCCP-HXUWFJFHSA-N 424.545 2.051 10 20 HECD CCCOc1cccnc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 758947364 YRWGNAQFACJLAU-UHFFFAOYSA-N 413.474 2.385 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1 759221921 SADYHALEMOSXQE-GOSISDBHSA-N 414.462 2.030 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CC[C@H](CO)CC3)CC2)cc1 759546716 VELZYYIBOBDNEN-WGSAOQKQSA-N 404.555 2.058 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H](Cc3ccc(Cl)cc3)C(N)=O)cc2)C1 760576628 OZHFPRQTERPWSI-PXNSSMCTSA-N 414.937 2.228 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CNC(C)(C)C(=O)NCC3CCCCC3)nc12 767673652 VZSSDCOVETVFSA-UHFFFAOYSA-N 417.510 2.176 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769814499 HXFXZUJZACQBOJ-OAHLLOKOSA-N 403.504 2.110 10 20 HECD COCCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 772997750 HTKAXEQCXIXATM-INIZCTEOSA-N 419.547 2.477 10 20 HECD COC(=O)CCCN1C(=O)/C(=C/c2cc(Br)nn2C)SC1=S 778243665 CIAUFMOTUMOVRJ-TWGQIWQCSA-N 404.311 2.337 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(S(C)(=O)=O)cc1 783153277 UGGCLFLJCPHPID-LLVKDONJSA-N 413.473 2.085 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1 784029733 GJUXDJODVKCEPK-UHFFFAOYSA-N 424.461 2.062 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3ccccc3S(C)(=O)=O)CC2)cc1F 786308010 HXSQTVNREXMXTH-UHFFFAOYSA-N 406.479 2.129 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 787323969 RADWMAINOOZLOE-CVEARBPZSA-N 419.522 2.056 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1F 787759204 PBFJIVWKKMZZBH-FQEVSTJZSA-N 412.509 2.461 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)cc1 788879817 DYIAZQIOKUUAHN-LJQANCHMSA-N 408.568 2.242 10 20 HECD CCOC[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 789866389 NHKGXUOWSWBHGB-PISNEZEASA-N 403.523 2.077 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](S(N)(=O)=O)C3)cc2Cl)C1 799993992 MTORUXNVYIFTQR-UKRRQHHQSA-N 414.959 2.149 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 801695569 BUHBKSMEVDAKJT-ZDUSSCGKSA-N 412.533 2.204 10 20 HECD COCCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686332 HUQMBIJRCADLRX-UHFFFAOYSA-N 409.530 2.403 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 806163448 FQSXXYOUEAOMGG-NRFANRHFSA-N 405.502 2.465 10 20 HECD CN1CCN(C(=O)C(=O)NCCCSc2nccs2)[C@@H](c2ccccc2)C1 806281942 CDKQJLWQLDSLBJ-MRXNPFEDSA-N 404.561 2.257 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H]2C[C@@]2(C)NC(=O)NC2=O)cc1F 806772344 OPOXBYVPXRHOET-QVKFZJNVSA-N 419.501 2.334 10 20 HECD COC(=O)COCC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 807962822 PVXTXSFKQISCGI-UHFFFAOYSA-N 413.338 2.463 10 20 HECD COCC[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 813042163 HGIAGBSBWVHYKL-SOLBZPMBSA-N 409.502 2.386 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccco4)n3)cc2F)C[C@@H](C)O1 917713252 JXHPAJNGQIAERE-OKILXGFUSA-N 414.441 2.002 10 20 HECD COc1ccc(OC)c(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 917832869 IZRLNZRJTQJZED-KRWDZBQOSA-N 411.502 2.264 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1=NO[C@@H](c2ccccc2)C1 919818752 SMBAIKJWERFOLL-HXUWFJFHSA-N 413.499 2.055 10 20 HECD CCOc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5sccc5n34)CC2)cc1 1116386781 QSEJZHFAUGVOIO-UHFFFAOYSA-N 424.530 2.364 10 20 HECD Cn1nc(C(C)(C)C)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1327615656 HAJOXESEFLYMGS-UHFFFAOYSA-N 419.551 2.274 10 20 HECD COCCNS(=O)(=O)c1ccc(-c2nnc(C3=S=C4CCCC4=C3)o2)cc1 1328220985 HEXSBZUSKTXGMO-UHFFFAOYSA-N 405.501 2.211 10 20 HECD CS(=O)(=O)C1=S=C(C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)C=C1 1357699179 UZZLUNPIVGGYSC-UHFFFAOYSA-N 417.390 2.344 10 20 HECD COc1cc(C)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603230 FOTYEUFIQCIDMK-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(CCc1ccco1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033737 ASUZPQBSPPETGG-VMPITWQZSA-N 412.442 2.246 10 20 HECD CCn1c(=O)oc2cc(S(=O)(=O)N3CCOc4cc(N(C)C)ccc43)ccc21 466968519 YVHUJMXSXZKKMO-UHFFFAOYSA-N 403.460 2.268 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN(C(=O)c3ccsc3)CC2)n(C)c2ccccc12 673315234 HGBMAALGKPTDJD-UHFFFAOYSA-N 424.526 2.149 10 20 HECD COc1ccc(N2CCC(NC(=O)CCn3c(=O)nc(O)c4ccccc43)CC2)cc1 726560785 NKVGJSQNSAPNTE-UHFFFAOYSA-N 422.485 2.286 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1 726726698 VIUHGOWDRUMBDQ-UHFFFAOYSA-N 410.474 2.377 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(OC)c2)cc1OC 727356772 HMMSSFVRVAXQNU-UHFFFAOYSA-N 400.478 2.266 10 20 HECD CCn1cc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 727458918 YTTHDFUBQVRNFR-UHFFFAOYSA-N 400.451 2.452 10 20 HECD CC(=O)N1CCC(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 729497618 WTRLWQZOQKSXRB-HOTGVXAUSA-N 420.529 2.497 10 20 HECD Cn1cnc2c(NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)ncnc21 731983464 KRPJMPJANSVHGC-UHFFFAOYSA-N 419.468 2.231 10 20 HECD CN(C)c1ccc(CNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1F 743636093 FROSRSAWMRBXQR-QGZVFWFLSA-N 414.481 2.371 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1 743906604 OMCWCFIIUNRBDB-CYBMUJFWSA-N 413.430 2.482 10 20 HECD CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745646180 BROOENBLQGADDT-IBGZPJMESA-N 422.545 2.039 10 20 HECD C[C@H](O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 749348804 XBXILAAHMLMIMK-JXFKEZNVSA-N 410.518 2.441 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC(O)(CN2CCOCC2)CC1 752739315 QLUBHCOXADLLPV-UHFFFAOYSA-N 403.548 2.455 10 20 HECD O=S(=O)(Nc1ccc2nc(N3CCOCC3)oc2c1)c1cccc2nonc12 753924011 KTIMEKGJJCTYQF-UHFFFAOYSA-N 401.404 2.001 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1cn(-c2ccccc2)nn1 755126047 GKAPTZFHQNCXPK-UHFFFAOYSA-N 410.453 2.242 10 20 HECD COC(=O)C1=C(COC(=O)c2cccc(O)c2O)N(C)C(=O)N[C@H]1c1ccccc1 758560652 IKCQKSDMBBYBGQ-KRWDZBQOSA-N 412.398 2.078 10 20 HECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 759570272 RXHDDXIPIPBMMP-NQIIRXRSSA-N 424.549 2.477 10 20 HECD CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1 763747727 GGYUDJIJZACRHX-UHFFFAOYSA-N 402.516 2.176 10 20 HECD COc1cc(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)ccc1OCC(N)=O 765402569 CHLNYUSFLQTTJP-HNNXBMFYSA-N 417.481 2.386 10 20 HECD Cc1csc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 769025539 RMQUHUFNQVCRIR-UHFFFAOYSA-N 413.547 2.238 10 20 HECD C[C@H](c1ccccc1)[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 771423257 RKDUOMPNSXODSG-NQSCKRDGSA-N 424.545 2.352 10 20 HECD COc1cc(OC)cc(N2C[C@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)CC2=O)c1 773740774 SWAHVFLHQPHEKB-UKRRQHHQSA-N 414.458 2.215 10 20 HECD O=C(Cn1c(C(F)(F)F)csc1=O)NCc1ccc(N2CCOCC2)c(F)c1 776285042 IDVDXRKCEBYDER-UHFFFAOYSA-N 419.400 2.221 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCCN(C(=O)C2CC2)C1 777828155 IPLPSUFIDPVFKH-AWEZNQCLSA-N 408.882 2.196 10 20 HECD CNC(=O)[C@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCO1 782086140 RZCPGAPXMRRNTH-QGZVFWFLSA-N 420.307 2.444 10 20 HECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cnc1Br 783627621 FGBMDKHTAOTBQW-UHFFFAOYSA-N 400.254 2.482 10 20 HECD CC[C@H]1CCC[C@@H]1NC(=O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785526989 HPHNRYPGOXHMAA-RXVVDRJESA-N 416.566 2.018 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCc2ccc(N(C)C)cc2C)n1 786734530 BNDJSBQSMXNXFU-UHFFFAOYSA-N 407.540 2.322 10 20 HECD CCOC(=O)C1(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC1 789168183 HPSASCKYAGWZPQ-KRWDZBQOSA-N 401.507 2.128 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1c[nH]nc1C1CC1 789742402 QRHKBZKETYVBCB-UHFFFAOYSA-N 421.480 2.473 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@@H]1c1cccnc1 789798380 GPPQSPDMTOUXOF-LJQANCHMSA-N 412.465 2.037 10 20 HECD C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)C1 789840612 KWFGUNIHWVIOAU-SPYBWZPUSA-N 405.514 2.344 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)[C@H]3OCCc4sccc43)nc12 795481876 RJXYUBMUSOWSLF-PIGZYNQJSA-N 402.476 2.465 10 20 HECD Cc1nc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 804812799 AGRJENILRANKQZ-VIFPVBQESA-N 407.477 2.172 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(-n2cncn2)c1 805745472 BSJRWOBQTCBBQX-UHFFFAOYSA-N 420.517 2.387 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 807095218 BJCKTCDADORFLP-KRWDZBQOSA-N 410.522 2.079 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc2c(n1)CCCC2 807573631 BOSRDKBUPWTUTM-UHFFFAOYSA-N 422.529 2.072 10 20 HECD CCCCN(C)C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 811931420 HCXJSMJAEPQZST-HKUYNNGSSA-N 403.571 2.308 10 20 HECD COCc1nc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 811945810 IAGFGAIDBVTWTO-UHFFFAOYSA-N 404.536 2.498 10 20 HECD Cc1cc(N2CCC[C@@H](N3CCN(Cc4ccc(N(C)C)c(C)c4)CC3)C2=O)n(C)n1 815086476 KMNDTJCEDJVZSK-JOCHJYFZSA-N 424.593 2.416 10 20 HECD CN(C)c1noc(CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 857473032 RSGGOXDMVNBXFF-HNNXBMFYSA-N 407.902 2.208 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C3CCCC3)cc2F)C[C@@H](C)O1 917710039 AAUIOKPAMQXKAL-HUUCEWRRSA-N 412.527 2.413 10 20 HECD CC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@H]2C1 1790126356 VZFGHNMMKQSXCK-BVSLBCMMSA-N 423.513 2.276 10 20 HECD O=C(C1=CCCS1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546429 AWZHQIDZRPQUAW-UHFFFAOYSA-N 403.504 2.358 10 20 HECD Cc1nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cs1 1842531836 JQSRDHFHGZGKFS-GQCTYLIASA-N 415.471 2.099 10 20 HECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)s1 1848177772 ABOACFUMUITJJT-HOTGVXAUSA-N 401.488 2.311 10 20 HECD Cc1cc(C(=O)COC(=O)CCCN2C(=O)CN(C)C2=O)c(C)n1-c1ccccc1 7372780 BJEVKRFOHMOKAH-UHFFFAOYSA-N 411.458 2.494 10 20 HECD Cc1c(CNC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)n(C)c2ccccc12 472235803 AXAPYIIBCVSOOB-UHFFFAOYSA-N 404.536 2.243 10 20 HECD Cn1nnnc1SCCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726568008 YJUAEHWAMCMMHY-UHFFFAOYSA-N 412.466 2.079 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CC(=O)N3CCCC3)cc2F)C[C@H](C)O1 729224931 AKSNVIOPVSEZHE-HOTGVXAUSA-N 406.502 2.203 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)c1 734059699 GDNBZTRQTNSTOM-UHFFFAOYSA-N 421.475 2.172 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c(Br)c1 734072868 RMQKWQCRDJHPDU-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)NCc2ccc(N(C)C)cc2C)CC1 734468066 IESWNMGVRJNJBT-UHFFFAOYSA-N 405.539 2.015 10 20 HECD C[S@@](=O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 735054353 ZLINYWWJQQSQJU-IYNHSRRRSA-N 402.588 2.224 10 20 HECD CS(=O)(=O)c1ccc(OCCNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741086854 NESWNKDKQPIUAZ-UHFFFAOYSA-N 415.515 2.345 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCc3nnc(C(C)C)o3)CC2)cc1 746824304 KUKWCNHPPKGJDG-UHFFFAOYSA-N 415.538 2.463 10 20 HECD CCn1cc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cn1 749226072 IFCCKVWMQZTAMZ-UHFFFAOYSA-N 402.476 2.438 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3c3c(C)n[nH]c3C)CC2)cc1 754080204 CBUROGZDYKINRB-IRLDBZIGSA-N 413.566 2.355 10 20 HECD CCN(CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)C1CC1 759266593 NBFZVPUCNDNKHU-UHFFFAOYSA-N 406.527 2.028 10 20 HECD CC(C)CO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 759566271 AQWGCNKHQPWANW-UYAOXDASSA-N 402.539 2.345 10 20 HECD COc1cc(N2CCN(C[C@H](O)COCc3cccs3)CC2)cc(OC)c1OC 759885757 GUYWBMHCTVSTSJ-KRWDZBQOSA-N 422.547 2.474 10 20 HECD Cc1noc(C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2)n1 760762323 QUSDWQBWYJXGDM-INIZCTEOSA-N 416.459 2.169 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1 762267759 QKWSAFGEOKULGP-HNNXBMFYSA-N 418.877 2.337 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NCc1cccc(Br)c1O 765731717 KSLABDHGTHUIBS-CQSZACIVSA-N 419.341 2.365 10 20 HECD COc1ccc(CN(Cc2cc3c(cc2O)OCO3)[C@H]2CCS(=O)(=O)C2)cc1 768193814 RAIVFFIPUYQHKD-INIZCTEOSA-N 405.472 2.319 10 20 HECD CC(C)(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 772212914 VBYKYSILZDZVBC-UHFFFAOYSA-N 401.536 2.446 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)/C=C/c1ccccc1 773750845 XIWNEMXUUYBNAU-HBIYDYFMSA-N 404.488 2.125 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCc1nc(O)n[nH]1 774915589 XXFFYYDEHBQJJJ-JXMROGBWSA-N 410.502 2.297 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCc2ccccc2CN2CCCC2=O)c1 775369989 DOJSLDOCKLHYRA-INIZCTEOSA-N 411.502 2.490 10 20 HECD C[C@@H](c1ccccc1)N(Cc1nc2c(=O)n(C)c(=O)n(C)c2[nH]1)Cc1ccccc1O 776010881 QBLKTXJSDYQZSZ-HNNXBMFYSA-N 419.485 2.429 10 20 HECD C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cn(CC(=O)N(C)C)nn1 777823569 UTRCQDMDMQROGQ-INIZCTEOSA-N 407.474 2.476 10 20 HECD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(O)c(O)c1 778930365 UUKIFFBXHXDJFG-OAHLLOKOSA-N 419.459 2.174 10 20 HECD Cc1cc(Br)cc(CN[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 779432528 UHUMEEDTXGPTAS-GDBMZVCRSA-N 404.326 2.289 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCCN(S(=O)(=O)c2ccccc2)CC1 779501635 XWJGABOOVFKOTH-CSKARUKUSA-N 402.472 2.034 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 785304845 SASPFKXGJKHRAL-JTQLQIEISA-N 406.822 2.224 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1)c1ccc(N(C)C)cc1 785477750 ABSAZCBHECIPHT-SFHVURJKSA-N 424.545 2.078 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC4(CCO4)CC3)CC2)cc1 800698638 JTRIRNLTJIIONG-UHFFFAOYSA-N 402.539 2.172 10 20 HECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664656 MNXFHZIJUSJXEH-CQSZACIVSA-N 424.517 2.270 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC3CCC(O)(c4cccnc4)CC3)ccc21 803689002 HTDRGIJVFQAZDD-UHFFFAOYSA-N 422.529 2.027 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C[C@@]2(CCOC2)O1 804853265 VIQWDXJNMUWETK-VGOFRKELSA-N 421.513 2.085 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1 807101587 ZNCCRHNYANVNKX-MRXNPFEDSA-N 406.490 2.135 10 20 HECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807672700 GIMSQRXWYFGILE-MRXNPFEDSA-N 402.539 2.037 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOCC(F)(F)C3)cc2F)CC1 812033529 XWFWDFLVXAJJJN-UHFFFAOYSA-N 400.445 2.145 10 20 HECD COCC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCOCC1 813590586 OELKYCIJQLCIJR-UHFFFAOYSA-N 409.502 2.029 10 20 HECD Cc1cc(N/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)n(-c2nc3ccccc3[nH]2)n1 814318278 IASJLNUASJUZPJ-LCYFTJDESA-N 423.502 2.252 10 20 HECD COc1ccc(S(=O)(=O)N2CC(NCc3cc(Cl)c(F)cc3O)C2)cc1 816569916 AVKWFIICIVYCBU-UHFFFAOYSA-N 400.859 2.356 10 20 HECD Cc1ncc(S(N)(=O)=O)cc1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 816825840 OJGDPFQICQGAIL-UHFFFAOYSA-N 402.520 2.300 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1C 900692038 PVHLLOUIWZEVLY-UHFFFAOYSA-N 424.545 2.019 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4nccnc4c3)CC2)cc1 918462057 PIWHUMZQCJBFCY-UHFFFAOYSA-N 405.458 2.316 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CSCc3c(C)noc3C)nc12 918818801 CPMXGTNVVXMPPI-UHFFFAOYSA-N 420.447 2.193 10 20 HECD C=CC(=O)NCc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 919989332 TVAVZJJBGSVVAT-HXUWFJFHSA-N 420.513 2.121 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](C)OCC3CC3)cc2F)C[C@@H](C)O1 920779105 PNHSKFUFCRQWNH-BZUAXINKSA-N 422.497 2.414 10 20 HECD COCCN1C(=O)/C(=C\Nc2cc(C)nn2-c2cccc(Cl)c2)C(=O)NC1=S 920979666 GGFUSJLHLXTSAE-UVTDQMKNSA-N 419.894 2.020 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(Cc2ccccc2)c1 1116571204 QQENBRTYXHPBRS-SFHVURJKSA-N 409.442 2.247 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](CO)CC1CCOCC1 1322043924 OGQNSNBBIIRGPO-GOSISDBHSA-N 423.529 2.011 10 20 HECD Cc1cscc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1797049702 PFKFNIYMFIKKOM-CLLJXQQHSA-N 423.585 2.169 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(O)c1)c1cc(O)c(O)c(Cl)c1 1802032631 HDBJGBKFRTVZET-BTTYYORXSA-N 417.849 2.417 10 20 HECD CC(C)(C)OC(=O)CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500550 NHZTVVMGCKEJSO-UHFFFAOYSA-N 424.881 2.300 10 20 HECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cc(O)n1 1845501110 AREVHXLQJSPYPX-UHFFFAOYSA-N 417.849 2.291 10 20 HECD Cc1cc(C(=O)CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 13145217 KFNVMTCZSHMQRP-GASCZTMLSA-N 405.520 2.033 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c1 22278362 PPFRHQWRYQAZSD-UHFFFAOYSA-N 420.487 2.147 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C(N)=O 727594963 SIJPTTXGSNUDSE-MRXNPFEDSA-N 409.490 2.117 10 20 HECD Cc1ccccc1[C@H](O)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732886515 GLKZIWWVPTZIEZ-GHTZIAJQSA-N 410.518 2.230 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)c1 734551057 FYIJRJJLSXXJKR-UHFFFAOYSA-N 422.850 2.397 10 20 HECD CC1CCC(NS(=O)(=O)CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 735516716 XLOSRLWWINCOAB-KVZIAJEVSA-N 424.563 2.398 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2nc3c(s2)COCC3)cc1F 735585980 QCZTVAUUPLSFIZ-UHFFFAOYSA-N 406.483 2.456 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(CN4CCOC4=O)c3)ccc21 747016670 BXJGMPKXPDUXEE-UHFFFAOYSA-N 422.485 2.276 10 20 HECD O=C(NCc1ccon1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 747515855 VBHOCRCCVRWAJN-UHFFFAOYSA-N 418.387 2.019 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)s1 751319273 UXMDCPJOWJVZJN-VIFPVBQESA-N 401.462 2.297 10 20 HECD CCc1ccc([C@@H](COC)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 754346771 GMSDVJNIRCZJAR-HXUWFJFHSA-N 401.507 2.477 10 20 HECD C[C@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758390341 VMVYPPYKGIGWFC-YLJYHZDGSA-N 415.582 2.260 10 20 HECD CCC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 759421852 NPPLGNXZKPOZKG-SFHVURJKSA-N 419.547 2.425 10 20 HECD CC1(Cn2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nn2)COC1 759958747 ONUWDRGAXAVLCL-INIZCTEOSA-N 419.913 2.068 10 20 HECD COc1cc(N2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)cc(OC)c1OC 760085041 DAOCEMQLSLYNGO-UHFFFAOYSA-N 400.479 2.277 10 20 HECD COc1cc(Cl)cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1O 761193459 DZNFFWZDVSEOIF-UHFFFAOYSA-N 414.897 2.348 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(F)cn3)CC2)cc1 764352905 YGSVTWHKFIQGFT-UHFFFAOYSA-N 401.486 2.241 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 772929311 QYDYNKHXZHYMHG-GJZGRUSLSA-N 400.454 2.398 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)C2CC2)cc1 776076148 JXCJTQGBPMQXRO-UWJYYQICSA-N 421.563 2.163 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(CCC(C)(C)C)CC3)CC2)cc1 779221846 QEANKQNBKLGCCH-QFIPXVFZSA-N 418.626 2.232 10 20 HECD CC[C@]1(CO)CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 779537416 SYSMFHQLTLOAQK-AVRDEDQJSA-N 402.539 2.082 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](CC(F)F)C(=O)O)cc2F)C[C@@H](C)O1 780445841 TZGLXBAYNHKGJL-UHIISALHSA-N 403.401 2.347 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1cc(OC)ccc1O 781520489 ZLCZYOAIMUIDPP-UHFFFAOYSA-N 408.357 2.111 10 20 HECD COC(=O)[C@@H](Cc1ccc(F)cc1)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 783569638 NLVKYMKDRCDIHO-WIYYLYMNSA-N 413.493 2.401 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCCCC3)nc2)cc1 785432679 GWUUTSTUTUZNNO-UHFFFAOYSA-N 409.534 2.461 10 20 HECD CCOC(=O)[C@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 787640036 YBOBZSHBCMLXEO-HXUWFJFHSA-N 420.487 2.015 10 20 HECD O=C(NCCOc1ccc(F)cc1F)C(=O)NCc1ccc(N2CCCC2)cc1 788910924 HOTRHUHTQNKCJS-UHFFFAOYSA-N 403.429 2.376 10 20 HECD Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 789558715 UAXQQLYAXLDHMS-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1F 792104065 HCVRHWHZWGMXRT-SFHVURJKSA-N 415.387 2.140 10 20 HECD COc1cc(N2CCN(CCC(=O)Nc3cccnc3)CC2)cc(OC)c1OC 792287201 PYVINJQQLIAUAM-UHFFFAOYSA-N 400.479 2.258 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCN(CC(F)(F)F)C1 795731055 BYRVOOJDAXMRBF-OAHLLOKOSA-N 401.429 2.138 10 20 HECD CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 799253537 MHASRCYRMZBWAS-UHFFFAOYSA-N 404.398 2.454 10 20 HECD O=C(CNC(=O)c1cccc(O)c1O)Nc1ccc(I)cc1 803492961 OEHMOLQTLAZXHF-UHFFFAOYSA-N 412.183 2.071 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(N3CCCCC3)CC2)cc1F 803661419 AJIAODLPPBTUTA-UHFFFAOYSA-N 404.530 2.421 10 20 HECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](C)S1(=O)=O 804968769 JTGPNHUBORBWJB-CRAIPNDOSA-N 411.593 2.347 10 20 HECD COc1cc(Br)cc(CN2CCC[C@@H]2C[C@]2(C)NC(=O)NC2=O)c1O 809705790 ZUTCAJHPYKLWTR-PXAZEXFGSA-N 412.284 2.116 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(c4nccs4)CC3)cc2)CC1 812832717 BBRRCXQNLAUNPD-UHFFFAOYSA-N 406.577 2.137 10 20 HECD CCc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 917918223 MSXIOIFYNBGINA-UHFFFAOYSA-N 422.478 2.401 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cc(F)cc(F)c1 918442506 NGAJTCGNPOECMO-UHFFFAOYSA-N 403.429 2.428 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncs3)cc2F)C[C@H](C)O1 919042768 ZTKKBWJYYWMEGG-STQMWFEESA-N 407.467 2.369 10 20 HECD C[C@H](OC(=O)c1cnsn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919483490 CSYJYOVEOKQFIG-JTQLQIEISA-N 407.407 2.498 10 20 HECD COc1ccc(CNC[C@H]2CN(C(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)CCCO2)cc1C 1078432536 CBUIJOLUDALZKV-RVEDGADZSA-N 400.519 2.134 10 20 HECD CCOc1ccc(N2CCN(C[C@H](O)COc3ccc(C(=O)OC)cc3)CC2)cc1 1319611646 GQSMRMZSPVMOPU-FQEVSTJZSA-N 414.502 2.434 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1ccccc1)n1cccn1 1342914406 FEWGXAIWGYNFKA-FXAWDEMLSA-N 409.442 2.174 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=CCCS1 1793645100 KUJDOAVUXIGOHK-RRJKNOHSSA-N 416.499 2.476 10 20 HECD Cc1csc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1793748989 FINJSPGPZLZQKY-CLLJXQQHSA-N 423.585 2.169 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccccc1N1CCOCC1 64195005 JWPBMIBWHJRMGL-UHFFFAOYSA-N 411.502 2.405 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(OC(F)F)c2)SC1=S 727176199 HNTPXTIRTVMBHY-FLIBITNWSA-N 408.473 2.038 10 20 HECD O=C(c1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1)N1CCOCC1 727467573 GVOYWZKPYZIRCT-UHFFFAOYSA-N 413.493 2.425 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1c(Cl)nc2sccn12 728584898 OSDWGIVPMCCWGN-UHFFFAOYSA-N 412.924 2.364 10 20 HECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCCCSc1nccs1 733972996 CLSIXYNMAHYHQY-AWEZNQCLSA-N 403.537 2.030 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H](CS(N)(=O)=O)C2)c(C)n1-c1cccc(F)c1 733997980 XYOVPEBWIDVQMG-MRXNPFEDSA-N 407.511 2.416 10 20 HECD O=C(C[C@@H]1OCCc2ccccc21)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 734423367 NWHLHMFTIBMWIA-NRFANRHFSA-N 414.527 2.242 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 741084478 FUOCMYGEGIOSKG-APWZRJJASA-N 409.552 2.319 10 20 HECD CCN1C[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751979 YMEYVCRXFFSBQP-SJLPKXTDSA-N 418.538 2.303 10 20 HECD CC[C@@](C)(CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1OCCO1 748365756 BGQOUNAKNVKMIN-SFHVURJKSA-N 400.497 2.063 10 20 HECD CC(C)(C)C(=O)NCCNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 749532941 LFKHEUVXFXIVKO-UHFFFAOYSA-N 423.425 2.262 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCc4occc4C3)CC2)cc1 752920866 VFCRPDXYBWNSMW-HJWRWDBZSA-N 409.486 2.468 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C12CCC2 754099705 XPLKNIXAYLENBP-YMPZKCBVSA-N 417.594 2.458 10 20 HECD CS(=O)(=O)c1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)s1 761602085 XHFCZKQCORIFIR-UHFFFAOYSA-N 414.892 2.475 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@@H]2C1 766270677 KRYSXSGKAXTQFG-HUUCEWRRSA-N 417.465 2.096 10 20 HECD Cn1cnnc1Sc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1[N+](=O)[O-] 768917710 QKNMGHKOWAZBDC-UHFFFAOYSA-N 401.404 2.216 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)CCCn3ccnc3)cc2F)CC1 769101354 GGIZLTUZXKCRRB-UHFFFAOYSA-N 402.518 2.396 10 20 HECD NS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(F)c1 770556123 YIUSZBBWEDANHO-AWEZNQCLSA-N 408.451 2.000 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 774363905 NNDGXQUXQDTIPJ-UHFFFAOYSA-N 411.458 2.068 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3CSC)CC2)cc1 778388132 AQOPZIIMPDNQAE-QZEKMECESA-N 403.548 2.254 10 20 HECD COC[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)O1 784374184 XVVMFXBVZNXSOC-HUUCEWRRSA-N 408.454 2.136 10 20 HECD CN(C)CCN(Cc1ccccc1F)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427661 FUXIOIDFEVPERA-UHFFFAOYSA-N 400.498 2.098 10 20 HECD C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785433709 OVVAZBKDGUBWOQ-IBGZPJMESA-N 408.546 2.492 10 20 HECD O=C(c1ccc(NCc2ccc(N3CCCC3)cc2)nc1)N1CCS(=O)(=O)CC1 786769415 SQLHIGWTWMRZMS-UHFFFAOYSA-N 414.531 2.165 10 20 HECD C[C@H]1CCCC[C@H]1OCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787987617 LLVDLDHDYKFSFM-GHTZIAJQSA-N 417.550 2.193 10 20 HECD COc1ccc(F)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1OC 788465808 XVLARDVHHCGKQR-UHFFFAOYSA-N 415.465 2.441 10 20 HECD COc1ccc(N2CCN(CCCN[C@H](c3cccnc3)c3nc[nH]n3)CC2)cc1 788505051 JINXVVVMAJQGJH-OAQYLSRUSA-N 407.522 2.100 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cnn(Cc4ccccc4)c3)ccc21 788827814 OHLDQEBYCVMDGF-UHFFFAOYSA-N 417.513 2.246 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)cc1 788975557 QTZUHUHCVGIEMR-UWJYYQICSA-N 405.564 2.320 10 20 HECD COC[C@@H](C)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248970 NLCJGORUOZTIIX-RHSMWYFYSA-N 415.556 2.273 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(OC)c1 803659997 XVLMSFXMNKPSNI-UHFFFAOYSA-N 403.454 2.184 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3cccc(F)c3)N(C)C)ccc21 803685645 HHQNCWXHWLLILI-OAQYLSRUSA-N 412.509 2.243 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]4CN(C)CC[C@H]43)cc2)CC1 805025917 ZXEUYRPRLIKHTD-RBBKRZOGSA-N 412.578 2.482 10 20 HECD Cn1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccccc21 805742874 PPYOCYOAGOKGDL-KRWDZBQOSA-N 422.485 2.103 10 20 HECD CN(Cc1nc(O)c2sccc2n1)C(=O)C(=O)NCCCSc1nccs1 806275668 PPUYPCOWQSNYJA-UHFFFAOYSA-N 423.545 2.110 10 20 HECD CN(C)CCN(Cc1cccs1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291781 NJMNRJIVDGZWPF-UHFFFAOYSA-N 412.559 2.331 10 20 HECD CN(CCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)OC(C)(C)C 807292374 XADMBFIAHLTYFI-UHFFFAOYSA-N 416.522 2.004 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC([C@@](C)(O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673550 VORGMLUZWXKMLR-BFUOFWGJSA-N 415.456 2.482 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 809129393 AMJJYYRSRVJHTK-XMSQKQJNSA-N 403.523 2.054 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3ccco3)cc2F)C[C@@H](C)O1 918203148 VDPBEKCCDZMVBC-HUUCEWRRSA-N 418.469 2.262 10 20 HECD CCO[C@@H](CC)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 920672280 FQYMMTYTMHLSLC-IBGZPJMESA-N 422.503 2.283 10 20 HECD CC(C)[C@H](CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 920921031 QAVZJHOUCOLTDC-KNQAVFIVSA-N 417.598 2.155 10 20 HECD Cc1ncc(Br)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 1320484898 ZKAMGPMXEQYQAD-UHFFFAOYSA-N 409.259 2.453 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)Cc4ccccc4)CC3)cc2F)CC1 1326563422 XERIALZZEOHICF-UHFFFAOYSA-N 410.537 2.464 10 20 HECD COc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601391 BRSWSSZVXVKLFY-CLLJXQQHSA-N 403.460 2.129 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@H]1CCCS1 1804291916 YIMOMONULHNYNM-ZTIJGCPXSA-N 418.515 2.350 10 20 HECD CC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CCCC1 1804334610 UJZTYWSVWKUESM-BTTYYORXSA-N 409.577 2.065 10 20 HECD O=C(c1ccncc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427023 MSHLSAIMORJDGT-GOSISDBHSA-N 410.474 2.435 10 20 HECD CCOc1ccsc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1840982061 DEWAQTJHYHBGAO-UHFFFAOYSA-N 403.460 2.084 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2ccsc2)C1 1843069576 ZXJYYHUODVLGFX-HWKANZROSA-N 414.483 2.324 10 20 HECD O=C([C@@H]1[C@@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250186 SSXKCNWLKYPZPE-GBESFXJTSA-N 423.494 2.198 10 20 HECD C[C@@]1(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)CC1(F)F 1843442899 BPAMJCCIVWWYAR-IBGZPJMESA-N 416.428 2.028 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(F)c(C)c4)n3)CC2)cc1 109342340 OUYBJONTVDXSLL-UHFFFAOYSA-N 410.453 2.145 10 20 HECD C[C@@H](NC(=O)N1CCN(CC(F)(F)F)CC1)c1ccc(N2CCOCC2)cc1 139989526 UETXRGAVYSZJEZ-OAHLLOKOSA-N 400.445 2.474 10 20 HECD C[C@@H](NC(=O)NCCNC(=O)c1cccs1)c1ccc(N2CCOCC2)cc1 140999974 PSNUQTJLMVQZPM-OAHLLOKOSA-N 402.520 2.375 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCC[C@H]1C 726611300 OCCNSBPSTXONGF-CVEARBPZSA-N 406.502 2.251 10 20 HECD CCC1(CC)NC(=O)N(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 731857265 YTQXCXQABZSRFH-MRXNPFEDSA-N 403.479 2.010 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](N3CCCC3=O)C2)c1 732186098 JFJGULPRFLLNGM-OAQYLSRUSA-N 415.534 2.014 10 20 HECD CN(Cc1ccccc1O)C(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1 732702933 DORPOONCALWNTK-UHFFFAOYSA-N 409.430 2.095 10 20 HECD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798643 AMOHQSOTOPDBNN-CYBMUJFWSA-N 422.388 2.143 10 20 HECD O=C(COC(=O)c1ccc(CO)o1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 745383353 KHAJXHQWWPJWIX-UHFFFAOYSA-N 405.362 2.343 10 20 HECD C[C@@H]1CC[C@H](CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)O1 745708367 KTFZTZWQUSQKKI-NVXWUHKLSA-N 408.470 2.169 10 20 HECD COC(C)(C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 745736808 KXBNBJSGHAXENO-UHFFFAOYSA-N 416.501 2.167 10 20 HECD CC(C)(C)OC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 746751572 SDOYQRQNEOLFEL-GOSISDBHSA-N 421.563 2.492 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(CO)CCOCC3)cc2F)C[C@@H](C)O1 749176285 RQIQPHIYNZNAHY-IYBDPMFKSA-N 409.502 2.028 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CN(C(=O)OC(C)(C)C)C1 752755036 JNWSTQCUUMJJOO-UHFFFAOYSA-N 412.870 2.414 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@]3(C)CCO[C@H]3C3CC3)CC2)cc1 753132755 NVRAOOJSCZKJBB-UNMCSNQZSA-N 402.539 2.074 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1F 753738373 IJJMDGKFCIYZET-UHFFFAOYSA-N 421.494 2.047 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@]3(C)CCOC3)cc2F)C[C@@H](C)O1 755122713 ZZUBUICFLIDAQT-LRAJWGHMSA-N 408.470 2.025 10 20 HECD COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 755336356 IDAYOTGHIAANPY-OAHLLOKOSA-N 412.446 2.235 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@]4(CCOC4)C3)cc2F)C[C@@H](C)O1 756903420 TVDVRXFNWNDCLA-YVHKJVDXSA-N 405.514 2.168 10 20 HECD C[S@](=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765926671 OYPHVDYJOWICGU-DEOSSOPVSA-N 411.277 2.147 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(CC(=O)Nc3ccccc3F)no2)c1 770928060 BJXUAXRINSDLHS-UHFFFAOYSA-N 406.395 2.134 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc(C)nc4C)n3)CC2)cc1 771057548 OWYYPTOHBNAXHX-UHFFFAOYSA-N 408.462 2.043 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 772115659 WZWHDORAGGEYIW-BJLQDIEVSA-N 402.539 2.391 10 20 HECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773847057 MSVAWMUSVIXQFG-OAHLLOKOSA-N 417.531 2.422 10 20 HECD C[S@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1F 774274097 YFSIEAYZEGZMHU-NDEPHWFRSA-N 401.463 2.194 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3COc4ccccc4C3)CC2)cc1 778231286 FSXPHVKZZRMEHV-OEIFXAAASA-N 421.497 2.020 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NCc1ccc(O)c(O)c1 778925580 LXZCDPBQQFCVII-UHFFFAOYSA-N 416.455 2.408 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 779481679 QZCIEGHUUGVTMS-VQHVLOKHSA-N 416.499 2.328 10 20 HECD C[C@@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1ccc(N2CCOCC2)cc1 780337542 BHCWDFDBEZAAAN-QGZVFWFLSA-N 400.523 2.238 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](CO)C3CCOCC3)cc2F)C[C@@H](C)O1 782501589 UCIUFCGKSDFLHF-SPYBWZPUSA-N 409.502 2.026 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1 784026601 WADVSIODFVCIJR-UHFFFAOYSA-N 418.515 2.357 10 20 HECD CC[C@H]1Oc2cc([C@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)cc3)ccc2NC1=O 785438343 CLUZPONBCBQOIV-IFXJQAMLSA-N 424.501 2.356 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](c1cccc(F)c1)c1nccn1C 785601984 DJLDQCYYOAJYNT-HXUWFJFHSA-N 423.492 2.489 10 20 HECD CCCN(CCC)C(=O)CCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786661095 OXBLLNPOWBEBIE-UHFFFAOYSA-N 416.566 2.400 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCC3CCCC3)cc2)C1 788225153 OMGFVOWJPRYWGO-IBGZPJMESA-N 414.550 2.091 10 20 HECD O=C(NCCCc1cccc(F)c1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789797924 DHALFBRYPOGVGJ-UHFFFAOYSA-N 417.456 2.167 10 20 HECD COc1ccc(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c(O)c1 794390097 HOZBTDPCCMTWTO-UHFFFAOYSA-N 421.471 2.042 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc4ccccc4c(=O)o3)CC2)cc1 797715223 KTJARMBSSDFBHM-UHFFFAOYSA-N 407.470 2.354 10 20 HECD COC(=O)[C@H](C)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 802166668 HNQFMEMWNKSHCK-HIFRSBDPSA-N 422.503 2.360 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCN(C2CCC2)C1 803663132 KDOBERMXLMDTLG-WBVHZDCISA-N 404.530 2.277 10 20 HECD O=[N+]([O-])c1cc2c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ncnc2s1 804419027 BMWVDKOHWPDMDA-UHFFFAOYSA-N 419.488 2.446 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 807749548 VJDDHTBKFQXPPS-RXVVDRJESA-N 408.546 2.490 10 20 HECD CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1 808108110 RXDMMQARRADLMU-UHFFFAOYSA-N 400.434 2.285 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H](C(=O)NC2CC2)c2ccc(F)cc2)c1 920636401 TYUZWPNYQSMKGY-KRWDZBQOSA-N 422.434 2.080 10 20 HECD CN1CCN(c2ccc(CNC[C@@]3(O)CCN(Cc4ccccc4)C3)cc2F)CC1 1323122772 BLGMPDLPJZDUEI-DEOSSOPVSA-N 412.553 2.304 10 20 HECD Cc1nc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)no1 1324670816 AGCZKFFYYRIRIQ-SECBINFHSA-N 408.461 2.437 10 20 HECD COc1cc(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796604831 QPFHVSAJAAYYKF-BJWYYQGGSA-N 411.458 2.375 10 20 HECD CC(C)CC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837645779 QJTHQVPTRXCAHU-UHFFFAOYSA-N 405.495 2.151 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc(Cl)ncn2)C1 1844573973 CDNLTXLDYCWNBV-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H]2CNC(=O)C2)C3)cc1 1845399294 LJICPYDNVFHJBI-IBGZPJMESA-N 420.513 2.047 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(Cc4cccc(C)c4)CC3)CC2)cc1 22770852 USPIAOMQIGDPJJ-UHFFFAOYSA-N 422.573 2.470 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4cccc(OC)c4)CC3)CC2)cc1 69193170 DHPSPOPZDBMRRY-UHFFFAOYSA-N 424.545 2.175 10 20 HECD O=C(CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1 303523643 CZGHYEZLSQIXIY-UHFFFAOYSA-N 400.454 2.490 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccccc3F)cc2)C1 725825538 PEOFXICNLIZPHW-MRXNPFEDSA-N 405.495 2.147 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 726237643 YSTXRGFSYIWCDF-IBGZPJMESA-N 402.539 2.361 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2cc3c(cc2O)CCC3)c(O)nc1=O 726588727 FMUOXPNBKLXETL-UHFFFAOYSA-N 402.495 2.179 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CCN(C)C)cc1)c1ccc(N2CCOCC2)cc1 728141347 NPURDEWZQGWQBM-GOSISDBHSA-N 424.545 2.443 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4cnccn4)n3)cc2)C1 728245344 SLRQZEYOFXQUPJ-OAHLLOKOSA-N 422.514 2.232 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1O 729859293 LVJMMNLJNDXMLY-INIZCTEOSA-N 408.458 2.446 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1CCN(CC(F)(F)F)C1=O 732571473 DKHBZHZROHPHKV-OAHLLOKOSA-N 416.469 2.202 10 20 HECD COC[C@@]1(C)NC(=O)N(CN(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 733297936 FERGYCFVZYVIRJ-QGZVFWFLSA-N 402.417 2.031 10 20 HECD CNS(=O)(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 733349042 SYIAPDHZDUGSBW-IBGZPJMESA-N 408.568 2.146 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2CCCCCC2)CC1 734687553 IJPIGXVDLYHJNA-UHFFFAOYSA-N 415.582 2.291 10 20 HECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 734943451 YTUKPJCNIWEESR-LAUBAEHRSA-N 422.533 2.364 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1occc1Br 751353603 IONAVYIXRNHLAL-UHFFFAOYSA-N 413.293 2.207 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc(-c3ccc(Cl)cc3)n[nH]2)c1 753413691 DFHQSIYFMNECOZ-UHFFFAOYSA-N 407.839 2.455 10 20 HECD COc1ccc(N2CCN(Cc3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1F 753858565 WMJJSFBMLKRUGD-UHFFFAOYSA-N 407.511 2.407 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cnn(-c2ncccn2)c1 754922252 OLYJNNLXPLZYAR-UHFFFAOYSA-N 419.489 2.250 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)cc2F)CC1 757681456 CEKUPPVDZUPBRM-OXQOHEQNSA-N 403.546 2.250 10 20 HECD COc1cc(N2CCN(C(=S)NC[C@@H]3CCCCO3)CC2)cc(OC)c1OC 758921727 LPQCFJCYYGZEJD-INIZCTEOSA-N 409.552 2.278 10 20 HECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1S(C)(=O)=O 758964000 MZBYGLNBHIKOMZ-UHFFFAOYSA-N 403.504 2.062 10 20 HECD COc1cc(N2CCN(C(=O)NCCN(C)C3CCCC3)CC2)cc(OC)c1OC 759266293 MCUOHJAEDQDLJU-UHFFFAOYSA-N 420.554 2.418 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@]12CCCO2 759323880 UWKLOTRFMOXSOB-QZNHQXDQSA-N 417.550 2.421 10 20 HECD COc1cc(N2CCN(C(=O)CNC(=O)CC3CCCC3)CC2)cc(OC)c1OC 759403648 CUBLILHLQGEHCJ-UHFFFAOYSA-N 419.522 2.058 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)cc(OC)c1OC 760097319 QHABJIMDJBWHRS-DLBZAZTESA-N 418.538 2.171 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCO[C@@H](C4CC4)C3)CC2)cc1 765320166 GEGBYNYDPPUEAH-SIKLNZKXSA-N 416.566 2.464 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc2nccnc2c1 765928416 YTWDYZWQMQBZBI-UHFFFAOYSA-N 401.220 2.353 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncccc1C(F)(F)F 770680758 WMWUBABIPXPYJT-UHFFFAOYSA-N 413.421 2.265 10 20 HECD COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1F 770727474 YIEBLKOXYPQWAZ-UHFFFAOYSA-N 415.465 2.298 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773750749 WLLIDTXRSRPYJO-YJBOKZPZSA-N 418.515 2.307 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N(C)C3CCCCC3)CC2)c1O 774878622 UQXUYQPTVIPZPL-UHFFFAOYSA-N 420.510 2.218 10 20 HECD CC[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(Cl)c(Cl)c1O 775499294 QLCILCDDLIQYCF-CQSZACIVSA-N 410.367 2.317 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](COC)c3ccc(F)c(F)c3)nc12 775535000 COQSMKIGOJKGEA-INIZCTEOSA-N 406.389 2.367 10 20 HECD C[C@H](CCO)C1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC1 776041472 JIUMCWLJUHPUDT-IEBWSBKVSA-N 416.566 2.376 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1 785427674 GFDBKJCWGKCYLI-UHFFFAOYSA-N 418.501 2.141 10 20 HECD CCCN(CCCN(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 786712144 LLIJSSNOOKBRET-LJQANCHMSA-N 403.571 2.262 10 20 HECD COc1ccc([C@H](CNC(=O)NCc2ccc(OC)cc2O)N2CCOCC2)cc1 792788410 DMILEIXBCQTJOF-FQEVSTJZSA-N 415.490 2.282 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C(F)(F)F)OC(C)(C)C3)nc12 795059678 DBJMPQVTFVQYMQ-LBPRGKRZSA-N 402.373 2.153 10 20 HECD Cc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)co1 801390830 PPSRBQCRYMAIEB-STQMWFEESA-N 405.426 2.209 10 20 HECD CCc1nc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 803296455 CSKJNHVYSFAEJW-OAHLLOKOSA-N 416.547 2.078 10 20 HECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803658676 BMNZIFHDUBNHEW-CQSZACIVSA-N 403.454 2.100 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 804278196 QCPMGBRTQFHBHG-NRFANRHFSA-N 408.546 2.349 10 20 HECD CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807679272 PLBZZSLREIGORR-BQFCYCMXSA-N 418.538 2.303 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCC[C@H]2COC(=O)N[C@@H]2CCOC2)c1O 809707706 MGHAXJMGBRTZBK-CABCVRRESA-N 409.439 2.179 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOCC(F)(F)F)cc1C 811683126 NVOXJEDNNPLRNI-UHFFFAOYSA-N 404.432 2.077 10 20 HECD CCS(=O)(=O)N[C@H](CCSC)C(=O)NCc1cc(Cl)cc(Cl)c1O 813684992 AEYUBPZLBWEVKA-GFCCVEGCSA-N 415.364 2.376 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(Cn4cccn4)o3)CC2)cc1 915266173 DPYPHWRPNFSTBR-UHFFFAOYSA-N 423.517 2.475 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1 918430312 WSRCTARRCBHFSD-UHFFFAOYSA-N 417.531 2.500 10 20 HECD Cc1ccc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918464775 ZVATXPCSVJUADE-INIZCTEOSA-N 412.465 2.091 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 920870312 QBVRTVREFRNCKM-CYBMUJFWSA-N 407.448 2.177 10 20 HECD CN1CCN(c2ccc(CNc3cccc(CN4CCNC(=O)C4)c3)cc2F)CC1 1324704720 SKMSBPCNGLXGEG-UHFFFAOYSA-N 411.525 2.121 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ccnnc3)CCC2)cc1)c1cc(O)nc(O)c1 1788424189 FLURJBBIQWOUDK-UHFFFAOYSA-N 405.414 2.344 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1Cl)c1cc(O)nc(O)c1 1798742065 DGYHULXYGVSQHC-CLLJXQQHSA-N 402.838 2.107 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769459 MZZCXMXHQAMFBF-VGXVWSLXSA-N 422.909 2.391 10 20 HECD C/C=C/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728637 JYBFFQCODKWEGT-MJMJCPQHSA-N 400.460 2.307 10 20 HECD O=C(c1ccnc2ccccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249517 SDWJNXBMOHRYBQ-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N(Cc1ccco1)Cc1ccccc1O 255377861 DYVHORRVGHLXSG-VUEDXXQZSA-N 406.438 2.321 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccc(OC(F)F)cn2)n(C)c2ccccc12 511069009 MAYPUTMGIFZHFA-UHFFFAOYSA-N 402.401 2.416 10 20 HECD COc1ccc(CNC(=O)NCc2c(C)c3ccccc3n2C)cc1S(N)(=O)=O 673567491 GZPNOJHHVYDEJX-UHFFFAOYSA-N 416.503 2.142 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1F 731346535 LQWBABGOLXDVSG-UHFFFAOYSA-N 419.478 2.133 10 20 HECD COc1cccc(SCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 733136345 TYDPUMWGWBOYKV-UHFFFAOYSA-N 420.556 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)cc1 733632196 XJLWWFOZUWBPFE-UHFFFAOYSA-N 411.506 2.460 10 20 HECD CSC[C@@](C)(O)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 738972162 ZWSMNEKERJZWHF-KRWDZBQOSA-N 421.485 2.455 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCOC[C@H]3CCOC3)cc2F)CC1 740920206 FPUKCWLUHVRUBM-LJQANCHMSA-N 422.545 2.210 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(N2CCOC2=O)cc1 741100095 SGQMIQUCAGSGSS-UHFFFAOYSA-N 406.442 2.274 10 20 HECD COC(=O)CCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748027410 LXIJNBZXIBBNSV-UHFFFAOYSA-N 412.489 2.280 10 20 HECD CN(C)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 748466437 IQLKUAKQXTZMHG-LJQANCHMSA-N 409.534 2.454 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(Cc2ccccc2)no1 752815538 KRHCRTSLWPYDRF-GFCCVEGCSA-N 416.459 2.229 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)cc1F 753370087 CCYQQFYBKJITHV-OAHLLOKOSA-N 423.485 2.453 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(-c2ncco2)c1 754488686 IXUCACPOEPTOPG-UHFFFAOYSA-N 406.442 2.433 10 20 HECD CCc1noc(CC)c1CC(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 756477609 XDFIBJMGELZYEX-UHFFFAOYSA-N 415.490 2.243 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(-n4cccn4)ccn3)CC2)cc(OC)c1OC 759223644 SJHKJYQAPIMZTR-UHFFFAOYSA-N 423.473 2.256 10 20 HECD NS(=O)(=O)c1ccc(CCC(=O)NCc2cccc(Br)c2O)cc1 765753644 OSPVKOOVLUBZOP-UHFFFAOYSA-N 413.293 2.051 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 770494307 VGQPGXSGNPWNSP-LJQANCHMSA-N 409.552 2.273 10 20 HECD Cc1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1OC(F)F 777875037 JQMRNKHDWQCWFO-FLIBITNWSA-N 422.500 2.347 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3ccccc3C)CC2)cc1 778350281 QLUGAHGADHXTEU-GJCOWUBNSA-N 423.513 2.058 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1O 778853115 JAYLRVOEGQNPPU-UHFFFAOYSA-N 402.422 2.150 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc(F)ccc3[N+](=O)[O-])c2)CC1 780407577 LWRNYKRWHBNXRL-UHFFFAOYSA-N 422.438 2.203 10 20 HECD COc1ccc(Cn2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)n2)cc1 785296559 GHYYGHROVWUFQL-CQSZACIVSA-N 424.457 2.037 10 20 HECD O=C(COc1cccc(I)c1)NCCc1ccc(O)c(O)c1 787444013 FKSFKMLWISWZMM-UHFFFAOYSA-N 413.211 2.440 10 20 HECD Cc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788332517 OOFSLPFLBWEOGX-UHFFFAOYSA-N 411.502 2.033 10 20 HECD CCO[C@@H]1C[C@](O)(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 788756316 KECRQGJVMQFGRI-NBCNXNJRSA-N 405.539 2.450 10 20 HECD COc1ccc(N2CCC(NCc3ccc(S(=O)(=O)CCO)cc3)CC2)cc1 790760440 WSKBMIVQTHMWHE-UHFFFAOYSA-N 404.532 2.220 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(O)c1 794378358 FAFYZIKYNJUIHA-CYBMUJFWSA-N 405.432 2.292 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)nc12 795122046 NHECYVSJAYTBDT-OKILXGFUSA-N 417.510 2.079 10 20 HECD O=C(COC(=O)[C@H]1CCC(F)(F)C1)NCc1ccc(N2CCOCC2)c(F)c1 796369026 FTTVIFGXXMBHTO-AWEZNQCLSA-N 400.397 2.257 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(OC)c(C)c1OC 796769690 UUISERIBOHYMBV-UHFFFAOYSA-N 419.453 2.481 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCCC12CCOCC2)c1ccc(N2CCOCC2)cc1 803304578 ZQYWQXUWLGCFLJ-PXNSSMCTSA-N 415.534 2.166 10 20 HECD C[C@H](NC(=O)C(=O)N1CC(C)(C)OC(C)(C)C1)c1ccc(N2CCOCC2)cc1 803305054 JEIUVDXAZRGSEW-INIZCTEOSA-N 403.523 2.116 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CN1Cc1ccccc1 803664720 PQJJMZJSRZCIKC-LPHOPBHVSA-N 412.509 2.287 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1 804967317 NOZLMCWRIHCJSW-OAHLLOKOSA-N 424.489 2.154 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCN(CCO)C(C)(C)C3)cc2F)C[C@@H](C)O1 806457562 OJDCVBSWGYBIFN-IAGOWNOFSA-N 422.545 2.037 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)c1 807678879 LSVSYZRYFUNKGL-QGZVFWFLSA-N 410.518 2.287 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1 812500607 BCJKSHCURPLYOI-UHFFFAOYSA-N 413.540 2.400 10 20 HECD C[C@H]1[C@@H](N(C)C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816767493 ZVJMAHOMDIMHOQ-WFASDCNBSA-N 409.533 2.419 10 20 HECD CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442461 LFIAXQQZNHDIHV-UHFFFAOYSA-N 409.486 2.353 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796001511 GPAXRPIYRJXUDB-RLDUGPAZSA-N 409.914 2.376 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1 1823819145 UWNBGWXGDPHSQV-ROUUACIJSA-N 417.506 2.295 10 20 HECD CC(C)N(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832418328 CZBHHIYEIGSPTD-GOSISDBHSA-N 418.538 2.066 10 20 HECD O=C(CCCn1ccnc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502392 SJBZFWPWIWAQHL-UHFFFAOYSA-N 418.881 2.245 10 20 HECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 60750353 LUZRYHPZAASTEH-UHFFFAOYSA-N 408.502 2.334 10 20 HECD CC(=O)NC1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 725876720 SVGMXUBZZMQWJQ-UHFFFAOYSA-N 406.502 2.033 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c1O 729859170 ILDNMQURGOTDLN-UHFFFAOYSA-N 419.231 2.076 10 20 HECD C[C@H](NC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 735748218 CEFRZFAHOBNQQU-ZDUSSCGKSA-N 422.482 2.192 10 20 HECD C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1ccccc1SCC(=O)N1CCCC1 736269786 GSGNDKZTZRBSPO-LSDHHAIUSA-N 410.561 2.049 10 20 HECD CN(C)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 743868944 IJYRKHWQFAJKLJ-UHFFFAOYSA-N 405.495 2.057 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743956334 QWARJKNVSYOTLV-UHFFFAOYSA-N 412.442 2.078 10 20 HECD CN(C)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 748039287 XMSIMRDWILKWKO-AWEZNQCLSA-N 409.533 2.421 10 20 HECD C[C@]1(c2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)NC(=O)NC1=O 748041339 YJSBQZNMMFSUAP-WZONZLPQSA-N 423.469 2.268 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CSCCS3)cc2)C1 752880374 ITHFEZJESBHPCV-NVXWUHKLSA-N 408.593 2.036 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1 753642428 DFTRNPYIONTKKA-CYBMUJFWSA-N 424.544 2.234 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)cc2F)CC1 753926834 YBQRUWKDCARGHI-WMZOPIPTSA-N 403.546 2.392 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C4CCCCC4)CC3)CC2)cc1 754098391 RIFQPENMSYBSOG-QHCPKHFHSA-N 416.610 2.128 10 20 HECD Cc1noc([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 754689984 SNWGONRDHZVXJC-HZSPNIEDSA-N 405.474 2.098 10 20 HECD O=C(Nc1cnn(-c2ccccn2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 754923941 UETABKBKDVDJAL-GOSISDBHSA-N 421.457 2.119 10 20 HECD CN(C)c1cccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 755057997 ASMKSDCABRXLSO-UHFFFAOYSA-N 401.486 2.247 10 20 HECD Cc1cc(CC(=O)N(CCO)CCN2CCOCC2)c(C)n1-c1ccc(Cl)cc1 757103841 FHDQTQWRAXIACG-UHFFFAOYSA-N 419.953 2.443 10 20 HECD COc1ccc(CCNC(=O)[C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 759580340 QTGYTEZTWBQFIU-PIZKADEWSA-N 415.442 2.419 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3(N4CCOCC4)CC3)cc2F)C[C@@H](C)O1 764762415 FIQFEBREKDICTA-IAGOWNOFSA-N 420.529 2.103 10 20 HECD O=C(NCCN1C(=O)c2ccccc2C1=O)NCc1cccc(Br)c1O 765476786 LLERNOJBJLFVLZ-UHFFFAOYSA-N 418.247 2.250 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@@H](CCSC)C(=O)N(C)OC)CC2)cc1 765877935 PJGOHBGOHIMRKW-SFHVURJKSA-N 424.567 2.058 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3cc(Cl)ccc3OCC(N)=O)ccc21 766792949 MLVDPFIDRAMUAG-UHFFFAOYSA-N 423.922 2.065 10 20 HECD O=C(CCn1cnc2ccc(Br)cc2c1=O)NCc1ccc(O)c(O)c1 768913942 IKCUUDOEKUUDFU-UHFFFAOYSA-N 418.247 2.277 10 20 HECD C[C@]1(c2cccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2)NC(=O)NC1=O 769038117 BARXEHRNQJXKFL-WZONZLPQSA-N 423.469 2.268 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2Cn2cnc3ccccc32)c1 770122624 VJQVGXYLTSMERV-HNNXBMFYSA-N 414.487 2.418 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(Br)n3)cc2)C1 770280941 OOANXJIVTBWWIY-AWEZNQCLSA-N 417.307 2.476 10 20 HECD Cn1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(C(F)(F)F)n1 773757156 TXIDIWMYQKAOKZ-UHFFFAOYSA-N 421.173 2.162 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCC[C@H]3OC)CC2)cc1 774789585 TWRBJXLNYYKUDY-WIYYLYMNSA-N 404.555 2.322 10 20 HECD CCN(C)C(=O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 775951812 PQMJOGTVTWPEEH-JLHYYAGUSA-N 411.574 2.324 10 20 HECD COc1ncc(/C=C/C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)cn1 776307301 VZXDWTDSHZDODX-JBVUFVISSA-N 408.458 2.305 10 20 HECD CC[C@H](CSC)N(C)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778420200 RXQGQHUIQHYLBM-SXSDINLZSA-N 405.564 2.500 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC[C@H](OCCO)C1 780388222 XDBAPWZFQCXZIX-SFHVURJKSA-N 413.465 2.440 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCC(=O)[C@H](C)C3(C)C)nc12 781312489 GCGVOEYLSBMSJV-FZMZJTMJSA-N 403.435 2.296 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(C)cc(Br)c3=O)CC2)cc1 783128309 YPWBJBPKCZQYAF-UHFFFAOYSA-N 420.307 2.277 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cc3ccc4c(c3)NC(=O)C4)cc2F)CC1 783963185 CAVDSEKZLNFBFN-UHFFFAOYSA-N 410.493 2.321 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(Cn2ccnc2)c1 787297744 KKBGJGQAGMULCY-UHFFFAOYSA-N 415.544 2.303 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1 788979664 ZNRMREODPZKVFG-WMZOPIPTSA-N 418.538 2.132 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCCO1 789825652 NIRJXRCJNADYLM-XYJFISCASA-N 421.513 2.083 10 20 HECD O=C(NCCc1ccc(F)cc1F)C(=O)NCc1ccc(N2CCSCC2)cc1 789862519 UPOSNXZQBOUKLY-UHFFFAOYSA-N 419.497 2.493 10 20 HECD CCc1cc2nncn2c(SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 794487833 CXBQWTAIIVWKBD-UHFFFAOYSA-N 412.519 2.136 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)ccnc2Cl)cc1 797430973 DNCWIEMTZKETOZ-UHFFFAOYSA-N 411.292 2.065 10 20 HECD CCOC(=O)CC1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 804851409 BDQRPMSIHZXWJA-UHFFFAOYSA-N 421.513 2.480 10 20 HECD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCN(Cc2ccccc2)C1 806280038 IDVPJFUSQJIMEW-QGZVFWFLSA-N 418.588 2.474 10 20 HECD O=C(NC[C@H]1CSCCS1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806479433 XPUCULXQBFZUNU-INIZCTEOSA-N 406.529 2.479 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 806520791 WLPNTHBLRUIYNZ-INIZCTEOSA-N 416.522 2.099 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc[nH]1 806524927 ORIFTDIEYCYQLM-KRWDZBQOSA-N 409.534 2.040 10 20 HECD CCOC(=O)N1CCC([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807677202 MRDCRDLMANLWAY-HOTGVXAUSA-N 418.538 2.303 10 20 HECD CN(Cc1ccoc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808856349 RUYDSBDPSNAJBN-UHFFFAOYSA-N 410.518 2.086 10 20 HECD NS(=O)(=O)c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] 809348720 FBGYABXBLNGGAS-UHFFFAOYSA-N 420.491 2.063 10 20 HECD Cc1cc(C(=O)COC(=O)c2cc(F)c[nH]2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815390780 WUCNBEIFIRSMPZ-UHFFFAOYSA-N 419.434 2.248 10 20 HECD O=C(CCn1cc(Br)cn1)NCc1ccc(N2CCOCC2)c(F)c1 917712985 YWOXUAAJPCZTDN-UHFFFAOYSA-N 411.275 2.328 10 20 HECD COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CO2 917833931 VSHXJCBFLJUDBR-PKOBYXMFSA-N 423.513 2.264 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](C)n3nc(C)cc3C)nc12 919314796 MYNYCBKSJVDDKN-CYBMUJFWSA-N 401.423 2.119 10 20 HECD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2c(Cl)ccc3nonc23)C1=O 1117507274 GBIFGODUUBJXJP-GOSISDBHSA-N 417.784 2.421 10 20 HECD CC(=O)Nc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603573 SRLFRZKLXLSILO-MUJYYYPQSA-N 424.457 2.017 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)CCC(N)=O)C3)cc1 1845399330 QHPDPOOYYPWVKK-UHFFFAOYSA-N 408.502 2.177 10 20 HECD Cc1c(CNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)n(C)c2ccccc12 473276646 ZIZDWKURTBUYIS-UHFFFAOYSA-N 420.517 2.022 10 20 HECD CSc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 727228756 ZAHVUYVEVHNJAT-UHFFFAOYSA-N 414.531 2.267 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 729535260 OIKSPSYPRDXJRV-MKVSYHDVSA-N 420.531 2.485 10 20 HECD CCOCCN1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 729994044 DGPUZUZEUBIHIZ-UHFFFAOYSA-N 421.497 2.055 10 20 HECD C[C@H](NC(=O)c1sccc1S(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 731979440 FOOWWQDSSYQQQP-AWEZNQCLSA-N 423.560 2.326 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H]3CCCN(c4ccccc4)C3=O)nc12 734489046 SHILBFCQOOMWGO-GOSISDBHSA-N 423.473 2.239 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1 739080175 KOKWZEDXTJFKIY-LSDHHAIUSA-N 413.474 2.442 10 20 HECD CC(=O)[C@H](Cc1ccccc1)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 741732688 IHRQLFSMYSAPNG-QHCPKHFHSA-N 409.530 2.272 10 20 HECD CCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C)c1ccc(OC)cc1 746109001 HHXRAHKVLOBVOD-CQSZACIVSA-N 403.504 2.147 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3c3c(C)n[nH]c3C)CC2)cc1 754080207 CBUROGZDYKINRB-RBBKRZOGSA-N 413.566 2.355 10 20 HECD COC[C@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 756655954 RMSWROJPZSVXAU-CYBMUJFWSA-N 422.503 2.140 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCc3cccc(Br)c3O)ccc21 765736527 NGIUTWIIRYQXTK-UHFFFAOYSA-N 418.247 2.108 10 20 HECD CC(C)C(=O)NCCN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767767642 FJWYYFUBDLABLE-UHFFFAOYSA-N 407.470 2.105 10 20 HECD CC(C)C(=O)NCCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767768761 NNTUPWHUOANNCI-HNNXBMFYSA-N 421.497 2.493 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCOC4(CCC4)C3)CC2)cc1 768522355 MHKNIEGKPYKJCG-GOSISDBHSA-N 402.539 2.218 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CS(=O)(=O)N(CC)CC 769292986 XDPFTGYEHUTPIP-UHFFFAOYSA-N 407.330 2.175 10 20 HECD CCN1CCN(CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 771057316 HXFPJKOQHVNJMM-LJQANCHMSA-N 408.974 2.154 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773740643 SCGNBLPZXDYEIU-ZDUSSCGKSA-N 408.458 2.232 10 20 HECD CN(C)CCCNS(=O)(=O)c1ccc(NCc2ccccc2O)c([N+](=O)[O-])c1 774524388 RUJLWMFNXCFGRY-UHFFFAOYSA-N 408.480 2.143 10 20 HECD Cc1nc2ccccn2c1[C@@H]1C(=O)NCCN1Cc1ccc(N2CCN(C)CC2)cc1 775695419 XGUXUFWTDIKCEJ-HSZRJFAPSA-N 418.545 2.068 10 20 HECD COc1cc(O)c(CNCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1OC 776174309 LZFCMIMGMRIUPL-UHFFFAOYSA-N 412.430 2.061 10 20 HECD CCCCCN(CC(N)=O)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 780339094 SUMDCZOOJCYWGG-UHFFFAOYSA-N 407.470 2.378 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cnc2c(c1)CCCC2 782781413 NWAFWYSQTCZHFO-UHFFFAOYSA-N 408.502 2.394 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(F)(F)c3ncccc3C)nc12 787209717 QLJNHYOTQFSJMV-UHFFFAOYSA-N 406.345 2.150 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nc(C(C)C)nc3O)cc2)CC1 787321415 FIPTYQBVHWLHST-UHFFFAOYSA-N 411.506 2.213 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)cc1 788974955 LQTGTJMWJCTWTO-IBGZPJMESA-N 403.523 2.341 10 20 HECD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)C1 789171198 JNBYFIXDMWWASJ-GOSISDBHSA-N 401.507 2.396 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)Cn1cccn1 790229849 WRWKZPLKHXCOAQ-CYBMUJFWSA-N 423.311 2.152 10 20 HECD CC(=O)c1cc(F)cc(CN[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 791622861 FOYMWHOWZOZUFW-IBGZPJMESA-N 417.485 2.044 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@@H]1CC=CCC1 793820369 RXENFLUAPZJUSW-LJQANCHMSA-N 410.562 2.307 10 20 HECD CCN(C)Cc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 793868305 MYSUVHQXXPSQDH-UHFFFAOYSA-N 400.498 2.276 10 20 HECD Cc1cc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)on1 803309501 YOIJCSXJEQYEMC-LPHOPBHVSA-N 412.490 2.361 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(C(C)C)no3)CC2)cc1 804316292 AHASSRICBDAZRP-UHFFFAOYSA-N 400.479 2.208 10 20 HECD Cc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 916677014 ZHXLDYTZSKOYBD-UHFFFAOYSA-N 402.516 2.233 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H]4OCCC[C@H]4C3)CC2)cc1 1319263014 QAPOFYVOAKHFOU-UGKGYDQZSA-N 416.566 2.418 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)no1 1796932671 PTTUUCQEYXWPMO-ACHSLPGTSA-N 421.457 2.028 10 20 HECD CN1CCCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712858 XOTKZDBTSKWVQQ-JYYAWHABSA-N 421.925 2.487 10 20 HECD CC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708592 JEZKEYDTQIESLN-VIFPVBQESA-N 409.851 2.023 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2)CC1 1825821642 AEYIMKUHJQDLPK-SFHVURJKSA-N 410.474 2.435 10 20 HECD CC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837673013 OINUKTSJFKYAEA-UHFFFAOYSA-N 405.495 2.151 10 20 HECD CC(C)n1cnc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1843537052 IYUNXDTZCTVORF-UHFFFAOYSA-N 419.869 2.054 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CC[C@@H]2CCOC2)C1 1846729572 NGLMQVUTUBKYNY-CYBMUJFWSA-N 408.882 2.385 10 20 HECD O=C(c1ccccc1O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034058 YLUZKVQLWAXJJT-VQHVLOKHSA-N 410.426 2.039 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 7097233 MOKYVHSCFLUFFV-UHFFFAOYSA-N 418.515 2.280 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)cc1F 15224791 KHDIOFBSFBBMBC-UHFFFAOYSA-N 423.448 2.172 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3-n3cnnn3)cc2F)C[C@@H](C)O1 108287589 MHDBPTZWQGNXCZ-GASCZTMLSA-N 410.453 2.345 10 20 HECD COCc1nc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cs1 147419001 YIMHGBSRIOCBQK-UHFFFAOYSA-N 404.536 2.240 10 20 HECD COc1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1-n1nnnc1C 542024568 SFYPBJISQBCDBJ-UHFFFAOYSA-N 409.450 2.476 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cc3nnc(O)c4ccccc34)cc2F)CC1 730194590 MPOHXIFSNVTBKI-UHFFFAOYSA-N 423.492 2.475 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(N(C)S(=O)(=O)CC)CC2)cc1 731359720 NXBXNXIJLFXGND-UHFFFAOYSA-N 410.584 2.488 10 20 HECD COC[C@@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 733196317 APTJWEHSSOQTIN-ZHALLVOQSA-N 407.530 2.414 10 20 HECD COc1cccc(CNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c1O 745615794 FTXUONUVGKSGSP-UHFFFAOYSA-N 422.526 2.143 10 20 HECD COc1cc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1O 750039624 BNCGSZNZCFHZEU-UHFFFAOYSA-N 417.481 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(OC[C@H]4CCCO4)CC3)CC2)cc1 751488503 YFMSGDPCLKIGCN-JOCHJYFZSA-N 417.550 2.004 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3c3cn(C)nc3C)CC2)cc1 754058475 AWTJLASFVZVZKJ-NZQKXSOJSA-N 413.566 2.057 10 20 HECD C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc([N+](=O)[O-])ccc1O 756454135 AVYCNSHDUHOMGX-IUODEOHRSA-N 401.419 2.276 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@]4(CCOC4)C3)cc2F)C[C@@H](C)O1 756903419 TVDVRXFNWNDCLA-JKSBSHDWSA-N 405.514 2.168 10 20 HECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 761057906 NWCQBRPESAIOLY-LLVKDONJSA-N 424.450 2.149 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 765802399 QKRLWCLOEDYMBI-KDOFPFPSSA-N 403.504 2.014 10 20 HECD CCC[C@@H]1C(=O)NCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 766257100 NTCYBXISWGFLIU-GOSISDBHSA-N 405.454 2.001 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] 769751851 HVFDDWXZOAYASW-UHFFFAOYSA-N 419.503 2.436 10 20 HECD CC(C)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 769976008 YBVIYPGSHCYRKN-AWEZNQCLSA-N 400.497 2.250 10 20 HECD CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)c2)n1 774362705 DVNCZNOJUPIUAG-UHFFFAOYSA-N 410.430 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C[S@@](C)=O)c3ccccc3)CC2)cc1 775616458 BRZOBXCWFVHKEA-ONOMSOESSA-N 415.559 2.053 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)[C@H]4c5ccccc5CCN4C3=O)cc2)C1 777609247 BWCGRMHAMNETAA-GHTZIAJQSA-N 418.497 2.450 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(-c3ccccc3)nc2)cc1 780367088 MGLQYTXDJQRIIQ-UHFFFAOYSA-N 404.473 2.316 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1ccccc1F)c1nccn1C 785601947 CVUGXYPJAIIDES-FQEVSTJZSA-N 423.492 2.456 10 20 HECD CCOc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 787192804 NNOWBKQZCXZQKP-UHFFFAOYSA-N 411.502 2.197 10 20 HECD CN(C)CCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934932 AFAITZHVHYWTDU-UHFFFAOYSA-N 424.545 2.160 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ncnn2-c2ccccc2)cc1 788952331 RPSNRSZMBLWJAV-UHFFFAOYSA-N 406.490 2.046 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCOC2(CCCC2)C1 789860171 ISZOOMFZRDKRLK-SFHVURJKSA-N 417.575 2.464 10 20 HECD O=C(NCCN1Cc2ccccc2C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793863936 FXFKJAFIYATVSO-NRFANRHFSA-N 423.513 2.032 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3ccccc3c2)cc1C(=O)O 800835390 XVMXDEQWIZJSTG-UHFFFAOYSA-N 421.456 2.105 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C 803089759 IJUDMVOBYLWDIA-ACJLOTCBSA-N 418.494 2.487 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(OCC2CC2)CC1)c1ccc(N2CCOCC2)cc1 803298540 CCSHRDPCQWTDDG-QGZVFWFLSA-N 415.534 2.118 10 20 HECD COCC[C@@H]1CCCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803301253 OBJKSZNPTCXVPU-MOPGFXCFSA-N 417.550 2.366 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCc2c(C)nn(C)c2C)cc1F 804852440 AOSBTLJVNPKNQZ-UHFFFAOYSA-N 417.529 2.387 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](Cc4cnn(C)c4)C3)cc2)CC1 805020167 PKSZXQCEJGCZFT-HXUWFJFHSA-N 423.561 2.364 10 20 HECD C[C@H](c1cccnc1)N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806278122 NGYSCESZAQTNFL-OAHLLOKOSA-N 419.576 2.042 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1 806846419 NJFYSMGKZUFPPJ-SFHVURJKSA-N 418.563 2.066 10 20 HECD Cc1noc(C)c1CO[C@@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807672877 JVMHKQJOBDIUCZ-AUUYWEPGSA-N 414.506 2.352 10 20 HECD COC(=O)CC[C@@]1(C)NC(=O)N(CN2CCCc3cc(OC(F)F)ccc32)C1=O 811761928 LKPISQJDCFDRAP-LJQANCHMSA-N 411.405 2.262 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)cc3)cc2)CC1 813532034 QNZMLJQGKKFVPZ-HXUWFJFHSA-N 401.894 2.358 10 20 HECD C[C@@H](CN1CCCCC1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117079 GKIPCXUFECYABX-HKUYNNGSSA-N 401.555 2.062 10 20 HECD CS(=O)(=O)N1CCCc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc21 918374566 MOGIUHKUGKPKKU-UHFFFAOYSA-N 415.515 2.488 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(CCc4cccs4)CC3)nc12 920087580 KSSAJHCRLNYXDB-UHFFFAOYSA-N 415.519 2.033 10 20 HECD O=C(Nc1c(Cl)ccc2nonc12)c1cccc(S(=O)(=O)N2CCOCC2)c1 1116850969 XUOXTWFJECZQKM-UHFFFAOYSA-N 422.850 2.149 10 20 HECD C[C@@H](OC(=O)[C@]1(F)CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1117344683 CIQQFIFPDNJBMN-IPQOISQHSA-N 411.385 2.461 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2Cc2ccc(N3CCN(C)CC3)c(F)c2)cn1 1343627822 VOQKNXFFBZNFOG-KCWXNJEJSA-N 419.570 2.100 10 20 HECD CC1(C)CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)C1 1777851255 XCUMZKYYYRRCOD-OPAMFIHVSA-N 417.506 2.057 10 20 HECD CCC(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361974 CVIWTOVEOKQDLD-LBPRGKRZSA-N 411.487 2.258 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(F)cc3)CC2)cc1 12069521 XQAPRFRHULAMFP-UHFFFAOYSA-N 414.481 2.101 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)s1 580473093 ISTYXFMIAXCOLC-UHFFFAOYSA-N 412.489 2.197 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C 608250305 LRRYEQYDMFNWJA-UHFFFAOYSA-N 421.457 2.017 10 20 HECD COc1ccc(OCc2nc(/C=C3\SC(=S)N(CC(N)=O)C3=O)cs2)cc1 727176364 QASUALNXDWHIHI-MLPAPPSSSA-N 421.525 2.417 10 20 HECD CNS(=O)(=O)[C@H]1CCCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 733311952 ZHZKARUTWUNGAB-SFHVURJKSA-N 407.511 2.430 10 20 HECD Cc1sc(=O)n(CCC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1C 734591675 AIWMLXGLAXTNCS-UHFFFAOYSA-N 405.520 2.185 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)/C=C/c3ccc(F)cc3)cc2)CC1 747261500 GIXLTVPAVJUKQO-FMIVXFBMSA-N 424.519 2.151 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 747841282 DUOYEYOGOCYBOY-UHFFFAOYSA-N 422.478 2.236 10 20 HECD C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 749185482 FDTFOQUBZLMZTP-MRXNPFEDSA-N 418.563 2.051 10 20 HECD Cc1nccn1C[C@H](C)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 749196927 VKTTYXPWBBHNII-APWZRJJASA-N 412.538 2.029 10 20 HECD Cc1ccc(C(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c(O)c1O 751538993 XENOZAOHRVZGMT-UHFFFAOYSA-N 403.866 2.138 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCc2ccc3c(c2)CCCN3C)cn1 753447660 XZXBHIMLBVHCNY-ACSYHNTCSA-N 415.563 2.301 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)CC2)cc1 754100529 PBIWHDGYXRCKNC-NJYVYQBISA-N 414.550 2.074 10 20 HECD CC[C@H](C)[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 754678244 ALEDWXDVBXAXQS-IWLLQYOYSA-N 423.529 2.233 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC(OCCO)CC3)cc2F)C[C@@H](C)O1 757626929 FTZDRTGXVZTSJE-HZPDHXFCSA-N 409.502 2.122 10 20 HECD Cc1nnc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 759313494 ILGZTLNQYNZVBA-SWLSCSKDSA-N 402.524 2.109 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 760456022 ZTYLJPCMALKFQG-UHFFFAOYSA-N 417.418 2.289 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)nc3)cc2F)C[C@@H](C)O1 766326285 BYWXACWZWUCTLT-CHWSQXEVSA-N 404.417 2.228 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 767939047 QBGVYSZNSNDYSV-VXKWHMMOSA-N 416.566 2.090 10 20 HECD C[C@@H](CO)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 771779029 GPFBLQWMLZLCKZ-TXEUWIOXSA-N 415.334 2.147 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)N(C)C)c1 774945531 AINMZHMCGICCMI-JOCHJYFZSA-N 424.545 2.331 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1cccc(Cl)c1 775125859 HRYQNFSIPWDTRW-UHFFFAOYSA-N 415.921 2.494 10 20 HECD Cn1cc([C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccc(F)cc2)cn1 775229960 IMDRVAKYUBTCHT-SFHVURJKSA-N 418.450 2.156 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(ncn4-c4ccccc4)C3)nc12 778233911 JESFQVKGQQMHAJ-UHFFFAOYSA-N 418.457 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3ccccc3C)CC2)cc1 778350284 QLUGAHGADHXTEU-LEQVUBRHSA-N 423.513 2.058 10 20 HECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)nc1I 778927580 PLRAGRRVKDWZJR-UHFFFAOYSA-N 400.172 2.036 10 20 HECD COC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1F 785294803 NOVIZVVDYUMFAZ-JTQLQIEISA-N 405.382 2.101 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2NC(=O)O[C@@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 786069291 MTGUPXOFGFDDJW-YJYMSZOUSA-N 414.414 2.088 10 20 HECD CO[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 786659164 XSUGOBDFQCELRU-CTNGQTDRSA-N 412.486 2.404 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N(C)c3ccccc3)CC2)cc1 787640810 QRTGDOAJORSLLL-GOSISDBHSA-N 424.545 2.421 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3[nH]nnc3-c3ccccc3)CC2)cc1 789947229 SBOSKNXMMWAWJB-UHFFFAOYSA-N 420.517 2.422 10 20 HECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)N(C)C)cc1 793723972 XWZOCCNHVUCJEZ-JOCHJYFZSA-N 408.546 2.413 10 20 HECD C[C@@H]1CCC[C@](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)(N(C)C)C1 793816274 ZHWNNJITTMRNDZ-HXOBKFHXSA-N 400.567 2.312 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 798217733 YUYHIVNBXQLAHY-UHFFFAOYSA-N 404.398 2.489 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cncc(F)c1 799256601 OJRHRODBAADCGT-UHFFFAOYSA-N 411.481 2.008 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1 804318628 QHWZJOOQAUJOOO-XUVXKRRUSA-N 415.534 2.100 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3cc[nH]n3)C2)cc1F 804852014 WWAAUDJIVBTMAT-INIZCTEOSA-N 401.486 2.417 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)OC[C@H]1CCCO1 804964602 NCAGWARNVAKOQU-QGZVFWFLSA-N 415.469 2.348 10 20 HECD Cc1cnc(Br)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 812988621 HCVOTGWIEIGMJU-JTQLQIEISA-N 408.252 2.250 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnn2c1OCCC2 814320511 UGWGMBOZUNCSLM-UHFFFAOYSA-N 410.396 2.451 10 20 HECD O=C1CC[C@](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)(c2ccccc2)CN1 816891071 HSBBHIXBDXXOFK-HSZRJFAPSA-N 411.477 2.127 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ccc(F)c(F)c3)CC2)cc1 914469777 HFDXXIVTUAGHRN-UHFFFAOYSA-N 424.469 2.237 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C(C)(C)C)CC3)CC2)cc1 1317903208 BNWJESUMPCFPHZ-UHFFFAOYSA-N 417.598 2.333 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSCc1c(C)noc1C 1321049660 XDYOQTFICXXWFP-HNNXBMFYSA-N 408.476 2.226 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(O)cc2)CC1)c1cc(O)nc(O)c1 1793167529 BCQXXJWGDRRDDN-BJWYYQGGSA-N 423.469 2.182 10 20 HECD CCn1nc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cc1C 1845501744 XVIYHZPLSJQVOG-UHFFFAOYSA-N 418.881 2.407 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 21930990 MWXSRJVCXKDLDX-UHFFFAOYSA-N 417.531 2.282 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CCN(S(C)(=O)=O)CC3)c2C)cc1 24509618 JUUAITXVNSCLKX-UHFFFAOYSA-N 419.547 2.253 10 20 HECD Cn1ncc(NCc2ccc(N3CCC(CO)CC3)cc2)c(Br)c1=O 301220055 AGBLDFCWWHETAY-UHFFFAOYSA-N 407.312 2.364 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](CS(N)(=O)=O)C3)ccc21 554296986 XWWCVQYFYIIQME-MRXNPFEDSA-N 407.536 2.045 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(Cc4cc(C)no4)CC3)CC2)cc1 726716335 HKGAWWCZGFLDOD-UHFFFAOYSA-N 413.522 2.488 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 728984496 QMFUAWVAQZLRGA-LBPRGKRZSA-N 418.446 2.034 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1 729053566 NHEOJFFBKSTJQQ-QKVFXAPYSA-N 412.446 2.016 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 734467958 NQRSZDSCVMVBKG-GOSISDBHSA-N 402.564 2.292 10 20 HECD CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738887246 FGSGVMRYLWVXTM-UHFFFAOYSA-N 416.503 2.202 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cn1 743045446 KNSQMSFVPGBFAF-UHFFFAOYSA-N 414.415 2.259 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3cnn(C(C)C)c3)CC2)cc1 754803789 WBAVWSJZQWHONR-NQIIRXRSSA-N 401.555 2.306 10 20 HECD COCC(C)(C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 756374089 UIXXRQNDPAEGSY-UHFFFAOYSA-N 422.503 2.140 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@H](c4ccc(O)cc4)C3=O)cc2F)CC1 761282734 RKPPOGFYYXUDNJ-HXUWFJFHSA-N 412.465 2.466 10 20 HECD COCCOc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765925465 FWYFAPGTKLLHAF-UHFFFAOYSA-N 423.263 2.435 10 20 HECD CCc1nc(CN2CCN(Cc3cc(Br)cc(OC)c3O)CC2)no1 769383827 KGSRBWRDOATPEW-UHFFFAOYSA-N 411.300 2.427 10 20 HECD COCCn1ncc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc21 769731723 FLIRSPKPQYALLX-UHFFFAOYSA-N 404.448 2.012 10 20 HECD COC(=O)[C@@H](C)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769941654 GMVVQIUDCGXPMS-YVEFUNNKSA-N 406.460 2.044 10 20 HECD Cc1ccccc1C(=N)NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772876814 FTUKHWVAORHBLQ-UHFFFAOYSA-N 400.454 2.134 10 20 HECD CCN1C(=O)c2ccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2S1(=O)=O 775404717 NIDDUTCDKMNUBO-ZDUSSCGKSA-N 401.488 2.408 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 778418372 DLLJJLSIYKDABB-PLUMIXRBSA-N 415.534 2.220 10 20 HECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 779337025 VIFXZTIAOHQSBA-NSHGMRRFSA-N 402.539 2.081 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccnc(-n3cccn3)c2)cc1 787244721 ZYSCIBPIUYAMQW-UHFFFAOYSA-N 406.490 2.046 10 20 HECD COc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1OC 787304104 GUJIGFRWHPHCJN-UHFFFAOYSA-N 415.490 2.053 10 20 HECD COc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788909974 JHLVODDWUNDBCI-UHFFFAOYSA-N 411.502 2.449 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 788913227 VXROLXDCQCSDEH-UGKGYDQZSA-N 410.562 2.378 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1 788969073 YQISEUPVHDHSSD-BBRMVZONSA-N 401.429 2.327 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NOC3CCCCC3)cc2F)C[C@@H](C)O1 789816620 DSGVJVMGXHTRIR-GASCZTMLSA-N 407.486 2.436 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C 796322551 FFWAUTRHIOVMCE-CQSZACIVSA-N 415.515 2.073 10 20 HECD NC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2cccc(Br)c2O)c1 798455666 WEASZGLRIWUQMI-UHFFFAOYSA-N 419.684 2.386 10 20 HECD Cc1c(C(=O)NCc2cccc(Br)c2O)nnn1Cc1ccncc1 803213115 MTGJYNSJTXAXHQ-UHFFFAOYSA-N 402.252 2.428 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCOC[C@@H]1C1CC1 803450873 SQALSHAZHWIERJ-GOSISDBHSA-N 423.460 2.010 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807672286 XMIXOMGXUBEMBC-JXFKEZNVSA-N 408.502 2.194 10 20 HECD C[C@H](N1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1)C(F)(F)F 807677136 MDWIPSSKKSJWPM-KGLIPLIRSA-N 400.445 2.025 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNCc3ncc(C4OCCO4)s3)cc2)C1 809632450 PZIMPPZATDWXCC-OAHLLOKOSA-N 402.520 2.180 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cc3n(n2)CCO3)NC(=O)OC(C)(C)C)cc1 810447830 RRELDKZSTUISHC-QGZVFWFLSA-N 415.494 2.337 10 20 HECD CC(C)N(CC(N)=O)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 914405954 DCGKMHMSFOWSPP-UKTHLTGXSA-N 411.574 2.452 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(OCC(=O)O)cc3)CC2)cc1 917759109 FHIDNEZLTADLLL-UHFFFAOYSA-N 420.487 2.060 10 20 HECD CC(C)CN1C(=O)/C(=C/NC[C@@H](c2ccccc2Cl)N(C)C)C(=O)NC1=S 920980370 KXTGFYJQKWAPEK-IDJPSDCMSA-N 408.955 2.316 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1COc2ccc(F)cc2C1 1320397829 FAHONOGTTSLIBK-ZBFHGGJFSA-N 403.406 2.079 10 20 HECD CN1C[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 726537722 PPLBRONLVLVPGB-KWJWQAOWSA-N 409.558 2.076 10 20 HECD CCOC(=O)COc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 729063970 MPQBSYKGGOJWMY-CYBMUJFWSA-N 416.430 2.159 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CC1 732884415 BMKGTOCUOFGUCH-UHFFFAOYSA-N 400.445 2.435 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1 734703968 UIENPJOREQPMRF-UHFFFAOYSA-N 410.474 2.268 10 20 HECD O=C1C[C@@H](Cc2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)C(=O)N1 743339795 YQPFCDZSJATIKS-UXHICEINSA-N 422.481 2.419 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CC(N)=O)C3)cc2F)C[C@@H](C)O1 746758141 KVSFJNMOBIILQM-BFYDXBDKSA-N 406.502 2.236 10 20 HECD COC(=O)c1ccc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)[C@H](C)C2)cc1 749915033 UDLWIOFDTBEMRB-GOSISDBHSA-N 424.545 2.366 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccccc2O)c(Br)c1 751151065 PZBGFYDDQVEZCM-UHFFFAOYSA-N 400.250 2.420 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc([N+](=O)[O-])c3)CC2)cc1F 753861068 LNWFNKMVXQGVSF-KRWDZBQOSA-N 405.426 2.304 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc1F 754040590 SBSJRENPWQWNJE-UHFFFAOYSA-N 406.439 2.190 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3[C@@H](O)c3ccccc3)CC2)cc1 758231682 PVHOUDDDUYNTPH-GMAHTHKFSA-N 422.529 2.157 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@@H](CC(F)(F)F)C3=O)CC2)cc1 760948102 DEMAPYHLNQMELC-INIZCTEOSA-N 414.428 2.080 10 20 HECD CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 762552792 JQIIYQRSWXODLY-UHFFFAOYSA-N 422.501 2.328 10 20 HECD NC(=O)CNC(=O)c1cccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 770521632 MDPTYKYHUGBTKN-UHFFFAOYSA-N 411.462 2.412 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCc3cnccn3)cc2F)C[C@H](C)O1 771464777 QBSJUZLPINLVFR-IRXDYDNUSA-N 415.513 2.020 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](OCC(C)C)C3)CC2)cc1 778323881 LGELYGFWJXOZFY-MHNQQFQPSA-N 415.534 2.174 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(C)c(=O)n(C)c1 785194442 JVSKFRIPGLRRCE-UHFFFAOYSA-N 422.279 2.149 10 20 HECD CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785293710 IBHJUSPTOURMSN-JOHMGYAOSA-N 412.442 2.360 10 20 HECD COC(=O)Cc1sc(NS(=O)(=O)c2cnn(C)c2C)nc1-c1ccccc1 794015350 BRCXNIRKAFGYFX-UHFFFAOYSA-N 406.489 2.368 10 20 HECD O=S1(=O)CCC(O)(CNCc2ccc3c(c2)CCN3Cc2ccccc2)CC1 796311384 GFRHYVURLYVITE-UHFFFAOYSA-N 400.544 2.279 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NCc1ccc(N(C)C)cc1 796407647 QZLHZQQBBQSFFJ-UHFFFAOYSA-N 418.563 2.309 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)CC3CCCC3)cc2)C1 798382988 FXQQHPHVIPXABP-VQTJNVASSA-N 416.566 2.376 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3(c4cccc(OC)c4)CC3)nc12 803792558 PTGCIWNXJWNTOS-UHFFFAOYSA-N 411.414 2.395 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2c(F)cccc2N2CCCC2)c1 804129115 GPDPUQDJHNEXBT-UHFFFAOYSA-N 407.467 2.433 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)Nc2ccccc2)cc1F 804853147 LCGRFPPXUYQDEW-UHFFFAOYSA-N 414.481 2.433 10 20 HECD O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCc1cc(Cl)cc(Cl)c1O 805195165 WENBCZYAJHVKKT-FCIDVOKBSA-N 424.284 2.305 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1 806887033 WSCTWENGURDNDQ-SECBINFHSA-N 419.821 2.201 10 20 HECD C[C@H](CCc1cccn1C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807651425 YZECZROBJZLGQP-YLJYHZDGSA-N 413.518 2.376 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 811847790 DTUSNFSQBMVPHW-UHFFFAOYSA-N 407.444 2.166 10 20 HECD C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 813636672 CALGGWOMRCBZJP-GFCCVEGCSA-N 419.507 2.230 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cn2nc3ccccn3c2=O)cc1 914491563 KVESBKXYKJESEZ-UHFFFAOYSA-N 405.458 2.384 10 20 HECD O=C(CN1CCN(CC2CC2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 917159461 XXUNNXYJNSYQAS-UHFFFAOYSA-N 403.482 2.428 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)cc1 918429787 PDRZVUHSYNIEOX-UHFFFAOYSA-N 407.478 2.072 10 20 HECD C[C@@H](OC(=O)CO[C@@H]1CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1318911084 RGAFPVMXGNYSHL-UKRRQHHQSA-N 423.421 2.138 10 20 HECD COc1cc(N2CCN(C(=O)c3ccn(-c4ccncc4)n3)CC2)cc(OC)c1OC 1320807483 XXYDGUNNEZYDJJ-UHFFFAOYSA-N 423.473 2.256 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 1323192852 LBFHZOJOBHYRAR-UHFFFAOYSA-N 422.485 2.100 10 20 HECD CC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1800514971 JMXGDFMKQHEIFH-QQFNCUIESA-N 422.529 2.482 10 20 HECD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccnc1 1800712878 XXFZIUVZZKZOGG-REBRKWNGSA-N 418.881 2.461 10 20 HECD CC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1801660341 GLCOALKKPQWOEO-QQFNCUIESA-N 422.529 2.482 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnccc2F)C1 1843166879 ALAVLNSVIFHNRY-UHFFFAOYSA-N 405.813 2.416 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CSC[C@H]3CCCCO3)cc2)C1 727308624 QBUWRDASRSPELI-PKOBYXMFSA-N 405.564 2.307 10 20 HECD NC(=O)c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1-c1ccccc1 732273198 MCEDNWYKOXUULM-UHFFFAOYSA-N 421.526 2.454 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)Nc1ccccc1 732591346 BZFHRRMHKNSPRL-AEFFLSMTSA-N 423.517 2.215 10 20 HECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cnc1Cl 748671999 ASVCEDVYQRFDPX-UHFFFAOYSA-N 415.924 2.079 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)NCc1ccc2c(c1)CCCN2C 751058067 QCNFZZWOQWWKTO-UHFFFAOYSA-N 409.895 2.383 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)OCc3ccccc3)CC2)cc1F 753731437 NRFXSHJNHUGGJX-UHFFFAOYSA-N 401.438 2.409 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC3(c4cccc(OC)c4)CC3)CC2)cc1 754162390 FNNURHOUKJPYKJ-OAQYLSRUSA-N 411.546 2.466 10 20 HECD C[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1O 756362558 JWERBVMUVDHCRW-AWEZNQCLSA-N 421.475 2.172 10 20 HECD COc1cc(N2CCN(Cc3cc(=O)n4cccc(C)c4n3)CC2)cc(OC)c1OC 759872502 LDPNIAOZAZVTML-UHFFFAOYSA-N 424.501 2.351 10 20 HECD COCCC(C)(C)CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 760122755 BOGHIEVRIUEOIR-MDZDMXLPSA-N 403.523 2.079 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 763280361 RVLLXVFZLKJKGX-AWEZNQCLSA-N 406.504 2.489 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(Cl)n1 765902778 DKQURXUOVFGHCZ-UHFFFAOYSA-N 414.643 2.467 10 20 HECD O=C(COc1ccccc1NC(=O)C(=O)NCc1ccccc1O)Nc1cccnc1 768116285 DMABEGRRFIKISN-UHFFFAOYSA-N 420.425 2.060 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCNC(=O)OCc2ccccc2)c1 771763365 WXGGVFGNYDSLTP-CQSZACIVSA-N 408.476 2.308 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCCN1CCCCCC1=O 775098498 YSUGUMCXDIFVMD-UHFFFAOYSA-N 403.523 2.430 10 20 HECD C[C@@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775259679 XDHLCWOXPCIGGH-MRXNPFEDSA-N 417.531 2.216 10 20 HECD COc1cccc(O)c1CN1CCC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2=O)C1 777223879 XOXDNOMWMRZPOL-INIZCTEOSA-N 419.522 2.445 10 20 HECD O=S(=O)(NC1CCCC1)[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 781919565 DKJWJNQXSSNMOE-NRFANRHFSA-N 407.580 2.350 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-c4ncn(C)n4)cc3)cc2)CC1 786259960 SXJHZTOQYHTJML-UHFFFAOYSA-N 418.501 2.081 10 20 HECD C[C@H](NC(=O)C(=O)NCCO[C@H]1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 787991187 SYIDNIVFPLIOOH-LQWHRVPQSA-N 417.550 2.412 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCN(CC(F)(F)F)C2)cc1 803385752 FJWOVTNFOQVNSF-INIZCTEOSA-N 414.472 2.244 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)cc1 804317649 KVIAVIJEEVYDGJ-JOCHJYFZSA-N 422.529 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3ccnn3C)C2)cc1F 804853334 ONRNSWLRCSZVOZ-KRWDZBQOSA-N 415.513 2.428 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806254790 SUTIUHVKJNGMTB-PMACEKPBSA-N 417.550 2.281 10 20 HECD C[C@@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 807291244 VFVLZRLIOXNNRB-NQIIRXRSSA-N 407.514 2.350 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 807292770 YCQPCMKISCMUPC-WOJBJXKFSA-N 409.486 2.387 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)c3nc(C)cs3)CC2)cc1 807351698 WECNPRRERJRBIH-OAHLLOKOSA-N 416.547 2.419 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc21 809181299 PHSQTWXPHFFQFD-FQEVSTJZSA-N 408.502 2.325 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c[nH]c4ccccc4c3=O)CC2)cc1 915190288 XWGUZJIQIXWPPT-UHFFFAOYSA-N 420.513 2.479 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccccc3F)cc2)C1 918116921 CIJQOLNOKNIFKR-OXQOHEQNSA-N 414.481 2.060 10 20 HECD CCN(C(=O)COC(=O)c1sccc1-n1c(C)ccc1C)[C@@H]1CCS(=O)(=O)C1 919565706 IPBWAMDRVCUWST-OAHLLOKOSA-N 424.544 2.348 10 20 HECD Cc1cc[nH]c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816170282 BQIVKGXJEWBDKZ-CQSZACIVSA-N 410.434 2.472 10 20 HECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)no1 1827426756 FMDZECRAIJYWJV-QGZVFWFLSA-N 414.462 2.336 10 20 HECD CN1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1841364384 ZODKVWPURBOOKR-OAHLLOKOSA-N 407.898 2.053 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 60750220 UTPLFWXWIXIYEF-UHFFFAOYSA-N 415.515 2.036 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCCCSc2nccs2)n(C)c1 733972152 MNAWYBOBOVLYOW-UHFFFAOYSA-N 416.594 2.424 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1C(=O)N(C)C 734492290 DGFQWJVUOOUSKY-UHFFFAOYSA-N 417.531 2.476 10 20 HECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097392 PQIQXPBZSHYOIO-UHFFFAOYSA-N 408.502 2.258 10 20 HECD CCCn1c(CCC(=O)NCc2ccccc2O)nc2cc(S(N)(=O)=O)ccc21 748354023 VGMNBAWLDBRZQA-UHFFFAOYSA-N 416.503 2.048 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc2c1=O 758118432 KZQRDRYDJPZVCE-KRWDZBQOSA-N 418.497 2.170 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCc1ccc(C(=O)N2CCCC2)cc1 759597881 UBPRYSLQNXBBIF-POHAHGRESA-N 424.453 2.207 10 20 HECD Cc1c(O)cccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 761425698 BHUCFVZUKPMJLN-UHFFFAOYSA-N 402.422 2.150 10 20 HECD CCN(CC)c1ccc(CNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1 764918440 CPANNHRUXDFYSF-UHFFFAOYSA-N 424.549 2.068 10 20 HECD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440185 UCISVULOEJYISO-VBKZILBWSA-N 415.465 2.102 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCSCC(F)(F)F)cc2)C1 769732863 PJQGBUULHAMMLP-CQSZACIVSA-N 418.485 2.483 10 20 HECD Cc1ccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 770299656 KLMDWYFEZKDSSG-CTNGQTDRSA-N 410.518 2.230 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 772929314 QYDYNKHXZHYMHG-HUUCEWRRSA-N 400.454 2.398 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773088219 NKPIBYZYFNJWDD-AWEZNQCLSA-N 411.549 2.042 10 20 HECD CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774357267 QDGKNAUUWYDYFR-UHFFFAOYSA-N 412.471 2.303 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@H](Cc4ccccc4)C3=O)cc2)C1 777610385 JSSBWSDVNFSOEG-AZUAARDMSA-N 406.486 2.051 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 778930640 WGEIDOJSAQGSTO-QRWLVFNGSA-N 402.447 2.444 10 20 HECD CCC[C@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780161266 DBWZNUCHFQPJAK-MSOLQXFVSA-N 422.497 2.417 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C3=NO[C@@H](c4ccccc4)C3)cc2)CC1 786660757 ISBHSIBFRSIILT-JOCHJYFZSA-N 406.486 2.489 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1CCN(c2ccccc2)C1 788812188 AHDJRJGBAYQGME-OAHLLOKOSA-N 404.561 2.384 10 20 HECD CCc1csc(NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)n1 789472321 KVRNXSADDUEWBL-UHFFFAOYSA-N 419.526 2.241 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC[C@@H]1CCc2ccccc21 789798154 CNYMHNFNJIWDMY-SFHVURJKSA-N 411.477 2.125 10 20 HECD CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C(C)(C)O1 789862910 YHKPNBALFCYPMN-QGZVFWFLSA-N 405.564 2.318 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)c1ccc(N2CCOCC2)cc1 803309930 DVKBQHPAGMVZAY-KCUHQSDYSA-N 415.534 2.020 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H]3C[C@H](O)c3ccco3)ccc21 803688828 CEKRBZVGQBGUIX-QUCCMNQESA-N 411.502 2.393 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCN(C(C)C)CC3)cc2)CC1 805025823 VOBNCFHDTDVGGI-UHFFFAOYSA-N 400.567 2.482 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c[nH]nc4c3)cc2)C1 806494958 ZBHNDYSWGIGHQX-LJQANCHMSA-N 420.517 2.307 10 20 HECD C[C@@H]1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807008775 HPSYISIEYNMQOR-NQIIRXRSSA-N 412.578 2.387 10 20 HECD CSC1(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 807768925 BWDPFWULUABLQL-CYBMUJFWSA-N 413.490 2.385 10 20 HECD CC[C@H](CSC)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807911851 CIEQMACVWSEALU-LJQANCHMSA-N 418.607 2.093 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809438380 PZRFBKQRKAAWDH-UXHICEINSA-N 417.550 2.192 10 20 HECD CCS(=O)(=O)NCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 915775029 TWPVYEQVJAIDHQ-UHFFFAOYSA-N 403.464 2.096 10 20 HECD CC[C@@H](C)NC(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 918228300 ICIOODUYQYYJHR-GOSISDBHSA-N 403.571 2.275 10 20 HECD Cc1c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1-c1ccncc1 1319586311 WFIFSWQKSQAWBJ-UHFFFAOYSA-N 407.474 2.457 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C1=CCCC1 1786327334 CZJYXKMNXMYMDY-YEWWUXTCSA-N 420.893 2.455 10 20 HECD O=C(Cc1c(F)cccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847417111 WBCSEDABGBQFTL-HOTGVXAUSA-N 419.840 2.343 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 65715632 LAPXIOSHFKHSIF-OAHLLOKOSA-N 411.458 2.110 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NCCCN3CCC[C@@H](C(N)=O)C3)c2C)cc1 111080210 XPHGXEXSRDTNHQ-GOSISDBHSA-N 412.534 2.420 10 20 HECD COc1ccc(CNCc2ccccc2S(=O)(=O)N2CCN(C)CC2)cc1C 237446418 DDFPSWJLOZCNLP-UHFFFAOYSA-N 403.548 2.230 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 726601216 KRIZEHGNCRXANO-UHFFFAOYSA-N 410.517 2.491 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](n4ccnc4)C3)cc2)C1 728747471 NYVIXDWWWWJVQL-UYAOXDASSA-N 410.522 2.132 10 20 HECD C[C@@H](NC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 734271876 MWCJNGGOBOTNKX-UYAOXDASSA-N 415.582 2.052 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 734687308 UIDMAVSETIDEAV-UHFFFAOYSA-N 416.547 2.277 10 20 HECD COC(=O)[C@H](c1ccccc1)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 736312499 UGAIWOFWWNISKL-QFIPXVFZSA-N 411.502 2.190 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@H](O)COc1ccc2c(c1)OCO2 741090206 DVBLHAKXPRJRFD-SFHVURJKSA-N 411.458 2.031 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 741743159 AHGQAOWAXOEZTN-LJQANCHMSA-N 409.490 2.094 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)cn1 743045841 BGMAUIWPGIKUPL-UHFFFAOYSA-N 410.452 2.428 10 20 HECD Cc1nc2nc(N)nn2c(C)c1CC(=O)N(Cc1ccco1)Cc1ccccc1O 743431130 RKCUNURZDQTMIF-UHFFFAOYSA-N 406.446 2.393 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cn(CC(C)C)cn3)cc2F)CC1 749288199 YKXXKBHJSXIGCF-UHFFFAOYSA-N 423.558 2.299 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(OCC(N)=O)c2)cc1 750874891 PBZDKOSOKDMGNP-OAQYLSRUSA-N 411.502 2.438 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCn3cccc3)cc2F)C[C@H](C)O1 750943422 NDUSATNVIDCDCQ-IRXDYDNUSA-N 417.481 2.491 10 20 HECD O=C(Cn1nc(-c2ccccc2)oc1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751294826 PTDDMVFWLVJYJT-SFHVURJKSA-N 409.442 2.417 10 20 HECD COc1ccc(N2CCN([C@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc1F 753857146 LTNRJHLWCXDYKD-GFCCVEGCSA-N 406.483 2.144 10 20 HECD COCc1ccccc1CNC(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 753857819 RJKWEKUNHGWNCA-UHFFFAOYSA-N 401.482 2.419 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](c3ccsc3)N(C)C)CC2)cc1 758211382 UUFLUEMZGGWSDF-IRLDBZIGSA-N 418.607 2.132 10 20 HECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 760239961 VOTHXQZCXKIHOC-UHFFFAOYSA-N 402.458 2.207 10 20 HECD Cc1ccc(S(=O)(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 761345384 XZTVVOZRVXJIKT-UHFFFAOYSA-N 423.472 2.096 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)CC2)cc1 761652450 WHVVZPPIQBYAGE-NJDAHSKKSA-N 402.539 2.074 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c4c(nn3C)CCCC4)CC2)cc1 764610209 SVGGRSHHCZDBIK-UHFFFAOYSA-N 411.550 2.250 10 20 HECD CCOc1ccc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c(O)c1 768155249 CWXZTEUVRVXOQQ-UHFFFAOYSA-N 421.475 2.206 10 20 HECD COCCOCC(=O)NC1CCC(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773020581 PLPZVWRLZWEMHF-IVMQYODDSA-N 405.539 2.268 10 20 HECD C[C@H](NC(=O)NCCCN1CCN(c2ncccn2)CC1)c1ccc(N(C)C)cc1 773136467 IIHIEOAETVKVQH-SFHVURJKSA-N 411.554 2.115 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1OC 774730637 WRQKYHRSEIZDQC-UHFFFAOYSA-N 411.502 2.279 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@@]2(C1)C(=O)Nc1ccccc12 777458369 DNUPXQQDLJNUQL-QHCPKHFHSA-N 424.476 2.468 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 777828159 IPLPSUFIDPVFKH-CQSZACIVSA-N 408.882 2.196 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](O)c3cccc(C)c3)CC2)cc1 778389604 MMZQIEBCDJPHDS-NEQMZLFVSA-N 423.513 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCO[C@H](C(C)C)C3)CC2)cc1 778418369 DLLJJLSIYKDABB-ONFKWDQZSA-N 415.534 2.220 10 20 HECD COc1ccc(C)cc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785433832 PQHPYZSJDPSNBZ-UHFFFAOYSA-N 424.545 2.030 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1 785602121 YBYNQZSVXPWILW-IBGZPJMESA-N 409.465 2.147 10 20 HECD CCC[C@@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786656772 RECRJTYNBDIYKT-XLIONFOSSA-N 414.550 2.008 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccn(-c4ccccc4)n3)cc2)CC1 786657203 UUCINAOGHMYZRF-UHFFFAOYSA-N 417.513 2.400 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@]3(CO)CC(C)C)CC2)cc1 788764812 JJCRICCFNGOGTN-HSZRJFAPSA-N 418.582 2.400 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)cc1 788928246 CIAJLLHYBVUDAX-YPQLRWHESA-N 407.580 2.345 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCSCC3)cc2F)C[C@H](C)O1 789811716 GJNYZHJWJVPBBD-GJZGRUSLSA-N 409.527 2.021 10 20 HECD CSc1nc(=O)n(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)[nH]1 794440613 HBMSSSKKUQAUBD-UHFFFAOYSA-N 400.460 2.355 10 20 HECD CCOc1ccc(O)c(CNc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1 796403330 NSJVEFDIDMLCRK-UHFFFAOYSA-N 422.503 2.433 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803298045 NWBQBHQIQHTFQL-KRWDZBQOSA-N 408.502 2.287 10 20 HECD CC(C)[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2ccccn12 804100925 JHICDXRYIFEMAT-IBGZPJMESA-N 408.506 2.267 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3cnn(C(C)C)c3)CC2)cc1 806158607 MYMUEGUROIREEF-QGZVFWFLSA-N 413.522 2.389 10 20 HECD Cc1nccn1CCCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807383812 NIZYHTIMRVTGNB-LJQANCHMSA-N 414.506 2.001 10 20 HECD CNC(=O)C[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)c1ccccc1 807730749 QHSVDXJBZDEKEF-OAQYLSRUSA-N 422.529 2.237 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(N4NC(=O)CCC4=O)cc3)CC2)cc1 920293263 YQNDPMFFQSLAFU-UHFFFAOYSA-N 422.485 2.206 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2=COCC2)CC1 1832411125 ZIXQVVMDSCGRIL-KRWDZBQOSA-N 401.463 2.030 10 20 HECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)ccc21 60763605 YHVMRKLOPNATGI-UHFFFAOYSA-N 406.486 2.233 10 20 HECD Cc1ccc(C(=O)OCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c(O)c1O 110007925 LEJTUCKDUSSNHS-UHFFFAOYSA-N 412.442 2.440 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)CCO4)cc2)C1 725874622 HBAIFTXBATWEKF-IBGZPJMESA-N 408.502 2.323 10 20 HECD COC(=O)[C@H](C)CN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)C1CC1 726786685 QOMPAUXQRREEFN-OAHLLOKOSA-N 404.507 2.201 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4c(s3)CCOC4)CC2)cc1 728645507 XRWBKPNJHPZSTE-UHFFFAOYSA-N 416.499 2.335 10 20 HECD COC(=O)C1CCC(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 730119451 KYLRNYCJGXCCOX-UHFFFAOYSA-N 403.523 2.426 10 20 HECD O=C(Cc1cccnc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 731978697 PMKQGRLGBDUTIG-UHFFFAOYSA-N 406.465 2.196 10 20 HECD C[C@H](NC(=O)N1CCC[C@H](N2CCCC2=O)C1)c1ccc(N2CCOCC2)cc1 732243938 WIQCDEJOGFFDCQ-PXNSSMCTSA-N 400.523 2.381 10 20 HECD CC[C@@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H](C)O1 732443567 HYBHMGYTJOTHMM-UYAOXDASSA-N 404.555 2.416 10 20 HECD CC(C)C[C@H](CCO)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745699950 ZHRKROIEGOEOKB-RBUKOAKNSA-N 404.555 2.232 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](Cn3cccn3)c3ccccc3)nc12 746468623 HNWPEAUFEVZQKN-GOSISDBHSA-N 406.446 2.339 10 20 HECD O=C(NCCn1c(O)nc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 752004855 LAAMAZKVFRTYKU-UHFFFAOYSA-N 413.453 2.217 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C4CCCCC4)CC3)CC2)cc1 754098388 RIFQPENMSYBSOG-HSZRJFAPSA-N 416.610 2.128 10 20 HECD CCC(=O)N1CCC[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759221214 NYZRKGQNZGFQPX-INIZCTEOSA-N 419.522 2.010 10 20 HECD COCC1(O)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 759285132 CRCWKLFVKTWDRD-IYBDPMFKSA-N 409.502 2.122 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCN(C[C@H]2CCCO2)CC1 761003956 LCZMKOWACSSRQZ-QGZVFWFLSA-N 407.898 2.453 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(c2ncccc2F)CC1 761670033 QJYIMICHQULNTQ-UHFFFAOYSA-N 417.460 2.228 10 20 HECD Cc1cc(Cc2nc(-c3ncn(CC(N)=O)n3)no2)c(C)n1-c1ccc(Cl)cc1 761931697 NQKMMQABQKZNNR-UHFFFAOYSA-N 411.853 2.465 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(O)c3)cc2F)C[C@@H](C)O1 762849759 RHSIAWSFDIEOFW-ZIAGYGMSSA-N 417.437 2.013 10 20 HECD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 764141321 YTYGSHUMTSSLRO-UHFFFAOYSA-N 419.503 2.128 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 764862464 BPSOZOWRPPZMSQ-OAQYLSRUSA-N 414.502 2.182 10 20 HECD CC(=O)Nc1cccc2c1CCCN2C(=O)c1cc(NS(C)(=O)=O)ccc1O 769713477 YYBUFPVLCHMZJF-UHFFFAOYSA-N 403.460 2.315 10 20 HECD CC(=O)N(C)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772899740 WFZSUSOANDOJRP-UHFFFAOYSA-N 415.465 2.340 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773087283 JCENVEFXTSFYNP-CYBMUJFWSA-N 420.487 2.365 10 20 HECD CCC(=O)[C@H]1CCCCN1C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 773538905 QYFMOEOMLOVTEL-ZCPJJFRWSA-N 413.518 2.260 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCO[C@@H](Cc4ccccc4)C3)CC2)cc1 776607856 KXEWGVNWNDYORC-QHCPKHFHSA-N 409.530 2.287 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nnc(C(F)F)s3)CC2)cc1 778245889 MWWQQSYZIZHDBF-SREVYHEPSA-N 423.445 2.328 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)[C@H](C)C[S@](C)=O)c([N+](=O)[O-])c1Br 784384382 BSTJTGIWSQLDKL-WBOGJMANSA-N 410.246 2.477 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785295610 XERUIIGLMHFFDI-GFCCVEGCSA-N 422.865 2.462 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](Oc4ncccc4F)C3)nc12 785837113 FJJYQWALMMXWBD-CQSZACIVSA-N 415.425 2.189 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)nc1C 786260057 VTDHCFPTBDWVQG-UHFFFAOYSA-N 424.501 2.165 10 20 HECD COc1ccc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 786759505 IGCBVRXUGNUSKL-QGZVFWFLSA-N 411.502 2.368 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc4c(c3)CCO4)CC2)cc1 788342341 KWEHELFZPYKGNJ-UHFFFAOYSA-N 409.486 2.032 10 20 HECD CCN(CCCN1CCCC1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855932 MGFHUERALDSLQA-UHFFFAOYSA-N 418.607 2.190 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCC3(CC2)OCCO3)cc1)C1CCCCC1 803676263 CPYMNAZZZWBZJI-UHFFFAOYSA-N 415.534 2.437 10 20 HECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688096 KZMYHCRQQAQVKW-GDLZYMKVSA-N 413.543 2.081 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 804318351 IIZCRMRXSGUHKB-FXAWDEMLSA-N 416.566 2.111 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc2c(c1)CC(=O)N2C 804574667 XJEUFNVSZMDFJM-MRXNPFEDSA-N 418.497 2.075 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807674415 KNOOGVKBBKCHTA-RDJZCZTQSA-N 403.523 2.368 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1C[C@H]2CCCC[C@@H]2C1 808851300 BIIRBAUPDVBHKP-FGZHOGPDSA-N 424.589 2.483 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(C4CC4)ccc3=O)cc2F)C[C@@H](C)O1 810010724 LCDVCMPGAFCVFI-GASCZTMLSA-N 414.481 2.190 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@H]3CC(C)(C)OC3=O)cc2F)CC1 813633102 RVYLOSWZLBVRCS-SFHVURJKSA-N 406.502 2.203 10 20 HECD Cn1cc(S(=O)(=O)NCc2cccc(Br)c2O)c(C(F)(F)F)n1 815039310 ULDAGMWIRBHPLQ-UHFFFAOYSA-N 414.203 2.386 10 20 HECD Cc1cc(C)c([C@@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c(O)c1 815562065 WFUBTDILPIENSR-GOSISDBHSA-N 418.563 2.207 10 20 HECD CCOC(=O)[C@H](CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)=O 816890936 CPGFPWAESPMJIS-JKIFEVAISA-N 408.470 2.214 10 20 HECD COc1ccc(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)cc1OC 913072260 MKAFBIZKWCQRJI-UHFFFAOYSA-N 422.488 2.066 10 20 HECD CCC(=O)N[C@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 914672582 UNWPLUGAFVUDSF-CHWSQXEVSA-N 422.437 2.247 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1 914929208 CATKIAPJGDMMGL-SFHVURJKSA-N 415.534 2.435 10 20 HECD Cc1c(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1-n1cnnn1 916670228 ABTZTVYLBRNNKG-UHFFFAOYSA-N 411.441 2.268 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@]34CCC(=O)N3CCS4)cc2F)C[C@@H](C)O1 917709819 GEQWHTQMDZSQTP-LAPQFRIASA-N 407.511 2.121 10 20 HECD CCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918031406 WJEPFSNWBZFIPI-SFHVURJKSA-N 423.517 2.460 10 20 HECD CC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 918188709 WBOAUOXHHORURY-GJZGRUSLSA-N 406.502 2.249 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCN1C(=O)Cc1ccccc1 920291483 PTTBAAUWDULFSQ-QFIPXVFZSA-N 407.514 2.373 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)CC1 1323082814 HHHZCSREFRPBGH-LMHXZZLNSA-N 411.546 2.303 10 20 HECD CNC(=O)c1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1324542762 NBAVEBKJHUVIHX-OAHLLOKOSA-N 402.882 2.195 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1)C1=NN(c2ccccc2)C(=O)C1 1795015945 WGVRWIYWSVNALQ-GGPHIMKMSA-N 417.469 2.126 10 20 HECD Cc1cc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)cc2s1 1845618208 PKWLNRMBSFGFNO-UHFFFAOYSA-N 412.471 2.475 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCCC[C@@H]1C 726616893 VDLCGMQRXIMLMF-ROUUACIJSA-N 416.566 2.484 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3cccc(F)c3)cc2)C1 734660412 PTTURHSIQNPDST-YLJYHZDGSA-N 414.481 2.060 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1 734703965 UDJODOROPQKIGZ-UHFFFAOYSA-N 410.474 2.268 10 20 HECD CCOc1ccc(N(C)CC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)cc1 739922580 MWRVYEINTVTJCN-AWEZNQCLSA-N 403.504 2.147 10 20 HECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743715978 GILWUSJEVRTDFP-UHFFFAOYSA-N 404.488 2.383 10 20 HECD COc1ccc(N(CCNS(=O)(=O)c2cnn(C)c2)Cc2cccs2)cc1 744397075 ZISACSGYCCDLAI-UHFFFAOYSA-N 406.533 2.475 10 20 HECD Cc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1-n1cncn1 745412002 ZZDAVDHVOMLKAQ-UHFFFAOYSA-N 407.474 2.457 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCS(=O)(=O)[C@@H]2CCCC[C@H]21 753857564 NDSJSPXEQHASNZ-RTBURBONSA-N 423.604 2.491 10 20 HECD CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 754567783 DKZSAFILVQPXEV-MJGOQNOKSA-N 404.555 2.231 10 20 HECD CN1CCN(CC2(C)CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)CC1 755236402 VNLIQZJDEVGBAX-UHFFFAOYSA-N 415.626 2.061 10 20 HECD O=C(NCCCSc1nccs1)NC[C@]1(N2CCOCC2)CCSC1 759567838 AWEIHIGNHHENKJ-MRXNPFEDSA-N 402.611 2.132 10 20 HECD O=C(CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)N1CCc2ccccc2C1 761220139 BXAOUUOVCFRWST-UHFFFAOYSA-N 413.861 2.395 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCSC3)cc2F)C[C@@H](C)O1 762036458 OAYKFTKQSYAEGL-LZWOXQAQSA-N 410.511 2.352 10 20 HECD COc1ccc(N2CCN(CCNC3CCN(Cc4ccccn4)CC3)CC2)cc1 765403904 WYUQTEKNXNUYQH-UHFFFAOYSA-N 409.578 2.466 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@H](O)[C@@H](O)c1nc2ccccc2s1 765729589 PLIIYPICIMWIFE-HUUCEWRRSA-N 423.288 2.475 10 20 HECD O=C(CNC(=O)NCc1ccc(F)cc1)NCc1cccc(Br)c1O 765755141 GRYWHKCWARYOKU-UHFFFAOYSA-N 410.243 2.409 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1 768719698 DBUMJPVGCFHPGE-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CN(C)C(=O)[C@H](C)n1cccn1 769289914 GFOXDKQPAMAJIR-ZDUSSCGKSA-N 423.311 2.419 10 20 HECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N(C)C)c(F)c1 772530313 LJTDVSXBIHIFBR-HNNXBMFYSA-N 423.514 2.386 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773856562 JCPCRUANGJPBGO-CQSZACIVSA-N 412.490 2.279 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1 774361813 IZACBELPPZAKNE-MRXNPFEDSA-N 414.458 2.343 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1O 774876565 AQIQUVIGKLFCAB-WBVHZDCISA-N 420.510 2.122 10 20 HECD CC[C@H](CO)NC(=O)Cc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2O)cc1 774930407 RKUHREAXRGFYRJ-OAHLLOKOSA-N 403.435 2.351 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc2c(c1)N(C)CC2 776043399 WNHNLMIEIMWGAC-UHFFFAOYSA-N 408.502 2.113 10 20 HECD Cc1cc(C(=O)NCC(=O)N2CCOCC2)c(C)n1-c1ccccc1Br 776718052 MPLRARIKSDZZNX-UHFFFAOYSA-N 420.307 2.445 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(C)nc3N(C)C)CC2)cc1 778392839 SZKCQFFKNJPXBI-QXMHVHEDSA-N 423.517 2.308 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(O)cc(OC)c3)CC2)cc1 781024021 IRJGJJHQGOPUFM-FPLPWBNLSA-N 411.458 2.253 10 20 HECD COc1ccc(CNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c(O)c1 794371031 WEXJWHCFUVUEDT-UHFFFAOYSA-N 410.386 2.093 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c(O)c1 797388868 CWPPXIFLEMOHJL-UHFFFAOYSA-N 411.458 2.168 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1 807095871 ANFHMPCLOFODQH-GOSISDBHSA-N 418.538 2.097 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCCN(C2CCC2)C1 808022303 IZXNGAQMAZZDDE-PKOBYXMFSA-N 400.567 2.480 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cncnc1-c1ccccc1 810173212 ZSHIBVXDOURQCY-UHFFFAOYSA-N 422.510 2.308 10 20 HECD CO[C@@](C)(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 812479728 PIQNKHHWCVAPOV-JOCHJYFZSA-N 413.497 2.374 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc4c3CCCC4)cc2F)C[C@H](C)O1 816890958 DBJXSYSKXIVJBY-GJZGRUSLSA-N 401.486 2.226 10 20 HECD COc1ccc(-n2c(C)cc(-c3nc(-c4cn(CCO)c(=O)nc4O)no3)c2C)cc1 904861928 UTUSCUDJFWBNAA-UHFFFAOYSA-N 423.429 2.074 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(F)c(F)c1F 918285128 ZULCCMVOQQVXOQ-UHFFFAOYSA-N 411.355 2.335 10 20 HECD Cc1noc(C)c1CSCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338423 UQWBIHLYGSTLJE-UHFFFAOYSA-N 423.560 2.076 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COCC3CC3)cc2F)C[C@@H](C)O1 919150791 HKMWQZCYTZUNEO-GASCZTMLSA-N 408.470 2.025 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)c1 1322899511 ZTWXHNKEAHODGS-SECBINFHSA-N 412.851 2.425 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(CO)on3)CCC2)cc1)c1cc(O)nc(O)c1 1788427695 DLMBGHQNMURKGN-UHFFFAOYSA-N 424.413 2.035 10 20 HECD COc1ccc(N2CCN(c3cc(N4CCCC[C@H]4CO)ncn3)CC2)cc1F 302869999 AXTOSCAJTPYXLT-KRWDZBQOSA-N 401.486 2.302 10 20 HECD CCOC(=O)c1cnc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)cn1 530536346 AFPLHHFUASZJEQ-UHFFFAOYSA-N 406.442 2.476 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN(c3cccc(O)c3)CC2)n(C)c2ccccc12 583584267 GRZZCMBALGSPIS-UHFFFAOYSA-N 406.486 2.157 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1ccc(N2CCCC2=O)cc1 608259104 JRODMVIHZRTNQU-UHFFFAOYSA-N 401.488 2.467 10 20 HECD CCSc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 727798505 CKXYDUOCWPYNAW-UHFFFAOYSA-N 405.545 2.358 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3CCCN(C(C)C)C3)CC2)cc1 729607577 QUBQFCQGCTYQGA-FQEVSTJZSA-N 417.598 2.237 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1F 740609182 GLBRIFDBEPGHHI-UHFFFAOYSA-N 407.467 2.337 10 20 HECD NC(=O)[C@H]1CC(C(=O)NCc2ccc(N3CCCCC3)cc2)=NN1c1ccccc1 742475902 FEBCGQSBHCDIQN-OAQYLSRUSA-N 405.502 2.413 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC[C@H](CNS(N)(=O)=O)C3)c2C)c1 749349358 KILVVXXBEAAZFW-GOSISDBHSA-N 418.563 2.356 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(N(C)C)n1 750233801 UHWXZEOPTWJHAD-MRXNPFEDSA-N 411.506 2.109 10 20 HECD COCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCCO1 752850601 KRFRCAKMUVWFHD-KRWDZBQOSA-N 419.501 2.468 10 20 HECD COc1ccc(N2CCN(CC(=O)NCCOc3ccc(F)cc3)CC2)cc1F 753858591 XTEIAKNIZVTAHA-UHFFFAOYSA-N 405.445 2.291 10 20 HECD CC(=O)N1CC[C@@H](CN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 755044257 CAHZTOMZHJAGNX-INIZCTEOSA-N 419.481 2.201 10 20 HECD Cc1cc(C(=O)NCCC(=O)NC(N)=O)c(C)n1-c1ccc(Br)cc1 758297615 FHSZOOSWODWTEM-UHFFFAOYSA-N 407.268 2.171 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C)c(S(C)(=O)=O)c1 759015777 WZCCMKLYEPMFOX-UHFFFAOYSA-N 403.504 2.028 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@@]12CCCO2 759319712 PPLYOFFWKCRSLU-VWPQPMDRSA-N 403.523 2.391 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)CN(Cc4ccccc4)C3=O)cc2)C1 761119736 KBNUCBYXNXMDHW-LJQANCHMSA-N 406.486 2.353 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1cnc(-c2ccccc2)n1 761585854 DWYLONOAIFPIHE-UHFFFAOYSA-N 407.474 2.213 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(Br)c2O)c1 765765466 RXWWUMXHZZCTOP-UHFFFAOYSA-N 415.265 2.162 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 768939009 XXNBNMDQKWNANZ-UHFFFAOYSA-N 419.428 2.189 10 20 HECD Cc1ccc(O)c(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1 769209999 KURYXYXGLRNMFL-UHFFFAOYSA-N 418.515 2.368 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCC[C@H]1c1ccncc1 769443263 ZFIHGKBQKOTYNN-FQEVSTJZSA-N 414.531 2.363 10 20 HECD CS[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H]1N(C)C 776003456 XGHALLFIOUIJGS-RTBURBONSA-N 423.538 2.378 10 20 HECD O=C(Nc1cnc2c(c1)COCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 777238142 PSINFPMHUNSDKX-SFHVURJKSA-N 411.458 2.006 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)(C)OCC3(C)C)CC2)cc1 778280797 XHDYKUJHFOWNOZ-KHPPLWFESA-N 415.534 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3OCO4)CC2)cc1 782829524 XUYDVWDDVUFVOW-KTKRTIGZSA-N 409.442 2.267 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nc(-c2ccccc2)no1 785423903 IHHWZELRXXSVBD-HNNXBMFYSA-N 407.474 2.339 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C 785596989 CGHPCVKVPWQARW-HXUWFJFHSA-N 423.492 2.456 10 20 HECD Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 786112742 XUQTVFSEYLVNOQ-IBGZPJMESA-N 401.482 2.374 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)c1nnc2n1CCC2 786436457 NBYWRAQWNLZFRF-INIZCTEOSA-N 424.549 2.487 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3cc(N4CCNC(=O)C4)ccn3)cc2)CC1 786923563 RXOLKNUTVDZQSW-UHFFFAOYSA-N 407.518 2.184 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCS3)cc2F)C[C@@H](C)O1 789833671 IFPADPZGHZHGLO-IJEWVQPXSA-N 409.527 2.067 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)CC3CCC3)CC2)cc1 792791259 IAKYYTQHZXXROH-IBGZPJMESA-N 404.555 2.058 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c(O)c1 794380679 GRWXQYVPDZIKJE-ZSEKCTLFSA-N 403.479 2.154 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)c2cn(C)cn2)NC(=O)OC(C)(C)C)cc1 795249217 QGBAAIDRLRNGRA-MRXNPFEDSA-N 423.539 2.030 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2C 804570026 AGAXVOQWKGOONT-INIZCTEOSA-N 422.529 2.497 10 20 HECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](C)S1(=O)=O 804968772 JTGPNHUBORBWJB-MAUKXSAKSA-N 411.593 2.347 10 20 HECD O=C(OCC(=O)N1CCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 864095235 ACBTVFSHSHMFGR-UHFFFAOYSA-N 410.473 2.034 10 20 HECD CCN(CC)c1ccc(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 917085279 HEFMAKAULILWTJ-UHFFFAOYSA-N 417.579 2.476 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C(N)=O)c3ccccc3)cc2F)C[C@@H](C)O1 918199438 AMVSFZJSSSDXOL-QEEYODRMSA-N 414.481 2.465 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)C1CCOCC1 1800715729 YAXNOCYFVSSMAU-QDMKHBRRSA-N 408.882 2.430 10 20 HECD C[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CC=CCC1 1804339984 FDIAPWGFFMIGPC-YYQBIWNASA-N 421.588 2.231 10 20 HECD Cc1ccc2[nH]cc(CC(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c2c1 1841974161 FBBBDEIDUBGEOB-UHFFFAOYSA-N 420.469 2.342 10 20 HECD O=C(c1ccncc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249941 SKDKFGDTCRMVQD-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)n(C)c2ccccc12 556120959 RUTXIMBAFIJUGK-UHFFFAOYSA-N 406.486 2.121 10 20 HECD COc1cc(Br)cc(CNC[C@](O)(c2nccn2C)C(F)(F)F)c1O 725849529 POJOBHQBGLDMNK-AWEZNQCLSA-N 424.217 2.437 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3[C@H](C)O)cc2F)C[C@@H](C)O1 730260537 BBIBXVDAXNXTKI-PFRQMTDMSA-N 407.530 2.291 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 733648029 ZMARWUUDMCRQBY-HXUWFJFHSA-N 417.598 2.381 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H]2CN2CCCC2)c1 738106131 VGSHVOHDQOTVEB-QFIPXVFZSA-N 401.551 2.487 10 20 HECD CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1ccc(S(C)(=O)=O)cc1 740887506 VYYCQMYMYUTXCP-UHFFFAOYSA-N 403.548 2.247 10 20 HECD CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCC1 742051033 PATBROBXLUWQPS-NRFANRHFSA-N 407.530 2.416 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](C)C(=O)OC(C)C)cc2F)CC1 745808420 LIBUMTXNFAIAMQ-MRXNPFEDSA-N 408.518 2.355 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(N(C)C)ncnc2n1C 747201447 DLMROZYCTYDFNO-UHFFFAOYSA-N 408.506 2.143 10 20 HECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1 754153990 LLODRIIKAPGLQR-OAHLLOKOSA-N 421.357 2.027 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCS(=O)(=O)C[C@@H]3C)c2C)cc1 754661172 XBLOJSURXDXRSY-HNNXBMFYSA-N 418.515 2.182 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccnc3OCC(F)F)cc2)C1 760389096 ILDQKIXZGROQSQ-HNNXBMFYSA-N 418.444 2.357 10 20 HECD CCCCNS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765037395 YTFATRCXBZVNBX-UHFFFAOYSA-N 410.477 2.102 10 20 HECD NC(=O)c1cc(C(=O)NCc2cccc(Br)c2O)nn1-c1ccccc1 765735079 DMVXOKQRNIDTFB-UHFFFAOYSA-N 415.247 2.369 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(C)ccc3O)CC2)cc1[N+](=O)[O-] 768182467 GSGOHZCIUREINL-UHFFFAOYSA-N 421.475 2.124 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1c1ccccc1Br 768465683 PQUUCHVVDYDOIG-FUHWJXTLSA-N 419.275 2.254 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCCc2ccccc2)nc1 774361448 DWKSWOJPQMYPHZ-UHFFFAOYSA-N 421.453 2.412 10 20 HECD CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774362615 NSZNRMUOEFXVBA-UHFFFAOYSA-N 422.865 2.464 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2)cc1 774782199 VHECLWVWOHGZPJ-QFIPXVFZSA-N 424.545 2.153 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc3c(cc2OC(F)F)OCO3)cc1 785434920 XJHRPZFCIIKEEX-UHFFFAOYSA-N 421.400 2.015 10 20 HECD CC[S@](=O)c1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787319561 MCRVNFVPZVQACF-LJAQVGFWSA-N 413.543 2.413 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(N(C)C)cc1 787635594 FFZFIDCZHCGZCW-QRWLVFNGSA-N 400.498 2.488 10 20 HECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 788009447 ZGBDEEREMSDEMH-MRXNPFEDSA-N 416.566 2.473 10 20 HECD Cc1cccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 788154695 XJMIVSNVETYROU-MRXNPFEDSA-N 418.444 2.393 10 20 HECD COC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c([N+](=O)[O-])c1 790101998 UQIANSDYLXIEJW-UHFFFAOYSA-N 404.398 2.489 10 20 HECD COc1ccc(CNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c(O)c1 794376115 AFINAZAHULGKIJ-UHFFFAOYSA-N 414.277 2.497 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc2c1CCO2 796705268 HNHYJIDTJNOTNM-UHFFFAOYSA-N 409.486 2.085 10 20 HECD CCS(=O)(=O)NCCNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799919476 PMZVHUDOLNZPIV-CQSZACIVSA-N 416.975 2.315 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CC[C@H]1CCCCN1C)c1ccc(N2CCOCC2)cc1 803310018 FMHKDGMAAQYGDQ-AZUAARDMSA-N 416.566 2.033 10 20 HECD C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662869 IMENHFBYIGRTPC-ONSXPEOJSA-N 419.522 2.465 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)c1 804117509 CJDNRDIEQYCWPZ-AEFFLSMTSA-N 410.518 2.334 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](C4OCCO4)C3)cc2)CC1 805024385 DNTUXEVMZFMIAL-LJQANCHMSA-N 415.534 2.151 10 20 HECD CCc1cc(CNC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)n[nH]1 805852724 AWCSTIPGZOCFLH-UHFFFAOYSA-N 409.284 2.105 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)C(=O)NCCCSc1nccs1 806279430 NUPLPKCNCBANJG-MRXNPFEDSA-N 418.588 2.474 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1nc(C2CCOCC2)cs1 807023586 AOJFETGZMRKAPS-NSHDSACASA-N 405.476 2.134 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 808237798 GMERIJNXLXPFDW-HUUCEWRRSA-N 415.531 2.062 10 20 HECD Cc1cc(N2CCC(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)CC2)n[nH]1 809678963 WNWVUHLFDYIEFF-UHFFFAOYSA-N 424.549 2.060 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3ccc(-n4cccn4)cc3)cc2)C1 917836696 RIBVSYYJTVXMPB-HXUWFJFHSA-N 417.513 2.433 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 1116419914 UZEQQDPEFJHYFQ-QHCPKHFHSA-N 422.485 2.102 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(O)nc2ccc(F)cc12 1116646386 DDGUGAROVXTROT-INIZCTEOSA-N 414.389 2.395 10 20 HECD O=C(CC(F)(F)F)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809487926 JUQOATCZMJNBLP-UHFFFAOYSA-N 401.385 2.290 10 20 HECD Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)nc1 1810542969 GVZNQTFYSHDPTP-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)C1 1810554622 QFYXVXMBLMBIAH-OLMNPRSZSA-N 415.515 2.213 10 20 HECD CCN1CCN(CCCCNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 46753611 NNIPQXVICVGMGF-UHFFFAOYSA-N 419.639 2.457 10 20 HECD CCCS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 106256126 JHKNFEZDOUQJBI-UHFFFAOYSA-N 404.536 2.423 10 20 HECD COc1ccc(N(C)CC(=O)NCC2(N3CCOCC3)CCCCC2)cc1OC 140302515 HKGZOGIRRKVKMV-UHFFFAOYSA-N 405.539 2.291 10 20 HECD O=C(NCC(=O)N1CCc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 303207001 ZFYMFLOUBQRQNQ-UHFFFAOYSA-N 422.529 2.284 10 20 HECD O=C(CNC(=O)NCc1ccco1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566956 ICCOBPWKHGKGJL-UHFFFAOYSA-N 422.432 2.465 10 20 HECD Cc1n[nH]cc1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 732046085 RBHYRNWXIFJIOG-LBPRGKRZSA-N 424.548 2.368 10 20 HECD CCN1C(=O)c2ccc(C(=O)NCCCSc3nccs3)cc2S1(=O)=O 733973035 QONJKALGYQFLTN-UHFFFAOYSA-N 411.530 2.220 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1OC 739670325 IGJACAONSNWZGO-CHWSQXEVSA-N 405.542 2.091 10 20 HECD CNC(=O)c1cccc(CCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 741081723 YZSLKFORUKQEDK-QGZVFWFLSA-N 410.518 2.486 10 20 HECD Cc1nn(C)c(C)c1C[C@@H](C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 745277152 RTEYKIKYEKWWFW-OAHLLOKOSA-N 400.523 2.483 10 20 HECD COCCOC[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 745606848 OKHZZPZJHBEMHF-CQSZACIVSA-N 419.444 2.393 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](c1ccccc1)n1cccn1 748713463 YUNSBVLVRIWBIZ-OAQYLSRUSA-N 424.526 2.024 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3ccn(-c4ccccc4)n3)cc2)C1 756916174 KBOLPRDJMQWQPM-LJQANCHMSA-N 417.513 2.433 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3c(C)ccn(C)c3=O)CC2)cc1 758625900 DZZCHBBDNSKNNC-UHFFFAOYSA-N 413.522 2.036 10 20 HECD CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769032155 BUIHCBQLQYHTLR-UHFFFAOYSA-N 416.610 2.439 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3nc(N)ns3)CC2)cc1F 769104607 GTJVACTWZQXSFY-UHFFFAOYSA-N 407.519 2.137 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(N2CCOCC2)cn1 772439754 WWMBJIOVKMGFKK-UHFFFAOYSA-N 411.506 2.419 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 772998350 JOMGEJDNVXTXAI-GASCZTMLSA-N 408.518 2.401 10 20 HECD CCN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774358066 FQVBTENQUHCSGH-FQEVSTJZSA-N 422.529 2.053 10 20 HECD C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1sccc1C(N)=O 775258474 BPMTXWPMTOWTQB-KBPBESRZSA-N 402.520 2.361 10 20 HECD COC(=O)CN(Cc1cc(OC)cc(OC)c1)C(=O)/C=C/c1ccc(O)c(O)c1 779511667 VOTHZQFCOMZZRI-FNORWQNLSA-N 401.415 2.330 10 20 HECD CC(C)(O)CCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400572 YCNSNPYLOHPMON-UHFFFAOYSA-N 424.431 2.419 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(CN2CCCC2=O)cc1 787430051 DURXQAQMNZAIEK-UHFFFAOYSA-N 422.529 2.150 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(O[C@H]4CCOC4)cc3)cc2)C1 788741445 GYBTYFZHNMAVDS-KNQAVFIVSA-N 423.513 2.486 10 20 HECD CSCCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789827449 SRLPEWCBSDBMTM-HUUCEWRRSA-N 411.543 2.267 10 20 HECD CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccc(N(C)C)c(F)c3)cc2CC1 790181720 BTQXPUGOZHOEPH-UHFFFAOYSA-N 419.522 2.317 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@@H](C(F)(F)F)OC(C)(C)C3)CC2)cc1 795061046 JLWFFXFTDYDNNB-KRWDZBQOSA-N 415.456 2.386 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c(O)c1 797388254 VISPBEZJKCLAHK-UHFFFAOYSA-N 421.457 2.251 10 20 HECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CC[C@H](C)C1 803303263 JTLDSSOLRUHRFN-WAOWUJCRSA-N 417.550 2.364 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1(C)C 804314894 BUHWVLXCDKUKBT-WOJBJXKFSA-N 417.550 2.442 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)CC2 804360863 RYFNEDHHXSHEKV-GOSISDBHSA-N 424.549 2.103 10 20 HECD O=C(NCCOC[C@H]1CCOC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804935744 WYOBDIHGAIAMMB-KRWDZBQOSA-N 404.507 2.223 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4oc(O)nc4c3)CC2)cc1 806320100 CYEDKDJFFCIPDM-UHFFFAOYSA-N 410.474 2.484 10 20 HECD COC1CCC(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 806541397 RSBMNWWCKPYOPN-UHFFFAOYSA-N 417.550 2.193 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291514 XOSKFNNTBGHKCF-MRXNPFEDSA-N 416.522 2.051 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H](OCC(F)(F)F)C1 807291722 MIWLBNLVCJSJGS-KRWDZBQOSA-N 411.424 2.249 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 807481160 IICIUKQRLMIHFT-RDTXWAMCSA-N 418.538 2.349 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCCN1CCCO[C@@H](C)C1 807928601 BODIUVXJAXRXPC-SFHVURJKSA-N 405.539 2.138 10 20 HECD CCOC1(C)CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 813609984 IGBINIABQBPFLA-UHFFFAOYSA-N 404.555 2.418 10 20 HECD Cc1cc(C(=O)N[C@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1Br 819721500 VGMNSYVHPIXIIZ-AWEZNQCLSA-N 404.264 2.344 10 20 HECD O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)NCCCO 864049544 JMHIJRHUDGVKTN-WQLSENKSSA-N 415.334 2.149 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCn3cc(Cl)cn3)CC2)cc1 917625531 XQRMXAAMOVVDHM-UHFFFAOYSA-N 405.930 2.264 10 20 HECD COCCOc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 918207176 AZPBFACDHQFMBE-UHFFFAOYSA-N 418.469 2.082 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1 919663602 MPTVWBLFTGFKRC-UHFFFAOYSA-N 410.474 2.461 10 20 HECD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1ccc(N2CCC(CO)CC2)cc1 919969962 LPCCXLAQTIGNGQ-UHFFFAOYSA-N 423.473 2.470 10 20 HECD COc1cccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 920994542 DWUHMEADCYKIHD-UHFFFAOYSA-N 405.545 2.417 10 20 HECD O=C(COC(=O)c1ccccc1N=Nc1ccc(O)cc1)N[C@H]1CCS(=O)(=O)C1 1317690892 ZQBAYMZWUFOTIB-AWEZNQCLSA-N 417.443 2.268 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)noc1C(F)(F)F 1320394594 SFAXOWPOXXOZAF-JTQLQIEISA-N 402.325 2.317 10 20 HECD CC(C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1816771401 LQWLPNHZQRDVJK-ZDUSSCGKSA-N 423.564 2.308 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1 1823077350 GNRCFQRVJYOYLM-CYBMUJFWSA-N 403.414 2.414 10 20 HECD CCn1nc(C)c(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1C 727602657 VXIMFIFCRSHFAM-UHFFFAOYSA-N 414.554 2.150 10 20 HECD COc1cccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1O 727760945 FEPJNZDVWRTANL-ZACQAIPSSA-N 400.475 2.383 10 20 HECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2cccc(OC)c2O)c(OC)c1 729861481 PGMQPDZTWAFMJH-QGZVFWFLSA-N 414.458 2.339 10 20 HECD CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 730120368 KEWAVTKEYVTWJR-QGZVFWFLSA-N 404.511 2.332 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(Cc1cscn1)c1ccccc1 731176918 GASZSXURJJGQGP-UHFFFAOYSA-N 400.485 2.174 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnn(-c2ccc(F)cc2)n1 738512584 AHYATALXJWKEID-UHFFFAOYSA-N 413.428 2.437 10 20 HECD CCN1CCC(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 740874521 MBLAGOHTVLATLS-QZTJIDSGSA-N 420.573 2.472 10 20 HECD O=C(NCCCN1C(=O)CCC1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743598298 LKNYAWVDODVTGH-AWEZNQCLSA-N 424.448 2.095 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 745985461 JAWHGWNMHYUXMI-SFHVURJKSA-N 422.529 2.463 10 20 HECD O=C(NC[C@@]1(O)CCSC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747584938 DKCYMQCUJNUSKR-ACJLOTCBSA-N 401.479 2.424 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3cc(F)cc(C(C)=O)c3O)CC2)cc1 748046744 MQTVTKKKQJTYJM-UHFFFAOYSA-N 422.478 2.249 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)C(=O)NC4CC4)CC3)c2C)c1 749347769 HDLBUNXAAPKULU-UHFFFAOYSA-N 422.529 2.274 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(CNC(C)=O)ccc2OC)c1 751316734 ACKYKZQDASGFJH-GFCCVEGCSA-N 408.476 2.085 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1cccc(Br)c1 753637386 UWQQOBOCNXXQJG-LLVKDONJSA-N 407.264 2.338 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(C(N)=O)c4ccccc43)CC2)cc1F 753740023 YGQSLFDDWQZDDJ-UHFFFAOYSA-N 410.449 2.237 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc([N+](=O)[O-])c3)CC2)cc1F 753861073 LNWFNKMVXQGVSF-QGZVFWFLSA-N 405.426 2.304 10 20 HECD CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 755328121 CVGBPGWECXRSDV-WFASDCNBSA-N 410.517 2.488 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc([N+](=O)[O-])ccc3C)CC2)cc1 758222935 JCAJGCLBGRHQFB-IBGZPJMESA-N 401.463 2.474 10 20 HECD CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 759206201 APWDQVCSYPOWNT-IAGOWNOFSA-N 424.409 2.294 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(OC)c3ccccc3F)nc12 759281678 PVXVKQNTQSLJMS-FQEVSTJZSA-N 417.393 2.356 10 20 HECD COCCS(=O)(=O)c1ccc(CN[C@H](C)c2cc(C(=O)OC)ccc2O)cc1 760020220 XNWFAKVZSWVJGL-CQSZACIVSA-N 407.488 2.450 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1Cc1ccnc(N2CCOCC2)c1 761001390 FKDQLIBCZFGKLH-UHFFFAOYSA-N 416.865 2.242 10 20 HECD CSc1nsc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 762951561 GDPDOFKYPXGCQZ-LBPRGKRZSA-N 406.537 2.283 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 765802406 QKRLWCLOEDYMBI-RDTXWAMCSA-N 403.504 2.014 10 20 HECD COc1ccc2c(c1)CCCCN2Cc1nnnn1-c1ccc(S(C)(=O)=O)cc1 766271224 YLTNWOQZTFLPSL-UHFFFAOYSA-N 413.503 2.417 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCCCSc1nccs1 766511953 HBQHELVJLOAIBW-UHFFFAOYSA-N 411.505 2.406 10 20 HECD COC(=O)C1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCC1 767499301 FZADZJNARNBHBJ-UHFFFAOYSA-N 406.438 2.476 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1 767793203 AQGWIRCTBYLHMH-CQSZACIVSA-N 406.504 2.227 10 20 HECD Cn1ncc2c(N3CCN(Cc4cccc(Br)c4O)CC3)ncnc21 768234937 SJCOJWRLCZYMJJ-UHFFFAOYSA-N 403.284 2.154 10 20 HECD CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NCc2ccccc2O)cc1Cl 768998256 KLFPXRFNPSBIOR-UHFFFAOYSA-N 404.854 2.185 10 20 HECD CCO[C@H](C)c1noc(CN2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)n1 774903192 ISYAFPMZJIZFMF-CYBMUJFWSA-N 421.454 2.107 10 20 HECD COc1ccc(O)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 775671144 WQFUYGLMFNNCAW-UHFFFAOYSA-N 406.869 2.227 10 20 HECD COc1ccc(O)c(CNCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c1 776039250 QYMDWEJVUJYSSY-IBGZPJMESA-N 400.475 2.365 10 20 HECD COc1cc(OC)cc(C(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1 779499410 MICXRMPVVZWURR-GQCTYLIASA-N 412.442 2.113 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)Cc2ccn(C)n2)NC(=O)OC(C)(C)C)cc1 782711293 IYBYEGNVBJONQX-SFHVURJKSA-N 401.511 2.411 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C[C@H](NC(=O)OC(C)(C)C)CC1=O 782926883 PMTLAVSGKMLMGC-GOSISDBHSA-N 418.538 2.038 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)O[C@H](C)C2 786625463 IJHKELNVKVGNPA-CYBMUJFWSA-N 415.465 2.156 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC2(CCOCC2)O1 790667168 XDLMVPZECSVNDV-INIZCTEOSA-N 421.513 2.266 10 20 HECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CC[C@@H](C)C1 803303260 JTLDSSOLRUHRFN-DBXWQHBBSA-N 417.550 2.364 10 20 HECD COc1cccc([C@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CCO2)c1 803664870 QKOKYRDQGHBHOV-HXUWFJFHSA-N 415.465 2.117 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)C3CCCCC3)cc2F)CC1 805006816 HHWJRNCCDDDZAJ-UHFFFAOYSA-N 404.530 2.375 10 20 HECD CC[C@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007909 UOUHEPPRUJSLTR-PKOBYXMFSA-N 404.530 2.279 10 20 HECD C[C@@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807013608 AQXPRCHRMNEKGP-WIYYLYMNSA-N 412.578 2.387 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccccc1-c1cnn(C)c1 807098087 STWDVEQCIWBQBD-UHFFFAOYSA-N 405.502 2.394 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(OC(F)F)nc1 807387781 WNICIPWFPGSAPQ-UHFFFAOYSA-N 416.178 2.406 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)c1ccc(N(C)C)cc1 807670205 BSTJHTDFKFUVHG-YWZLYKJASA-N 400.498 2.488 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccccc1-c1cnn(C)c1 808357424 GQYVBFOXBZXIKA-UHFFFAOYSA-N 405.502 2.428 10 20 HECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1cc2c(cc1O)OCO2 809720065 WYSCSSYGIOLINF-AWEZNQCLSA-N 408.451 2.105 10 20 HECD COc1ccc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(OC)n1 811970482 CZZQEOKHXZNCQH-UHFFFAOYSA-N 400.479 2.277 10 20 HECD NC(=O)c1cc(Cl)ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917197149 PKEDBZABASKBMN-UHFFFAOYSA-N 421.856 2.110 10 20 HECD Cc1[nH]nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1Br 919754020 LCTYUDZUCJZQLM-CYBMUJFWSA-N 420.311 2.112 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2cc(F)c(F)cc21 920194533 FJGALOIPFLKLOZ-UHFFFAOYSA-N 401.413 2.007 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](C)NC(=O)C1CCCCC1 1325762003 GOTCBABJQAWQHT-PBHICJAKSA-N 420.506 2.163 10 20 HECD Cc1ncoc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932538 HRRPSWMMLRUTQW-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cccnc2n1)c1cc(O)nc(O)c1 1798011795 NJEVCBPGTGQYMQ-MUJYYYPQSA-N 419.441 2.002 10 20 HECD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)s1 1804332265 UQCXDBFBPZIJMF-CLLJXQQHSA-N 423.585 2.169 10 20 HECD CCN(C)[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831073708 STIWIIJQNDTAOK-CRAIPNDOSA-N 418.538 2.066 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)nc1 1842507501 FWXAZRCTAWNWII-VMPITWQZSA-N 409.442 2.037 10 20 HECD COc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc2c1 1843249566 ZHPFVZWKCASUQS-UHFFFAOYSA-N 423.425 2.378 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)C1 1845806057 XQBAYTZTXIBUTQ-XFJVYGCCSA-N 406.891 2.443 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3C(=O)NC4(CCCC4)C3=O)CC2)cc1 110353275 CDGLFAVEZXQAKJ-UHFFFAOYSA-N 414.506 2.035 10 20 HECD CN(C)C(=O)C1(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCC1 303577350 JUZXGWVJEQARHO-UHFFFAOYSA-N 402.539 2.313 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 726239766 YHNGAZKZABSAJF-WOJBJXKFSA-N 417.598 2.237 10 20 HECD COc1cccc([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 732242280 WVKGAIDFELICPI-HXUWFJFHSA-N 403.454 2.204 10 20 HECD C[C@@H](NC(=O)N1CCC(OCCN(C)C)CC1)c1ccc(N2CCOCC2)cc1 734271265 FVNVVCDDSZCLJJ-GOSISDBHSA-N 404.555 2.336 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccccc1CN1C(=O)CNC1=O 734513211 VKMOLVPPXXZPSZ-UHFFFAOYSA-N 405.505 2.499 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc(C(=O)N2CCN(C)CC2)cc1 734521263 AINFXYYCZZBROR-UHFFFAOYSA-N 423.561 2.448 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1 737182228 FSWIBAOKVPBQRS-HUUCEWRRSA-N 413.474 2.442 10 20 HECD O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ccc(N2CC=CC2)cc1 741082244 GYTBIMYQPCWRTJ-UHFFFAOYSA-N 419.529 2.211 10 20 HECD Cc1nc(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2)n[nH]1 741100318 ZEGRBYMQXXKDNM-UHFFFAOYSA-N 402.458 2.411 10 20 HECD CCCNC(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 741182081 XCDDPGZKYCSRTE-FQEVSTJZSA-N 422.529 2.458 10 20 HECD COC[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 743769737 KCWQAWQTRRLAJC-VEMDQMBVSA-N 414.574 2.243 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1 744884850 MOSLGGXIGYJQRQ-UHFFFAOYSA-N 416.503 2.271 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCS(=O)(=O)C1 745446725 NSCRXIVVCOUDPI-NSHDSACASA-N 405.314 2.121 10 20 HECD CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 746760659 YSMMETRLWWZGRT-LJQANCHMSA-N 422.545 2.305 10 20 HECD COc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 751212469 GPWKIZAUPWBXKB-UHFFFAOYSA-N 424.544 2.348 10 20 HECD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 753645515 UXVWOQUIQJMAII-ZDUSSCGKSA-N 404.488 2.208 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 756396596 PPHQGQNDSOCDGK-CQSZACIVSA-N 403.479 2.474 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 759603671 ZLLHWOFJMQAJPE-NNWRFLSQSA-N 405.583 2.361 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(OC(C)C)c3)nc12 759965635 DHJQMVZSQKODGG-UHFFFAOYSA-N 400.391 2.151 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](CC(=O)OC(C)C)C3)CC2)cc1 766904982 JCIAPQQOEOMDHV-LJQANCHMSA-N 417.550 2.398 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cc(C)c(C)cc3O)CC2)cc1 769380314 SRYUJGKFFVTGBJ-UHFFFAOYSA-N 417.575 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)CCCNC(=O)c3cccnc3)CC2)cc1F 772105814 MTQMLAGUEQYEOC-UHFFFAOYSA-N 400.454 2.088 10 20 HECD COc1ccc(CNC(C)=O)cc1S(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773089673 UAZFUPLVORVING-AWEZNQCLSA-N 405.520 2.437 10 20 HECD O=C(NCCC1=CCCCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774684610 BSOBUAOUARQOIY-UHFFFAOYSA-N 403.498 2.410 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCCO[C@@H]3CC(C)C)CC2)cc1 775870487 MOFRANTYFDODBW-YMPZKCBVSA-N 405.583 2.361 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1 776038944 OCFAQMFUBZDBIG-UHFFFAOYSA-N 412.414 2.330 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 778296148 ZGUDIKIVOQLFDC-OTXYMOGGSA-N 415.534 2.220 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](CC(F)F)C(=O)O)cc2F)C[C@@H](C)O1 780445840 TZGLXBAYNHKGJL-JTNHKYCSSA-N 403.401 2.347 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 780822297 ZLZNPJMHUIFJCP-UXLLHSPISA-N 418.513 2.249 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785294749 DZGUWZZTNDNGSN-JTQLQIEISA-N 405.838 2.396 10 20 HECD Cc1cccc(Cn2nccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785305326 XGRCQSOABICDQL-OAHLLOKOSA-N 408.458 2.337 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](C)NC(=O)c3ccccc3)cc2)CC1 786258750 GXKSTUCVDLLENU-SFHVURJKSA-N 422.529 2.180 10 20 HECD CCN1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 787324847 KVNJUYGKFFOLMW-HNNXBMFYSA-N 419.481 2.343 10 20 HECD COCCN(Cc1ccco1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789862556 WAWKUTCDFRYIHE-UHFFFAOYSA-N 417.531 2.124 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)c2cccc(O)c2O)CC1 790632151 WLYXCXYQASHAKY-UHFFFAOYSA-N 419.522 2.105 10 20 HECD CS(=O)(=O)C1(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 793061468 KIBVXCDTOCRGPH-ZDUSSCGKSA-N 417.478 2.133 10 20 HECD CCOc1ccc(C(=O)NCC(=O)NCc2ccc(OC)cc2O)cc1OCC 794379077 YKPLDAQZNKKYPK-UHFFFAOYSA-N 402.447 2.244 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C12CCC2 803308761 JPJQDJHMPQOEMW-LSTHTHJFSA-N 415.534 2.164 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1 806423860 FDXIJFXFDXOFKB-QFIPXVFZSA-N 408.546 2.458 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1Cc1ccccc1 807290415 ISJTWOZVNVEPDM-UGKGYDQZSA-N 418.541 2.458 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCO[C@@H](C2CC2)C1 807769072 DBKPQVDZTNHJNI-MAUKXSAKSA-N 423.460 2.010 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)c3ncc(C)s3)CC2)cc1 808824309 PUAUEOHMPSXWSJ-OAHLLOKOSA-N 416.547 2.419 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1CC[C@@H](C2CC2)C1 808856523 VHABRLVNVLLCDT-OAQYLSRUSA-N 410.562 2.093 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)Cc1ccccc1 918204116 RWJFODCBODERMP-GOSISDBHSA-N 401.482 2.190 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)COc1ccccc1 918213190 HZTBXESTXMRJLZ-GOSISDBHSA-N 417.481 2.026 10 20 HECD Cc1ccc(CC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)o1 1846669584 HMBOGCBADNAJMU-UHFFFAOYSA-N 420.469 2.127 10 20 HECD Cn1c(=O)c2ccccc2n2c(CN(Cc3ccccc3O)C[C@@H]3CCCO3)nnc12 302834435 UWBUWCWJIKLNNQ-KRWDZBQOSA-N 419.485 2.468 10 20 HECD Cc1cc(C(=O)CN2CCN(CC(N)=O)CC2)c(C)n1-c1cccc(C(F)(F)F)c1 303324527 VAXWVLCWQDBDAH-UHFFFAOYSA-N 422.451 2.399 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCCNS(=O)(=O)c1ccc(F)cc1 434238763 FYZKGRGQVAIZPF-UHFFFAOYSA-N 421.494 2.376 10 20 HECD COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCN(c2ccc(OC)cc2)CC1 726594233 KMLCHPFOBHQNJT-UHFFFAOYSA-N 419.503 2.210 10 20 HECD Cc1noc2ncc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc12 726792529 AXVCFIHGYBREHI-UHFFFAOYSA-N 402.476 2.189 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1 728943985 HCOUPOODQVDPAP-HNNXBMFYSA-N 413.474 2.434 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1 729062127 NTWPNPUEKKSDOK-ZDUSSCGKSA-N 413.430 2.169 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCn2nc3n(c2=O)CCCC3)cc1F 731364999 YFKBMFIWIFQTAW-UHFFFAOYSA-N 418.517 2.256 10 20 HECD COc1ccc(N2CCCN(C[C@H](O)Cn3c(-c4ccccc4)noc3=O)CC2)cc1 731531831 UTNCVKXRTXOCJM-FQEVSTJZSA-N 424.501 2.085 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1 734015335 HSKXVUUASACKPY-CQSZACIVSA-N 422.478 2.257 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)c1 734879020 ZBIIGOXRULJMTM-OAHLLOKOSA-N 407.467 2.302 10 20 HECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 737156968 GLFFFUPZKIVYFG-MRXNPFEDSA-N 424.501 2.322 10 20 HECD CCN(CC(=O)NCCCN1CCCC1=O)Cc1cc(Br)ccc1O 743871061 OJKRMGREFNEPQR-UHFFFAOYSA-N 412.328 2.105 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CC(=O)N(c2cn[nH]c2)C1 748853375 NZEWOZOELDCPRC-KBPBESRZSA-N 419.432 2.149 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(CC(F)F)n3)cc2)C1 748950093 XSWWWOGYYRCFER-CQSZACIVSA-N 406.437 2.172 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 749730054 HOOGGABKWQCTLI-UHFFFAOYSA-N 404.517 2.272 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(OC[C@@H]2CCCO2)CC1 751604902 BQYWBPMMBHGIFS-NRFANRHFSA-N 403.523 2.393 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@H]([C@@H]4CCCO4)C3)cc2F)CC1 757199999 KWWJFZAGOSJXSJ-LEWJYISDSA-N 420.529 2.057 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(C)cc3[N+](=O)[O-])CC2)cc1 758221328 BALJCMKKLLBFTO-SFHVURJKSA-N 401.463 2.474 10 20 HECD COc1cc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccn1 759216249 MTVRZYUADXLUNH-UHFFFAOYSA-N 416.478 2.148 10 20 HECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n(-c2ncccn2)n1 767969127 RJXBDNSIECEESW-UHFFFAOYSA-N 407.478 2.107 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 768328585 VZBJYHDXMUQETH-WMLDXEAASA-N 413.465 2.438 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1 769027677 NJGJMLIRCTVESL-LRTDBIEQSA-N 403.479 2.469 10 20 HECD C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CN(C)CCO1 770124735 ROQSDQBGQUZCEB-MPGHIAIKSA-N 412.481 2.275 10 20 HECD CCOC1CC(O)(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 770261848 KVZGUDPBWAWTRH-MZJZNKMSSA-N 409.502 2.169 10 20 HECD Cc1[nH]ccc(=NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1Cl 771764785 DOLACOLCOYMQHW-UHFFFAOYSA-N 408.911 2.022 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(C)c1Br 773612470 SIJMMGGOAXIFQB-UHFFFAOYSA-N 416.659 2.357 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCCCC1=O 775096796 OIJLEIJBKIWJOK-UHFFFAOYSA-N 402.539 2.010 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cc(Cl)cc(F)c2O)CC1 775646870 LBFJVDVVVJWKQZ-UHFFFAOYSA-N 403.863 2.296 10 20 HECD CN(C(=O)CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1)C1CCCCC1 779510927 CTDCLZQPOPIETO-NTMALXAHSA-N 401.507 2.046 10 20 HECD C=CC(=O)NCc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786655043 BVSHAEFDUBYNLA-UHFFFAOYSA-N 420.513 2.087 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccnc3N3CCCC3)cc2)CC1 786658634 BYGVFGGHMATNTE-UHFFFAOYSA-N 407.518 2.280 10 20 HECD Cc1cc(C(=O)CN2C[C@H](C)O[C@H](CO)C2)c(C)n1-c1ccc2c(c1)OCCO2 787315081 UHBIMCFIDCCPJO-YJBOKZPZSA-N 400.475 2.130 10 20 HECD C[C@@H]1CCCC[C@H]1OCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787987620 LLVDLDHDYKFSFM-WIYYLYMNSA-N 417.550 2.193 10 20 HECD C[C@H](NC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccc(N(C)C)cc1 790503571 VUOSSVBXXUOSTE-HNNXBMFYSA-N 405.520 2.079 10 20 HECD CNC(=O)[C@]1(C)CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C1 797438379 PIRGSGOKUQOHAH-CQSZACIVSA-N 417.216 2.237 10 20 HECD O=C(C[C@H]1CCCS(=O)(=O)C1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835076 JQIBCHGDGIJJAM-PBHICJAKSA-N 414.955 2.341 10 20 HECD Cc1cc(CCNC(=O)NCCS(=O)(=O)NC2CC2)c(C)n1-c1ccccc1 916220895 GUXGHBQGAPGEQC-UHFFFAOYSA-N 404.536 2.018 10 20 HECD O=C(CN1C(=O)NC2(CCCCC2)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 920496180 UARMCRXNUMHWFB-QGZVFWFLSA-N 415.490 2.155 10 20 HECD C[C@@H]1CCN(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1254033652 SJALIAWWKDMZSX-CYBMUJFWSA-N 409.533 2.326 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1318646831 NTZUOVSXAZOBDN-QGZVFWFLSA-N 420.554 2.237 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)[C@H](C)N2CCN(c3ccc(OCC)cc3)CC2)C1 1319715412 RROPQSRBNNKJBR-OALUTQOASA-N 417.550 2.398 10 20 HECD CCOc1ccc(N2CCN(Cc3c(C)nn(CCS(C)(=O)=O)c3C)CC2)cc1 1326957874 RUJKCFAPAFZMRQ-UHFFFAOYSA-N 420.579 2.265 10 20 HECD CON(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1332246399 CJYNVPDCFGIQKB-UHFFFAOYSA-N 422.526 2.372 10 20 HECD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)n1ccnn1 1788429111 VTIMLORXTMOSOF-CYBMUJFWSA-N 422.445 2.093 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(c3ccccc3F)CC1)C2 1843251199 GMLNQKVOEVMEPC-UHFFFAOYSA-N 411.433 2.181 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)cc3C)CC2)cc1 56966080 YAHFIPHRZWEOCY-UHFFFAOYSA-N 403.548 2.413 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3cccc(C(=O)NC4CC4)c3)CC2)cc1 302918372 USCZBEBVJYLIBE-UHFFFAOYSA-N 408.502 2.348 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)cc1 726632430 WBLUJUFPVPYKCU-UHFFFAOYSA-N 423.922 2.395 10 20 HECD CSc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 732859797 FSTOGNPXZBLJNA-UHFFFAOYSA-N 408.451 2.450 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1O 737279198 VXMDNFLAUUAYDZ-UHFFFAOYSA-N 411.458 2.200 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1NC(C)=O 741099540 DKYUECKENOEIPU-UHFFFAOYSA-N 408.458 2.285 10 20 HECD COC(=O)c1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 742920746 NBDQWQQMDPKSTD-UHFFFAOYSA-N 403.504 2.095 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSCc3c(C)noc3C)CC2)cc1 742926620 KHZZAFRUZPZMQA-UHFFFAOYSA-N 418.563 2.472 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 749627835 KVNOQSMAYNJJKO-UHFFFAOYSA-N 419.489 2.215 10 20 HECD Cc1ccc(C(=O)N2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)c(O)c1O 751532699 FBSMBBKOGOZWBY-UHFFFAOYSA-N 408.451 2.128 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1 755924106 FLCJDCVPRSLGKF-ZDUSSCGKSA-N 413.540 2.354 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)CCC(=O)N4C)CC2)cc1 758798179 KIPRLEYMWQYHOE-UHFFFAOYSA-N 422.529 2.156 10 20 HECD COc1cc(N2CCN(C(=O)NCc3cccc(O)c3)CC2)cc(OC)c1OC 759283330 ZMINGTZUEYMOGT-UHFFFAOYSA-N 401.463 2.450 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 760086104 RYLWXZCSWCSKMX-AWEZNQCLSA-N 423.510 2.274 10 20 HECD Cn1cc(-c2ccccc2CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 760807590 FRJHYPDNZOALIG-UHFFFAOYSA-N 400.460 2.094 10 20 HECD CC(C)(C)C(=O)N1CCC(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 762873011 NXVPYTWTQDYIBQ-UHFFFAOYSA-N 412.508 2.205 10 20 HECD COc1cc(O)c(CN2CCC(NS(=O)(=O)c3cccs3)CC2)cc1OC 768443112 ZDZILPXBPPWEDD-UHFFFAOYSA-N 412.533 2.414 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)c1 769539186 AHLWWFKRYLINRP-AWEZNQCLSA-N 400.431 2.087 10 20 HECD COc1ccc(N2C[C@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)CC2=O)c(OC)c1 773741764 XRUVKSKUOCVKRO-DZGCQCFKSA-N 414.458 2.215 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccco2)N(C)C)cc1F 774829457 XXCWPLTYSUKOAD-SFHVURJKSA-N 404.486 2.300 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1O 775004380 NAPBKPHZTWXXHN-LBPRGKRZSA-N 409.464 2.410 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 775258008 OISSSGDDGNRNOZ-DYESRHJHSA-N 414.502 2.400 10 20 HECD CN(Cc1ccccc1)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 775984587 XBHJIQRIYJCKMR-IBGZPJMESA-N 417.531 2.404 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F 776656998 DTTLDXVBFUKFPD-KRWDZBQOSA-N 413.440 2.065 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CC3(Cl)Cl)CC2)cc1 778238863 QNEOJSXYMGREEX-UZYOAWRESA-N 412.317 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(O)CCCCCC3)CC2)cc1 778285544 MASUGFFLOJRBMN-KHPPLWFESA-N 415.534 2.102 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@]12CCOC2=O 779254848 YPZKMFHDVPNODX-SFHVURJKSA-N 422.484 2.176 10 20 HECD COC(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(OC)c1 780299549 QTHBEIVWDRRLGU-UHFFFAOYSA-N 413.474 2.251 10 20 HECD O=C(c1cccc(NCc2ccc(N3CCOCC3)c(F)c2)n1)N1CCC[C@@H]1CO 788743166 FIZHGXQKPWTWIB-QGZVFWFLSA-N 414.481 2.266 10 20 HECD COCCOc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931254 ZNDNGEDXYQQTML-UHFFFAOYSA-N 411.502 2.245 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCSC3(CCOCC3)C2)cc1 788966420 UKWOTYVKGSDQDO-UHFFFAOYSA-N 405.564 2.274 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(C(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 799764997 AFLFVPZZMIWPSH-MRXNPFEDSA-N 417.531 2.265 10 20 HECD Cc1cc(C(=O)Nc2cccc(C(=O)N(C)CC(N)=O)c2)c(C)n1-c1ccccn1 803709047 ITOGDUFQPWKZHI-UHFFFAOYSA-N 405.458 2.299 10 20 HECD CS(=O)(=O)CCN1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 805097306 FQCWXJWRRIPQEA-UHFFFAOYSA-N 424.350 2.007 10 20 HECD C[C@@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 807291248 VFVLZRLIOXNNRB-WIYYLYMNSA-N 407.514 2.350 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1ccc(N(C)C)cc1 807670954 JWGGTNOSMRCCDH-SJORKVTESA-N 416.566 2.331 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](CO)CC1 819232398 BQXMSGNUHNNKSZ-ZDUSSCGKSA-N 410.517 2.489 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)NCc1ccccc1 916645210 IYLXKQNYYJSSOT-UHFFFAOYSA-N 404.536 2.014 10 20 HECD CCCCn1c(O)nnc1SCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917184616 JOELBYGUQSCBRX-UHFFFAOYSA-N 423.514 2.168 10 20 HECD Cn1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(Cl)c1Cl 918339882 JLOBAQHMWFXBFH-UHFFFAOYSA-N 416.330 2.497 10 20 HECD C[C@H](NC(=O)Cc1ccccc1NS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 1251761586 ILMGBIXLZGECBB-INIZCTEOSA-N 417.531 2.315 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778900729 FAYVXCKUBYUCHP-PUXBEBEGSA-N 417.506 2.057 10 20 HECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C24CC(F)(C2)C4)C3)=NN1c1ccccc1 1796931181 RSGCJAXUSMEEEB-CRKWVHSTSA-N 424.476 2.310 10 20 HECD Cc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1800717966 DREWZYXFCOXEDI-YOWGUQMCSA-N 418.881 2.277 10 20 HECD O=C(c1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427251 SVPUTWHUDAJHFJ-SFHVURJKSA-N 410.474 2.435 10 20 HECD C/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828198356 XRDKOJYLEIXLTI-VPCUOIRZSA-N 415.471 2.461 10 20 HECD O=C(c1cc(F)cc(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251322 UEVFHKYEOQIOLA-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 110360132 JLNMYSZJLWRVRO-UHFFFAOYSA-N 417.531 2.344 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 116046454 CJKFBAJCIZRXIJ-STQMWFEESA-N 405.430 2.169 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 139942043 CVRLXBVAVRNZJF-RXVVDRJESA-N 404.555 2.240 10 20 HECD NC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 726620592 JBGFSFHCVVJGOD-UHFFFAOYSA-N 410.518 2.036 10 20 HECD Cc1noc(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 727054972 FNEJYABAJRMROF-UHFFFAOYSA-N 406.354 2.034 10 20 HECD Cc1cc(C(=O)CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C)n1-c1ccccc1 727296081 BHNKXULMXIKTMV-FQEVSTJZSA-N 415.559 2.082 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1 728948579 HAXBXANHFAYEIW-DIFFPNOSSA-N 416.400 2.335 10 20 HECD Cc1cc(C(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 729342088 XGORFUIWJAELTN-ZWKOTPCHSA-N 417.531 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3noc4c3CCCC4)CC2)cc1 731279124 FAUCSZYTJKDNFH-LJAQVGFWSA-N 417.531 2.160 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3CCO)cc2F)C[C@@H](C)O1 731751535 ZQQONIOXOYOREU-ZHALLVOQSA-N 407.530 2.292 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1 734178000 RKTRZMDGGWPITR-KRWDZBQOSA-N 403.504 2.158 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(C)c1 741097105 KRNUHAZILLFGAC-UHFFFAOYSA-N 406.486 2.376 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 744357424 QMOFMIJHPZMRDF-UYYRZJCPSA-N 413.518 2.042 10 20 HECD COc1ccc([C@@H](CNC(=O)NCc2cccc(OC)c2O)N2CCOCC2)cc1 745289080 GARONKYXUQXADQ-LJQANCHMSA-N 415.490 2.282 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC(C)(C)C[C@@H](C)O)CC2)cc1 745352097 VLSWDZGQYJFULI-GOSISDBHSA-N 406.571 2.304 10 20 HECD CN1CCCc2cc(CNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C3CC3)ccc21 746879824 GEYVRCPRQZADLW-UHFFFAOYSA-N 405.458 2.144 10 20 HECD COc1ccccc1COC[C@H](O)COc1ccc(N2CCN(C(C)=O)CC2)cc1 755302656 GFRFVZSZQWFINI-NRFANRHFSA-N 414.502 2.320 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)CCc3cccs3)cc2)C1 767489462 AHAHGBSORTYMPZ-INIZCTEOSA-N 407.561 2.112 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 769385724 SQOZVSQXAUZTLG-ZWKOTPCHSA-N 402.539 2.487 10 20 HECD COc1ccc([C@@H](OC)[C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 772881061 JANGBIRMNOJGCQ-SGTLLEGYSA-N 408.476 2.278 10 20 HECD CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774357680 XJPDQVCSUDZCDQ-UHFFFAOYSA-N 415.446 2.030 10 20 HECD O=C(NCc1cccc(O)n1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 777460658 YIKHEXRBKRVAPG-UHFFFAOYSA-N 405.457 2.285 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H](C)C3CCS(=O)(=O)CC3)CC2)cc1 779003963 ALDYUDXFPRYTBN-SFHVURJKSA-N 409.596 2.010 10 20 HECD COC(=O)[C@H]1CCN(Cc2cc(Br)cc(OC)c2O)[C@@H](C(=O)OC)C1 780784269 SKJQGWAHCMPVLN-GXFFZTMASA-N 416.268 2.090 10 20 HECD O=C(OCC[C@@H]1CCOC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785408704 XBEOASLMGSVRTD-NSHDSACASA-N 411.457 2.365 10 20 HECD CC[C@H]1CCCCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716318 CEDLQTYOPAKVEQ-MOPGFXCFSA-N 414.550 2.186 10 20 HECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 797639535 FADNPUAFBCNCFD-NHYWBVRUSA-N 422.507 2.023 10 20 HECD CCC[C@]1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 812010542 QWOZXYSWLLDDFN-GCJKJVERSA-N 402.539 2.082 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ccc(C(N)=O)cn3)CC2)cc1 918210141 WPWDFQFVTAKJQZ-UHFFFAOYSA-N 410.522 2.059 10 20 HECD O=C(NCC1CC1)[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 918223759 KZKHAUPDHNKQSE-SFHVURJKSA-N 418.513 2.110 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2C1 919796498 WSMWWLVQZOLUIL-UHFFFAOYSA-N 422.529 2.096 10 20 HECD Cc1ncncc1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1319706242 AQYZGRDGZKYJML-UHFFFAOYSA-N 401.378 2.356 10 20 HECD COc1cc(N2CCN([C@@H](C)C(=O)NCc3ccco3)CC2)cc(OC)c1OC 1337846392 MSTZOOWAXIGOGR-HNNXBMFYSA-N 403.479 2.132 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ncc[nH]1)c1cc(O)c(O)c(Cl)c1 1802714353 RZQBQGABDFJDAE-BTTYYORXSA-N 418.881 2.359 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(CC(=O)NC4CC4)CC3)c2C)cc1 32242826 RMUKJTYICQEGIK-UHFFFAOYSA-N 410.518 2.139 10 20 HECD COc1cccc(C[C@@H](C(=O)N2CCOc3cc(N(C)C)ccc32)n2nnnc2C)c1 475932547 OPFNKXVVUBIPIU-FQEVSTJZSA-N 422.489 2.266 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 513829400 BQXYYZSRYTZPQQ-UHFFFAOYSA-N 405.432 2.104 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCCC[C@H]1C 726616892 VDLCGMQRXIMLMF-QZTJIDSGSA-N 416.566 2.484 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc1 728187720 PTDHLLUUPVJZGE-UHFFFAOYSA-N 424.545 2.339 10 20 HECD CN(C)C(=O)COc1ccccc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 728301741 XIGXIFJZAHLNCC-UHFFFAOYSA-N 411.502 2.262 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)NC3CCCCC3)cc2F)CC1 730234779 ARBMCMROUCPENL-UHFFFAOYSA-N 419.545 2.216 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)CN3CCN(CC(N)=O)CC3)c2C)c1 730805819 KLNZQQIGOGEDGH-UHFFFAOYSA-N 400.548 2.102 10 20 HECD O=C(COC(=O)c1cc(O)cs1)Nc1cccc(C(=O)N2CCSCC2)c1 733497294 SAPNFGNQHSJJEG-UHFFFAOYSA-N 406.485 2.438 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cc(S(N)(=O)=O)ccc1F 734674213 RSCAFXUTCSEEAX-UHFFFAOYSA-N 408.499 2.271 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1 735518148 IPZXRIJCLYTNBI-DLBZAZTESA-N 413.522 2.367 10 20 HECD COC[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 743769712 KCWQAWQTRRLAJC-GQPJMJRUSA-N 414.574 2.243 10 20 HECD CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 743806627 MYDYBDGJBZWYOD-KRWDZBQOSA-N 417.531 2.358 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)cc1 748049236 GRVGPGNRIGAGEJ-UHFFFAOYSA-N 412.309 2.093 10 20 HECD CN(C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCCCC1 748667280 UITNPIMYUMLAPR-UHFFFAOYSA-N 420.529 2.377 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)s1 749105825 LCELUOYLJSTYEE-UHFFFAOYSA-N 402.469 2.227 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccccc1CN1CCOCC1 749730370 NVIQQBJGXLABEA-UHFFFAOYSA-N 420.560 2.212 10 20 HECD COc1cc(OC)cc(N2C[C@@H](C(=O)NCc3cccc(OC)c3O)CC2=O)c1 752797070 NGYGFNPPRQFNLG-AWEZNQCLSA-N 400.431 2.087 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753858545 WSBDMYFICYUQCP-INIZCTEOSA-N 421.513 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(NC(C)=O)c3)CC2)cc1F 754212609 MUUNCADILOZQGT-UHFFFAOYSA-N 414.437 2.080 10 20 HECD COc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OC)c1 754217551 WLOOCHFXOMRSNT-UHFFFAOYSA-N 417.437 2.139 10 20 HECD CC(=O)N1CC[C@@H](CN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 755046668 QZAXARLNEMMBNG-INIZCTEOSA-N 419.481 2.201 10 20 HECD O=C(CN1CCN(c2cccs2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 757850099 GPKQEHZXRBIXMP-UHFFFAOYSA-N 418.538 2.162 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](c3ccccc3)N(C)C)CC2)cc1 758184611 FEJVIYFSJLYUFW-ISKFKSNPSA-N 412.578 2.071 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccccc2O)c2ccccc12 759033074 UZXDDSVDKCSACI-UHFFFAOYSA-N 408.410 2.352 10 20 HECD COc1cc(N2CCN(C(=O)[C@](C)(O)Cc3ccccc3)CC2)cc(OC)c1OC 760087390 YTXBHHXUYLEFDM-HSZRJFAPSA-N 414.502 2.355 10 20 HECD C[C@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 765735009 BVMZZHSJRBKKDJ-WXHSDQCUSA-N 409.280 2.335 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1 768398588 QAVHSGUYRWFXDT-UGSOOPFHSA-N 423.510 2.244 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2c(c1)C(=O)NC2=O 771059440 RHXZBEVWKJRGHP-OAHLLOKOSA-N 413.861 2.324 10 20 HECD COc1ccc([N+](=O)[O-])cc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772896634 BJWZVNUWBIADGN-UHFFFAOYSA-N 418.425 2.307 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 772998361 JOMGEJDNVXTXAI-HUUCEWRRSA-N 408.518 2.401 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 773618188 IOESSWMDVSBLQD-AEFFLSMTSA-N 418.538 2.257 10 20 HECD Cc1cnccc1OC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 773664616 GTGNDSRIOZKTCJ-UHFFFAOYSA-N 405.476 2.151 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(C(C)(C)C)c3)CC2)cc1 778250553 CGLAUTFNMYOTGP-KTKRTIGZSA-N 411.506 2.490 10 20 HECD COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 785501691 RWSFYYCQCQYEQC-ZDUSSCGKSA-N 403.454 2.403 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cn3c(C)nc4ccccc43)cc2)CC1 786661009 MEICMBHFQXNKFN-UHFFFAOYSA-N 405.502 2.330 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1-n1ccnc1 787442383 LBNSTJVWHVLRML-UHFFFAOYSA-N 420.517 2.387 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3nccs3)cc2F)C[C@H](C)O1 789819959 PJNNWBIJKOALBN-KBPBESRZSA-N 420.510 2.171 10 20 HECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854417 HPJUHNUETIQRFI-ZDUSSCGKSA-N 402.520 2.338 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 789863796 IEKLVLTTYDWCTA-MRXNPFEDSA-N 413.543 2.226 10 20 HECD COc1ccc(CNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c(O)c1 794373804 MGJYUJAGDPSPIP-AWEZNQCLSA-N 407.492 2.010 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCC(=O)NC)cc1C 797071668 QBQGACQUSJTLOG-UHFFFAOYSA-N 413.474 2.203 10 20 HECD CN(C)C(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 799749488 IACVTZBXKQJVJP-UHFFFAOYSA-N 417.531 2.046 10 20 HECD CCOc1cccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 800123302 JGWVKTDUIZRGSO-UHFFFAOYSA-N 417.531 2.232 10 20 HECD CS(=O)(=O)[C@@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 800704468 GBDXGNDOCOSMLC-MRXNPFEDSA-N 417.478 2.085 10 20 HECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803305901 NYGTXGIKZIKAQG-ZIAGYGMSSA-N 400.479 2.183 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)ccc21 803686038 TYNFQUNIALGOKD-NJAFHUGGSA-N 405.589 2.181 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)OC(C)(C)C 804259109 QFYXCEMCOMPGMQ-UHFFFAOYSA-N 416.522 2.052 10 20 HECD Cc1nn[nH]c1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805546760 QGGSGQWQDGVACC-NSHDSACASA-N 404.382 2.073 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@]2(C1)OCc1ccccc12 806278804 YEIGMCSZZPFMBS-LJQANCHMSA-N 403.529 2.400 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 807098405 VLJOBFFXSRTDBM-QGZVFWFLSA-N 405.564 2.238 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(Cc2cccs2)CC1 807289509 XKSWFJHOKGAALH-UHFFFAOYSA-N 410.543 2.085 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc(N(C)C)cc1 807672568 DJUHFIYRTQKBBZ-WQIZZMQYSA-N 401.532 2.326 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O)c1ccc(N(C)C)cc1 807673924 BQSHEYPOXNTPDQ-OXQOHEQNSA-N 414.550 2.370 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3(c4ccccc4)CC(=O)C3)cc2)C1 810183436 WAAKFQSEKHONMX-GOSISDBHSA-N 405.498 2.305 10 20 HECD C[C@H]1[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1Cc1ccccc1 813824628 QDRQWTKUVSTQOL-KBXCAEBGSA-N 403.504 2.157 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCN4CCCC[C@@H]34)CC2)cc1 916197130 UTXCTVUKYRVBPD-VXKWHMMOSA-N 415.582 2.133 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 916502689 KFIOSJHDOKMGQM-UHFFFAOYSA-N 410.430 2.353 10 20 HECD CN(C)c1ccc(CN(CC(=O)Nc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1 917418003 SHWVVQFMMDCSJN-UHFFFAOYSA-N 402.520 2.003 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)NCc3ccc(F)cc3)CC2)cc1 918665031 LWXHFWUBACOEJO-UHFFFAOYSA-N 414.481 2.372 10 20 HECD C[C@H](NC(=O)c1cc(S(N)(=O)=O)ccc1Cl)c1ccc(N2CCOCC2)cc1 920889718 BKSRBZRQASPRSH-ZDUSSCGKSA-N 423.922 2.315 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(-c2ccccc2)nc1 1116570813 KKBVQMPTZIFFRL-KRWDZBQOSA-N 407.426 2.459 10 20 HECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 1325692654 BFZUOUQHYGWTNQ-UHFFFAOYSA-N 412.446 2.072 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(F)cc3)CC2)cc1 12068988 QBSJVVFCYUQHIY-UHFFFAOYSA-N 407.511 2.325 10 20 HECD CCOC(=O)C1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCC1 741079187 BEFUEGPFGRXDEL-UHFFFAOYSA-N 403.523 2.428 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1 743911026 UBGHYRVWCIOKOM-UHFFFAOYSA-N 420.425 2.303 10 20 HECD O=C(CNc1ccccc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 745860958 FNELDWVQVTXMRH-UHFFFAOYSA-N 407.923 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1F 745991371 PUZYWZADZWVWRA-UHFFFAOYSA-N 421.494 2.312 10 20 HECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccccc2O)(c2ccccc2)CC1 748345267 BWKSSYRGYOYGTK-UHFFFAOYSA-N 402.516 2.392 10 20 HECD CC(C)(CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)S(C)(=O)=O 748970069 NEMOVPHRBQSXLJ-UHFFFAOYSA-N 419.494 2.379 10 20 HECD CCN(CC(=O)NCc1cccs1)C(=O)CN(C)c1ccc(OC)cc1OC 752126526 TXDVFXOKCCMXIE-UHFFFAOYSA-N 405.520 2.366 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(CO)CCCCC3)CC2)cc1 752907413 QRALADYPXZDZDR-UHFFFAOYSA-N 404.555 2.059 10 20 HECD CCOc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cn1 758147268 JGIIZUPQLWRAMR-UHFFFAOYSA-N 405.885 2.306 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc(Cl)ccc3F)CC2)cc1 758881750 CEIRZLGKFTUABU-UHFFFAOYSA-N 407.829 2.388 10 20 HECD COc1cc(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc(OC)c1OC 759100005 YNJJXIUUJBOKCY-UHFFFAOYSA-N 406.504 2.364 10 20 HECD COc1cc(N2CCN(C(=O)c3nnc4ccccc4c3O)CC2)cc(OC)c1OC 760084931 CAOXIJMEJCMBAH-UHFFFAOYSA-N 424.457 2.324 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@H]4Cc5ccccc5CN4C3=O)CC2)cc1 761181653 DGYMZBCKRMLKRE-JOCHJYFZSA-N 420.513 2.206 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1OC 762275490 SCEYYMAAPDSWTR-UHFFFAOYSA-N 422.503 2.109 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 764681656 DTGIQFNEICKVKK-QINHECLXSA-N 423.529 2.416 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)NC(=O)CC2 768116507 ALJJFEUIRXHTCT-UHFFFAOYSA-N 422.485 2.217 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)NC1CCCCC1 769320485 QUMGVOIHCGEMAT-UHFFFAOYSA-N 400.567 2.090 10 20 HECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)cc1C 770469198 MXLSOYVBLHHKCO-UHFFFAOYSA-N 404.488 2.170 10 20 HECD CCNC(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 782341731 GZTUAMCKKIKRAO-UHFFFAOYSA-N 400.431 2.117 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)nc3)cc2F)C[C@H](C)O1 785641366 WQLRXPFJRMLSHB-KBPBESRZSA-N 419.428 2.447 10 20 HECD O=C(NCCc1cnn(-c2ccccc2)c1)C(=O)NCc1ccc(N2CCCC2)cc1 786117513 MLWPTMPWFXCIAS-UHFFFAOYSA-N 417.513 2.448 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)nc1Cl 786656196 LSUVAZKCAFMAKU-UHFFFAOYSA-N 402.882 2.342 10 20 HECD COC(=O)[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]1C 787505982 XALAJANNYSWJEV-AAEUAGOBSA-N 424.500 2.278 10 20 HECD COc1nc(Br)ccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 789567986 UGDRMRCXZLMHOU-UHFFFAOYSA-N 421.295 2.482 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H]1CCCO1 789832627 BLQQSLVMBCUJOC-ZDUSMZPESA-N 421.513 2.129 10 20 HECD COc1cccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)n1 790108449 POYQIKCEGZXJDA-NTEUORMPSA-N 421.525 2.139 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2c(Cl)cccc2Cl)ccc1O 790407121 STUMGCRVNVLPPE-UHFFFAOYSA-N 411.288 2.408 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc(O)c1O 790569730 FHWCYNWQAHWGKR-UHFFFAOYSA-N 423.448 2.284 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)ccc2OC)cc1 797431633 UTZNPZZLCJKPIH-UHFFFAOYSA-N 405.885 2.026 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1 798000155 ZDOBPRAKMYIXJR-CYBMUJFWSA-N 410.467 2.289 10 20 HECD CCCn1ccnc1CCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685166 BDFCNUXACNASPU-UHFFFAOYSA-N 411.550 2.383 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](C)[C@H]3C)cc2F)CC1 805006658 AMFGCUNDLNUYLV-IAGOWNOFSA-N 404.530 2.231 10 20 HECD CNC(=O)CC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806458524 YVMHDRFJIQZKKG-KRWDZBQOSA-N 406.502 2.253 10 20 HECD CC[C@@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1nccs1 807256752 SREIWHFHLQYSHY-QGZVFWFLSA-N 402.520 2.458 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 807289681 DYAJNNXQBWLOEA-GOSISDBHSA-N 415.559 2.240 10 20 HECD COc1c([N+](=O)[O-])ccc(CN(CCCN2CCOCC2)Cc2ccncc2)c1O 809727700 SMHZTHDSWAAWEM-UHFFFAOYSA-N 416.478 2.429 10 20 HECD CC(C)OCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)no1 811866454 LQBBPWPPLNYLSP-HNNXBMFYSA-N 403.483 2.392 10 20 HECD COC(=O)N1CCN(c2ccc(NCc3ccc([N+](=O)[O-])c(OC)c3O)cn2)CC1 816659467 PJGCBQIEPADZMS-UHFFFAOYSA-N 417.422 2.205 10 20 HECD CCc1nc(C)c(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 817066077 PMTHDCHFSUMFLG-MDZDMXLPSA-N 412.490 2.075 10 20 HECD CC(C)N(CCC(=O)N1CCN(c2ncccn2)CC1)Cc1ccc(N(C)C)cc1 917075404 VKBKQZBGJNKVND-UHFFFAOYSA-N 410.566 2.492 10 20 HECD CN(Cc1nccn1C(F)F)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117485 LMSNKIBTRZMAMT-OAHLLOKOSA-N 420.464 2.322 10 20 HECD COc1ccc(N2CCN(CCCNCc3ccc(S(C)(=O)=O)cc3)CC2)cc1 918199079 RYHJJXKEMXFNNG-UHFFFAOYSA-N 417.575 2.401 10 20 HECD O=C1COc2ccc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)cc2N1 918294825 ZQWOTONQAZQFFO-UHFFFAOYSA-N 421.409 2.484 10 20 HECD CCN(CC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1 921061566 GYJNFBBGJNLWBF-GOSISDBHSA-N 424.563 2.488 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-n2ccc(C)n2)c1 1255149305 UYHCQASVSCLAHF-SFHVURJKSA-N 409.442 2.496 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1nccn1C(C)(C)C 1338286432 AXTNXVCEKUCUHZ-AWEZNQCLSA-N 421.519 2.432 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCC1)c1cc(O)c(O)c(Cl)c1 1792626303 CFVZPGYWCSVBJH-QDMKHBRRSA-N 407.898 2.099 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccco1 1805371046 JAPQGIVHRUPJCE-LIRRHRJNSA-N 408.414 2.114 10 20 HECD Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807992149 VMGLDXYTATZSAZ-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)[nH]n1)c1cc(O)nc(O)c1 1817846465 ZFUJJYAOWFSSSH-GJZGRUSLSA-N 413.434 2.215 10 20 HECD Cc1ccn(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820357546 WUMPHPBNTBONKR-HNNXBMFYSA-N 424.461 2.483 10 20 HECD COc1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501056 UKKRVUSCBDTMIC-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)OC(C)(C)C)cc2F)CC1 303279138 IDFWLUJQGBNFNJ-UHFFFAOYSA-N 408.518 2.499 10 20 HECD O=C1NC2(CCCCC2)C(=O)N1CCCNCc1ccc(N2CCOCC2)c(F)c1 727466396 ODOUREWYVRADRU-UHFFFAOYSA-N 418.513 2.397 10 20 HECD COc1ccc(CC(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 727883600 PNELCSDMBLUCKI-UHFFFAOYSA-N 415.446 2.414 10 20 HECD O=C(N[C@H]1CCCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 730036541 YLUBTKMGZNWWOG-ZDUSSCGKSA-N 421.431 2.010 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1 734687224 ORHUEEAYXSALPK-IBGZPJMESA-N 415.582 2.289 10 20 HECD CCCNC(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 741182082 XCDDPGZKYCSRTE-HXUWFJFHSA-N 422.529 2.458 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1F 743598526 LMVXUSCDWQQLIT-KDOFPFPSSA-N 416.501 2.399 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745819514 AATBVFARMADEJX-UONOGXRCSA-N 419.494 2.379 10 20 HECD Cc1nccn1CCCN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 747388415 LALNPMMNRQDMDJ-IBGZPJMESA-N 412.538 2.125 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]([C@H](C)O)C3)CC2)cc1 747393277 AYKYLMUCXZDSJB-OALUTQOASA-N 404.555 2.010 10 20 HECD CC(=O)NC1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 747666996 OPNLNYKEGUJMGM-UHFFFAOYSA-N 421.409 2.111 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CC(=O)N1CCCC1 749901250 DEERBRMOAWPRHP-OAHLLOKOSA-N 419.481 2.343 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCCCSc2nccs2)ccc1F 752727962 QGXAAGKWJTZSKO-UHFFFAOYSA-N 410.496 2.221 10 20 HECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 754732642 RQYNGTNXTFJQMN-QGZVFWFLSA-N 421.582 2.357 10 20 HECD CCc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1CC(C)C 755585903 GEYVIVUTSWSWBN-UHFFFAOYSA-N 418.563 2.266 10 20 HECD CN(CCC1CCOCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 757637520 IYYWWKFOSOWNKW-IBGZPJMESA-N 402.539 2.346 10 20 HECD COCc1nc2n(n1)C[C@H](NCc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)CC2 757700588 FBLGBEODLYNLIC-MRXNPFEDSA-N 400.483 2.428 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(OCCF)c1 760093145 UTNBQFRKRMUBJU-UHFFFAOYSA-N 415.465 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCCC[C@@H]3N3CCOCC3)CC2)cc1F 763660122 QASQZOUWGVSKQC-PMACEKPBSA-N 420.529 2.309 10 20 HECD C[C@@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763853951 LXBACADSIPZQGC-IQYXRRSRSA-N 424.522 2.489 10 20 HECD O=C(COC(=O)[C@@H]1C[C@@]12CCOC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 764634618 GJXNFVKRCUCGQX-QMHKHESXSA-N 405.406 2.370 10 20 HECD CCOc1cccc(CN2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c1O 768215623 VMUYYMMMOBXYAJ-UHFFFAOYSA-N 400.504 2.178 10 20 HECD CN(C(=O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)C1CCCCC1 769319951 GFISXOUJPGWHBL-UHFFFAOYSA-N 414.594 2.432 10 20 HECD COc1cccc(CNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c1O 769499272 SFUAPMLNONBFMX-AWEZNQCLSA-N 407.492 2.010 10 20 HECD O=C1COc2ncc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2N1 770790791 GLISWPOMNBYOEJ-HNNXBMFYSA-N 416.865 2.166 10 20 HECD CS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 771842007 RSVHYXWSLYUWMG-UHFFFAOYSA-N 424.469 2.259 10 20 HECD C[C@@H](NC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc(N(C)C)cc1 773012701 YOFPPCPGYFCUHI-CQSZACIVSA-N 422.576 2.309 10 20 HECD CN(C)C(=O)CCCOC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 787972033 FQZYVJSRGQXBKD-UHFFFAOYSA-N 410.382 2.395 10 20 HECD Cc1cccc2c(CCNC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c[nH]c12 788319523 LKEAMKRZRVXGSI-UHFFFAOYSA-N 420.513 2.288 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1 788954804 PYZJYSXRVCESEX-QGZVFWFLSA-N 413.497 2.078 10 20 HECD CSC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 789210794 UZXPLILQDVTQPN-KBPBESRZSA-N 410.511 2.494 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC4(CCOCC4)CC3)CC2)cc1 792934305 UNPOKTYZGUILNJ-OAQYLSRUSA-N 403.567 2.071 10 20 HECD COc1cc(N2CCN(C(=O)Cc3ccc4n[nH]cc4c3)CC2)cc(OC)c1OC 793816228 TWJVMKOCERVBNX-UHFFFAOYSA-N 410.474 2.480 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cnc(C)c(C(=O)OC)c3)c2)CC1 794029147 MNABGDOAJPAQQB-UHFFFAOYSA-N 418.519 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4nc(C)n(C)c4c3)CC2)cc1 796033826 XZIOAWUENVVDTK-UHFFFAOYSA-N 422.485 2.396 10 20 HECD O=C1CC[C@@H](OC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C(=O)N1 798590821 UWBQMELNNDEYOH-ZGSOTFDTSA-N 424.525 2.078 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)N1CCSCC1 802126592 CUCIUNGNNJMMJN-UHFFFAOYSA-N 415.581 2.083 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@H]1OC 803298242 RQQJIXGPGMVIRJ-NSISKUIASA-N 417.550 2.410 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 807073295 GEWJEEFSNQYTSY-WBMJQRKESA-N 423.318 2.235 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC(F)(F)C3)cc2F)C[C@@H](C)O1 808785153 WIHKTFWSJGLVJA-GASCZTMLSA-N 415.456 2.023 10 20 HECD CC(C)[C@@]1(CO)CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 815232205 SVYVPUSADSPUGA-QFIPXVFZSA-N 407.530 2.009 10 20 HECD COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918444547 UZBKOSYUBCNQOG-UHFFFAOYSA-N 411.458 2.376 10 20 HECD CN(C)c1ccc(CNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1 920019741 LURYFSFTMKFYOT-ZGQNHIEXSA-N 420.513 2.172 10 20 HECD C[C@H](NC(=O)[C@H](C)N1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1ccc(N2CCOCC2)cc1 920881997 UHYYLVRMGCGHTD-XAMWDVODSA-N 413.518 2.264 10 20 HECD COCCn1c(C)c(C)c2cc(-c3nc(-c4cn(C)c(=O)n(C)c4=O)no3)ccc21 1116809459 DLLYITCMLHALBL-UHFFFAOYSA-N 409.446 2.019 10 20 HECD Cc1ocnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798964961 IBEBILRFBIBPEB-PLCSWTFUSA-N 413.430 2.065 10 20 HECD CN1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1799897676 WNMZLSINHJVDIA-HNKHHVNMSA-N 421.925 2.345 10 20 HECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1807993712 MNXNBHFXXGEBOM-MGPUTAFESA-N 422.441 2.423 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1 1828892143 GHKDYDZGDXJTSW-MSOLQXFVSA-N 415.490 2.419 10 20 HECD COC(=O)c1cc(OCC(=O)NCc2ccc(N(C)C)cc2)cc(C(=O)OC)c1 7771408 OHZNOTTWRSKZES-UHFFFAOYSA-N 400.431 2.021 10 20 HECD CCN(CC)CC(=O)N1CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 729050584 OVQZKIZKJDUYEE-UHFFFAOYSA-N 403.571 2.228 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1 734015488 NYGBIWBFHNYXDC-KRWDZBQOSA-N 418.515 2.259 10 20 HECD COC(=O)CCCS(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 735674472 OFNFAJPQPMNMFB-UHFFFAOYSA-N 406.451 2.129 10 20 HECD Cc1cc(NC(=O)NCc2c(O)ccc3c2CCCC3)n([C@@H]2CCS(=O)(=O)C2)n1 743080232 DEGHTOSENWDKES-OAHLLOKOSA-N 418.519 2.457 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)c(F)c3)ccc2O1 751981693 VPCUYAXAZWENOF-IBGZPJMESA-N 422.478 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H](C)c3nccs3)CC2)cc1 756688556 OSGWEOAJFKLRAL-WAVCKPEOSA-N 414.531 2.276 10 20 HECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc(N(C)C)c(F)c1)C2=O 756957045 JZGMXQANIGCZJI-KBPBESRZSA-N 404.486 2.255 10 20 HECD Cc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 757255219 HGMINNLPZLPTBP-UHFFFAOYSA-N 402.520 2.224 10 20 HECD O=S(=O)(NCc1cccc(Br)c1O)c1cnn(C2CCOCC2)c1 766179006 HMTGLVFRAPCTEX-UHFFFAOYSA-N 416.297 2.181 10 20 HECD C[C@@H](c1ccccc1)[C@@H](CO)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 766979234 GMQQAXOSNMFTCP-LAUBAEHRSA-N 415.509 2.033 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1O 768724873 LVOXOQJNDZWMQQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2cnnn2)cc1 771057393 ITLMHMMYXBAYOI-QGZVFWFLSA-N 412.881 2.416 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 775036815 KAPWIISEOXKDTE-OAQYLSRUSA-N 404.514 2.070 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC(OC(F)F)C1 781207120 QSPYNPSWPKOXRP-UHFFFAOYSA-N 404.416 2.318 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2 783327264 LMTULKCKXYTJLT-UHFFFAOYSA-N 410.474 2.459 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO1 784509651 HKGHSSWQAVBAMX-AOIWGVFYSA-N 402.539 2.393 10 20 HECD CN(C(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 785407039 CMLUEHAJFFFFGY-UHFFFAOYSA-N 410.473 2.032 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](c3ccccc3)n3cccn3)cc2)CC1 786659465 KXOYUAIMJBPYMB-HSZRJFAPSA-N 417.513 2.457 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 788279422 MYJRMWWTEFBUSU-QGZVFWFLSA-N 418.538 2.227 10 20 HECD CCN(C)C(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 788731874 GYGJAJDANRDVOT-CYBMUJFWSA-N 416.444 2.208 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)OC(C)(C)C3)cc2F)C[C@@H](C)O1 789811748 HANVGHAYADWBLA-BZUAXINKSA-N 421.513 2.081 10 20 HECD C[C@@H](OC(=O)Cn1cccn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792668771 XOHMWDGWPHNIIX-CYBMUJFWSA-N 403.394 2.229 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c(O)c1 797388846 BXIAYJJSLXIZHH-UHFFFAOYSA-N 411.458 2.282 10 20 HECD COc1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1NS(C)(=O)=O 797630096 IVUSWJAAXDDSMA-NSHDSACASA-N 409.464 2.231 10 20 HECD CC(C)CCN1CCC(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803664441 IZBJFCAGUGHVFM-UHFFFAOYSA-N 406.546 2.382 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nccn2CC(C)C)cc1F 804851794 PDVFAWKDCUJWFI-UHFFFAOYSA-N 403.502 2.457 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 805736727 CYWVQJRXQZJFBZ-LSDHHAIUSA-N 406.527 2.207 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CC1 807095872 ANFHMPCLOFODQH-SFHVURJKSA-N 418.538 2.097 10 20 HECD C[C@@H](NC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1ccc(N(C)C)cc1 807141067 PWTPQMFCFWAYFA-CVEARBPZSA-N 408.568 2.317 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1)c1ccc(N(C)C)cc1 807674438 KVTDQZZRYMZQLN-XJKSGUPXSA-N 401.429 2.500 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCO[C@]2(CCSC2)C1 809494910 DGGCLWODDUOLNE-LAUBAEHRSA-N 405.564 2.272 10 20 HECD O=C(NOC1CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 812795156 NYBJUZJCPLLBEU-UHFFFAOYSA-N 407.404 2.315 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@@]3(O)C[C@H]4CC[C@H]3C4)cc2)C1 813594864 OGHNVYFFAAOXRI-QPXQOZNCSA-N 414.550 2.129 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCS(=O)(=NS(C)(=O)=O)CC3)c2C)c1 820255182 GHEXDOOSCRZJLQ-UHFFFAOYSA-N 423.560 2.286 10 20 HECD COc1ccc(S(N)(=O)=O)cc1NC(=O)c1cc(C)n(-c2ccccn2)c1C 914849486 MSFLUPJCJSMGRG-UHFFFAOYSA-N 400.460 2.397 10 20 HECD COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NCCc1ccc(O)c(O)c1 917356227 ZIYMKLRVGRVXQL-MRXNPFEDSA-N 418.515 2.317 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)cc1)Nc1ccc(F)c(F)c1F 919792154 QBYBKIJJYRYWJP-UHFFFAOYSA-N 422.407 2.378 10 20 HECD CC(C)(C)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969285 IISPXOFHPVNAPO-IBGZPJMESA-N 405.514 2.440 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OCC4CC4)nc3)nc12 1318203113 WDGNNJJRARDTQS-UHFFFAOYSA-N 412.402 2.152 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3c(C)nn(COC)c3C)CC2)cc1 1326722271 ZDAXSKCVAZRISH-UHFFFAOYSA-N 408.524 2.013 10 20 HECD CN1CCCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793137231 IOTJJQUPNJWBPF-JYYAWHABSA-N 421.925 2.487 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797296159 HSWRXTRKXAPFLM-UDUPSFLGSA-N 422.909 2.391 10 20 HECD COc1ccc([C@@H](C)C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841256646 ZTHFTXWJCJQJMP-CQSZACIVSA-N 411.458 2.122 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cnccc2C(F)(F)F)C1 1842426001 BNVANBHOCNDALO-UHFFFAOYSA-N 422.363 2.037 10 20 HECD COc1ccc(N2CCN(c3ccc(S(=O)(=O)N4CCCC4)cn3)CC2)cc1 38581960 JTPLBKSKXWAQTA-UHFFFAOYSA-N 402.520 2.201 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C1CCN(C(=O)N2CCCC2)CC1 108806637 RRTFYPZLHUNIAU-UHFFFAOYSA-N 400.523 2.067 10 20 HECD Cc1ccc(CCC(=O)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 116393675 HZNCVNCYXORHQP-UHFFFAOYSA-N 413.493 2.336 10 20 HECD CCCCn1nccc1NC(=O)C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 438814706 QSKREGPWXCEVOO-UHFFFAOYSA-N 411.487 2.477 10 20 HECD COC(=O)C[C@H]1CCCCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 726587043 RDUDOSFOKYZRME-HXUWFJFHSA-N 404.507 2.345 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2cccc(OCC(=O)N(C)C)c2)c1 728945966 RTGNMJQWCMQCTR-AWEZNQCLSA-N 401.463 2.428 10 20 HECD COc1cccc(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c1O 730282034 BRAWMZQLPRTHHE-AWEZNQCLSA-N 421.519 2.090 10 20 HECD COCCS(=O)(=O)c1ccc(C(=O)NCCCSc2nccs2)cc1 733884432 UGWNIZIHVVGFAW-UHFFFAOYSA-N 400.547 2.475 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3CCCN(c4ccccc4)C3=O)nc12 734489047 SHILBFCQOOMWGO-SFHVURJKSA-N 423.473 2.239 10 20 HECD Cc1cc(-n2cncn2)ccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 742056130 WYTKZXZQWOPXNL-UHFFFAOYSA-N 411.487 2.063 10 20 HECD O=C1CC[C@@]2(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)SCCN12 742800431 KAPJTYFSJNFJGW-DJJJIMSYSA-N 411.474 2.439 10 20 HECD CCN(CC)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 745352399 YKLKPZJOLDYWMR-NRFANRHFSA-N 417.598 2.333 10 20 HECD COc1cccc(CNC(=O)NCCNC(=O)c2cccc(Br)c2)c1O 745794017 VWPMEAXCAOUKLS-UHFFFAOYSA-N 422.279 2.393 10 20 HECD CN1CCCc2cc(CNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]43)ccc21 746880006 RDMQOOPHAKFJGV-KPFFTGBYSA-N 402.564 2.411 10 20 HECD O=C1C[C@@H](Cc2ccc(NC(=O)NCc3ccc(N4CCOCC4)cc3)cc2)C(=O)N1 747554919 VTCUXOWLDSVUBO-GOSISDBHSA-N 422.485 2.050 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNC(=O)CC1CCCCC1 748913379 WQWAQECDXCRSKJ-UHFFFAOYSA-N 403.523 2.341 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H](CO)C(C)(C)C)cc2F)C[C@@H](C)O1 749467426 ZBQLUTBITFBUJR-YRNRMSPPSA-N 409.546 2.394 10 20 HECD CN1CCCc2cc(CNC(=O)N[C@@H]3CCCN(Cc4ccccn4)C3=O)ccc21 753150008 OZXNHYQCOOIVPA-HXUWFJFHSA-N 407.518 2.454 10 20 HECD COc1cc(C)cc(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c1O 754726108 OHTNOIVRSKQPHK-UHFFFAOYSA-N 411.568 2.336 10 20 HECD O=C(/C=C/c1ccc(Cl)nc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 758536776 NYPFDSZZIRJDFN-XBXARRHUSA-N 405.907 2.299 10 20 HECD COc1cc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3)CC2)cc(OC)c1OC 759201789 XGWZCODQCHTCHO-UHFFFAOYSA-N 414.462 2.165 10 20 HECD COc1cc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc(OC)c1OC 760087847 QHHDXLBQHJPNDN-FNORWQNLSA-N 414.458 2.486 10 20 HECD C[C@@H]1C(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C(=O)N1C1CC1 761120559 MMGGXDZGMVNZDQ-OAHLLOKOSA-N 424.480 2.257 10 20 HECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 763390287 QIWKENXIWAFNMK-UHFFFAOYSA-N 416.459 2.075 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCCCSc1nccs1)NC(=O)CC2 768182770 CRKRDDCKTVMIGR-UHFFFAOYSA-N 420.516 2.274 10 20 HECD CCCCCCn1cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c(O)nc1=O 769625746 KULMIAXJPGXMJP-UHFFFAOYSA-N 422.551 2.416 10 20 HECD COC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)c(F)c1 774025334 QOFSMHMCXGFKKP-OAHLLOKOSA-N 400.403 2.159 10 20 HECD COc1ccc(CN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H]2CCS(=O)(=O)C2)cc1 779513381 ISOMWQYFHVZQCN-MPNRVQBSSA-N 417.483 2.336 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3[nH]2)cc1F 779627770 NPCLMMIYRKRQJC-OALUTQOASA-N 400.454 2.259 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(S(C)(=O)=O)c1 784026801 JFCCTDXXNTZSEF-UHFFFAOYSA-N 404.488 2.481 10 20 HECD O=C(OC[C@@H]1CCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398187 NDGOGNCVACTCGW-AWEZNQCLSA-N 422.415 2.437 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cnn(-c2ccccc2)c1 785966601 KPSFKDIGRPQUAL-UHFFFAOYSA-N 401.517 2.244 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCc2ccc(N3CC=CC3)cc2)n1 786736960 WGIVBFAHPMXAHF-UHFFFAOYSA-N 417.535 2.324 10 20 HECD Cc1ccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788310249 KFWSRSXCRGOREJ-GOSISDBHSA-N 411.502 2.032 10 20 HECD C[C@H]1c2ccc(F)cc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331243 IDTLKULQRJSZFL-INIZCTEOSA-N 411.477 2.424 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nccn2CC(F)(F)F)cc1 788928169 ARRWKBQXBIWIQZ-UHFFFAOYSA-N 411.428 2.224 10 20 HECD CCCc1csc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 789378188 NVKCIYLYPDFBCF-UHFFFAOYSA-N 420.510 2.451 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)c4ccccc43)CC2)cc1F 791052728 BGTPEIMORAEOTA-QGZVFWFLSA-N 418.490 2.444 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCC[C@@H]3C[C@@H](C)O)CC2)cc1 791166648 ZVYMWTPBYXCXRY-HPTYGODWSA-N 415.534 2.052 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(C)nc3OCC)nc12 791655024 QAETXJLBMLKPFP-UHFFFAOYSA-N 400.391 2.071 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)ccc2[nH]1 792354744 BQVDBFCNUHQHCH-CYBMUJFWSA-N 407.474 2.409 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc3c2OCO3)cc1F 793737020 HNFFXZPLWNCMRO-UHFFFAOYSA-N 401.438 2.333 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCc2ccccc2CC1)c1ccc(N2CCOCC2)cc1 803310971 KTGXKZMHFOTPGN-GOSISDBHSA-N 407.514 2.328 10 20 HECD CCOC1CC(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803315134 IPLDNAHEZFOEBV-VXESANQCSA-N 403.523 2.022 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(-n2ccnn2)cc1 807290263 GPKWFEDPRRGDCS-QGZVFWFLSA-N 416.485 2.137 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)C[S@](C)=O)cc2Cl)C1 807954034 GSJUUQDIBWVJCI-ZRBXUZRCSA-N 413.971 2.076 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 918307146 PPTLXTQSKWPIAU-UHFFFAOYSA-N 421.494 2.282 10 20 HECD COc1ccc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918438498 FYEBXQDTXZDOBH-UHFFFAOYSA-N 415.465 2.359 10 20 HECD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1c2ccccc2C[C@H]1C 920637578 KIBFCTISAFGNHG-CHWSQXEVSA-N 418.471 2.287 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 920867504 UATIWEWJKLMATR-MSOLQXFVSA-N 417.550 2.364 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)(Cl)Cl)C2 1796602559 PVYAPPWYRQFTNR-ILWJIGKKSA-N 408.669 2.115 10 20 HECD Cc1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1 1808479599 JQGDHFLUKUSDIB-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C([C@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428203 LLXWCEIVIUBWNB-ZWKOTPCHSA-N 415.490 2.419 10 20 HECD CC(C)(C)CC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834408807 XRBHQHUAZGDXMS-UHFFFAOYSA-N 418.538 2.114 10 20 HECD Cc1ncsc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842473136 SFDPBPOMVDWHNX-UHFFFAOYSA-N 423.498 2.061 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 51135196 BKIUAIJDIKFASW-UHFFFAOYSA-N 402.520 2.154 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 437007255 JKQJGHVVPOLRGF-UHFFFAOYSA-N 401.488 2.114 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1 728977797 DFEPPPLYOQWZOB-AWEZNQCLSA-N 421.519 2.405 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCN(C4CC4)C3)cc2F)CC1 730118326 WKNQROZIPQJAIN-SFHVURJKSA-N 403.546 2.251 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4ccc(C)cc43)cc2F)CC1 730390905 DHFXIHIRDBOGES-UHFFFAOYSA-N 424.520 2.482 10 20 HECD CCCc1nnc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 738885226 LOZWRFOVNBYICA-UHFFFAOYSA-N 409.537 2.047 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 740388310 LUDLLTWTEAVAJL-UXLLHSPISA-N 408.470 2.025 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CCN(C)C)CCN(C)C)cc2F)C[C@@H](C)O1 741080338 ZWTDABGSYKCMME-HDICACEKSA-N 423.577 2.074 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)OCc3nc(CS(C)(=O)=O)no3)c2C)cc1 744510151 BFSKRKFFFPXCOT-UHFFFAOYSA-N 419.459 2.387 10 20 HECD Cc1nc(C(C)C)nc(O)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 747368015 WVGYKLPKBLFTJF-MRXNPFEDSA-N 411.506 2.246 10 20 HECD C[C@@H]1CC[C@@H](C)N1CCN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 748988577 CWOVMUIJDBKQCV-NHCUHLMSSA-N 415.626 2.201 10 20 HECD O=C(NC[C@@H](O)c1ccco1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751064296 IAQAICCCJHUCAH-CQSZACIVSA-N 408.457 2.311 10 20 HECD Nc1ccc(Cc2nc(C(=O)O[C@H]3CCN(C4CCOCC4)C3=O)cs2)cc1 751946283 YNPLAGKTWIEQAR-KRWDZBQOSA-N 401.488 2.253 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(-c2ccccn2)c1 754927757 HNOJUBCIWAVLPI-UHFFFAOYSA-N 422.514 2.075 10 20 HECD COc1cc(N2CCN(C(=O)CCCn3ccnc3C)CC2)cc(OC)c1OC 759220020 FQSUZBUZJWDGMF-UHFFFAOYSA-N 402.495 2.346 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3ccc(C)nc3)CC2)cc(OC)c1OC 759263957 AZCXKLHXPSFMIW-UHFFFAOYSA-N 414.506 2.490 10 20 HECD NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NCCCSc1nccs1 766805737 GJOQBQUKDSSECP-UHFFFAOYSA-N 421.953 2.121 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(C4OCCO4)c3)nc12 766912285 BBWSTFSRQNDHKN-UHFFFAOYSA-N 413.386 2.014 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(OC(F)F)cn3)cc2)C1 772320582 TVFFQHUUGBJPFH-AWEZNQCLSA-N 404.417 2.315 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)C2CC2)cc1 772470682 IXSRYQIHPYOWHB-GOSISDBHSA-N 420.513 2.486 10 20 HECD Cc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2o1 774106966 ZOQKXDSGTBUIGS-UHFFFAOYSA-N 412.421 2.367 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnc2c(c1)c(C)nn2C 777828620 MIICQAHHQPATKR-UHFFFAOYSA-N 402.838 2.451 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccncc3)C3CC3)CC2)cc1 778246956 UJJKPIBLVFMALS-HJWRWDBZSA-N 420.513 2.486 10 20 HECD CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778916391 GQKJYVGHNBBFDH-MRXNPFEDSA-N 404.488 2.031 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779473346 NLNGRHNATLHFFV-NTMALXAHSA-N 409.486 2.456 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(C(N)=O)c2OC)cc1F 782801966 DLGIKYMFRBXMOX-UHFFFAOYSA-N 416.453 2.034 10 20 HECD Cc1nc(C)c([C@H](C)N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 788310607 KRFIWODVGARNCS-HNNXBMFYSA-N 416.547 2.432 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)cc1 788928244 CIAJLLHYBVUDAX-WCZIJOHHSA-N 407.580 2.345 10 20 HECD C[C@H]1c2nncn2CCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 790220482 WFLLYGAJMJRARP-KFWWJZLASA-N 402.474 2.317 10 20 HECD COc1ccc(N2CCN(CCN[C@H](C)c3ccc4c(c3)OCC(=O)N4)CC2)cc1 796727144 KLZYGWXOHJVLFJ-QGZVFWFLSA-N 410.518 2.499 10 20 HECD CNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 799537955 SRPNIEZQBOZJBE-UHFFFAOYSA-N 411.288 2.408 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803301529 SOAVFYCSQXHYQV-CABCVRRESA-N 414.506 2.225 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3cnc(C)s3)CC2)cc1 804317970 URYJGJVDHMHKCU-UHFFFAOYSA-N 402.520 2.204 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC([C@H]4CCCO4)CC3)CC2)cc1 804318911 VMEBQWXJGAZHDC-OAQYLSRUSA-N 415.534 2.198 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)C2CC2)cc1 806686347 DFWVAIGAWNHZBS-IBGZPJMESA-N 401.507 2.046 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O 807095089 KBZTZNRFLZDVGA-KQLYMOGASA-N 401.551 2.465 10 20 HECD CC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387402 JBWVXYJPUMUYSS-UHFFFAOYSA-N 420.263 2.392 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O 807653344 BQCBIMJXQQTTGW-LPHOPBHVSA-N 409.486 2.441 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O 807654006 JSYGYFOVAIXWCB-DYESRHJHSA-N 422.529 2.411 10 20 HECD CC(=O)N[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(Cl)c3nonc23)C1 814388140 ZRVDSGKKLISLIF-LBPRGKRZSA-N 406.851 2.132 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(C(=O)OC)n3C)cc2F)CC1 815492045 FCIJJYWUWAZXPW-UHFFFAOYSA-N 402.470 2.023 10 20 HECD COCCNS(=O)(=O)c1ccc(CNCc2cc(Cl)c(F)cc2O)cc1 816541865 WMABLLQGXMBEIG-UHFFFAOYSA-N 402.875 2.399 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)COc3ccccc3C=O)CC2)cc1 849193886 WJPMPXONHJQQLY-UHFFFAOYSA-N 411.502 2.215 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(OC)c1OC 919879698 ZMMXPHCTHUPHFK-UHFFFAOYSA-N 420.487 2.200 10 20 HECD CC(C)COC[C@H](O)CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 920092361 UWMIIBNMCGUTFR-LJQANCHMSA-N 417.529 2.065 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 920919862 CVRLXBVAVRNZJF-WIYYLYMNSA-N 404.555 2.240 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1322168671 GZRBNRQAVIKVAS-UHFFFAOYSA-N 404.488 2.351 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cn(C)nc3C)n2)cc1 1324115785 MEVXAVVIYFZGJU-UHFFFAOYSA-N 405.505 2.289 10 20 HECD O=C(/C=C/C1CC1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720424 RJUGNHOPMXHARR-MJRJWQSSSA-N 400.460 2.141 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)on1 1825965086 WPHCTOFXMZLQQA-INIZCTEOSA-N 414.462 2.336 10 20 HECD COc1ccc(N2CCN(C(=O)c3c[nH]n4c3nc(=O)c3ccccc34)CC2)cc1 108787910 IBRINHILRKFRNX-UHFFFAOYSA-N 403.442 2.147 10 20 HECD CCN1CCN(c2ccc(CNc3cc(N4CCOCC4)ncn3)cc2F)CC1 302919661 YQJOHHVFRQMIOI-UHFFFAOYSA-N 400.502 2.206 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c1 728977597 AVTSPHFOGOQRDZ-AWEZNQCLSA-N 419.503 2.074 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCOc1ccc(S(C)(=O)=O)cc1 730066051 CLYPDSHVDNFRFU-UHFFFAOYSA-N 405.520 2.377 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](OCCO)C1 734485690 PYGBMWRSPFDWTQ-RDJZCZTQSA-N 422.481 2.262 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2C)c1 734557819 KZRDEHSMPLVQJE-UHFFFAOYSA-N 417.531 2.248 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1O 737285118 ZOFJCHSZADCQPI-HHHXNRCGSA-N 410.879 2.188 10 20 HECD COC(=O)CCCc1nnc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 740465827 SVOPHEZAOTZDIE-UHFFFAOYSA-N 419.507 2.397 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)c3ccc(C)o3)CC2)cc1 741401795 FNPPWTRNTVLBFU-HXUWFJFHSA-N 416.522 2.142 10 20 HECD O=C(NC[C@]1(O)CCSC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747584940 DKCYMQCUJNUSKR-FZKQIMNGSA-N 401.479 2.424 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C)c1 749917629 BKTLBOBSMPPMNB-MRXNPFEDSA-N 423.496 2.096 10 20 HECD CCN1CCN(CCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 750872483 MUZXUSWIUPKTOC-ROUUACIJSA-N 406.546 2.083 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3[nH]c4c(c3C)C(=O)CCC4)nc12 751640099 QGZODBGIYCEBEU-UHFFFAOYSA-N 412.402 2.124 10 20 HECD CC[C@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCCO1 756106299 YXZGWDKJKMNJGN-LEWJYISDSA-N 404.555 2.464 10 20 HECD C[C@H](NC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 756812676 OPKUMPIIBDVGBC-XDHUDOTRSA-N 423.513 2.107 10 20 HECD COCc1nc2n(n1)C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)CC2 757778287 UPMWTLWHLBCHKE-KRWDZBQOSA-N 400.527 2.426 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 760141036 GBHXUJNISWGRHX-GFCCVEGCSA-N 406.460 2.368 10 20 HECD C[C@H](NCCc1ccc(S(N)(=O)=O)cc1)c1ccc(N2CCOCC2)c(F)c1 764807241 CVLYPBOALKGKDQ-HNNXBMFYSA-N 407.511 2.203 10 20 HECD O=C(NCCc1cn2c(n1)SCC2)NCc1ccc(N2CCC(O)CC2)c(F)c1 767939360 ARHJINNXGVHCFJ-UHFFFAOYSA-N 419.526 2.131 10 20 HECD CC(C)[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 770562245 SDPHGYKPPKWNGZ-ZSDSOXJFSA-N 410.486 2.006 10 20 HECD CC(=O)C[C@@H]1COCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773883457 RATUJBPOFXDIBL-CQSZACIVSA-N 424.500 2.075 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CCc3cccn3C)CC2)cc1 778295085 NHCBLXZQPIKMOP-JXOMPUQVSA-N 424.545 2.376 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 781440029 MSEUDATVXGFOGS-UHFFFAOYSA-N 411.458 2.337 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCCOC(C)C)CC2)cc1 783636731 CEQOWLWZSZFLNG-KHPPLWFESA-N 403.523 2.221 10 20 HECD Cc1cccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788310703 LUXBJVYYSFZXEM-SFHVURJKSA-N 411.502 2.032 10 20 HECD COCCCN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788939619 VFTAZEISDRNXKE-UHFFFAOYSA-N 410.518 2.363 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@]3(CO)CC(C)C)CC2)cc1 789512708 BDFWFASRFXZUHY-JTHBVZDNSA-N 405.583 2.051 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@]3(C)CCCS3)cc2F)C[C@@H](C)O1 789837366 ZBJODIBESJBFTO-PZPWOCDFSA-N 423.554 2.457 10 20 HECD CC(C)(C)N1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 793736837 CTQANOXMEVXRIP-IBGZPJMESA-N 417.550 2.279 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC(=O)NC1CCCCC1 793760693 KGEMDSNUNAPVBB-UHFFFAOYSA-N 402.539 2.056 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnc(C(C)C)nc3)CC2)cc1 794413078 WUJCCWOWFYCYPS-CMDGGOBGSA-N 409.490 2.452 10 20 HECD O=C1N[C@H]2CCN(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C[C@@H]2CO1 798399246 BNLUZFSJNXWGPY-DYVFJYSZSA-N 424.448 2.397 10 20 HECD CC[C@H]1C[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007080 MQTMMEHCZWZCEL-AEFFLSMTSA-N 404.530 2.231 10 20 HECD CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 807131570 PXFVBFJGBDDOBJ-ICSRJNTNSA-N 404.507 2.364 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(N(C)C)cc1 807670013 AYVZYEVPGBMBCR-ZBFHGGJFSA-N 415.925 2.373 10 20 HECD CCOC(=O)c1sc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nc1C 807672535 CZPFXHLEHMBGLG-GFCCVEGCSA-N 418.519 2.188 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O)c1ccc(N(C)C)cc1 807673923 BQSHEYPOXNTPDQ-OXJNMPFZSA-N 414.550 2.370 10 20 HECD CC(C)n1cc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nn1 808380226 BTGMOJZTOMSBPS-UHFFFAOYSA-N 410.501 2.405 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809527181 YZKPXPNYPRIFJV-KDOFPFPSSA-N 415.490 2.425 10 20 HECD C[C@@](O)(C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CCC1 812676173 KGPRWUQQXBMGQJ-QHCPKHFHSA-N 407.422 2.495 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(C)c4nccn4c3)CC2)cc1 815400998 IFUHZMLVFJNUCB-UHFFFAOYSA-N 407.474 2.329 10 20 HECD CCOC(=O)N[C@@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 917461756 XCQSWSBNWZUQPS-HXUWFJFHSA-N 419.522 2.138 10 20 HECD CCOC(=O)C1CCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 917657880 DOPBTORXIZYFSA-UHFFFAOYSA-N 411.568 2.483 10 20 HECD CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(N2CCOCC2)cc1 919767028 KNLOILBBFMGWBR-QHCPKHFHSA-N 420.513 2.368 10 20 HECD COc1ccc(OC)c([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 919791164 VXLKFCQDBWGYEV-HXUWFJFHSA-N 415.490 2.073 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cscn1 1796932699 SNHRERRMQVWAGR-RBVVOMGSSA-N 423.498 2.188 10 20 HECD COc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1803471005 DIJSIOMUMABZTI-QDMKHBRRSA-N 415.421 2.206 10 20 HECD O=C(Cc1cccc2ncccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248874 CSSQEGVQQJVQMK-UHFFFAOYSA-N 418.453 2.101 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 5602666 LWTODBAYAXISSU-UHFFFAOYSA-N 412.489 2.247 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729061399 COVMOTWAALVZHY-LBPRGKRZSA-N 406.460 2.010 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)NC)c2)cc1F 731408531 OTNYRJIUNXFDGR-UHFFFAOYSA-N 400.454 2.286 10 20 HECD C[C@@H]1[C@@H](C)[S@](=O)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 736630296 YWVCVMYHEWSIGP-RVDBKZMJSA-N 410.495 2.242 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccoc4)no3)cc2)C1 739525474 IRCRFMFJUMOXDQ-MRXNPFEDSA-N 423.473 2.280 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1 743639603 WULBXHSOOKZXFL-CVEARBPZSA-N 413.474 2.441 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751227755 KKIBKPAPCQHNTN-UHFFFAOYSA-N 406.479 2.468 10 20 HECD CN(C)CC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCC1 760093952 BPVJAACCLZOLEB-IBGZPJMESA-N 415.582 2.310 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 767887183 GDWAUSZNHKLCKB-SFHVURJKSA-N 411.502 2.401 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc3c(cc2OC)CCC(=O)N3)c1 768142337 AOJSCBPNJYFGIG-LLVKDONJSA-N 413.430 2.110 10 20 HECD CN(C)S(=O)(=O)CCCS(=O)(=O)N(Cc1ccccc1O)C1CCCCC1 774887379 RGTGLEFJEUMZRX-UHFFFAOYSA-N 418.581 2.138 10 20 HECD CN(Cc1nc2c(=O)n(C)c(=O)n(C)c2[nH]1)c1ccc(OCc2ccccc2)cc1 781960134 DYSRIFVIOYROEC-UHFFFAOYSA-N 405.458 2.176 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cccc1N1CCNC1=O 787481994 XATJCDQCRZLQCQ-UHFFFAOYSA-N 421.501 2.162 10 20 HECD Cc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788319205 BHCKJJNIJSBTQO-GOSISDBHSA-N 411.502 2.032 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCSC(F)(F)F)CC2)cc1 788538004 DABFTFDTMMZDQG-UHFFFAOYSA-N 405.442 2.149 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]2CCC[C@H]21 789848124 ZYGUZYKVBIHZME-QFBILLFUSA-N 403.498 2.194 10 20 HECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 789984458 RGQJHNPPHUHFEE-GGPKGHCWSA-N 414.550 2.090 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CCc4ccccc4OC3)CC2)cc1 801571422 SMKBMUOHEMWVAO-IRLDBZIGSA-N 411.546 2.162 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1ccc(O)cc1SC 802721856 JGZRRFYMRAHSDQ-UHFFFAOYSA-N 403.503 2.327 10 20 HECD C[C@H](NC(=O)C(=O)N1CCOCC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803297897 JNRYGICTYCPXLC-SFHVURJKSA-N 415.534 2.120 10 20 HECD Cc1cc(C(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c(C)n1-c1ccccn1 804645424 YQLCGCZCGSXAFI-YQQQUEKLSA-N 409.534 2.303 10 20 HECD COCC[C@@H]1COCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 813321577 YJKHGFDEYZADQX-CYBMUJFWSA-N 424.409 2.248 10 20 HECD O=S1(=O)CCN(c2ccc(CN[C@H](c3nc[nH]n3)C3CCCCC3)cc2)CC1 813860826 LUOYTFQUDACVDW-IBGZPJMESA-N 403.552 2.451 10 20 HECD O=C(CSc1nnc2n1CCCCC2)NCc1ccc(N2CCOCC2)c(F)c1 917176097 WDTYEVOKGMSZKZ-UHFFFAOYSA-N 419.526 2.389 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(Cl)nc3)cc2)C1 918017271 XYHXRYTWLQBLRE-INIZCTEOSA-N 401.898 2.436 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](C)OCC3CC3)cc2F)C[C@@H](C)O1 920779108 PNHSKFUFCRQWNH-XHSDSOJGSA-N 422.497 2.414 10 20 HECD COc1ccc([C@@H](CNC=C2C(=O)NC(=S)NC2=O)c2c[nH]c3ccccc23)cc1 920978957 XOZOVWAZUCEZLW-MRXNPFEDSA-N 420.494 2.313 10 20 HECD COC(=O)COc1ccc(/C=C2/N=C(C3=S=C(C)C=C3)OC2=O)cc1[N+](=O)[O-] 1116737458 ULUCKKOOXJJMOZ-KPKJPENVSA-N 402.384 2.111 10 20 HECD CN1CCN(CC2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)CC1 1324018622 IHXFLMCPXBXFFQ-UHFFFAOYSA-N 403.590 2.037 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCC=C1F)C2 1796603441 LRDWMOVLPPZFIR-PSUSHLJKSA-N 407.417 2.490 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1cc(O)nc(O)c1 1817844098 PXIXFUWUDXUMLL-GFCCVEGCSA-N 414.447 2.292 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3ccccc3SCC(N)=O)CC2)cc1 7905915 ZDGABHFGSDTXRT-UHFFFAOYSA-N 414.531 2.033 10 20 HECD COC(=O)c1cc(OC)ccc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 63480903 JFMWAMKLIIKKRS-UHFFFAOYSA-N 413.474 2.251 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NCc2ccc(C(=O)NCC(N)=O)cc2)cc1 71939359 RGAHWRSCHCFPRW-UHFFFAOYSA-N 404.470 2.239 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(F)cc1F 138477067 RWCJNQHBMXVTRS-UHFFFAOYSA-N 417.412 2.389 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1F 729061349 BKOKZCZYVCMQTH-LBPRGKRZSA-N 406.410 2.381 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1 731055293 NFYMZVPWUOJTND-IBGZPJMESA-N 422.478 2.489 10 20 HECD CSC[C@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 731385016 DXERMXYFWVYRHZ-LBPRGKRZSA-N 424.544 2.467 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1sccc1S(=O)(=O)N(C)C 732054243 NWOYJFKPNWALSX-UHFFFAOYSA-N 423.560 2.107 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1 735518154 IPZXRIJCLYTNBI-IRXDYDNUSA-N 413.522 2.367 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCCN3C)cc2F)C[C@@H](C)O1 745080944 YSTCWYPNPJHMTQ-QINHECLXSA-N 421.513 2.083 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)c2cccnc2)c(C)n1-c1ccc(F)cc1 746276674 ZMFWRNBHYNKLNA-UHFFFAOYSA-N 416.478 2.337 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(C)(=O)=O)cc1 753200830 NGBDKFACONWHSY-OAHLLOKOSA-N 420.506 2.486 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(N4C(=O)CCC4=O)cc3)CC2)cc1F 753738904 MSKMTYUIRXOBNZ-UHFFFAOYSA-N 411.433 2.450 10 20 HECD COc1ccc(N2CCN(C(=O)NCC(=O)N(C)Cc3ccccc3)CC2)cc1F 753852760 XXLYHXVCBUFKKN-UHFFFAOYSA-N 414.481 2.325 10 20 HECD COC(=O)c1sccc1NC(=O)CN1CCN(c2ccc(OC)c(F)c2)CC1 753857479 MKCJNMUIGHJZAS-UHFFFAOYSA-N 407.467 2.443 10 20 HECD C[C@@H]1C[C@H](NCc2ccccc2S(=O)(=O)N(C)CCO)c2c(O)ccc(F)c21 756704695 KXXLRXQDJZEFTL-CJNGLKHVSA-N 408.495 2.482 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc4nnc(C)n4c3)CC2)cc(OC)c1OC 759220858 LOHYKXHQMZUMOT-UHFFFAOYSA-N 411.462 2.026 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC1(CO)COC1 763644448 QJGHYSANUBDNKS-NTUHNPAUSA-N 413.542 2.282 10 20 HECD C[C@H]1CN(CCCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCCO1 764279391 QHFGGVJZFCMERZ-OALUTQOASA-N 404.555 2.384 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 764915079 KOGMEBDPRUHFDZ-SFHVURJKSA-N 421.563 2.492 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)NCc1cccc(Br)c1O 765927436 RRUWFWVUSPCMOP-UHFFFAOYSA-N 413.249 2.258 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1F 766974439 UTKREJUYGBRSCC-FQEVSTJZSA-N 419.545 2.120 10 20 HECD C[C@H](NC(=O)N1CCCC[C@@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 767780693 IRCDNDFSJLLECK-QFBILLFUSA-N 409.552 2.193 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2n[nH]cc2-c2ccc3c(c2)OCO3)c1 769924790 HFQHVWZUSTWOFI-UHFFFAOYSA-N 416.415 2.135 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCc4cc(O)ccc4C3)cc2)C1 770302485 WSABABMMIBKWCX-VQTJNVASSA-N 422.529 2.451 10 20 HECD CCOC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 770347754 YLCFSUPEFUZTPD-INMHGKMJSA-N 422.501 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCC(=O)C[C@@H]4C)n3)CC2)cc1 771083867 TUPBGHNLQPVNPU-KXBFYZLASA-N 412.490 2.442 10 20 HECD O=C1c2ccccc2C(=O)N1C[C@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 771173249 NOZTZRRHRFEKME-MRXNPFEDSA-N 403.438 2.437 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(I)cn2)cc1 772834403 RZKAYHMQBZORNA-UHFFFAOYSA-N 424.242 2.007 10 20 HECD CCC(=O)N1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 773031726 GCCXRHHLPVNCPX-OAHLLOKOSA-N 413.440 2.417 10 20 HECD COCCNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773990692 WGVOOZHBJKASES-HNNXBMFYSA-N 405.520 2.168 10 20 HECD O=C(CN1CCC[C@H]1C1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 777741866 CKPIESBFBLDKRD-FQEVSTJZSA-N 405.514 2.170 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 781436888 ORDGHLOXKRRIOA-UHFFFAOYSA-N 405.401 2.462 10 20 HECD Cc1cc2c(cc1NC(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)OCO2 781469672 BRMIHEXVNFUNQO-UHFFFAOYSA-N 417.487 2.280 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OC)cc1Cl 785295984 ABIYGBPQBJEZDD-JTQLQIEISA-N 408.838 2.454 10 20 HECD COc1cc(F)c([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785432673 GRYUFCZEZIUJSM-CYBMUJFWSA-N 403.454 2.403 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC(F)F 785435452 ZNFDBZUOFTYJMK-UHFFFAOYSA-N 421.444 2.338 10 20 HECD O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786648764 MHIYSPUDIAYLDT-INIZCTEOSA-N 418.444 2.127 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCN1c1ccccc1 787087897 VNQIBMPTWULBHE-NRFANRHFSA-N 413.543 2.207 10 20 HECD COC(=O)[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]1C 787505993 XALAJANNYSWJEV-YPMHNXCESA-N 424.500 2.278 10 20 HECD COCc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 787506371 SOEIECOPBNJLTR-KRWDZBQOSA-N 411.502 2.163 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccccc2N2CCOCC2)cc1 788335607 PERKYLVXYRDFJF-UHFFFAOYSA-N 424.545 2.302 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC([C@H]2CCCO2)CC1 789862974 ZDTWFSRCNDPJEN-HXUWFJFHSA-N 417.575 2.274 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1nccs1 789867073 FMKVIMBAGQJLMF-AWEZNQCLSA-N 404.561 2.232 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)/C=C\c2cccc(Cl)c2)ccc1O 790408084 TVJFVPOWBIZCMF-FPLPWBNLSA-N 402.881 2.366 10 20 HECD COC(=O)c1cn(CCNC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)nn1 790695197 HGXDNKDGKDRXJG-UHFFFAOYSA-N 414.510 2.333 10 20 HECD CN(CCCNC(=S)Nc1cccc(NC(=O)NCC(N)=O)c1)c1ccccc1 797792013 SAOPZPOJDYUMEQ-UHFFFAOYSA-N 414.535 2.106 10 20 HECD COc1cc(C)cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803301676 WFCXGGSZCUWUBO-KRWDZBQOSA-N 411.502 2.334 10 20 HECD CCC(CC)N(CCOC)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306602 SEKDGNNUXBCTMB-KRWDZBQOSA-N 405.539 2.364 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cc1F 803661916 OJCWTDQUQFCMOV-GOSISDBHSA-N 421.513 2.085 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 804842617 MHFBDTUSLRJPLN-QGZVFWFLSA-N 416.472 2.384 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 806282421 KROTUGMMWNJYBV-HNNXBMFYSA-N 409.508 2.481 10 20 HECD COc1cnccc1[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807175893 WNNWRDKUKSGYLW-NVXWUHKLSA-N 413.474 2.181 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCN(c2nccs2)CC1)c1ccc(N(C)C)cc1 807670534 GFVCHZOLLRRMRF-OAHLLOKOSA-N 401.536 2.125 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1ccccc1 916295551 NUUFHVSHCAFLLT-UHFFFAOYSA-N 404.536 2.263 10 20 HECD O=C(CSc1nnnn1C1CCCC1)NCc1ccc(N2CCOCC2)c(F)c1 917199637 GUJQGUFYYQQRHH-UHFFFAOYSA-N 420.514 2.172 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(N2CCCC2=O)cc1 919839111 BMAAXRNKHYXBKS-UHFFFAOYSA-N 413.499 2.301 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccc([N+](=O)[O-])c1C 1321366883 PVAMJGCFFAPHRA-HNNXBMFYSA-N 402.403 2.148 10 20 HECD Cc1cc(CC(=O)NCC(=O)N2CCN(C)CC2)c(C)n1-c1ccc(Cl)cc1 1349649486 PUKUJOQMQCXOBT-UHFFFAOYSA-N 402.926 2.180 10 20 HECD CC(C)(F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795923866 RKUKSTZMBDUZRP-RBVVOMGSSA-N 400.454 2.166 10 20 HECD COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1C 1796603821 YUARNNCVLMORGO-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@H]1CCCCO1)c1cc(O)nc(O)c1 1798480197 VOTVJCWNFACVDW-YGTYGHESSA-N 421.519 2.004 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccncc1 1804283554 CGCWCXPSWDKCQT-KYXSFPASSA-N 409.442 2.164 10 20 HECD COCCS(=O)(=O)c1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 116423089 GZBGHGPDPGUJIE-UHFFFAOYSA-N 402.516 2.419 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCn1cc(Br)ccc1=O 477125999 ZFWYQDQGWKNBBC-UHFFFAOYSA-N 406.280 2.493 10 20 HECD CC(C)C(=O)N1CCCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 727842739 CZGSROOOQNNYLF-SFHVURJKSA-N 402.539 2.484 10 20 HECD Cn1c(=O)oc2cc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 728393180 JZVGYHJDZATQCJ-UHFFFAOYSA-N 400.410 2.429 10 20 HECD CCOC(=O)N1CCC(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730192542 FNIKVJAYJSSZED-UHFFFAOYSA-N 420.529 2.452 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCN1CCCC1=O 733195423 NBNYIGBCQQVJCF-OAHLLOKOSA-N 419.481 2.343 10 20 HECD CC(C)[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 734269229 JMZCNFWELJUCJD-KHYOSLBOSA-N 406.502 2.105 10 20 HECD Cc1cc(C(=O)NCc2cc(S(N)(=O)=O)ccc2F)c(C)n1-c1ccccn1 734551302 RIUWGOPUDQWQAT-UHFFFAOYSA-N 402.451 2.206 10 20 HECD CC1CCN(c2ccc(CNC(=O)N[C@H]3CCN(c4cnn(C)c4)C3=O)cc2)CC1 735513556 PYSUEBXQXDKDRZ-FQEVSTJZSA-N 410.522 2.261 10 20 HECD O=C(Nc1cccnc1-n1cncn1)C(=O)N(Cc1ccco1)Cc1ccccc1O 737111328 WNKGADNKJXOBQX-UHFFFAOYSA-N 418.413 2.128 10 20 HECD COCCN(CCOC)S(=O)(=O)NCc1ccc(N(C)C2CCCCC2)cc1 742637428 ZFKBFBUUYMEERF-UHFFFAOYSA-N 413.584 2.385 10 20 HECD COc1ccc(C[C@H](CO)CNC(=O)NCc2ccc(N(C)C)cc2C)cc1O 745826699 CFMMBQUHARFQPI-KRWDZBQOSA-N 401.507 2.426 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 752151693 LOLGMJRPSNNSSC-QGZVFWFLSA-N 418.515 2.478 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3C3CCCC3)CC2)cc1F 754213397 RSFQOIUEEZVIOP-UHFFFAOYSA-N 415.469 2.433 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1 756178919 MKSUZGDMKVAUTD-OAHLLOKOSA-N 421.453 2.427 10 20 HECD Cc1cc(C(=O)N(CCCN(C)C)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 758278068 CDPGYXOEVZNSQF-GOSISDBHSA-N 418.563 2.070 10 20 HECD CCN(CC)c1ccc(CNC(=O)N(C)C2CCN(S(C)(=O)=O)CC2)cc1F 759581873 XQPGKQIZHSEFDV-UHFFFAOYSA-N 414.547 2.237 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCc1ccc(C(=O)N2CCCC2)cc1 759597882 UBPRYSLQNXBBIF-UXBLZVDNSA-N 424.453 2.207 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H](C)c3c(C)n[nH]c3C)CC2)cc1 759820824 ZNKOHKWSJHWBED-HNNXBMFYSA-N 414.506 2.421 10 20 HECD NS(=O)(=O)c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1 765316203 TWUKUSANEOYVMO-UHFFFAOYSA-N 400.254 2.124 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC([C@H](O)C(F)(F)F)CC1 765690646 QZFPVDWSMMGHOJ-KRWDZBQOSA-N 401.429 2.368 10 20 HECD Cn1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1=O 769826146 LLQGEGXUTPODOB-UHFFFAOYSA-N 405.457 2.206 10 20 HECD CCNC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773847941 QCSSEDNXNIWNQZ-HNNXBMFYSA-N 412.490 2.083 10 20 HECD CN1CCC[C@H](OC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1=O 778742237 KPRJHZGYPVSKKB-HNNXBMFYSA-N 408.366 2.148 10 20 HECD COC(=O)[C@@H]1CCN(Cc2cc(Br)cc(OC)c2O)[C@@H](C(=O)OC)C1 780784272 SKJQGWAHCMPVLN-ZWNOBZJWSA-N 416.268 2.090 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1N1CCOC1=O 785295623 XNLGWLIUFDNRNR-ZDUSSCGKSA-N 413.430 2.049 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785298024 UHFHVMYJHJHTSP-CYBMUJFWSA-N 414.458 2.234 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)CCC(=O)N4)cc2)CC1 786256228 BUNFHNIVWOWJAK-UHFFFAOYSA-N 406.486 2.170 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCC=CO3)cc2F)C[C@@H](C)O1 787054005 RNILPXRZQNENKW-ZRGWGRIASA-N 406.454 2.291 10 20 HECD Cc1cccc2[nH]cc(CCNC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c12 788332523 OQYGKQDAIYRMFU-UHFFFAOYSA-N 420.513 2.288 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCOC3CCCC3)cc2F)C[C@@H](C)O1 789817193 GUOHTPVUFYCULT-HZPDHXFCSA-N 421.513 2.131 10 20 HECD CCC[C@]12CCCN1C(=O)N(CCN1CCN(c3ccc(OC)cc3)CC1)C2=O 794776747 PBWDGKXUHIBWFF-JOCHJYFZSA-N 400.523 2.414 10 20 HECD CO[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnn(C)c1 798397335 AMFLFDHLINBWQB-QGZVFWFLSA-N 412.412 2.279 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cncc(-n4ccnn4)c3)cc2F)C[C@@H](C)O1 801663301 MWHYJUUKJLQPGB-HUUCEWRRSA-N 410.453 2.345 10 20 HECD Nc1nnc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)o1 803125113 HCFQJZMHWPLJRQ-YFHOEESVSA-N 409.518 2.011 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)c3ccncc3)CC2)cc1 804315847 TUCAAUUVVJPDFV-UHFFFAOYSA-N 410.518 2.269 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC3CCC4(CC3)CC4)cc2F)CC1 805007655 WANURXKAACTIFS-UHFFFAOYSA-N 416.541 2.423 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccn1 806844535 ZJSYGGQBSDBILS-KBPBESRZSA-N 416.453 2.098 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccc(C)cc2)C1=O 807585945 KDADLJOGCONSTR-OAQYLSRUSA-N 422.529 2.331 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 808346872 RISOUQPSNQTBTJ-TZIWHRDSSA-N 417.550 2.015 10 20 HECD CNC(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 916677903 UQFZEQQZRSUWPL-UHFFFAOYSA-N 400.454 2.273 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C[C@@H](C)O1 918201058 CFZUURJNJDUHRN-KDURUIRLSA-N 418.582 2.194 10 20 HECD O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1ccc(N2CCC(CO)CC2)cc1 919968526 CQKGIKLXRWWGLW-UHFFFAOYSA-N 423.513 2.475 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969624 URTQYOHXQKLYQP-UHFFFAOYSA-N 420.506 2.429 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)[C@H](C)c1ccccc1 1320397044 CEDVLNHDHIKYQI-AOSWFRPUSA-N 401.459 2.243 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](CC(N)=O)C1 1322787339 XIXKHQLMHODBOX-GJZGRUSLSA-N 419.481 2.376 10 20 HECD CN1CCN(c2ccc(CNc3cnn(Cc4nnc5n4CCCC5)c3)cc2F)CC1 1324760191 VYYTUYJLFBMXTM-UHFFFAOYSA-N 424.528 2.362 10 20 HECD CC(C)/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007509 JNMCTNBCAGFBHJ-YADGQWAMSA-N 408.882 2.407 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C(F)(F)F)CCC1)c1cc(O)nc(O)c1 1795918271 WQGSJIZSHHIEMK-CLLJXQQHSA-N 413.396 2.477 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCC=C1F)C2 1796603440 LRDWMOVLPPZFIR-MWBIGIAMSA-N 407.417 2.490 10 20 HECD Cc1cnoc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799082007 QDEXWFRPNVAMNX-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Cc1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1800715900 WEFMBLWAJOHXST-QDMKHBRRSA-N 416.865 2.415 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccns1 1816273318 KYDXVCABOOPKFX-GFCCVEGCSA-N 414.447 2.292 10 20 HECD COCCOc1cnc(-c2noc(-c3ccc(NC(=O)C4=S=CC=C4)cc3)n2)cn1 445307925 RPKJXLGKIPFBSQ-UHFFFAOYSA-N 423.454 2.435 10 20 HECD COC(=O)c1cc2c(cc1NC(=O)C(=O)NCc1c(C)c3ccccc3n1C)OCO2 472795397 ZUHAQUFVZUXKHL-UHFFFAOYSA-N 423.425 2.257 10 20 HECD CCCCC(=O)N1CSC[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 730328966 IXGMPJCXFGCZND-SFHVURJKSA-N 421.563 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(NS(C)(=O)=O)cc3)CC2)cc1 741071280 ZUUBBMLXDDTPOO-UHFFFAOYSA-N 404.492 2.421 10 20 HECD CC(=O)N(C)c1cccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 746038605 NZSJYFOVKNNJSV-UHFFFAOYSA-N 424.501 2.103 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 754000566 WXHLTGAQCXJDRT-OAHLLOKOSA-N 406.552 2.421 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCSc2nccs2)CC1 759550566 ABGKYJUDQXMCOA-INIZCTEOSA-N 419.576 2.179 10 20 HECD COc1cc(N2CCN(C(=O)C3CCN(C(C)C)CC3)CC2)cc(OC)c1OC 760088622 WXSLONFFIRUWAH-UHFFFAOYSA-N 405.539 2.481 10 20 HECD CCN1CCN(C[C@@H](C)CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CC1 761126476 QDAKIKDJJAEENX-OAHLLOKOSA-N 408.930 2.083 10 20 HECD C[C@H](CNC(=O)c1ccccc1)c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762275651 CMQNGOSZEUCHHW-GFCCVEGCSA-N 416.459 2.347 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)nc12 768694165 FRODSDKOJLBRJM-UHFFFAOYSA-N 424.413 2.198 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccc2c(c1)COC2 769291816 MUYJTFXRKVDDQT-UHFFFAOYSA-N 404.488 2.140 10 20 HECD C[C@H](NCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 775835217 SMWLQHWAXALPSW-OXJNMPFZSA-N 407.580 2.362 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2cc[nH]n2)cc1 780049460 WPAXWBCTSAQINB-UHFFFAOYSA-N 405.458 2.168 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 785440372 ZCHRZMJIYUYTPZ-KRWDZBQOSA-N 418.538 2.132 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\c3ccc4c(c3)OCO4)cc2)CC1 786263459 XDVMRKVTNBWTFD-UITAMQMPSA-N 407.470 2.413 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3CCc4ccccc43)CC2)cc1 788141687 VUIROQLLIOFNCY-SFHVURJKSA-N 423.513 2.338 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccnc3F)cc2F)C[C@@H](C)O1 789007025 LDBCHITYQJRKMJ-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 793644656 IHORWEZDIDCMCP-KBXCAEBGSA-N 418.538 2.349 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 793862857 LIKWEFJPIIZDHS-IBGZPJMESA-N 422.504 2.461 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 793901177 LJVAHAOFXJFIHV-QZTJIDSGSA-N 416.566 2.017 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c(O)c1 794389961 UGBNVAHUHVLPFG-QGZVFWFLSA-N 418.515 2.426 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1F 796767184 AZFLLDHWEFRDIU-UHFFFAOYSA-N 417.412 2.389 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(c4nccnc4C)CC3)CC2)cc1 799570945 QOGNQDONVJGMSM-UHFFFAOYSA-N 410.522 2.294 10 20 HECD Cc1noc(C)c1CCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803304304 XORYLXOTJNDURT-HNNXBMFYSA-N 414.506 2.054 10 20 HECD CCN(CCCN1CCCC1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803313647 AIDNWCZJSSNLTD-LJQANCHMSA-N 416.566 2.035 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCC[C@H]1N1CCOCC1 806088471 WIHVFNIXZQSRDG-VQTJNVASSA-N 417.550 2.281 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 807671883 UJPNNRMZOGTQEX-KRWDZBQOSA-N 422.529 2.351 10 20 HECD CC(C)O[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1(C)C 809438191 KXZNXCSBWWPMDF-PMACEKPBSA-N 417.550 2.190 10 20 HECD CC(=O)c1cc(Cl)cc(CN(C)CCOc2ccc(S(N)(=O)=O)cc2)c1O 814648083 KYSCVYYTWOICJD-UHFFFAOYSA-N 412.895 2.406 10 20 HECD CCN1C(=S)N[C@@H](c2ccc(N(CC)CCO)cc2C)C(C(=O)N(C)C)=C1C 839457126 SMBJLAJUPQNCGU-IBGZPJMESA-N 404.580 2.427 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C(=O)C(C)(C)C)CC2)c1 914569775 YWJVCRNWZZGMID-UHFFFAOYSA-N 417.550 2.117 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1C 917758245 MTLCVLJOTHRSCS-UHFFFAOYSA-N 415.449 2.171 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 918286661 JQPXCBYGJGYGMO-OKILXGFUSA-N 416.453 2.098 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC=CO1)C1=NN(c2ccccc2)C(=O)C1 1798406491 NSLPSPFXPHXEFN-NFBUACBFSA-N 422.485 2.110 10 20 HECD CC(C)N(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832418329 CZBHHIYEIGSPTD-SFHVURJKSA-N 418.538 2.066 10 20 HECD Cc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc2n1 1843249980 XRHHEFQTABUMSN-UHFFFAOYSA-N 408.414 2.073 10 20 HECD Cn1ccc2cccc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c21 1843776948 ZMDCIMVIIVNXGN-UHFFFAOYSA-N 406.442 2.115 10 20 HECD O=C(c1ccccc1F)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038420 QMLAMHRYEBMQCO-VQHVLOKHSA-N 412.417 2.473 10 20 HECD CCn1cnnc1SCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 7371857 SDKCNNAETZVMDH-UHFFFAOYSA-N 419.532 2.328 10 20 HECD CCn1c(=O)[nH]c(=O)c2c(C(=O)NCc3ccc(N(C)C)cc3)cc(C(C)C)nc21 32413501 FCDCHRRFJKPBKG-UHFFFAOYSA-N 409.490 2.224 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)C(=O)N4CCCC4)CC3)c2C)c1 117729986 BLURGGGIQIGMDB-UHFFFAOYSA-N 422.529 2.309 10 20 HECD CCC(CC)N1C[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1=O 729328860 WTSWXHBGNPJAGL-ROUUACIJSA-N 414.550 2.042 10 20 HECD CC1CCN(c2ccc(CNC(=O)N[C@H]3CCCN(S(C)(=O)=O)C3)cc2)CC1 731120219 QZUKGPULMFIVSM-SFHVURJKSA-N 408.568 2.146 10 20 HECD COC(=O)CN(CC(=O)NCc1ccc2c(c1)OCO2)Cc1cc(Cl)ccc1O 731844708 IBSVETBMVBGORL-UHFFFAOYSA-N 420.849 2.066 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1 734073753 BSPBNSFGWKGOIR-UHFFFAOYSA-N 405.248 2.369 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 734219953 CLRJYIXXNKCTCW-MOPGFXCFSA-N 402.539 2.312 10 20 HECD CNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 734270890 ZIDZSDDBNLUORF-UXLLHSPISA-N 406.502 2.107 10 20 HECD O=C(NCc1nnnn1C1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 743698531 QMZFTJSLJTYMNP-UHFFFAOYSA-N 407.425 2.078 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1C 744453110 WUESRNONJFIMCG-UHFFFAOYSA-N 416.503 2.271 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1Cn1cccn1 746136434 RSCGUZJIECQIFY-UHFFFAOYSA-N 424.526 2.096 10 20 HECD COc1cc(C[C@H](CO)CNC(=O)NCc2ccc(N(C)C)cc2)cc(OC)c1 747446276 JQGCENNAHMUWHI-SFHVURJKSA-N 401.507 2.420 10 20 HECD Cc1cccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)nn2)c1 751098368 QLPLCYIJHPXZMH-GOSISDBHSA-N 418.501 2.207 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1 752725210 BBXNOLYMJKYLNR-LLVKDONJSA-N 403.410 2.058 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 753643297 HRJYRWKDDCRPFS-GFCCVEGCSA-N 415.402 2.442 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(F)c3)cc2F)C[C@@H](C)O1 759428787 CMLGYEKUAAXTCG-OKILXGFUSA-N 419.428 2.447 10 20 HECD Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 760094955 KFVBNDAJTYWAIB-OAQYLSRUSA-N 408.502 2.214 10 20 HECD COc1cccc(CNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)c1O 769504381 XEFCOQUHOFHXIV-UHFFFAOYSA-N 410.405 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](C[C@H]4CCOC4)C3)CC2)cc1 773704187 XMRNIQXTCYEXEN-WOJBJXKFSA-N 401.551 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3cccc(C)n3)CC2)cc1 778288708 WYXJCPQRBXJCLS-VAWYXSNFSA-N 408.502 2.262 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 781520289 DWGFJFCUPFFHHO-UHFFFAOYSA-N 415.396 2.383 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)cc1 785979591 IUZZHYFHNMMPBS-UHFFFAOYSA-N 420.517 2.388 10 20 HECD NC(=O)[C@@H]1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 786789324 QURDMNFWSXKFPA-ZIAGYGMSSA-N 413.440 2.450 10 20 HECD CCc1nc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)sc1C 789377547 LMHLHSCWFLEIDC-UHFFFAOYSA-N 416.547 2.478 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cncc(F)c3)cc2F)C[C@@H](C)O1 799251950 YUVQUXTUXAYGAO-BETUJISGSA-N 404.417 2.228 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CCO[C@H](C2CC2)C1 803451752 UXGVBPRTTSEYFS-SFHVURJKSA-N 423.460 2.010 10 20 HECD C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806493911 IBUUDWMRCPESBR-YFVAEKQCSA-N 413.566 2.157 10 20 HECD CCc1ccc([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 806494639 SSFPTBHRRROPTC-RBBKRZOGSA-N 424.545 2.484 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCN(C(=O)OCC(C)C)CC1 807096309 HVNBATRGNQLVLI-UHFFFAOYSA-N 418.538 2.004 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCN(c3ccccc3F)C2)c1 812602036 KGWAWIGZDUUCNX-CYBMUJFWSA-N 407.467 2.159 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1OC 917759122 GTYAMCQBXFKEKN-UHFFFAOYSA-N 415.449 2.166 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 918303618 CBOSBPMFNCNNPI-FQEVSTJZSA-N 424.501 2.467 10 20 HECD COC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424219 UTSCIMPKNDPZTP-PBHICJAKSA-N 405.495 2.009 10 20 HECD COc1ccc([C@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841572670 JZHIGNMIKPVRQT-MSOLQXFVSA-N 423.469 2.122 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c(O)n1 1845501729 WQRUBMMTWWQESV-UHFFFAOYSA-N 417.849 2.291 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(N2CCCS2(=O)=O)cc1 437017481 KSIOUHZKESWFSN-UHFFFAOYSA-N 401.488 2.332 10 20 HECD CC(C)N1CCC(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 725797744 FRRUETLYINVGNA-UHFFFAOYSA-N 406.546 2.083 10 20 HECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)N(C)Cc1ccc(N2CCCCC2)cc1 725818913 FQSNWIAAXLKYCS-LJQANCHMSA-N 409.552 2.381 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3CN3CCCC3)cc2)C1 729599180 OGNAPGVZLYMSNN-FPOVZHCZSA-N 413.566 2.158 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c1O 729859814 ZYBZFJWTYFVPMQ-QGZVFWFLSA-N 418.515 2.426 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1O 737285539 FVSNGOLWNAKKFQ-OAHLLOKOSA-N 418.421 2.353 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(F)c(NC(C)=O)c3)CC2)cc1 742917263 VMOBXMZJFVBLAG-UHFFFAOYSA-N 414.481 2.345 10 20 HECD CN1CC[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 750728896 KXJOMGWFPPTMAH-FQEVSTJZSA-N 413.543 2.161 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(C)(C)CN(C)C 754357584 RWHOOIVWKJDBFH-WMZOPIPTSA-N 403.571 2.164 10 20 HECD C[C@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1O 756592003 RIPFJAUUCXGWJR-HNNXBMFYSA-N 407.511 2.318 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2cncc(Cl)c2)cc1)C1=S=CC=C1 756597578 CFQZVRQOAGPDNI-UHFFFAOYSA-N 421.887 2.070 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCc3ccc(OC)c(F)c3)CC2)cc1 758209317 KAHPQWASHKNNNQ-LJQANCHMSA-N 403.498 2.116 10 20 HECD COc1cc(N2CCN(C(=O)CCCc3nc(C)no3)CC2)cc(OC)c1OC 760088156 UBGRDRAWYDZTKK-UHFFFAOYSA-N 404.467 2.075 10 20 HECD COc1cc(N2CCN(C(=O)c3cnn(C(C)C)c3N)CC2)cc(OC)c1OC 760455000 QBXXKIRUOCCWTK-UHFFFAOYSA-N 403.483 2.034 10 20 HECD Cc1oc(C(=O)NCc2cccc(Br)c2O)cc1S(=O)(=O)N(C)C 765726475 HATIRTSUCSKGOC-UHFFFAOYSA-N 417.281 2.236 10 20 HECD COc1ccc(OC)c(NC(=S)NNc2c(OC)cccc2S(C)(=O)=O)c1 767427203 SOOWFMJZJVWMPT-UHFFFAOYSA-N 411.505 2.429 10 20 HECD O=C(c1ccccc1OC(F)F)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440889 HJQULUBLRPWHGI-QGZVFWFLSA-N 420.412 2.377 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(O)c(O)c3)cc(C(C)C)nc21 768914383 OMNJREDFVBVVJO-UHFFFAOYSA-N 412.446 2.372 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccccc2O)ccc1Br 769363996 XIYYZQFHBFNYBU-UHFFFAOYSA-N 413.293 2.335 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cc(F)cc(OC)c3)CC2)cc1 769705799 MCCSRSHGXSZIQK-UHFFFAOYSA-N 416.497 2.464 10 20 HECD CC(C)(C)n1ncc2c(O)nc(NNC(=S)Nc3ccc4c(c3)OCO4)nc21 769796031 WFXBEYXJLUUJHI-UHFFFAOYSA-N 401.452 2.329 10 20 HECD COC(=O)[C@H](C)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769941651 GMVVQIUDCGXPMS-SJKOYZFVSA-N 406.460 2.044 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@H]4CCCCO4)n3)CC2)cc1 771069498 VZTOUZZIJRPFCL-LJQANCHMSA-N 414.506 2.471 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 773749520 QJKXODWLWDFRQF-CQSZACIVSA-N 404.488 2.243 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 775122180 QRCFKUXYVHQJCU-UWJYYQICSA-N 407.514 2.374 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 779496115 JYOFUZSGDCZDKE-GORDUTHDSA-N 403.416 2.065 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(-n2cncn2)cc1 785395164 DXCSYAAGFUOBJK-QGZVFWFLSA-N 416.485 2.137 10 20 HECD COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)CO2 786254633 GFWKFMBBTRQKAJ-HXUWFJFHSA-N 423.513 2.231 10 20 HECD C[C@@H](NC(=O)C(=O)NCCC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803303794 AFVIUQJWYXMMKO-XLIONFOSSA-N 403.523 2.166 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(OCC(C)C)CC3)CC2)cc1 804315029 ATGNEUXYENSQMG-UHFFFAOYSA-N 417.550 2.444 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805023514 IIMUFMDCWDITKO-LJQANCHMSA-N 415.534 2.341 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1 807288015 RDMFUSMWGXSBOW-OAQYLSRUSA-N 410.493 2.237 10 20 HECD CCc1cnc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)s1 807675625 YZQBYAGRJSTICQ-HNNXBMFYSA-N 415.563 2.298 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)[C@@H]3CCCCO3)CC2)cc1 809422915 IVLBPFJUHIZDNG-FQEVSTJZSA-N 417.550 2.445 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1COc2ccccc2[C@@H]1O 812009396 PDUOQMUXLWXPEK-NQIIRXRSSA-N 415.465 2.081 10 20 HECD O=C(CN1CCC(F)(F)[C@H](CO)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 812859824 QUHRJYCIIBAKST-ZDUSSCGKSA-N 414.408 2.350 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C 819755485 IYJFLIGRHMQSTE-UHFFFAOYSA-N 415.446 2.468 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1C 917833621 DAGQYCDIBANQNY-KRWDZBQOSA-N 424.501 2.198 10 20 HECD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284848 RLYNDCKUZKVRHF-UHFFFAOYSA-N 416.409 2.134 10 20 HECD C[C@H](CO)NC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1325695315 GYZIARKJZRWNIZ-MRXNPFEDSA-N 400.498 2.300 10 20 HECD CC[C@@H](C)[C@@H](N)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796001507 GPAXRPIYRJXUDB-LHNVCGPYSA-N 409.914 2.376 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)cc2)C1 1842717222 CLRPACWSAJFSOA-UHFFFAOYSA-N 401.850 2.206 10 20 HECD O=C(c1cccc(F)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038215 HUUOPCNTAOORDO-SOFGYWHQSA-N 412.417 2.473 10 20 HECD COc1cc2nc(CN(C)Cc3ccc(N4CCOCC4)cc3)[nH]c(=O)c2cc1OC 8307714 KCZFYTIUZZCEGP-UHFFFAOYSA-N 424.501 2.409 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(CC(=O)NC(C)C)CC2)cc1F 303337242 KUGYRMGFBLPIRL-UHFFFAOYSA-N 407.534 2.024 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)CNC2=O)c(C)n1-c1ccccc1Br 303655073 XUKLUXDTSCORCS-UHFFFAOYSA-N 419.279 2.138 10 20 HECD CCOCCCNC(=O)Cc1noc(-c2ccc(NC(=O)C3=S=CC=C3)cc2)n1 445337569 UHFJAEISGXKBNJ-UHFFFAOYSA-N 414.487 2.038 10 20 HECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 727150815 JBMFLLKOVRBCFR-IBGZPJMESA-N 420.554 2.237 10 20 HECD CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 730118103 GYAMHQMZQVNQRZ-MRXNPFEDSA-N 422.501 2.471 10 20 HECD Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 735192689 UZBVFABKXSPNSW-UHFFFAOYSA-N 417.531 2.203 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CC4CCOCC4)CC3)CC2)cc1 737048890 FRZPKSRFSVXCIK-UHFFFAOYSA-N 416.566 2.418 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C[C@H]3CCOC3)C3CC3)CC2)cc1 743363979 ZHOWNUXZWSXYBR-GOSISDBHSA-N 402.539 2.028 10 20 HECD Cc1cc(=O)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nn1-c1ccccc1[N+](=O)[O-] 753630333 AWZOMLYGJATHQE-LBPRGKRZSA-N 424.413 2.221 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccnc(O[C@@H]2CCOC2)c1 755045268 DJDCJAQNOHZUSR-LJQANCHMSA-N 413.474 2.131 10 20 HECD CC1(C)OCC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CO1 756705634 MEORPIQLHLUDRY-UHFFFAOYSA-N 412.489 2.136 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)OCCO4)CC2)cc(OC)c1OC 759240054 VJBFAJKBCZYWEN-UHFFFAOYSA-N 414.458 2.446 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCCc4c[nH]nc43)CC2)cc(OC)c1OC 760127001 BCBFNMNEQAPAIE-INIZCTEOSA-N 415.494 2.345 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(OCC(F)F)nc3)cc2)C1 761386674 WQAMZYGJEFBCJO-MRXNPFEDSA-N 418.444 2.357 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCO1 764237307 UVOQOGBFXYLLGQ-LJQANCHMSA-N 418.582 2.195 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](c4n[nH]c(C5CC5)n4)C3)CC2)cc1 766255937 GLGIZANXNFULTD-SFHVURJKSA-N 424.549 2.219 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc3c(c2)NC(=O)CO3)cc1 770724445 LAUKZKYNOKDCKM-GOSISDBHSA-N 410.474 2.300 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3COCCN3CC(F)F)cc2F)C[C@@H](C)O1 771623876 QYNUCRXLSYDGDA-IYOUNJFTSA-N 415.456 2.021 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC(Oc3ccnc(C(N)=O)c3)CC2)cc1F 772457372 VFKDWCVKCANNCI-UHFFFAOYSA-N 415.469 2.139 10 20 HECD COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cccc(OC)c2O)c([N+](=O)[O-])c1 774523686 HPXGSBFFIUTOGW-LLVKDONJSA-N 403.391 2.212 10 20 HECD CCN1CCN(C(=O)CC2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)CC1 774879582 IRYGJFAGNYQGJX-UHFFFAOYSA-N 420.510 2.075 10 20 HECD CCCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CCS(=O)(=O)C1 776039942 YVXAOUOCDLPQNQ-VQIMIIECSA-N 409.552 2.193 10 20 HECD Cc1nc([C@H]2CCCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)n[nH]1 776116613 ASRNDBYQUDYJET-INIZCTEOSA-N 416.501 2.303 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 782106152 ICJNFBRWCOSPCA-CQSZACIVSA-N 401.438 2.487 10 20 HECD C[C@@H](Cc1ncc[nH]1)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782914091 ZCQNNQWGFBAQPJ-HRCADAONSA-N 404.486 2.426 10 20 HECD COc1ccc(N2CCCN(C(=O)COCCNC(=O)c3ccccc3)CC2)cc1 783919758 LQMYJJIEXJYWLF-UHFFFAOYSA-N 411.502 2.181 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785295297 SQJHBGLFIJFNEM-ZIAGYGMSSA-N 414.458 2.135 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(O)c1 792850014 XRGDGZMHWLDTIF-UHFFFAOYSA-N 421.519 2.429 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3C[C@@H](C)O[C@]4(CCOC4)C3)cc2F)CC1 792991606 ADEAREVSSPVELT-VGOFRKELSA-N 420.529 2.057 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c(O)c1 797389932 FPKAMCIAVNUOLP-UHFFFAOYSA-N 423.469 2.345 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Br)c2)cc1 797430863 BMUJLUXVSHJUCX-UHFFFAOYSA-N 420.310 2.126 10 20 HECD COc1ccccc1OC[C@@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665064 SMSYDVGDVAMZQW-HNNXBMFYSA-N 417.481 2.348 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1F 804851859 QUBXGKZAQFTIAU-QGZVFWFLSA-N 413.497 2.078 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(c2nnc3ccccn23)CC1)c1ccc(N(C)C)cc1 807670959 JWSVIGYXFILRFT-INIZCTEOSA-N 420.517 2.379 10 20 HECD C[C@H](CO)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 914544772 GPFBLQWMLZLCKZ-TZZQWBKVSA-N 415.334 2.147 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](C)CN3CCCC3)CC2)cc1 918198985 XLZQHYRJPAYANG-HXUWFJFHSA-N 417.598 2.238 10 20 HECD O=C(Cc1cnn(-c2ccccc2)n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971224 MFLLEOHYJLBWHX-UHFFFAOYSA-N 409.465 2.226 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCCN1C(=O)CNC1=O 108207269 DJLMZGDZYSBINN-UHFFFAOYSA-N 402.476 2.375 10 20 HECD C[C@H](NC(=O)c1ccccc1NS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 148595097 ZHOSQVFDOHVFSC-HNNXBMFYSA-N 403.504 2.386 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCCn3nc(C(C)C)nc32)n(C)c2ccccc12 580232911 CJKMCXZOWCOCTM-INIZCTEOSA-N 408.506 2.469 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)c1 727227180 JQZZEGDAUYOGND-UHFFFAOYSA-N 411.502 2.467 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCN(C)c4ccccc4C3)CC2)cc1 727843845 MHEFZYGUTOTPSI-UHFFFAOYSA-N 423.561 2.479 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1 728979358 FIOSRWWIEMIPPJ-QKVFXAPYSA-N 415.421 2.184 10 20 HECD C[C@H](c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1)N1CCOCC1 737080054 WTMFPODVYYKHBQ-QGZVFWFLSA-N 410.518 2.401 10 20 HECD CN(C)C(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 739699840 CKFHQSUHLCXQJJ-SFHVURJKSA-N 423.517 2.412 10 20 HECD COC[C@@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 741796213 XLAFENOFTKZYGJ-ZBFHGGJFSA-N 408.454 2.136 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)o1 748054301 JZNQDMHSJXARBZ-UHFFFAOYSA-N 408.476 2.114 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(CC(C)C)cn2)cc1 749864568 NGCOQNJFVCSSSP-UHFFFAOYSA-N 400.526 2.492 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccc(OC)c(C(=O)N(C)C)c2)c1 751326257 NMTXBJDTBIRHAJ-LBPRGKRZSA-N 408.476 2.151 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1 753640247 MSQBLKFGCBOZIK-GXTWGEPZSA-N 410.517 2.060 10 20 HECD CCCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 756081856 ZALZFFPXUFBOFN-UHFFFAOYSA-N 406.483 2.326 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3ccccc3C=O)CC2)cc(OC)c1OC 759103479 RZUVVNKBIFMCIU-UHFFFAOYSA-N 420.487 2.036 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)NC(C)C)cc2F)CC1 760548106 YRQPKCKNRKIBSH-FQEVSTJZSA-N 419.545 2.166 10 20 HECD O=C(COC(=O)[C@H]1C[C@@]12CCOC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764640459 QKGKDSCAVYRTTN-WZONZLPQSA-N 405.406 2.370 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 768942435 ZNIFXBYXMNBLLV-UHFFFAOYSA-N 405.401 2.065 10 20 HECD COC(=O)CCc1csc(NC(=O)NCc2ccc(N3CCOCC3)cc2)n1 769013619 RBDUVRGBPMHKIA-UHFFFAOYSA-N 404.492 2.407 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1F 770200015 REHSCLVIGGECTP-UHFFFAOYSA-N 408.451 2.132 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@]4(C)CCCOC4)n3)CC2)cc1 771080670 FBKVBJAQXFVESI-NRFANRHFSA-N 400.479 2.038 10 20 HECD Cc1nc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)sc1C 773511468 MIUXTQYETDHJFZ-UHFFFAOYSA-N 407.467 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)CC(C)(C)OC)CC2)cc1 778287998 CHTUWYKNQIKDFH-SXSDINLZSA-N 403.523 2.220 10 20 HECD CN(Cc1ncc(Cl)n1C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 779336311 KFFZCTXHPOAWRS-OAHLLOKOSA-N 418.929 2.117 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCCCC(=O)N1CCN(c2ccccc2)CC1 779484312 MACDWLNEJRUCOC-PKNBQFBNSA-N 409.486 2.356 10 20 HECD CN(C)c1nc(N)nc(COc2cccc(NC(=O)/C=C/c3ccc(O)c(O)c3)c2)n1 779514286 NSOORIAPWQMHPG-VQHVLOKHSA-N 422.445 2.162 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 779515805 CBBNUQDIEYGPFJ-QRBZPYHOSA-N 407.470 2.061 10 20 HECD CC(C)[C@H]1C[C@@H](CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCO1 781951818 QOSAKAZJAQYCEO-AZUAARDMSA-N 408.564 2.379 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCSC[C@@H]3CO)c2C)cc1 784223180 JLGSDDCPXRUREP-SFHVURJKSA-N 402.516 2.473 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1 785427334 CTPKQBOVKBVANJ-NJYVYQBISA-N 411.502 2.110 10 20 HECD CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785433182 JRPWZQWNCPMNQC-HNNXBMFYSA-N 417.510 2.144 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)s1 786256595 GRROBDQIMZWEHQ-UHFFFAOYSA-N 401.488 2.133 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 790514893 VQHVMZRZZITNBP-UHFFFAOYSA-N 401.419 2.340 10 20 HECD C[C@@H]1CC(=O)C[C@@H](C(=O)NCc2ccccc2O)[C@@H]1C(=O)NCc1ccccc1O 791138406 HCACSOHCXAQTTQ-CFCCAZDESA-N 410.470 2.262 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c(O)c1 797389831 APJAWSNJBRXYAJ-UHFFFAOYSA-N 413.474 2.413 10 20 HECD C[C@H](OC(=O)[C@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 800244171 NMZNXCWOUDRYHQ-YVEFUNNKSA-N 420.421 2.001 10 20 HECD CCC[C@]1(C2CC2)NC(=O)N(CN(C)Cc2ccc(N3CCOCC3)cc2)C1=O 802724246 OSEVTJMMYQGSCP-JOCHJYFZSA-N 400.523 2.413 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)ccc21 803689730 YFAIHZRUNNFDCY-UHFFFAOYSA-N 404.514 2.378 10 20 HECD C[C@@H](OC(=O)[C@](C)(O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805581065 UAJLYZNMJQOVCI-SFDCACGMSA-N 407.422 2.493 10 20 HECD COCCC1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCC1 809295194 LSNPUVRDXWJKMY-GOSISDBHSA-N 404.507 2.223 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC)n1 811864407 ZDTWPZQMYZCFDK-UHFFFAOYSA-N 404.442 2.074 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](O)C34CCCC4)cc2F)C[C@@H](C)O1 814665834 SOMFWUQZVPFCNW-LZJOCLMNSA-N 419.541 2.435 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(Cc3ccc(F)cc3)CCOCC2)c1 817841047 SQJRPYGYDORDDC-UHFFFAOYSA-N 422.478 2.425 10 20 HECD C[C@H]1CCCCN1CCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918118596 UQUNJFBEHIDJBF-AZUAARDMSA-N 415.582 2.452 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918309931 GZYAYYIDAGYVPA-UHFFFAOYSA-N 401.438 2.268 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H]3CN3CCCCC3)CC2)cc1 110729776 NFQCVBUZJDJWOY-OAQYLSRUSA-N 400.567 2.294 10 20 HECD Cc1ccc(-n2nccc2NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)nn1 472773950 GLAXKWVHZWXMKB-UHFFFAOYSA-N 403.446 2.026 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)n(C)c2ccccc12 685030146 PKKOKQKXENTBBN-UHFFFAOYSA-N 406.442 2.097 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)O[C@H](C)C(=O)NC(=O)NC3CC3)ccc21 728637536 NEGSJVRTDNTRRK-CQSZACIVSA-N 401.463 2.438 10 20 HECD CCOC(=O)COc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729063971 MPQBSYKGGOJWMY-ZDUSSCGKSA-N 416.430 2.159 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@H]3CCC[C@@H](C)C3)CC2)cc1 733016259 AVCUGSVTQSVXRE-XLIONFOSSA-N 404.507 2.482 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCN1CCOCC1 733996771 WOGHTLRGSLRRMF-INIZCTEOSA-N 421.497 2.053 10 20 HECD COc1ccc(O)c(CNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1 734014797 BKRWZOXFUCJTLR-UHFFFAOYSA-N 418.515 2.434 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccccc2O)cccc1S(=O)(=O)NC(C)(C)C 740495569 QKCNQEAIYZNZRU-UHFFFAOYSA-N 419.503 2.032 10 20 HECD CS(=O)(=O)Cc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 746676348 CJXLRTDWBJQLFN-UHFFFAOYSA-N 403.504 2.390 10 20 HECD C[C@@H](NC(=O)N1CCO[C@H](C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 746755542 FMYUADKEHMVXAI-APWZRJJASA-N 419.522 2.336 10 20 HECD C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 755226925 PEGMXOMMDSBQJY-INIZCTEOSA-N 420.506 2.389 10 20 HECD CC[C@@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCCO1 756106301 YXZGWDKJKMNJGN-RTWAWAEBSA-N 404.555 2.464 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](CCO)C3CCCCC3)CC2)cc1 760863605 OOPNQSFLOVSKBD-JTHBVZDNSA-N 405.583 2.099 10 20 HECD CCCc1c(NC(=O)C(=O)NCc2cc(OC)ccc2O)cnn1-c1cc(C)ccn1 761058375 QEVOZFWXBCWVJM-UHFFFAOYSA-N 423.473 2.497 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccco3)cc2F)C[C@@H](C)O1 775117215 WTBHYKWRMKUWGI-GASCZTMLSA-N 403.454 2.007 10 20 HECD CC(C)CNS(=O)(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 779542886 UDYSYISUDQWOSC-POHAHGRESA-N 404.488 2.362 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(CCCO)CC3)CC2)cc1 782709639 RXSLDFFFKDRZJN-UHFFFAOYSA-N 418.582 2.401 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCN2CCc3c(Cl)cccc3C2)cc1 785435483 ZYXKRJYTIVZFHH-UHFFFAOYSA-N 414.937 2.197 10 20 HECD Nc1nc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cs1 788972181 XVSNFODECREBRP-UHFFFAOYSA-N 407.407 2.296 10 20 HECD CSC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 789199358 VBPVFXFKNFMSOY-UHFFFAOYSA-N 422.528 2.363 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)ccc2[nH]1 792344878 SXGNHTUQSHEMIP-UHFFFAOYSA-N 419.485 2.165 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2ccc(OC)cc2O)cc1 792773657 IUDYXJNJUAYUMT-UHFFFAOYSA-N 421.519 2.431 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccn(-c4ccccc4)n3)ccc21 793660996 LFXHHJQLJQEBLB-UHFFFAOYSA-N 403.486 2.187 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c(O)c1 797387760 OQEQJLSVJINRIW-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CN1CCN(CCNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1(C)C 799683839 PXUBDKXTTPEZOW-LJQANCHMSA-N 404.555 2.109 10 20 HECD COC1CCC(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803298407 APEPTQYAXVCPSM-MPQSDHOMSA-N 417.550 2.412 10 20 HECD Cc1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)sc1C 803301051 XRKZVKVOIRRORF-CQSZACIVSA-N 402.520 2.090 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@H]1C 803310480 KLXUPOQGMLLRGX-OPYAIIAOSA-N 416.566 2.032 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3C(C)C)cc2F)CC1 805007731 ZABHIDXTRYFTHE-IBGZPJMESA-N 404.530 2.231 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1Cc1ccccc1 807290414 ISJTWOZVNVEPDM-SIKLNZKXSA-N 418.541 2.458 10 20 HECD CNC(=O)c1ccc(CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C2CC2)cc1 807671923 VDEIEENBGDZOJP-INIZCTEOSA-N 422.529 2.481 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 810160110 UNFVOPMCZDTTOA-ZDUSSCGKSA-N 423.439 2.092 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c(O)c1 811484651 GISYXIDEDSBTGC-UHFFFAOYSA-N 419.286 2.302 10 20 HECD Cc1cc(Cn2nnc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c2C)on1 815655465 SQOHZMXPNPQUBH-UHFFFAOYSA-N 424.505 2.070 10 20 HECD COc1ccc(N2CCCN([C@@H](C)C(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 917208643 JBNUWZIFTJEHRL-FQEVSTJZSA-N 423.561 2.340 10 20 HECD Cc1cccc(OCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918336053 TXDVHSKJKFGPDO-UHFFFAOYSA-N 402.516 2.315 10 20 HECD Cc1cccc(O[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337591 BBAILNUFOKVZAL-QGZVFWFLSA-N 402.516 2.314 10 20 HECD C[C@@H](NC(=O)c1cccc(CN2C(=O)CNC2=O)c1)c1ccc(N2CCOCC2)cc1 920880348 GLNPKVADFOWGPH-MRXNPFEDSA-N 422.485 2.066 10 20 HECD COc1ccc(N2CCCN(C(=O)NCCN3C(=O)COc4ccccc43)CC2)cc1 1255218478 WHGGQKAZSFPRAF-UHFFFAOYSA-N 424.501 2.343 10 20 HECD C[C@@H]1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H](n2cncn2)C1 1261582493 VELQSRYJJJOLFD-LSTHTHJFSA-N 403.552 2.032 10 20 HECD CCN1CCC[C@H]1CN(CCN(C)C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1325714129 RJHKIEZYMSAESC-NRFANRHFSA-N 405.606 2.425 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ncccn1)c1cc(O)c(O)c(Cl)c1 1794478650 YVNYCSAYVOJUMO-BTTYYORXSA-N 416.865 2.036 10 20 HECD O=C(Cc1ccccn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501202 NOQBBRSIDKJCIQ-UHFFFAOYSA-N 401.850 2.206 10 20 HECD O=C(Cc1ccc(F)cc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848017074 XAHRBOXCGWBIGN-HOTGVXAUSA-N 419.840 2.343 10 20 HECD CS(=O)(=O)Nc1cc(NS(=O)(=O)c2cccc3nsnc23)ccc1F 603457123 SOJNVMJVPPCPKC-UHFFFAOYSA-N 402.454 2.003 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1 728948584 HAXBXANHFAYEIW-PIGZYNQJSA-N 416.400 2.335 10 20 HECD CC(=O)Nc1cccc(OCCNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 729227099 PDMLNBHXOUDJFJ-UHFFFAOYSA-N 412.490 2.360 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CN3Cc4ccccc4C3=O)cc2F)CC1 730235616 IMCLGFFCCGOTPI-UHFFFAOYSA-N 410.493 2.240 10 20 HECD O=C(COC(=O)COC[C@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733592790 IGPQPDCHPITMHN-OAHLLOKOSA-N 423.421 2.139 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@@H]1CCCO1 734151461 ITLCMJPCNUZRRR-SFHVURJKSA-N 419.547 2.425 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](CC(=O)OC)c4ccccc43)nc12 741789418 FLJIHROHBWUWGM-CYBMUJFWSA-N 410.430 2.279 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1 742655070 UEIWWIHZBBYAGM-UHFFFAOYSA-N 423.560 2.064 10 20 HECD CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 743736432 XPOFLBQKYJCURD-QGZVFWFLSA-N 403.504 2.110 10 20 HECD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 746137009 CWFKAODRRWWZRM-UHFFFAOYSA-N 403.350 2.171 10 20 HECD CCCCn1ncc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 746437230 UYHAYYYCIGGVFY-UHFFFAOYSA-N 417.485 2.427 10 20 HECD Cc1nc2n(n1)CCN(C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 753007023 MFUBPUCBAWOFLN-AWEZNQCLSA-N 406.437 2.382 10 20 HECD C[C@H](NC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 756812669 OPKUMPIIBDVGBC-BXKMTCNYSA-N 423.513 2.107 10 20 HECD CCOC(=O)c1ccccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758222975 KAHMTNPOWMKRML-LJQANCHMSA-N 414.502 2.434 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc([C@H]4CCOC4)c3)nc12 761537409 ADUGZXJKQBESEX-HNNXBMFYSA-N 411.414 2.473 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCCS1(=O)=O 773408103 QESUGKLQBBIDCB-RDJZCZTQSA-N 400.928 2.094 10 20 HECD COCCO[C@H]1C[C@H](CO)CN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 774850733 RJRTYRPRADVBCJ-UNMCSNQZSA-N 419.566 2.478 10 20 HECD CS(=O)(=O)N1CC(CNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 778959369 RANJJZMKVYRRLZ-UHFFFAOYSA-N 415.475 2.048 10 20 HECD O=C(CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)NCC(F)(F)F 779675433 CGKUZINXHIGPHD-CYBMUJFWSA-N 407.820 2.195 10 20 HECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 782104663 ILVKTJXKIPBEJS-UHFFFAOYSA-N 401.438 2.268 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 784558154 OGFFWGKQYLYUFY-UHFFFAOYSA-N 403.391 2.230 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1 785865150 HMOYVHVRAMKGAW-QZTJIDSGSA-N 418.582 2.153 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H](C)C1 796315472 MKDILVGSYQXZNZ-KURKYZTESA-N 406.546 2.082 10 20 HECD C[C@H](NC(=O)N1C[C@H](N2CCOCC2)C[C@@H]1C)c1ccc(N2CCOCC2)cc1 804988324 ATZJNSDAUQVGJF-BBTUJRGHSA-N 402.539 2.089 10 20 HECD Cc1nc([C@H]2CCCN(C(=O)C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)n[nH]1 805022894 HQDSMRQOLZUQCY-IBGZPJMESA-N 424.549 2.372 10 20 HECD COc1ccc(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)cc1C(N)=O 805134938 CTXGNWOZHKTCLU-UHFFFAOYSA-N 405.259 2.285 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@@](=O)Cc1ccccc1 805406596 IJCQAZFUTSRWTR-GDLZYMKVSA-N 415.559 2.166 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCC1CCN(c2ccncc2)CC1 806277534 CHIYQXALWSIPSQ-UHFFFAOYSA-N 419.576 2.169 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccc(F)c(F)c1 807095716 QIODAXHJSKBUQL-IBGZPJMESA-N 405.445 2.459 10 20 HECD C[C@H](NC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1ccc(N(C)C)cc1 807141068 PWTPQMFCFWAYFA-HOTGVXAUSA-N 408.568 2.317 10 20 HECD C[C@@H](CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCCCC1 807701753 KXSOSYGPCUPXTA-AZUAARDMSA-N 417.550 2.281 10 20 HECD CC(C)(C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 811156815 RZLFJQXYCQAWMG-NTMALXAHSA-N 409.394 2.298 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CCNS(=O)(=O)c2cccnc2)cc1 914831279 GZZKOXHYFZUOJB-UHFFFAOYSA-N 404.536 2.255 10 20 HECD O=C(C[C@@H]1C=CS(=O)(=O)C1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916458122 VWZLUIHVOPLAQQ-ZDUSSCGKSA-N 418.437 2.107 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cn2)C[C@@H](C)O1 919814715 MOMBMDVYTQXORU-BETUJISGSA-N 420.491 2.025 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920881675 KJTZAXTVZAXOBY-XLIONFOSSA-N 423.579 2.295 10 20 HECD CCCn1ncc(C(=O)N[C@@H](Cc2ccc(O)c(O)c2)C(=O)OCC)c1C1CC1 1320519740 LVILLIIIMQACHG-INIZCTEOSA-N 401.463 2.486 10 20 HECD O=C(CCc1cn[nH]c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715530 CLEBBBVCAYZKNP-QDMKHBRRSA-N 418.881 2.359 10 20 HECD COCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1813754647 PVMRJHXKUHTILQ-SECBINFHSA-N 411.867 2.080 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)N3C(=O)NC4(CCCC4)C3=O)CC2)cc1 726562337 IPEPYMDEXQAHLX-HNNXBMFYSA-N 414.506 2.033 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)ccc1F 729835648 HCXBFECMRLRXNA-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CCOCCN1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 729993909 BGRPWNPOCPOULY-UHFFFAOYSA-N 421.497 2.055 10 20 HECD COC(=O)[C@@H]1CC12CCN(Cc1cc(C(C)=O)cc(CN3CCOCC3)c1O)CC2 733791046 HXUQTCAQMGDXFP-FQEVSTJZSA-N 416.518 2.202 10 20 HECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1 738169293 HVFVJDXTOOSEJJ-MRXNPFEDSA-N 407.555 2.054 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)OC)c2)cc1C 743254054 JVOHERYAHQMPLR-UHFFFAOYSA-N 418.518 2.406 10 20 HECD CCN(CC)S(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 746314157 UEADVAAEPAVIKU-CQSZACIVSA-N 419.494 2.045 10 20 HECD CN1C(=O)N[C@]2(CCC[C@H]2CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1=O 748098832 OQPKOICXFHEFOD-KKSFZXQISA-N 415.494 2.395 10 20 HECD CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748485521 IVPZSRQSPDXERX-UHFFFAOYSA-N 419.503 2.068 10 20 HECD COc1cc(C=O)ccc1OCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405079 APBPYHWHCQCKAP-UHFFFAOYSA-N 416.449 2.303 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)COc1ccc(S(N)(=O)=O)cc1 749717066 XBGBIOGXEWXHOH-UHFFFAOYSA-N 417.531 2.362 10 20 HECD CC1CCN(c2ccc(CNC(=O)[C@H]3Nc4ccccc4S(=O)(=O)N3)cc2)CC1 749985622 NGQHWJPVJGFBBY-FQEVSTJZSA-N 414.531 2.269 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(F)c(OC)cc3F)CC2)cc1F 759039218 IDTLWWOJBNEHEX-UHFFFAOYSA-N 423.391 2.408 10 20 HECD Cn1cc(-n2cc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc2=O)cn1 760924648 LVEGNRBFPCMKAF-IBGZPJMESA-N 408.458 2.098 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[S@@](=O)C[C@@H](C)C2)c([N+](=O)[O-])c1Br 763039992 DDKWOJPYSCGQLA-OYWLMSRLSA-N 422.257 2.479 10 20 HECD CN(C)c1ccc(CNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1F 765336706 NFBBWHFVJMEXQC-UHFFFAOYSA-N 413.497 2.032 10 20 HECD NC(=O)[C@@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1 766597911 PYBLYMFQQKFVPJ-SFHVURJKSA-N 402.495 2.405 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 768938511 LXTYCKGIWJHNBX-UHFFFAOYSA-N 401.438 2.268 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)cn1 770222392 JTVZHKWXWIHNNF-UHFFFAOYSA-N 402.520 2.252 10 20 HECD COC(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 770499339 LPDNIIMYWOQJJY-UHFFFAOYSA-N 400.450 2.432 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCN1c1nccn2cnnc12 771206063 XOVNQZXZMQRORA-KRWDZBQOSA-N 420.521 2.145 10 20 HECD Cc1cccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 773670423 RUDUXTMWMQNKSS-MRXNPFEDSA-N 402.882 2.468 10 20 HECD C[C@@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1ccc(N(C)C)cc1 777705288 PSUKSPWKTJQEPF-MRXNPFEDSA-N 403.552 2.402 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](OC)CC3)CC2)cc1 783162562 MBOMVLFSSULDFQ-FQEVSTJZSA-N 404.555 2.418 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C 785295548 VYDPDMNHPJQOAP-CYBMUJFWSA-N 413.474 2.312 10 20 HECD Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786112535 UTTXYHFUDBIDTQ-IBGZPJMESA-N 401.482 2.374 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccnc(N2CCCCC2)c1 786463419 QALYDJVIBFXVHX-UHFFFAOYSA-N 409.534 2.379 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccccc2OC(F)F)c1 788535598 XYFINTYUBQKHOJ-UHFFFAOYSA-N 400.403 2.338 10 20 HECD CS[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)(C)C 789812180 JOAYGOSWZQBJDV-QGZVFWFLSA-N 411.543 2.172 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)NCc2cccc(Br)c2O)cn1 792368850 BZIORGSFMNUYIW-UHFFFAOYSA-N 407.268 2.398 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc(C(C)C)nc3)CC2)cc1 794413079 WUJCCWOWFYCYPS-HJWRWDBZSA-N 409.490 2.452 10 20 HECD COc1cccc(CNc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c1O 796431384 XPDXBBIPPDWSFT-UHFFFAOYSA-N 405.520 2.339 10 20 HECD O=S(=O)(C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)N1CCCC1 800537945 MLSXVEPEXHBQQT-UHFFFAOYSA-N 411.543 2.052 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 802281164 RSFFKJUBRBJGRJ-PXNSSMCTSA-N 410.536 2.440 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCN(c2nccs2)CC1)c1ccc(N(C)C)cc1 803176632 NUAVKGSJSVVUAG-AWEZNQCLSA-N 401.536 2.172 10 20 HECD COc1ccc2c(c1)CN(C(=O)C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)CC2 803302099 HFDLWLCPWSWNFF-QGZVFWFLSA-N 423.513 2.294 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CC[C@H]3CCCCN3C)CC2)cc1 804320234 YOAKZTXHHDBAQF-LJQANCHMSA-N 416.566 2.113 10 20 HECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100145 KWVVARGMNJYZFT-SJLPKXTDSA-N 418.538 2.050 10 20 HECD COC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 808789225 LBNYKFCFALNKSH-LJQANCHMSA-N 405.445 2.493 10 20 HECD CS(=O)(=O)c1ccc(N(C/C=C/c2ccccc2[N+](=O)[O-])CCN)c([N+](=O)[O-])c1 809727870 AJJDVONWJDIQBT-GQCTYLIASA-N 420.447 2.385 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnc1C 813655037 BTIWXGVNVBVFBV-AWEZNQCLSA-N 419.503 2.053 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(-n2ccnc2)nc1 914535261 XEEKBHXZADIRPR-UHFFFAOYSA-N 406.490 2.446 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccc(F)c(F)c2)cc1)C1=S=CC=C1 916815798 RQVQZBGZTMRWBT-UHFFFAOYSA-N 422.434 2.300 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](CO)Cc1ccc(F)cc1 918207697 JFYUABLQPABWDA-SFHVURJKSA-N 419.472 2.452 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cnn(C[C@@H]2CCCO2)c1 918221572 YFMBDNHNCNAMSQ-SFHVURJKSA-N 417.485 2.484 10 20 HECD CN(C)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918442585 KMZBEIMPRXOMGB-UHFFFAOYSA-N 410.518 2.216 10 20 HECD O=C(CCSCc1ccccn1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920083076 JTDBSSLOVXKRBV-UHFFFAOYSA-N 419.572 2.256 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@H](C)c1ccc(F)cc1 920637680 MXSVKCZRHFHPKX-NEPJUHHUSA-N 424.450 2.326 10 20 HECD CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 1318040322 GFIAKKQFZHKPKC-UHFFFAOYSA-N 404.448 2.124 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3ccc(C)s3)cc2F)CC1 1318318011 VJEOUIZYQCWCFG-UHFFFAOYSA-N 418.538 2.384 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H](C)C(=O)NCC(F)(F)F)CC2)cc1 1318339225 UVJJLYXDEOOPBB-GFCCVEGCSA-N 402.417 2.030 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC1CCC1 1793377229 ZPUDCWGHYFAWJL-QDMKHBRRSA-N 409.577 2.065 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1cc(O)nc(O)c1 1817843721 WSUGVTFXMOHVTF-JYMLRBTQSA-N 415.425 2.414 10 20 HECD O=C([C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424839 PSJZUROQBSCXKY-MSOLQXFVSA-N 417.506 2.295 10 20 HECD C[C@H](NC(=O)CNC(=O)c1cc(F)cc(F)c1)c1ccc(N2CCOCC2)cc1 109190222 YAOHSBUFOFCRIX-AWEZNQCLSA-N 403.429 2.409 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(-n3cnnn3)cc2)cc1 109701718 XHFZHLNXEHAQCB-QFIPXVFZSA-N 420.517 2.479 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4ncc[nH]4)C3)cc2)C1 727941057 QUYCDFUBGIBZAV-ROUUACIJSA-N 410.522 2.201 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3CCO)cc2F)C[C@@H](C)O1 731751534 ZQQONIOXOYOREU-SCTDSRPQSA-N 407.530 2.292 10 20 HECD C[C@@H](NC(=O)NC1CCN(C[C@H]2CCOC2)CC1)c1ccc(N2CCOCC2)cc1 736379652 IOMKTORXHQILML-RTBURBONSA-N 416.566 2.384 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H](O)C3CCOCC3)cc2F)C[C@@H](C)O1 736653242 LUZZDAQKSJYWRS-MDOVXXIYSA-N 409.502 2.026 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccc(CN2CCOC2=O)c1 741097409 QEIYPLPTRUTXQI-UHFFFAOYSA-N 420.469 2.270 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)CC2)cc1 742921219 QXLFOVAQXYFDFT-UHFFFAOYSA-N 424.461 2.032 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4c(c3)CCC4)CC2)cc1 743432236 KLWMEJZTTVKZPB-UHFFFAOYSA-N 422.529 2.061 10 20 HECD Cc1ccc2c(c1)N(C(=O)C(=O)NCc1ccc(N3CCC(CO)CC3)cc1)CC2 746990316 KBUCVWOMOIZMFN-UHFFFAOYSA-N 407.514 2.409 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc4c(cc3F)CCC(=O)N4)ccc21 747016854 FVVWUPGUJNVVFX-UHFFFAOYSA-N 410.449 2.348 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3cccc(OC)c3O)C2=O)c1 747955959 QKQRXIQUQVKQLZ-QGZVFWFLSA-N 415.446 2.023 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cc(F)ccc3F)c2)CC1 748676199 XPFVVCWHYGKEEY-UHFFFAOYSA-N 402.444 2.000 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)c3cc(-c4ccccc4)on3)CC2)cc1 749401033 YTHIKTOPYBDOLF-UHFFFAOYSA-N 420.469 2.429 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 753042187 KXKBTYHHOQITLF-GJZGRUSLSA-N 415.531 2.015 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4CCOC4)CC3)cc2)C1 753120208 AUESBNRUJYYOQC-PMACEKPBSA-N 414.550 2.346 10 20 HECD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NCc1ccccc1O 756768511 OHPQFZKMFJYAET-UHFFFAOYSA-N 400.385 2.479 10 20 HECD CN(C)C(=O)c1cccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 761672824 YLJXPXNHXFZHCW-UHFFFAOYSA-N 402.432 2.183 10 20 HECD NC(=O)c1cccc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 761878844 CBOLUWRPBGXPDH-UHFFFAOYSA-N 423.395 2.358 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1cccc(Br)c1O)N1CCN(C)CC1 765449526 YUMBODKZUBAZKB-MRXNPFEDSA-N 413.360 2.226 10 20 HECD CN(CC(=O)NCc1cccc(Br)c1O)S(=O)(=O)c1ccccc1 765730958 DXKRUZIWHUPNID-UHFFFAOYSA-N 413.293 2.092 10 20 HECD CN(C)C(=O)c1ccccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765930067 HAIVRTAACXGOBU-UHFFFAOYSA-N 420.263 2.111 10 20 HECD Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 769251850 GNKSLELGDDNYBP-UHFFFAOYSA-N 412.421 2.088 10 20 HECD Cc1cnc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)[nH]1 771036112 FGSJOJKVGLXQCT-UHFFFAOYSA-N 417.403 2.385 10 20 HECD C[C@H](N[C@@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(N2CCOCC2)c(F)c1 773024534 IJMOVMRUTAGGLL-MAUKXSAKSA-N 401.486 2.242 10 20 HECD Cc1cc(C(=O)N2CCC(O)(C(N)=O)CC2)c(C)n1-c1cccc(Br)c1 773569563 XVEPPYBSOYGLTI-UHFFFAOYSA-N 420.307 2.309 10 20 HECD C[C@@H](NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773995156 RRLSPXCAULPNRN-MRXNPFEDSA-N 417.531 2.265 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 775136487 KBTRIUNEQCVBBZ-UHFFFAOYSA-N 424.549 2.177 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1cc(C(F)(F)F)ccc1-n1cncn1 776281359 CADBWRXCYQOICL-UHFFFAOYSA-N 422.319 2.493 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 778965213 QXVJXGLAPPNSHI-UHFFFAOYSA-N 422.777 2.498 10 20 HECD Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 786224500 JYHQDZLNUGXDFK-NHCUHLMSSA-N 424.545 2.100 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccc(-n4cccn4)cc3)cc2)CC1 786256077 QSLHOTOYYRUZTA-UHFFFAOYSA-N 417.513 2.400 10 20 HECD Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324375 VOCKZOCVZPEONE-SFHVURJKSA-N 411.502 2.032 10 20 HECD O=C([C@@H](CNCc1cc([N+](=O)[O-])ccc1O)Cc1cccc(F)c1)N1CCOCC1 788530383 ZLJLBOPSHDYYOH-QGZVFWFLSA-N 417.437 2.247 10 20 HECD CCOC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 789816243 CKKGABFFJHSPDJ-BXWFABGCSA-N 423.529 2.233 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccccn3)cc2F)C[C@@H](C)O1 789816714 FHBSBCCMVOPXPN-HZPDHXFCSA-N 414.481 2.109 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC[C@H]3C)cc2F)C[C@@H](C)O1 789823192 ZNZVJLQSHSZDHR-KFWWJZLASA-N 409.527 2.019 10 20 HECD C[C@H]1CCCN(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789861718 RLBBJRFDPBDMML-ROUUACIJSA-N 418.607 2.093 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cnc2n1CCCC2 790973717 XZFYRPZLGRBBMI-UHFFFAOYSA-N 401.486 2.319 10 20 HECD C[C@H](OC(=O)Cn1cccn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 792668773 XOHMWDGWPHNIIX-ZDUSSCGKSA-N 403.394 2.229 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c(O)c1 797390622 KGKJMXMWVGKSED-GJZGRUSLSA-N 413.474 2.269 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 799763763 CARZFEMYCKBDJN-ZIAGYGMSSA-N 409.483 2.321 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H]3[C@H](CCCN3C)C2)cc1F 804853286 WDSFZBLCEGBTPF-MJGOQNOKSA-N 404.530 2.231 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCC3(O)CCOCC3)cc2F)C[C@@H](C)O1 804969501 QRGMWNMGWYZDRL-HZPDHXFCSA-N 409.502 2.170 10 20 HECD CN1CCN(C(C)(C)CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 916258725 FNXGUYJZIITNSM-IBGZPJMESA-N 404.555 2.109 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)CN3CCN(S(=O)(=O)N(C)C)CC3)c2C)c1 917098056 CDTNXHSYKWHBDO-UHFFFAOYSA-N 418.563 2.009 10 20 HECD O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)c(F)c1 918190611 NBYSTTCBNHZITB-UHFFFAOYSA-N 417.441 2.482 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3c(cnn3-c3ccccc3)C2)c1 919814366 RQYHWUKXNLVZHZ-UHFFFAOYSA-N 412.471 2.148 10 20 HECD C[C@H](NC(=O)CSCC(=O)N1CCCCC1)c1ccc(N2CCOCC2)cc1 920887312 CXENFNNWYKNWEU-KRWDZBQOSA-N 405.564 2.446 10 20 HECD O=C(CNc1cc(Cl)ccc1C(=O)c1ccc(F)cc1)N[C@@H]1CCS(=O)(=O)C1 1347019633 XEBBORZLSFAWFM-OAHLLOKOSA-N 424.881 2.425 10 20 HECD Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)ccn1 1810547187 QYODMCZABOUBOO-UHFFFAOYSA-N 410.474 2.355 10 20 HECD COc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846849638 CAGIJKJBVAGRNO-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)O[C@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1 7176670 AJJKYXPTXNNIRG-APWZRJJASA-N 418.515 2.285 10 20 HECD CCN(C[C@H]1CCCO1)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 261460459 PQAKEJIHVAHRFA-OAQYLSRUSA-N 404.555 2.418 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 726609786 FRXFFCXYJTXDDV-QZTJIDSGSA-N 404.555 2.463 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)nc12 731669377 IALMRHDKAQPMIU-ZDUSSCGKSA-N 419.482 2.053 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)CC2)cc1 736394052 JDCICSKHDUOOEQ-SFHVURJKSA-N 416.566 2.464 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 745778544 DIMPXHXVASKAHW-WOJBJXKFSA-N 417.598 2.157 10 20 HECD CCCn1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 746354983 PWEDJPQOLOXKFG-GJZGRUSLSA-N 417.485 2.301 10 20 HECD COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)C1=O 746739849 DWTDZFJZURDELX-MRXNPFEDSA-N 416.503 2.205 10 20 HECD COC(=O)C[C@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 749466009 PIHWWJROKXQTPY-SOLBZPMBSA-N 421.513 2.083 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc2nsnc12 751227090 CZJXSUBRLGQTKH-UHFFFAOYSA-N 422.507 2.270 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(C(N)=O)o3)cc2F)C[C@@H](C)O1 752003896 CYFUQWABFBSSCP-BETUJISGSA-N 404.442 2.131 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCC[C@@H]3O)cc2F)C[C@@H](C)O1 755062704 KXXJUHAXMIRVAX-RDBAUFEQSA-N 407.530 2.148 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1 755924102 FLCJDCVPRSLGKF-CYBMUJFWSA-N 413.540 2.354 10 20 HECD CCN1CCCC[C@@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759265542 MVSAIXDWNFJUCP-QGZVFWFLSA-N 420.554 2.418 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)CC2)cc(OC)c1OC 759286111 BQFRJKYWPDZRFP-CRAIPNDOSA-N 418.538 2.027 10 20 HECD C[C@](O)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(F)(F)F 761062195 ZXBFOBPAOCBKNL-AWEZNQCLSA-N 424.422 2.298 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COc3cc(C)ccc3F)CC2)cc1 767528838 LGRMVEMGPUSLKY-UHFFFAOYSA-N 416.449 2.414 10 20 HECD CN(C)c1ccc(CNc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)cc1F 770523498 GWAFTRFWDIYAAA-UHFFFAOYSA-N 413.453 2.384 10 20 HECD CN(C)CCc1ccccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 782257608 ZYFZEEKPFDIGBY-UHFFFAOYSA-N 424.545 2.224 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1 783317225 IVQRCQBPSPLNCP-HNNXBMFYSA-N 413.474 2.362 10 20 HECD CCO[C@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 788744715 ZNOUIMVCQHOERN-UGKGYDQZSA-N 423.529 2.152 10 20 HECD COc1cc(N2CCN(C(=O)NCCOC(F)(F)F)CC2)cc(OC)c1OC 788843300 BMIUTCXNNZWBCN-UHFFFAOYSA-N 407.389 2.080 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1ccc(OC)cc1O)O[C@H](C)C2 797389829 ANACSSBOYZWNKL-GFCCVEGCSA-N 400.431 2.378 10 20 HECD C[C@@H](CCN(C)C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 803201231 ORJQYJGSTSJPJJ-KRWDZBQOSA-N 400.523 2.331 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCc2c(O)cccc21)c1ccc(N2CCOCC2)cc1 803303974 BJUZDTSWZDALLG-YWZLYKJASA-N 409.486 2.210 10 20 HECD CSC[C@@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449297 VEUDDHNHNFJPTE-GFCCVEGCSA-N 401.479 2.241 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](C)N1CCc2ccccc2C1)c1ccc(N(C)C)cc1 803885335 LNRYIZXCNFITGU-QZTJIDSGSA-N 408.546 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCCSC3)CC2)cc1 813715147 GDIJOEDUPSKZIZ-XZVRFQMRSA-N 403.548 2.159 10 20 HECD CC[C@@H]1CO[C@@H](C)CN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 916199412 WWODZTJYNPVLSL-RBUKOAKNSA-N 404.555 2.416 10 20 HECD CC(C)N(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccc(N(C)C)cc1 917417950 PDXMPWZDGKDNMC-UHFFFAOYSA-N 404.536 2.249 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2 918204026 MGYWBDWYAVQLIA-QGZVFWFLSA-N 413.497 2.242 10 20 HECD C[C@H](OCC1CC1)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 920779106 PNHSKFUFCRQWNH-OAGGEKHMSA-N 422.497 2.414 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1C1CC1)C1=NN(c2ccccc2)C(=O)C1 1792956118 CARDMWQCOWOPBE-JUSBFGHESA-N 420.513 2.464 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC1CCCC1)c1cc(O)nc(O)c1 1793552349 MONLDEHGENSBJX-QDMKHBRRSA-N 405.520 2.420 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)c(F)c1)c1cc(O)nc(O)c1 1799755225 DTHDSSWQAQBFEY-BTTYYORXSA-N 403.385 2.337 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)O1 1827427686 PLABWMMHNQYVES-ZTFGCOKTSA-N 417.506 2.294 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030191 DWTWWDORMYIHAH-FPTDNZKUSA-N 417.506 2.151 10 20 HECD CCSc1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248844 SFSJKPRDQLKTHL-UHFFFAOYSA-N 414.487 2.131 10 20 HECD Cn1c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc2ccccc21 1843614620 QEXHDNJVPQMIJY-UHFFFAOYSA-N 406.442 2.115 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CC(=O)Nc3ccc(C)cc3)CC2)cc1 7490477 MHGKHLYXKQEHRM-UHFFFAOYSA-N 410.518 2.223 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)N[C@H](Cc2ccccc2)C1=O 16878682 RSRBTBDOWHMLBD-OAQYLSRUSA-N 408.502 2.076 10 20 HECD C[C@@H](NC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 145445189 NTBAMTXDJKMQNO-MRXNPFEDSA-N 417.531 2.265 10 20 HECD C[C@]1(c2ccc(CNCc3cccc(Br)c3O)cc2)NC(=O)NC1=O 726189552 COOHJOWABUERLE-GOSISDBHSA-N 404.264 2.499 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 726563120 VHYDWBIFRVQGNM-CWFSZBLJSA-N 413.518 2.344 10 20 HECD COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2cc(O)cs2)cc(C(=O)OC)c1 732354138 FFCIQFYJPZBBGK-SECBINFHSA-N 407.400 2.211 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1 734016289 OOJMCQVOVRLQFJ-OAHLLOKOSA-N 404.488 2.118 10 20 HECD C[C@@H](NC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 748532104 FVCYFWVFNBQLCX-CMJOXMDJSA-N 422.485 2.069 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(CCN(C)C)C(C)C)CC2)cc1 749166793 OPVFQJQXTVWRPA-UHFFFAOYSA-N 405.587 2.189 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H](CO)C(C)(C)C)cc2F)C[C@@H](C)O1 749467425 ZBQLUTBITFBUJR-QINHECLXSA-N 409.546 2.394 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)oc1C 751119689 FZDXQUVMRZUGQO-ZDUSSCGKSA-N 408.476 2.251 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc(C(C)=O)cc1 752661193 QRPBIDJXVWNOIZ-UHFFFAOYSA-N 417.531 2.282 10 20 HECD CNC(=O)CCCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 753042239 LXUDJCDVDPGTMF-UHFFFAOYSA-N 416.444 2.210 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C4CCOCC4)C3)cc2)C1 755060434 YKOIGQALZDEWPU-VQTJNVASSA-N 414.550 2.346 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCCOc3ccc(C)cc3C)CC2)cc1 758186172 PJORWPXCDVDTDA-QFIPXVFZSA-N 413.562 2.464 10 20 HECD COc1cc(N2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)cc(OC)c1OC 759220822 LGCGGBSAQGJEGI-UHFFFAOYSA-N 414.458 2.332 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3cscc3C)CC2)cc(OC)c1OC 759408997 HJNKICZSGMOQTH-UHFFFAOYSA-N 419.503 2.370 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cc(C(=O)OC)n(C)c3)cc2F)CC1 759514678 QEKZIPFODJRXOF-UHFFFAOYSA-N 417.485 2.414 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3cscn3)CC2)cc(OC)c1OC 760130534 WSOBJYVEONCJGH-UHFFFAOYSA-N 406.508 2.243 10 20 HECD COCCC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC1 760828612 KTJWHDQODUKVQO-GOSISDBHSA-N 402.539 2.394 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@@H]4C[C@H](C)CCN4C3=O)CC2)cc1 760952878 WDQJLLOGCSVYQJ-XLIONFOSSA-N 400.523 2.270 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCC(O)(C(F)(F)F)CC3)cc2)CC1 765980247 XUYCQDUCOXPTPT-UHFFFAOYSA-N 406.470 2.247 10 20 HECD CC[C@@H](C)NC(=O)CN1CCN(Cc2cc(Br)cc(OC)c2O)CC1 768250701 ACADZOCADOKRFA-CYBMUJFWSA-N 414.344 2.196 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1-n1cnnn1 768913299 YQWGNUFPZDEROO-MRXNPFEDSA-N 412.881 2.416 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 769302043 LPTQSQVJVQQFLT-LBPRGKRZSA-N 413.858 2.187 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC3CCN(C4CC4)CC3)cc2)C1 770299798 MPCHYDHRMSZWAV-IBGZPJMESA-N 413.566 2.062 10 20 HECD CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 775287697 FMUNCNZADWUEOA-UHFFFAOYSA-N 420.852 2.299 10 20 HECD C[C@@H](NC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C)c1ccc(N(C)C)cc1 775410603 LZOYIEUTPNCKNQ-GFCCVEGCSA-N 407.474 2.469 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)ccc1C 775836259 LTCTYLHOXPBTQV-HNNXBMFYSA-N 404.536 2.258 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N2CCN(Cc3ccsc3)CC2)cc1 784553029 BVGWYKSLRCMZNX-UHFFFAOYSA-N 417.531 2.081 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1 784703156 VCSDNFKGCNHESI-ZDUSSCGKSA-N 424.461 2.451 10 20 HECD Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786224934 MWQUZTLWTCKCPT-LJQANCHMSA-N 415.509 2.498 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1 788584775 QIBWMOSOYRPODA-HZPDHXFCSA-N 424.339 2.246 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(c4cccnc4)=NO3)cc2F)CC1 790593909 MYLHYTZRTUCPPE-OAQYLSRUSA-N 411.481 2.172 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1c([N+](=O)[O-])cnn1C 791245513 ANNRWAYTBFVHBI-UHFFFAOYSA-N 403.439 2.331 10 20 HECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803305899 NYGTXGIKZIKAQG-UONOGXRCSA-N 400.479 2.183 10 20 HECD COc1cccc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CCO2)c1 807291489 WQGHMWIJRQCMAI-QFIPXVFZSA-N 421.497 2.288 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCO[C@@H](C2CC2)C1 807769071 DBKPQVDZTNHJNI-CRAIPNDOSA-N 423.460 2.010 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(-n2ccnn2)cc1 809614560 NBOQPIKINQMCTB-INIZCTEOSA-N 406.490 2.169 10 20 HECD COC(=O)CC[C@]1(C)NC(=O)N(CN(Cc2ccc(N(C)C)cc2)C(C)C)C1=O 811734401 DSSNWIHDBZFHLA-NRFANRHFSA-N 404.511 2.184 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(=O)O 917917498 BFBJXLQBHDCBHF-UHFFFAOYSA-N 422.478 2.456 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CN1CCCCC1 919654470 LRTIHFISMLFZHA-AZUAARDMSA-N 415.582 2.310 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](O)c1cccc(F)c1 921123944 ZGSISWVWIRYKIT-HXUWFJFHSA-N 405.445 2.459 10 20 HECD CCn1cc(N2C(=O)/C(=C/c3ccc(OC)c(OCC(N)=O)c3)SC2=S)cn1 1318148754 UKVOSSNHVDLHJW-CHHVJCJISA-N 418.500 2.182 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccccc3)c3cnn(C)c3)nc12 1323729197 LETKXHGTYDLUID-IBGZPJMESA-N 406.446 2.224 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1NC(=O)C1CC1 1343960727 IBDOXWWBGCGXHP-KRWDZBQOSA-N 412.442 2.351 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@H]1C1CC1 1802985426 CENMGNWZYJLPHG-QUJKESNLSA-N 422.485 2.254 10 20 HECD O=C(c1cccc2nscc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250821 RLGWNCNCYVMZCY-UHFFFAOYSA-N 410.455 2.233 10 20 HECD O=C(c1ccnc(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847921500 MXCZKKCSYQDZLH-KBPBESRZSA-N 405.813 2.415 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(C)cc3)CC2)cc1 12068998 JGYGATJCQOLRAY-UHFFFAOYSA-N 403.548 2.494 10 20 HECD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NCc2ccccc2O)cc1 116289494 UXPVHBOYFLFNRD-UHFFFAOYSA-N 404.488 2.312 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)C3CCCCC3)cc2F)CC1 730287120 FOUAYIPHZUUQNJ-UHFFFAOYSA-N 404.530 2.280 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)NCc1cccs1 731844898 QOOIXFAOYQWDSN-INIZCTEOSA-N 403.504 2.461 10 20 HECD CN(C)S(=O)(=O)c1cc(NC(=O)COC(=O)c2cc(O)cs2)ccc1Cl 731910689 AMLRDSSYOLNVAU-UHFFFAOYSA-N 418.880 2.153 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2)CC1 740610249 UZKVLZPMAJBANL-UHFFFAOYSA-N 404.448 2.097 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 741216813 MXVDVSKCKCNSBB-DEOSSOPVSA-N 423.557 2.413 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(N4CCCNC4=O)c3)ccc21 743900530 KLDLZYPHMCETFQ-UHFFFAOYSA-N 421.501 2.244 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1O 745777258 MFEOCRNWGATJFW-UHFFFAOYSA-N 421.519 2.429 10 20 HECD COC(=O)C1(NC(=O)c2cc(C)n(-c3ccccc3C)c2C)CCS(=O)(=O)CC1 757031727 NGJIATAQUKHCIZ-UHFFFAOYSA-N 418.515 2.253 10 20 HECD CC(=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 757498032 REYDFZUMQQSQIK-UHFFFAOYSA-N 414.433 2.338 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCN(C4CC4)C3)CC2)cc(OC)c1OC 759278298 LWNWSZZDTHVGAY-MRXNPFEDSA-N 418.538 2.028 10 20 HECD COc1cc(N2CCN(C(=O)NC3C[C@H](C)O[C@@H](C)C3)CC2)cc(OC)c1OC 759296273 CPANCTHIYMRITA-GJZGRUSLSA-N 407.511 2.500 10 20 HECD COc1ccc(N2CCN(c3ncccc3S(=O)(=O)NC(C)C)CC2)cc1F 763029227 NDKOUJOLGYSHAF-UHFFFAOYSA-N 408.499 2.243 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 763283923 MBDFZYPUGOIRKA-WBVHZDCISA-N 418.515 2.246 10 20 HECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2c(O)ccc3c2CCCC3)c1 768296726 ZTSZERXMZVWJBT-UHFFFAOYSA-N 404.488 2.157 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1 769643301 SOYXGERNHQEVSF-UHFFFAOYSA-N 403.460 2.252 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)ncn4C)CC2)cc1F 772949030 WIWJFNPCFJJYEY-UHFFFAOYSA-N 404.467 2.232 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCC[C@H]3C)CC2)cc1 774760256 GQLNIQIHLCUSNS-WIYYLYMNSA-N 416.566 2.018 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)CC2)cc1 775156949 BBGRMNRSJLUPPP-GFCCVEGCSA-N 400.306 2.090 10 20 HECD COCC1=CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 776101570 KJKLLPPRTRJLQW-UHFFFAOYSA-N 402.539 2.195 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@@H](OCCO)C1 780506906 LMHBSCJWWBQCNQ-CRAIPNDOSA-N 413.465 2.440 10 20 HECD C[C@H](OC(=O)Cc1ccn(C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 782380206 KPWZUAMIAKOTIT-ZDUSSCGKSA-N 417.421 2.308 10 20 HECD CC[C@]1(C)CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 785496694 ZRANKSSUHWNSSW-OAQYLSRUSA-N 419.547 2.425 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4c(cc3F)NC(=O)CC4)cc2)CC1 786258314 BYMSBMSWPCWXBM-UHFFFAOYSA-N 424.476 2.309 10 20 HECD Cc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 786727267 YXACXVRHJAABQA-YLJYHZDGSA-N 422.529 2.190 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)c(C)n1-c1cccc(Br)c1 787929159 HREHFZWVOACOQG-AWEZNQCLSA-N 419.279 2.217 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@H]21 788921074 UJOJCMVBFWRPHV-OHLDOZIISA-N 411.546 2.423 10 20 HECD COC(=O)c1cnc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c([N+](=O)[O-])c1 790102112 WYYDUXWHCQCPTQ-AWEZNQCLSA-N 413.434 2.090 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cccc1NC(=O)N(C)C 792369613 FYXNXCVXSWATLT-GFCCVEGCSA-N 414.462 2.186 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H](C)[S@]1=O 792387965 JYPNZEHNHIWQKM-YZPHYWLRSA-N 410.495 2.242 10 20 HECD CC[C@H](C)NC(=O)CCNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 793666141 MWLUAPRKGMQQES-KRWDZBQOSA-N 402.539 2.056 10 20 HECD COC[C@H](C)[C@H](C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 812479466 CJJUHEVHZDQCFZ-IRXDYDNUSA-N 415.513 2.477 10 20 HECD CCCNC(=O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 916161867 SLTIHORAMKXYHL-RAXLEYEMSA-N 411.574 2.372 10 20 HECD CC[C@H]1CO[C@H](C)CN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 916199405 WWODZTJYNPVLSL-MOPGFXCFSA-N 404.555 2.416 10 20 HECD O=C(COC(=O)c1n[nH]c2c1CCC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 919332999 LWDIOPKNLDNBDR-UHFFFAOYSA-N 415.405 2.469 10 20 HECD C[C@H](NS(=O)(=O)N1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 920866000 ROHNXJFWOTVQSF-KRWDZBQOSA-N 401.532 2.477 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)cc2)CC1 1254166465 WUIVECQAKITUTF-UHFFFAOYSA-N 423.517 2.305 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(NC(C)=O)ccc1C 1338537649 RZCMMSIJFZWVFZ-KRWDZBQOSA-N 400.431 2.269 10 20 HECD CC[C@H](C)CC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785503686 NSJVNLDJVYYXAY-MKEIEPSASA-N 418.490 2.083 10 20 HECD O=C(CCc1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598786 IEULPKJLXWSJAW-QDMKHBRRSA-N 401.488 2.439 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)c(F)c2)C1 1841208193 YVIIOCXZLZQTQH-UHFFFAOYSA-N 419.840 2.345 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccco2)=NN1c1ccccc1 1848230404 FHWSCZRAGIZAOU-LTPVEEIWSA-N 418.453 2.288 10 20 HECD CCn1c(=O)c2ccccc2n(CC(=O)NCc2ccc(N3CCCC3)cc2)c1=O 28331336 LKMFIFWYRNJUEN-UHFFFAOYSA-N 406.486 2.100 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)NCc3c(C)c4ccccc4n3C)C2)nn1 472235611 BBBJCTNILFDIET-HNNXBMFYSA-N 410.478 2.412 10 20 HECD C[C@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 730218313 JWGRCPQUWGSKTJ-KBICQTFXSA-N 409.558 2.076 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(O)c3)cc2F)C[C@@H](C)O1 732392632 ZCOLAAGOFVNVKC-OKILXGFUSA-N 417.437 2.013 10 20 HECD Cc1ccc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1S(N)(=O)=O 735751958 QFWSPVWLLVITSQ-HNNXBMFYSA-N 418.519 2.362 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1O 737284475 NMBOGHTYVCFZKX-UHFFFAOYSA-N 411.458 2.282 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(F)ccc3C)CC2)cc1 743442584 OKQRBMJRBHFLDK-UHFFFAOYSA-N 414.481 2.020 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(F)c(F)c3F)c2)CC1 748673786 KKFZYQWOLVPRJR-UHFFFAOYSA-N 420.434 2.140 10 20 HECD CC(C)COC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 749178094 HHEGXBJISPTJIG-UHFFFAOYSA-N 422.501 2.282 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOC[C@H]3c3ccc(C)o3)CC2)cc1 754044004 XGABCQMXXRXSCA-UNMCSNQZSA-N 415.534 2.153 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3Cc4cccc(O)c4C3)CC2)cc1 758286802 VQWKCDKWAXHNLK-LJQANCHMSA-N 424.545 2.380 10 20 HECD Cn1cc([C@@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 766776891 MSVIPDXRXWTCMY-SFTDATJTSA-N 413.522 2.054 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cc(OC)cc(C)n3)CC2)cc1 767622829 QCPXRGTVBIVOTL-LJAQVGFWSA-N 417.531 2.005 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1 769086931 SBYCWBTWDHAVOA-UHFFFAOYSA-N 422.529 2.477 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(O)c([N+](=O)[O-])c1 770627961 CRZMFTKEUVTVIL-AWEZNQCLSA-N 406.826 2.449 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCO[C@@]2(CCOC2)C1 771421749 NLZUJIYHUUBLCL-UGKGYDQZSA-N 403.523 2.033 10 20 HECD CN1CCN(c2ccc(CN[C@@H]3CN(Cc4ccccc4)CC[C@@H]3CO)cc2)CC1 771841812 LPSAJVTYXNGCHD-ILBGXUMGSA-N 408.590 2.411 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C)nn1-c1ccc(C)nn1 773219065 RMIVIHMPMYPQJA-UHFFFAOYSA-N 421.505 2.332 10 20 HECD Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(F)(F)F)cc2)ccc1O 776748452 JJOUTWDOJYRRPC-UHFFFAOYSA-N 424.422 2.342 10 20 HECD CCCC[C@@H](COC)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778285017 DBHALFILOLXALI-JYBLJSLWSA-N 403.523 2.221 10 20 HECD C[C@H](C(=O)NCc1ccc(O)c(O)c1)N1C(=O)c2ccc(Br)cc2C1=O 778930345 UQMDOXYWQOTUPS-SECBINFHSA-N 419.231 2.161 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 781502403 AYWLMNCVGBWVJN-LLVKDONJSA-N 402.403 2.012 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCCN(c2ncccc2F)CC1 784073937 FSEWXNTUCMLAJB-UHFFFAOYSA-N 413.497 2.479 10 20 HECD CC(C)(C)OC(=O)N1CCC(OCC(=O)OCC(=O)c2ccc(O)c(O)c2)CC1 784825988 NMXLBCQHXXQEEB-UHFFFAOYSA-N 409.435 2.240 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(-c4ccccn4)c3C)cc2)CC1 786660761 ITBXNWZWSQNYRP-UHFFFAOYSA-N 418.501 2.174 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCCN2CCc3ccccc3C2)cc1F 787707988 HMDJQWWPRXLDLB-UHFFFAOYSA-N 412.509 2.073 10 20 HECD CN(C)CCC1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789854754 LCBMKHSROJJCDX-UHFFFAOYSA-N 418.607 2.046 10 20 HECD COC(=O)c1cn(CCNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)nn1 793106509 SDVMDHUEWMQEBX-UHFFFAOYSA-N 421.417 2.235 10 20 HECD COCCOC1CCC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793133207 RLKMRJOIMCBZKD-SCCNAQOGSA-N 417.550 2.226 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)N2CCCC2)NC(=O)OC(C)(C)C)cc1 795249125 OTUCJJDRWZKACU-QGZVFWFLSA-N 412.556 2.249 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3ccc(C)nc23)cc1 797431590 SVMNZLIPQPUVPC-UHFFFAOYSA-N 406.489 2.220 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2OC)cc1 797432647 MBOMXNQNWAGGCS-UHFFFAOYSA-N 405.885 2.026 10 20 HECD C[C@@H](CCc1cccn1C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803303572 PTZSSPGLEYNARF-ROUUACIJSA-N 412.534 2.176 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)C2)c1 803685440 AEWHQIZZKRTOEW-IBGZPJMESA-N 422.529 2.089 10 20 HECD CC(C)CN1CCC[C@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688219 MIWKKQQJFYTCPS-LJQANCHMSA-N 400.567 2.169 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 808298551 VGUSISWNTSVGCH-ZDUSSCGKSA-N 420.478 2.375 10 20 HECD COc1ccc(CN2CC[C@@H](NCc3cc(OC)c(OC)cc3O)C2=O)c(OC)c1 809725779 AQIZHUWSISSFLN-QGZVFWFLSA-N 416.474 2.317 10 20 HECD Cc1nnc(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)s1 811587632 BNYFJBZFMHKZOH-UHFFFAOYSA-N 424.529 2.387 10 20 HECD CS(=O)(=O)C[C@H]1CCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 916626446 ZAHBYEMYFSMFOT-KRWDZBQOSA-N 411.593 2.206 10 20 HECD CCOc1ccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cn1 1326488801 GRFLUCUHNOCPFE-UHFFFAOYSA-N 423.473 2.430 10 20 HECD CCC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1825094508 BDOITOWNWMWLCZ-SECBINFHSA-N 423.878 2.413 10 20 HECD COc1ccc(N2CCN(c3cc(N4CCC[C@H](CO)C4)ncn3)CC2)cc1F 301535374 ACWVUASWPIIGQR-INIZCTEOSA-N 401.486 2.160 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NCC3CCN(S(C)(=O)=O)CC3)ccc21 514131321 WJHDRPVIVSKRKY-UHFFFAOYSA-N 421.563 2.306 10 20 HECD O=C(COc1ccc(F)cc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 726742840 RCFKOFLVFMTDOK-UHFFFAOYSA-N 407.373 2.405 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3cnccc23)cc1C(=O)O 728015791 VGPOXPYBTFUHCX-UHFFFAOYSA-N 421.456 2.105 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccn(-c4ccccc4)n3)CC2)cc1 742919943 LXCMAJHVODESSJ-UHFFFAOYSA-N 405.502 2.433 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(-c4ccccn4)c3)cc2)C1 743186088 NKAJMWQEFLNEIR-KRWDZBQOSA-N 419.489 2.291 10 20 HECD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 748636122 RAALIDUETJVAJT-BMFZPTHFSA-N 408.449 2.319 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(N(C)C)n1 750413602 WPDIUMDKQSJWNZ-UHFFFAOYSA-N 417.535 2.013 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 751234922 BUPDFRKEFXBNNE-UHFFFAOYSA-N 424.544 2.388 10 20 HECD C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)ccc1O 756562744 JPSWOIWWYQWXLJ-GFCCVEGCSA-N 405.358 2.314 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)N3CCCC[C@H]3C)CC2)cc1 758207579 ATYOKSMJPCLPTQ-RZUBCFFCSA-N 404.599 2.031 10 20 HECD COc1cc(N2CCN(C(=O)CN3CCc4ccccc43)CC2)cc(OC)c1OC 759223711 WAYRCDDFJDEQHR-UHFFFAOYSA-N 411.502 2.424 10 20 HECD O=C(O)c1cc(S(=O)(=O)NCCCSc2nccs2)cc2c1OCCO2 761297205 PHJXQDJTAFWBAA-UHFFFAOYSA-N 416.502 2.073 10 20 HECD Cc1ccc([C@H](C)[C@@H](O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 764859545 QBOKNFVHSMEVMK-UCNVEGJOSA-N 409.530 2.478 10 20 HECD O=C(NC[C@H]1CCCS1(=O)=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765899455 NPZKKPWRTVAAAU-XJKSGUPXSA-N 417.478 2.133 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)CC2)cc1 767415911 SNHGEFHTEJNHAE-GOSISDBHSA-N 407.511 2.274 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc4ccccc4c3)cc2)C1 770231427 QJYMJIAERSFINH-SFHVURJKSA-N 424.526 2.415 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1O 774978634 XUMQIVXCMKXPBD-LBPRGKRZSA-N 409.464 2.410 10 20 HECD CN1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H](CNC(=O)OC(C)(C)C)C1 775419806 BJWXTERKQKASQN-MRXNPFEDSA-N 423.533 2.242 10 20 HECD COc1ccc(O)c(CN2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)c1 775646185 HPEMXPXDSGTSQW-UHFFFAOYSA-N 402.516 2.396 10 20 HECD C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 776306264 NBRGXQVBIHJANR-WMZOPIPTSA-N 413.497 2.374 10 20 HECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1cccc(S(=O)(=O)NC2CC2)c1 776748669 BMJYCQSDPAOLHF-UHFFFAOYSA-N 402.881 2.287 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCn4cccc4[C@@H]3C)CC2)cc1 778232253 GQNDWLUBXDPKKI-LPADLIQXSA-N 408.502 2.305 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@@H](C)CCSC)CC2)cc1 778286292 WPZBKATXXQGQBE-IBSYWUHOSA-N 405.564 2.500 10 20 HECD CCO[C@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 780311899 LZXNZJVVQICGHC-SIKLNZKXSA-N 423.529 2.152 10 20 HECD CN(C)CCn1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)n1 782896049 LIOIWRBBMXEZDY-UHFFFAOYSA-N 413.522 2.450 10 20 HECD C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785434594 VNCGPSCKNYLMSR-AVRDEDQJSA-N 408.546 2.396 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccc[nH]3)cc2F)C[C@@H](C)O1 789826401 PWWHUSJMAZQTIP-QLFBSQMISA-N 402.470 2.261 10 20 HECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842643 FJVZXFKJAMEOON-WBVHZDCISA-N 405.514 2.488 10 20 HECD CNC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1OC 795347650 IMMLDXVWQFUUSI-UHFFFAOYSA-N 415.811 2.123 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c(O)c1 797388320 XVGHUVCWBAFLTF-SFHVURJKSA-N 400.431 2.214 10 20 HECD C[S@](=O)C1(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 799404110 SIYYDGNCCMPMKH-QWVSSGJLSA-N 401.479 2.467 10 20 HECD C[C@H]1[C@@H](C)OCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450753 PCKAWCBSWWLPDN-UONOGXRCSA-N 411.449 2.009 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(-n2ccnn2)c1 806140772 ZYFOAFMPDUSVAV-QGZVFWFLSA-N 411.531 2.353 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 808489042 AASNMWRIHHTKPY-UHFFFAOYSA-N 401.868 2.220 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NCc1cccc(C)c1O 809682395 NVUZDWUCHOPPQW-UHFFFAOYSA-N 405.520 2.257 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1O 819427434 NFPZTPZSWZTWQD-AWEZNQCLSA-N 408.432 2.376 10 20 HECD COc1cccc(C[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)n2nnnc2C)c1 915681281 WNFAPVFSCIBOKE-OAQYLSRUSA-N 408.506 2.499 10 20 HECD CC(C)[C@@H](CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 920921032 QAVZJHOUCOLTDC-SIKLNZKXSA-N 417.598 2.155 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)CC3(C(=O)OC)CCCC3)CC2)cc1 1117657577 AIKRFGUUKVFHBS-UHFFFAOYSA-N 410.536 2.271 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc1C 1317896287 XFPXOTNXQUNFRR-UHFFFAOYSA-N 423.516 2.442 10 20 HECD CO/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428562 WDLDYMPMRBGEHQ-TUQDCPSNSA-N 403.479 2.276 10 20 HECD O=C(OCC(=O)N1CCOCC1)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 6460385 BNCJZQIIRINBNN-UHFFFAOYSA-N 413.813 2.131 10 20 HECD Nc1cc(N)nc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 31818330 QGJPMLLJUFUTFX-UHFFFAOYSA-N 405.439 2.147 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)nc1 38581961 KFCKBQULBHLVER-UHFFFAOYSA-N 404.536 2.447 10 20 HECD CC(C)Oc1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 727176886 ROTJAAGMJCWSAJ-GXDHUFHOSA-N 400.547 2.224 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1 729627738 QZGRNOYGSUWQDH-PZJWPPBQSA-N 400.567 2.482 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCN(CC4CC4)CC3)cc2F)CC1 730133247 NMNLMOHZRSFIKZ-UHFFFAOYSA-N 403.546 2.205 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccsc1 741080691 DMUBKFFLDOPJPK-IERDGZPVSA-N 416.547 2.157 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCc3nc(CS(C)(=O)=O)no3)ccc21 744950033 BDVOJBYRXYBRJX-UHFFFAOYSA-N 421.475 2.189 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCC4(CCOCC4)C3)cc2)C1 745691815 OGGRNYHMKMJJGS-LJQANCHMSA-N 414.550 2.491 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccnn1Cc1ccccn1 746356455 RUIMXIFNVGMBON-UHFFFAOYSA-N 404.474 2.182 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCn3c(CCc4ccccc4)nnc3C2)cc1 746474089 VMQOBQWVTNPKGF-UHFFFAOYSA-N 418.545 2.261 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H](O)Cc1ccccc1 747387162 FTYBIETYCACHFR-WEYGHZABSA-N 424.545 2.180 10 20 HECD COc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 748468422 XBCKKXWBSWTVJT-OKILXGFUSA-N 416.453 2.098 10 20 HECD Cc1nc2n(n1)CCN(CC(=O)c1cc(C)n(-c3ccc4c(c3)OCCO4)c1C)C2 750055410 BGSLWYFFSRCJPZ-UHFFFAOYSA-N 407.474 2.464 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c1 751415073 JLWCXJQZEDYWJQ-UHFFFAOYSA-N 418.393 2.171 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)CC2)cc1 753581165 FBHARKXPPFMSPR-UHFFFAOYSA-N 421.519 2.199 10 20 HECD CCc1nnc(O)c(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1CC 754667693 FDCVCMOKJMIFQC-UHFFFAOYSA-N 413.522 2.485 10 20 HECD COCCS(=O)(=O)c1ccc(CN[C@@H](C)c2cc(C(=O)OC)ccc2O)cc1 760020219 XNWFAKVZSWVJGL-AWEZNQCLSA-N 407.488 2.450 10 20 HECD CN(C)C(=O)NCCN(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 763035264 JVMQQLBEZXACIW-UHFFFAOYSA-N 413.469 2.169 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1 768498975 MGJVWPDGSASDIH-UHFFFAOYSA-N 402.425 2.086 10 20 HECD COC(=O)CSCCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768917004 VKSSBZCGBMPINN-HNNXBMFYSA-N 400.928 2.423 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 770255062 REEQGSGRZWUMFJ-GJZGRUSLSA-N 400.454 2.398 10 20 HECD COC1(CO)CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 770262518 VFUUBDKPCYPCDL-HZPDHXFCSA-N 409.502 2.122 10 20 HECD C[C@H](O)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 774176087 AUXHAZQMECHIIW-UWJYYQICSA-N 417.550 2.070 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@H]3CCCC[C@@H]3C)CC2)cc1 774760254 GQLNIQIHLCUSNS-RXVVDRJESA-N 416.566 2.018 10 20 HECD CC[C@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1cccc(S(N)(=O)=O)c1 775616499 FHBVMJAOBGLFHA-FQEVSTJZSA-N 418.563 2.099 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](n2cncn2)C1 776876865 HJCWLXCWIZHEAR-GJZGRUSLSA-N 415.453 2.328 10 20 HECD C[C@H](N[C@H]1C[C@H](C)N(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)c(F)c1 777116560 SNUVDASAIWAQNA-DOXZYTNZSA-N 401.486 2.240 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnc2[nH]nnc2c1 777796917 IIQARSOKKJKWEZ-UHFFFAOYSA-N 406.368 2.138 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1OC 779493910 UDCYAJSKMFNFJL-YWEYNIOJSA-N 412.442 2.113 10 20 HECD CN(C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)C(=O)OC(C)(C)C 785425186 XOOCOHXDZLYTET-KRWDZBQOSA-N 418.538 2.084 10 20 HECD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427699 GOXDFQXOVQWVII-MRXNPFEDSA-N 406.490 2.169 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 788313719 VDJNOZUENUPJMM-LJQANCHMSA-N 415.534 2.138 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1C 789500465 IWSFBCOMEBDUEH-UHFFFAOYSA-N 400.435 2.106 10 20 HECD O=C(COC(=O)Cc1ccc(Cl)cn1)NCc1ccc(N2CCOCC2)c(F)c1 792717025 NLZPGNUCFDJROG-UHFFFAOYSA-N 421.856 2.113 10 20 HECD CCCCN(CC(=O)N1CCN(CC(=O)NC(C)(C)C)CC1)Cc1ccccc1O 801595094 HKAZJGGMCHQRSO-UHFFFAOYSA-N 418.582 2.053 10 20 HECD CN(C)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)cc1 802376983 XUYAVALZDKIKPG-INIZCTEOSA-N 411.911 2.450 10 20 HECD CCN(C)c1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803310132 HFPDJQIRGCSZJH-SFHVURJKSA-N 424.545 2.473 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CN(C(=O)OC(C)(C)C)C1 804749464 QAOHJKHGMFIDHV-UHFFFAOYSA-N 405.495 2.256 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC(F)(F)C3)cc2F)C[C@H](C)O1 808785154 WIHKTFWSJGLVJA-GJZGRUSLSA-N 415.456 2.023 10 20 HECD N=c1cc[nH]c(-c2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)n1 813350640 KECVXBXAKLGSIC-UHFFFAOYSA-N 416.444 2.174 10 20 HECD COc1ccc(C=O)c(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917214918 FTSPDQKSYTWVLE-UHFFFAOYSA-N 402.422 2.179 10 20 HECD O=C(CNS(=O)(=O)c1ccccc1F)N(Cc1ccccc1O)C[C@H]1CCCO1 917364591 JKZQVOUBDITEIE-MRXNPFEDSA-N 422.478 2.017 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1 917753027 ICIXBVQACCCADS-UHFFFAOYSA-N 423.516 2.158 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1 919809711 BAQCBHONVWEXPD-UHFFFAOYSA-N 403.504 2.158 10 20 HECD C[C@H](CNC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 920636732 YXICHKYANJFOGG-ZIAGYGMSSA-N 420.487 2.229 10 20 HECD COCCN1C(=O)/C(=C/Nc2nc(-c3ccc(F)cc3)c(C)s2)C(=O)NC1=S 920979985 POKZOVFCZWNPME-UKTHLTGXSA-N 420.491 2.443 10 20 HECD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1347439188 YVHWRJGGAPSPGJ-QGZVFWFLSA-N 424.906 2.160 10 20 HECD O=C([C@@H]1C[C@H]1c1ccc(F)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248777 MIKJHCZKLGOPAZ-DLBZAZTESA-N 411.433 2.253 10 20 HECD O=C(/C=C/c1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249011 NMJIAQSVZPVYEY-HWKANZROSA-N 415.396 2.301 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(C(=O)N(C)C)ccc3C)CC2)cc1 728568818 SIMJALANTJRXGU-UHFFFAOYSA-N 410.518 2.466 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(CC(N)=O)cc3)cc2)CC1 731132254 XAEJFEXHLLOZFQ-UHFFFAOYSA-N 408.502 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(C)nc3C(C)C)CC2)cc1 734199297 FUTVBUODXNGLML-UHFFFAOYSA-N 412.490 2.423 10 20 HECD COc1cc(N(C)CC(=O)Nc2ccc(C(=O)N(C)C)cc2)cc(OC)c1OC 741795947 VXWGVNNLGQCBGZ-UHFFFAOYSA-N 401.463 2.489 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1 743050032 OHERCPJJJBLOHZ-UHFFFAOYSA-N 422.488 2.286 10 20 HECD O=C(CN1CCC(OCC2CC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 743872989 IQTGWLDEPQBFCI-UHFFFAOYSA-N 405.514 2.170 10 20 HECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2NC1=O 749731569 TVXMGQAUEMTMHT-JTQLQIEISA-N 406.489 2.100 10 20 HECD C[C@H](NS(=O)(=O)c1cnn(C2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 749919734 LKRGFBVKNZPAIT-INIZCTEOSA-N 420.535 2.111 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1 756707713 NKURAZDTTCOJSO-LLVKDONJSA-N 406.451 2.094 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](C)N3CCc4ccccc43)CC2)cc1 758209220 JAMOAOGKDWDIOQ-OFNKIYASSA-N 424.589 2.219 10 20 HECD COc1ccc(N2CCCN(C(=O)NC3CCN(c4cccnn4)CC3)CC2)cc1 759599288 OEHJXCWUULLCOT-UHFFFAOYSA-N 410.522 2.376 10 20 HECD O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NCCc1ccc(O)c(O)c1 762268732 SNJNPGRDMAMOOB-UHFFFAOYSA-N 417.405 2.335 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](O)c3ccccc3Cl)cc2)C1 764858015 BJLXGWYJONPBTR-DNVCBOLYSA-N 401.894 2.392 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c1O 767738528 VRFOATTXRKFPFT-UHFFFAOYSA-N 421.494 2.428 10 20 HECD COCCOCCS(=O)(=O)NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 768216031 GWOJGCHXDLGRNI-UHFFFAOYSA-N 408.520 2.434 10 20 HECD COc1cc(CN2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc(OC)c1 768463737 LRUQRROXIIXWAV-OAQYLSRUSA-N 400.475 2.153 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCN(C)C3CC3)cc2F)C[C@H](C)O1 770686256 XBCVKRADALMOIU-IRXDYDNUSA-N 406.546 2.082 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(Cl)sc3=O)cc2F)C[C@@H](C)O1 772247080 SDPCCTSWLPMJBP-PHIMTYICSA-N 414.890 2.027 10 20 HECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 774541183 URTWYUXQXGYIFM-FQEVSTJZSA-N 412.486 2.267 10 20 HECD O=C(NCCc1cnccn1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774681658 AKEOQJBLYBBMGS-UHFFFAOYSA-N 409.412 2.374 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1O 774838283 UVJPVOMOYUOCCL-UHFFFAOYSA-N 424.461 2.152 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1O 774993231 YPEJXANHVBBXRX-UHFFFAOYSA-N 421.475 2.383 10 20 HECD COc1cc(O)c(CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1OC 776174106 IPXJGEUFPIZHAQ-SFHVURJKSA-N 413.518 2.397 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4ncccc4c3)cc2)CC1 786121657 JDTIISCPCNPYAT-UHFFFAOYSA-N 424.526 2.382 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(C[C@H]1CCCO1)C1CCCC1 788321432 WHOCZADYOLAMTH-OAQYLSRUSA-N 415.534 2.090 10 20 HECD COC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCCO1 789381739 HUKTVJWFEWNWMR-OALUTQOASA-N 408.454 2.184 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc2nccnc2cc1F 791541557 ICUNYWNUSDBEMZ-UHFFFAOYSA-N 400.435 2.256 10 20 HECD COc1cc(Br)cc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797389325 ATSJMZZDERIHSH-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@H]2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)CC1 804761095 VUOAPYMDWFRIIR-WVRJYTFGSA-N 417.506 2.265 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C4(CCC4)[C@@H]3[C@@H]3CCCO3)CC2)cc1F 811754887 LUMKXDRATBBDNW-PMACEKPBSA-N 403.498 2.474 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3O)CC2)cn1C 816517349 MXQKMVNFUXQROK-UHFFFAOYSA-N 400.504 2.094 10 20 HECD CCC(CC)(CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)OC 817056441 DTIZUVKUTQHNNN-VAWYXSNFSA-N 403.523 2.221 10 20 HECD Cc1ccccc1[C@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)NC(N)=O 917708613 LCSKXBSBTARMSU-IBGZPJMESA-N 414.481 2.387 10 20 HECD COCCN(C)CCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918209477 MPNVTGQEXOLDGK-CALCHBBNSA-N 410.534 2.207 10 20 HECD Cc1cc(C)n2nc(C)c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2n1 918371671 IRURHWWVBMZNLC-GOSISDBHSA-N 420.517 2.286 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Cl)ccc1[N+](=O)[O-] 918643317 JSWWZBHNDTXKHB-UHFFFAOYSA-N 423.878 2.413 10 20 HECD C[C@H](NC(=O)CNC(=O)c1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 920890059 IUCZVDZCYDUIRS-AWEZNQCLSA-N 403.429 2.409 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H]1CCS(=O)(=O)C1 1116868530 BWVPJSGMFZDDHG-HNNXBMFYSA-N 410.536 2.200 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)CCc3ccc(C)cc3)cc2)CC1 1116929317 FFKNCWSBBAJEQX-UHFFFAOYSA-N 415.559 2.326 10 20 HECD O=C(C[C@@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547360 LZHRSABCFSMSON-KRWDZBQOSA-N 417.506 2.297 10 20 HECD C/C=C(/C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831352428 JTFYAUBCTPCWQW-AUBBPRACSA-N 423.604 2.433 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(O)cc2)C1 1844944127 OJYFFDGPDUQIKC-WEVVVXLNSA-N 410.426 2.039 10 20 HECD COc1ccc(N2CCCN(CC(=O)N(CCC(N)=O)Cc3ccccc3)CC2)cc1 108094627 GZKXDOUAIIAWPN-UHFFFAOYSA-N 424.545 2.112 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1S(=O)(=O)NC1CC1 524853792 JSLYTJZGMURWQE-UHFFFAOYSA-N 424.529 2.241 10 20 HECD Nc1c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(F)cc1[N+](=O)[O-] 728206945 BJOJXECVRGZBCV-UHFFFAOYSA-N 402.426 2.455 10 20 HECD CCOc1cc(/C=C2\C(=O)NN(c3ccccc3)C2=O)ccc1O[C@@H](C)C(=O)N(C)C 728697103 CPFUKXBXZVSYHI-VUODPORTSA-N 423.469 2.402 10 20 HECD CN(C)CCOC1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 734270122 PJMGACLXCZECBQ-UHFFFAOYSA-N 406.596 2.492 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Oc3ccc(C(=O)NCC(N)=O)cc3)ccc21 734718533 GDXSKQNFPYTSEX-UHFFFAOYSA-N 423.469 2.339 10 20 HECD COc1cc(OC)cc([C@@H](O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 735679641 AMYBZESESXPCEN-NRFANRHFSA-N 415.490 2.073 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(-n4cccn4)c3)cc2F)CC1 739554368 CPOGHRGRPBIFJI-UHFFFAOYSA-N 408.481 2.478 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C3CC3)[C@@H](C)O)c2C)cc1 745741224 AOBKNWZHBALZHT-IIBYNOLFSA-N 412.486 2.404 10 20 HECD O=C(NCCCNC(=O)c1cccs1)NCc1ccc(N2CCOCC2)cc1 748825621 HPANRWZLXDUOPM-UHFFFAOYSA-N 402.520 2.204 10 20 HECD COC(=O)c1c(F)cccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751042145 BTQBSGFCMSKBHJ-CQSZACIVSA-N 422.478 2.488 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C\c2cnc(C)s2)cc1 753056269 RMJUMQYIBLBMCE-YFHOEESVSA-N 409.533 2.395 10 20 HECD O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 759003134 IBXVCGFBBKVNJL-UHFFFAOYSA-N 409.439 2.190 10 20 HECD C[C@@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)NC2(CCCC2)C1=O 765770366 PCIQHCIBKJWGDN-JTQLQIEISA-N 410.268 2.024 10 20 HECD COc1cccc(CNC(=O)CC(C)CC(=O)NCc2cccc(OC)c2O)c1O 768083687 YTRWMYBTEGOMLG-UHFFFAOYSA-N 416.474 2.464 10 20 HECD O=C(Cc1c[nH]c2ccccc12)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768441540 DGVYUGCQPWRBHQ-OAQYLSRUSA-N 407.470 2.186 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3csc(NC4CC4)n3)CC2)cc1 768652652 FBDCGZIWCHLNEI-UHFFFAOYSA-N 416.503 2.232 10 20 HECD COCC(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 769757819 FYOSYEKGSFJKJZ-UHFFFAOYSA-N 423.447 2.256 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc([C@@H]2CNC(=O)C2)c1 772474722 PCFNYZZWUZOUFZ-SFHVURJKSA-N 408.502 2.343 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CN3CCCC3=O)c3ccccc3)nc12 774914823 RJSKIHOZVXMUBN-SFHVURJKSA-N 423.473 2.065 10 20 HECD Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 777915483 NETMGIAFCTZERB-UHFFFAOYSA-N 403.413 2.215 10 20 HECD CCOC(=O)C1CCN(C(=O)C[C@H](C)NCc2ccc(N3CCOCC3)cc2)CC1 783504499 NGFJWHMCMHNSIQ-SFHVURJKSA-N 417.550 2.193 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)cc1F 785981729 RPAZMGOCDIEAQT-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@@H]3CCOC3)CC2)cc1 788978771 RKSKUVNKNLHAJM-LJQANCHMSA-N 417.550 2.193 10 20 HECD CCCN(CCCN(C)C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789868091 LNOVHFFVWFELIY-UHFFFAOYSA-N 406.596 2.046 10 20 HECD CC(C)CN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949935 LIFOXJIDFZAWSY-UHFFFAOYSA-N 401.429 2.273 10 20 HECD CN1C(=O)C(=Cc2c(F)ccc(I)c2F)C(=O)N(C)C1=O 794866972 RPWGZXOFIWKPHS-UHFFFAOYSA-N 406.126 2.003 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)cc1C 795616014 KOMFWWWGGSPERZ-UHFFFAOYSA-N 409.533 2.304 10 20 HECD COc1ccc(N2CCCN(Cc3c(C)nn(CCS(C)(=O)=O)c3C)CC2)cc1 797950477 VLPCARBCJDIFQG-UHFFFAOYSA-N 420.579 2.265 10 20 HECD COc1cncc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 798440043 GEXCTKUMYXAWHS-HNNXBMFYSA-N 411.911 2.392 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C3CCN(C)CC3)C2)cc1F 804851428 BSLKNBBSCOKDQN-LJQANCHMSA-N 418.557 2.478 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)CCN(C)C(=O)OC(C)(C)C 807103622 SGXNBAYAYWPLQO-UHFFFAOYSA-N 406.527 2.003 10 20 HECD O=C(Nc1cccc2c1COC2=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 808919957 PGFHWOIWENVRGK-OAHLLOKOSA-N 410.426 2.209 10 20 HECD CC[C@H](O)c1nccn1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 810004548 VSLFNKJMIAWCRU-KHYOSLBOSA-N 404.486 2.396 10 20 HECD COc1ccc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OC)n1 811866095 FIYIZRKDWOIVIP-HNNXBMFYSA-N 400.479 2.496 10 20 HECD CCC[C@@]1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 812010547 QWOZXYSWLLDDFN-XMSQKQJNSA-N 402.539 2.082 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](O)c3ccc(Cl)cc3)CC2)cc1 813426647 MQEQNIMODIJPKD-FQEVSTJZSA-N 403.910 2.320 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)CN1CCOCC1 819518735 BTFJJJDTEXMOBM-QGZVFWFLSA-N 405.539 2.343 10 20 HECD O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NCCc1ccc(O)c(O)c1 917355424 BUQLTBSGTPXZPI-UHFFFAOYSA-N 414.483 2.278 10 20 HECD COCCNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1Cl 918444723 VEXRKRXBJGWPAH-UHFFFAOYSA-N 419.865 2.019 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C23CC(C2)C3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998122 IRMTUYUZKHNUPU-YUABNYNKSA-N 408.458 2.008 10 20 HECD C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1812574362 CGKYJATULJZODL-IOVOPAHISA-N 408.458 2.340 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1cc(O)nc(O)c1 1817845082 XTMUCNLNAQIGIC-INIZCTEOSA-N 424.461 2.483 10 20 HECD C[C@@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)CC1(F)F 1828046816 IPKJOADHHGTPDM-XLFHBGCDSA-N 424.429 2.220 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 7364638 IWUPDZGRQOLMGP-UHFFFAOYSA-N 401.488 2.091 10 20 HECD COc1ccc(-c2noc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 138520366 IFLFUNDUZWWSOZ-UHFFFAOYSA-N 419.415 2.179 10 20 HECD C[C@@H](NC(=O)Nc1ccc(S(C)(=O)=O)nc1)c1ccc(N2CCOCC2)cc1 141944512 TYPQYNSKLKEILL-CQSZACIVSA-N 404.492 2.204 10 20 HECD CCN1CCCC[C@@H]1CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 303446809 HGOWONSEUIXBEX-OAQYLSRUSA-N 417.598 2.381 10 20 HECD Cc1cc(-c2nc(CS(=O)(=O)C3CC3)no2)ccc1NC(=O)C1=S=CC=C1 445768139 VKFKWJYYKNAMMF-UHFFFAOYSA-N 403.485 2.338 10 20 HECD CN1CCN([C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 727755704 DAZCHKMLCQKEEC-HSZRJFAPSA-N 408.546 2.128 10 20 HECD CN(C)C(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 728179275 QHHOKPJIJOTUDX-LJQANCHMSA-N 408.502 2.020 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCn3ccnc3C)cc2F)CC1 730119986 WZIGAYCROAPJBM-UHFFFAOYSA-N 402.518 2.362 10 20 HECD O=[N+]([O-])c1cc(CNCCS(=O)(=O)NCC2CCC2)ccc1N1CCCCC1 731678527 GQAFXZRYUCFHKW-UHFFFAOYSA-N 410.540 2.394 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](c4nncn4C(C)C)C3)nc12 735872349 BUAXRXKZZPUNHC-AWEZNQCLSA-N 413.482 2.164 10 20 HECD COC(=O)CCCc1nnc(NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 740464186 BWTBLSWYSOTRBV-UHFFFAOYSA-N 419.507 2.192 10 20 HECD CC(=O)N1CCc2ccc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)cc21 743050037 OQEJNVLWASTURZ-UHFFFAOYSA-N 403.489 2.253 10 20 HECD CC(C)[C@@H]1C(=O)NCCN1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905343 NKWABUDMIVMCHE-RHSMWYFYSA-N 410.465 2.423 10 20 HECD Cc1nc2n(n1)CCN([C@@H](C)C(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)C2 750057463 NOFUKHCUCRMRMR-ZDUSSCGKSA-N 415.453 2.205 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN(C)C[C@@H](O)CN3CCOCC3)c2C)cc1F 751484734 HXEYHILEXUWBBW-HXUWFJFHSA-N 417.525 2.349 10 20 HECD O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCOCC2)cc1 752960923 FICAVQKRSFWHOI-FPLPWBNLSA-N 405.458 2.211 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 753637635 WQBNRLBFJGGWBS-LLVKDONJSA-N 412.895 2.363 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 753642695 FPRMENCFDBHPHY-CZUORRHYSA-N 424.453 2.234 10 20 HECD C[C@H](CO[C@@H]1CCOC1)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 753857639 NRAIJDCOPVTJMG-YFHUEUNASA-N 409.502 2.433 10 20 HECD CN1Cc2ccccc2[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 757629925 RGAHDRPYSISQGH-DENIHFKCSA-N 421.545 2.374 10 20 HECD O=C(CN1CC(=O)N[C@H]2CCCC[C@@H]21)Nc1cccc2c1C(=O)c1ccccc1C2=O 758772918 QTICYUQAHIPAFW-HKUYNNGSSA-N 417.465 2.144 10 20 HECD COC(=O)CC1(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCCC1 759736694 SCSHLJMRPKWCOZ-UHFFFAOYSA-N 421.513 2.134 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](CCO)C3CCCCC3)CC2)cc1 760863602 OOPNQSFLOVSKBD-GMAHTHKFSA-N 405.583 2.099 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(c2cccc(F)c2)C(=O)C1 765226463 DXTOJWGRUAEYFS-UHFFFAOYSA-N 412.465 2.221 10 20 HECD CCOC(=O)[C@H]1CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768548572 WQTKSZMPVKFQKE-CQSZACIVSA-N 424.500 2.422 10 20 HECD CC(=O)N1CCc2c(NC(=O)C(=O)NCCCSc3nccs3)cccc21 769252057 IBMATUFQYWKZER-UHFFFAOYSA-N 404.517 2.289 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1-c1cccc(F)c1 770729235 ZGWNUDZFLMOREW-UHFFFAOYSA-N 423.448 2.103 10 20 HECD Cc1n[nH]c(C)c1[C@@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 773545848 XHKZOLPXOVHMFV-FQEVSTJZSA-N 415.513 2.456 10 20 HECD Cc1ccc(S(=O)(=O)NCCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1C 773760531 ARNDZVVIUDHETC-OAHLLOKOSA-N 406.504 2.130 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3cccnc3)cc2F)C[C@@H](C)O1 774131221 VKDDBMRISOFWKC-OWCLPIDISA-N 414.481 2.328 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCCO[C@H]3CC(C)C)CC2)cc1 775870483 MOFRANTYFDODBW-MZYLBHOOSA-N 405.583 2.361 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCc3nc(N(C)C)no3)cc2F)C[C@H](C)O1 776633610 REZRBMPHZRKOKT-KBPBESRZSA-N 405.474 2.137 10 20 HECD CCOC(=O)c1ccc(N2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)nc1 779504544 APTKVMAWRHXWQU-WEVVVXLNSA-N 411.458 2.422 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(F)cc3F)cc2)CC1 786121978 LIIYPSDPMZQXMG-UHFFFAOYSA-N 409.458 2.112 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(-c4ccncc4)on3)cc2)CC1 786257167 NVXGTQPKPRSFSN-UHFFFAOYSA-N 405.458 2.335 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@H]12 788920958 SUKGUNGCHFEHJG-AISVETHESA-N 415.509 2.219 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)Cc2ccccc21 789855163 KVANTHLMHVZDFU-UHFFFAOYSA-N 424.570 2.335 10 20 HECD C[C@H](COc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789863400 GCFIBZKBEDEJPQ-QGZVFWFLSA-N 413.543 2.440 10 20 HECD Cc1cc(C(=O)CN2CC[C@@H](S(C)(=O)=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 800467975 CFKCPAZECXMZKJ-QGZVFWFLSA-N 418.515 2.167 10 20 HECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1 801735327 SHNBUVHLOVQWAU-SFHVURJKSA-N 403.548 2.370 10 20 HECD CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803297232 OAEIMFDXZQPBPO-LSTHTHJFSA-N 417.550 2.362 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C[C@H](O)c2ccc(F)cc2)C2CC2)cc1F 803664675 NGQVPZOVUJJOEI-FQEVSTJZSA-N 417.456 2.372 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2C 804569913 PYLHWRCVXREABO-HNNXBMFYSA-N 408.502 2.074 10 20 HECD CCCNC(=O)CN1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 804912205 RFQBOAYWUZUOCH-UHFFFAOYSA-N 417.337 2.489 10 20 HECD C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 804968632 HLQSBRGCNRJNFD-FXAWDEMLSA-N 404.580 2.244 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 806760173 DECIANSVWAVULY-OAHLLOKOSA-N 418.538 2.273 10 20 HECD C[C@@H]1COCCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768346 HKZCSHYKOQBGEX-HUUCEWRRSA-N 411.449 2.010 10 20 HECD CC(=O)Nc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cn1 807888891 YVAYPNMEJKMQBN-UHFFFAOYSA-N 423.517 2.305 10 20 HECD COc1cc(Br)cc(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)c1O 809688550 LUZRSINFNILIMK-GFCCVEGCSA-N 421.357 2.267 10 20 HECD CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](CNCc2ccc3c(c2)CCO3)C1 816545413 QDGDCJBCLMTCLG-KRWDZBQOSA-N 403.523 2.474 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc4c(c3)C(=O)OC4)CC2)cc1 917759789 ZIFVQADSLXUHQV-UHFFFAOYSA-N 402.472 2.267 10 20 HECD O=C(NCCc1nnc2n1CCCCC2)NCc1ccc(N2CCOCC2)c(F)c1 918200099 XARXDVRRNNFIGU-UHFFFAOYSA-N 416.501 2.022 10 20 HECD O=C(CCNC(=O)Cc1ccccc1)NCc1ccc(N2CCC(CO)CC2)cc1 919968312 BUBVISWOQFBXNJ-UHFFFAOYSA-N 409.530 2.261 10 20 HECD O=C(Cc1c(F)cccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604404 BOELLERNHCSZQX-BTTYYORXSA-N 417.412 2.266 10 20 HECD Cc1ccn(C)c1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546900 MFHKFDKVVYJLGT-UHFFFAOYSA-N 412.490 2.298 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C3CC(F)(F)C3)CC2)C1 1810549700 YXMVYTBWGMABQL-UHFFFAOYSA-N 409.433 2.383 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838030197 DWTWWDORMYIHAH-RCDICMHDSA-N 417.506 2.151 10 20 HECD CC(C)c1csc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)n1 1843249318 WTSMDRZDKBAXEY-UHFFFAOYSA-N 402.476 2.204 10 20 HECD O=C([C@@H](O)c1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500982 LNQQXHVRSBGFOP-KRWDZBQOSA-N 416.861 2.302 10 20 HECD Cc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039142 OYYJJRMPYJYQLC-SOFGYWHQSA-N 409.442 2.037 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(Cl)cc1Cl 1847204524 FYYPGYDKOWQIKZ-STQMWFEESA-N 423.256 2.324 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(OC)c3)CC2)c(OC)c1 8675399 GWKXLQDWWMYLDE-UHFFFAOYSA-N 422.503 2.232 10 20 HECD CC(C)(C)n1nccc1NC(=O)C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 438813075 WFSWXNHFABHQKK-UHFFFAOYSA-N 411.487 2.431 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1 729627732 QZGRNOYGSUWQDH-CTNGQTDRSA-N 400.567 2.482 10 20 HECD C[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 737037772 MHMYUEVDUMWEEA-IBGZPJMESA-N 416.566 2.338 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc4[nH]ccc34)CC2)cc1 737159028 OYVOTNBLQDTAQJ-UHFFFAOYSA-N 421.501 2.053 10 20 HECD CCN1CC[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C 740883386 OFVSQODQPPOPMP-IEBWSBKVSA-N 406.546 2.083 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)CC2)cc1 743899284 RKOZCNTVPUGDCN-UHFFFAOYSA-N 421.501 2.053 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CCOc1ccc(S(=O)(=O)N(C)C)cc1 746492732 KPGSAJNWGNRCPA-UHFFFAOYSA-N 405.520 2.281 10 20 HECD O=C(CCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)NC1CC1 751066116 XGDKGPXXDLITAJ-UHFFFAOYSA-N 423.516 2.043 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc2c1OCCO2 751227244 GCDAVAVCNAOJEF-UHFFFAOYSA-N 422.478 2.037 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 753643293 HOMTUPPDKGKMHV-CYBMUJFWSA-N 424.432 2.318 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)ccnc12 758003887 RHBOONHGTILMIY-UHFFFAOYSA-N 423.473 2.267 10 20 HECD CC(C)OC(=O)[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 759793805 YGBIHJOEMXNWNK-ULQDDVLXSA-N 423.529 2.327 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)NCc2cccc(Br)c2O)CC1 764790955 LBRPNQVBSZJPFJ-CQSZACIVSA-N 413.360 2.228 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F 774921207 URROFAGIKQMJTO-CQSZACIVSA-N 403.429 2.295 10 20 HECD Cc1nc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc(O)c1C 776864715 PYFGWTCDJOOIIV-UHFFFAOYSA-N 406.483 2.183 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@@H](C)CCSC)CC2)cc1 778286291 WPZBKATXXQGQBE-FVNWOWOISA-N 405.564 2.500 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(NS(=O)(=O)c2cccs2)CC1 779476656 UDYBHPQYWAMGDO-XQRVVYSFSA-N 408.501 2.142 10 20 HECD CC[C@@]1(CO)CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 779520846 VYNBSXINNUYMQY-HSZRJFAPSA-N 418.582 2.401 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1 782110906 KTPACTJMVWPHJQ-UHFFFAOYSA-N 409.442 2.113 10 20 HECD Cc1c[nH]cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1=O 782178217 ZLHZIKAGAPIAPD-UHFFFAOYSA-N 416.389 2.254 10 20 HECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(c1ccc(N)cc1)C1CCCCC1 784059789 SCIBWGZUANSOGF-UHFFFAOYSA-N 413.478 2.483 10 20 HECD O=C(NCCc1ccncc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 786791915 JUJBWWJZFXWNCZ-UHFFFAOYSA-N 418.444 2.127 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccnc(-n3cccn3)c2)cc1F 787242820 RKIRJYJQWSVMJG-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC(=O)N(C)Cc1ccccc1 787752865 CTNKLWLZTUHYNI-UHFFFAOYSA-N 411.502 2.296 10 20 HECD CC(C)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842183 AQDQUQFZDMCEBL-QGZVFWFLSA-N 405.514 2.298 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789863396 GCFIBZKBEDEJPQ-KRWDZBQOSA-N 413.543 2.440 10 20 HECD CCN(C)c1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cn1 790106606 QLOFYEXNOFSAQZ-SSZFMOIBSA-N 406.577 2.461 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(C(N)=S)cc3)CC2)cc1 798317089 TUMSKDHXUCNHPN-UHFFFAOYSA-N 412.559 2.272 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ccc(C)cc2)C1=O 807590470 QIPYIOGVIJLIGV-LJQANCHMSA-N 409.486 2.361 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC[C@@H]1C1CC1 807768422 JHYIKEHSMBWAHW-MAUKXSAKSA-N 423.460 2.010 10 20 HECD CCOC1CC(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 809465584 XTEMSUHBGRQLKS-UHFFFAOYSA-N 400.479 2.252 10 20 HECD O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NCCCSc1nccs1 810397962 DNILRMWCNFNSHR-UHFFFAOYSA-N 405.954 2.373 10 20 HECD CCOCc1nc([C@H](C)NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 812567498 FUAUASFRVRQNAH-HNNXBMFYSA-N 403.483 2.345 10 20 HECD CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)c3cccc(O)c3O)ccc21 817590714 WFIHJTMEIWCDJT-UHFFFAOYSA-N 406.341 2.352 10 20 HECD CN(C)[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cncn1C 857456517 OLWIZTAKCVXBJT-KDOFPFPSSA-N 407.465 2.409 10 20 HECD Cn1nc(C(F)(F)F)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 857457057 IUPLAOYDWFYHEK-UHFFFAOYSA-N 400.376 2.469 10 20 HECD COc1ccc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284886 TUZQIHZZTJARJW-UHFFFAOYSA-N 401.438 2.234 10 20 HECD Cc1cc(C)nc(SCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 918372065 KBPYBMKPHCDHDV-QGZVFWFLSA-N 413.547 2.204 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cnccc2n1)c1cc(O)nc(O)c1 1797407638 OSJOJCHEJYUTBT-MUJYYYPQSA-N 419.441 2.002 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)Cl)C1=NN(c2ccccc2)C(=O)C1 1802603683 CYHUOMCXGMHJFZ-UBSAEIQESA-N 424.835 2.249 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C2CCC2)[nH]n1 1823497462 ZGBQUYJGDJCTHZ-CYBMUJFWSA-N 421.548 2.062 10 20 HECD O=C(Cc1cc(F)ccc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248872 CODAASDPZWQMFG-UHFFFAOYSA-N 419.840 2.345 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1 734017051 YXLKCYIBNGLGRD-INIZCTEOSA-N 410.426 2.106 10 20 HECD C[C@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1 741251721 MDLVQGLKBYEVMM-SFHVURJKSA-N 415.509 2.162 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)cs1 742278498 KEZDZUQZOMUFPB-UHFFFAOYSA-N 410.517 2.444 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3c(C)nn(C(F)F)c3C)CC2)cc1 742917454 XEMUUUAXQBYIEU-UHFFFAOYSA-N 421.492 2.385 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2cccc(OC)c2O)cc1 745321404 INSJPHYXHZYKAN-UHFFFAOYSA-N 421.519 2.431 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCn3nc(C)nc3C2)c([N+](=O)[O-])c1Br 750030702 WLXSMGNSEZKXGU-UHFFFAOYSA-N 413.188 2.194 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 753212840 NCRDUTBQKZKGES-AWEZNQCLSA-N 421.519 2.166 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)[C@@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)C1 753862405 ZIZFWQSKJWEVSI-SJORKVTESA-N 421.513 2.147 10 20 HECD COc1cc(N2CCN(C(=O)Cc3cn4ccccc4n3)CC2)cc(OC)c1OC 759223063 QKXUICCBZYDMMG-UHFFFAOYSA-N 410.474 2.251 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN(C)[C@H](C)C3)CC2)cc(OC)c1OC 759280559 AUOIUMVNHLVDBP-HZPDHXFCSA-N 406.527 2.027 10 20 HECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(C)c2)c1C 767395485 SFHVFKJYEPFXGM-UHFFFAOYSA-N 406.504 2.376 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 768172499 JHDCPPSWBQJIFO-UHFFFAOYSA-N 413.449 2.367 10 20 HECD O=C(Cc1cccc(F)c1)N1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768462739 CPJGBOBDXBLZQN-HXUWFJFHSA-N 400.450 2.234 10 20 HECD COCCN(Cc1cc(Br)cc(Br)c1O)[C@@H](C)C(N)=O 775682352 WINZSUVPPIZHJL-QMMMGPOBSA-N 410.106 2.239 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 776078100 ZNHOEOZZCOMEQB-XLIONFOSSA-N 409.552 2.020 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCC3CCOCC3)CC2)cc1 778326149 QAIUVIYDNAKFCT-FPLPWBNLSA-N 415.534 2.175 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CC(=O)NCC(F)(F)F)cc1 779661235 QPGRVNXHAPMDJD-MRXNPFEDSA-N 401.429 2.329 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 782104548 GPUMSWNWHDALKR-UHFFFAOYSA-N 419.428 2.189 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 785298515 VPEWIBYNYBBREH-GFCCVEGCSA-N 421.457 2.446 10 20 HECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785445359 WXZZVAKPABZENU-QAPCUYQASA-N 418.538 2.131 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(F)cc1F 786981327 QTDHOBQREZPBRE-UHFFFAOYSA-N 403.429 2.076 10 20 HECD C[C@@H](CCc1cccn1C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854214 FHIHLXXSHSEDGF-KRWDZBQOSA-N 414.575 2.332 10 20 HECD C[C@H](CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCCCC1 789856750 XWTDHTORGCNYAY-GOSISDBHSA-N 418.607 2.237 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c(O)c1 797629407 FMQBRTSGBBVXOB-UHFFFAOYSA-N 421.475 2.172 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCc2ccccc2OC1)c1ccc(N2CCOCC2)cc1 803309222 RVRGEJSJBKDHFT-FXAWDEMLSA-N 423.513 2.210 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(CCN(C)C)Cc1cccs1 807102263 FGIFOQPUJVDCPT-UHFFFAOYSA-N 402.564 2.329 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](C)CC1(C)OCCO1 807421950 YHEIHTPHJYWVTI-KRWDZBQOSA-N 405.539 2.395 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCO[C@@]2(CCSC2)C1 809494912 DGGCLWODDUOLNE-UWJYYQICSA-N 405.564 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)c3ccccc3Cl)CC2)cc1 915676295 JZPBPUQANXHPOC-UHFFFAOYSA-N 408.907 2.471 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)O1 918201175 GFLVLVVFBAAOGT-IAGOWNOFSA-N 422.545 2.085 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3ccc(O)nn3)cc2)CCC1)c1cc(O)nc(O)c1 1787227493 SUFQPXZPRMPALL-UHFFFAOYSA-N 421.413 2.050 10 20 HECD CC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796603465 OGCAJUMZYRIFAP-BCDXTJNWSA-N 424.457 2.017 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C23CC(C2)C3)[C@@H]1c1cccnc1 1813642770 QNNZHFTVLXGWBO-VKTDNDKKSA-N 408.458 2.008 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429198 QODJMBNWBBKTSP-KSSFIOAISA-N 417.506 2.341 10 20 HECD CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)CCO2 1839348322 NMAIXNYNZLKODE-QHCPKHFHSA-N 411.502 2.184 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccccc2F)C1 1844852084 ZOQFEGXFIKGXBF-UHFFFAOYSA-N 420.444 2.436 10 20 HECD CC(C)(C)c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cn1 1847193257 GNXJWHACYSZYEW-HOTGVXAUSA-N 410.474 2.315 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)CN(C)C3=O)c2C)c1 7095680 SFRLFCYBQRMPMR-UHFFFAOYSA-N 411.458 2.331 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)C1CCCC1 727105265 YFRRIOQFXDWGTD-LPHOPBHVSA-N 414.550 2.090 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1 728979554 ZECVOLKJTYGEIL-OAHLLOKOSA-N 418.515 2.122 10 20 HECD CN(C)c1ccc(CNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)cc1 729836387 AYSUCVGEGVXQBW-UHFFFAOYSA-N 409.458 2.402 10 20 HECD Cc1cc(C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1cccc(C(C)C)c1 732066297 LHIZKTNMDHWCQW-UHFFFAOYSA-N 404.536 2.179 10 20 HECD CC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@@H](C)O1 732207937 DBDORSBFDNTZIR-QAPCUYQASA-N 419.547 2.424 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1O 737279173 VTMJZZJYCQBORO-UHFFFAOYSA-N 411.458 2.200 10 20 HECD CCS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739768001 JKBZINNDVYXSQM-UHFFFAOYSA-N 415.515 2.434 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)c3cnn(C)c3)CC2)cc1 743634570 YRWISGACSWNZIH-QGZVFWFLSA-N 400.527 2.001 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](CN(C)CC4CC4)C3)CC2)cc1 746494563 JOZDMIQYLHOKCK-FQEVSTJZSA-N 400.567 2.008 10 20 HECD CCN(C)C[C@H]1CCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 749198480 MHEWVKMYRLWMGY-LJQANCHMSA-N 405.562 2.451 10 20 HECD Cc1nc2n(n1)CCN([C@H](C)C(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)C2 750057462 NOFUKHCUCRMRMR-CYBMUJFWSA-N 415.453 2.205 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H]1CC(=O)N(C2CC2)C1 750636168 ATYDOYJSIKPSHQ-AWEZNQCLSA-N 408.449 2.319 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 754043066 NXIXOKKNPZSKSF-OFNKIYASSA-N 413.562 2.061 10 20 HECD C[C@H](NC(=O)N[C@@H](CO)C[C@@H](O)c1ccccc1)c1ccc(N2CCOCC2)cc1 754584931 YQLAOOCPMWCZOS-UCNVEGJOSA-N 413.518 2.368 10 20 HECD CC(C)Oc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccn1 759719027 UWJDBBOPUCNWOU-UHFFFAOYSA-N 403.504 2.034 10 20 HECD CCCNC(=O)CN1CCC(N[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)CC1 764897732 JKFSHJISSRLEFY-KRWDZBQOSA-N 406.546 2.304 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2ccnc2)nn1 771058903 OPRBFELIPHAVPO-INIZCTEOSA-N 412.881 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3ccc(C)cc3)CC2)cc1 772675429 IHWVQYGXSOLHGO-GJCOWUBNSA-N 423.513 2.058 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 773768520 IXWLMEWKJGECOY-ZDUSSCGKSA-N 401.419 2.204 10 20 HECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc21 773845922 KUHBFRVUZJCTNJ-OAHLLOKOSA-N 421.501 2.269 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cc(Br)cn(C)c1=O)c1ccc(N(C)C)cc1 773855293 FRWPMMSTSPTSMM-NSHDSACASA-N 421.295 2.030 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1c[nH]c2ccccc12 774616664 KVBPMWVVDYISMO-UHFFFAOYSA-N 420.513 2.322 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)CC2)cc1 778258039 XGFDQWCBBIQUQW-GFOMBABLSA-N 423.517 2.029 10 20 HECD CCCc1noc(CCCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)n1 787322572 RHWKGXBVBORCPX-UHFFFAOYSA-N 413.522 2.330 10 20 HECD COc1cccc(CNC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1O 788529407 MRJSKLCKDHCUMX-SFHVURJKSA-N 402.466 2.347 10 20 HECD O=C([C@@H](CNCc1cc2c(cc1O)OCO2)Cc1cccc(F)c1)N1CCOCC1 788533418 YLNYGDGPHKWFCR-QGZVFWFLSA-N 416.449 2.067 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H]1CCCO1 788882359 CDNJLIHMZYLBDV-CAQIIQHBSA-N 409.502 2.433 10 20 HECD COc1cccc(/C=C(\C(=O)N2CCOc3cc(N(C)C)ccc32)n2nnnc2C)c1 789653104 XRLCVOLAIVJSGD-DEDYPNTBSA-N 420.473 2.480 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)OC[C@@H]3C)cc2F)C[C@@H](C)O1 789820425 QSEVOUJFFBJKMV-HRCADAONSA-N 421.513 2.081 10 20 HECD COc1ccc(OC)c(C2=NO[C@H](C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)C2)c1 792306991 LUCBFEITYLHQSP-YUNKPMOVSA-N 400.431 2.355 10 20 HECD Cc1cnn(C)c1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 795865417 YNRZLWFSMIRLFG-ZDUSSCGKSA-N 400.451 2.277 10 20 HECD COc1ccc(NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 796393354 JFNAOCMKPFKDJC-UHFFFAOYSA-N 405.520 2.394 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)N1CCCC1 798372404 JXLIEQDLHAGKNX-OAGGEKHMSA-N 406.502 2.249 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)CCS(=O)(=O)N(C)C)cc2Cl)C1 800571420 JHYNHSBLRXVNHJ-CQSZACIVSA-N 401.960 2.474 10 20 HECD C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)NCCF 800710834 XRIKKGVTEHPSKR-STQMWFEESA-N 402.417 2.030 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C12CCC2 803308763 JPJQDJHMPQOEMW-PWIZWCRZSA-N 415.534 2.164 10 20 HECD Cc1cnccc1OC1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803688576 VAHKFTQAHKHFQC-UHFFFAOYSA-N 422.529 2.459 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C 804263122 ICPRDBQCYZQVSC-SFHVURJKSA-N 418.538 2.193 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1 806425957 TVOAECPMKXVPEJ-QHCPKHFHSA-N 418.541 2.460 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807653545 DVCFXKNUJDLEPJ-TWOQFEAHSA-N 408.502 2.240 10 20 HECD CC[C@H]1COCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768466 KKZUUJLOHYAQBB-CABCVRRESA-N 411.449 2.010 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 810044051 LMVIPRDOYOSDNQ-INIZCTEOSA-N 418.515 2.278 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@](C)(O)C3CCC3)cc2F)C[C@@H](C)O1 812665450 SGZRTTPXGHYPSY-ZCCHDVMBSA-N 422.497 2.150 10 20 HECD CCC(Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)=C1C(=O)NC(=S)NC1=O 814330040 JCKQNTRGWSPCIG-UHFFFAOYSA-N 424.438 2.433 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCN3CCCCC3)cc2)C1 918117265 BJIXCGAXJQJVPR-LJQANCHMSA-N 401.555 2.064 10 20 HECD NC(=O)C1(CNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCOCC1 918437607 ZQMHBMUQFSMFBA-UHFFFAOYSA-N 409.446 2.439 10 20 HECD Cc1cccc2c(=O)n(CC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cnc12 919969436 YDKQFASUTUKYQC-UHFFFAOYSA-N 420.513 2.230 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nnc(C)o2)cc1 1116570614 DJYYLRJZPFGRKH-INIZCTEOSA-N 411.414 2.360 10 20 HECD CCCCC[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1846024407 ZZDAAESTVRQURW-CQSZACIVSA-N 411.593 2.267 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H]2C[C@@H]2C2CC2)=NN1c1ccccc1 1847486009 FKZGQPQFUXBDNJ-UMGGQSCQSA-N 406.486 2.027 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 23855196 FLUCSPYXORHFGP-UHFFFAOYSA-N 410.430 2.117 10 20 HECD Cc1cc(C)c2c(N)c(C(=O)OCC(=O)c3ccc(S(N)(=O)=O)cc3)sc2n1 115688477 FNQLMCQKVSTVOJ-UHFFFAOYSA-N 419.484 2.182 10 20 HECD CN1CCCc2cc(CNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)ccc21 116167312 RDMQOOPHAKFJGV-QRFRQXIXSA-N 402.564 2.411 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1 726793060 NSWSCRBNFTXJIO-UHFFFAOYSA-N 423.560 2.113 10 20 HECD Cc1cc(C(=O)CN2CCCO[C@H](C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 727437984 VITCBMCVDLWTBZ-OAHLLOKOSA-N 405.520 2.035 10 20 HECD CNC(=O)C1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 730044396 ZQVNCBVRLVPNSB-UHFFFAOYSA-N 412.442 2.133 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3cccc(F)c3)cc2)C1 731671744 OBEQVMVCPVWCLA-QGZVFWFLSA-N 405.495 2.147 10 20 HECD CCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H](C)CS(=O)(=O)CC 733345819 PGZUAXKXKNHWEM-IAGOWNOFSA-N 411.568 2.439 10 20 HECD COc1ccc(O)c(CNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c1 734065076 UFTKBMISZKRLJX-UHFFFAOYSA-N 412.490 2.303 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)c1O 737285121 ZPHJXCZCFPEDAU-GASCZTMLSA-N 413.474 2.269 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4ccccc4)cc3O)cc2)C1 743316242 PHNZGNCLJZAERL-KRWDZBQOSA-N 419.485 2.210 10 20 HECD O=C(NCc1nncn1C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748041105 VKSZAOXUOZZQDS-UHFFFAOYSA-N 419.488 2.111 10 20 HECD C[C@@H](O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 753110485 YZQVNLZGOVVUJC-UKRRQHHQSA-N 401.429 2.454 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 753150596 PMQVYMVALMNHAD-AWTIPJNISA-N 415.534 2.221 10 20 HECD Cc1nnccc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 753524586 JRUBGPHOEKOXFA-ZIAGYGMSSA-N 416.453 2.011 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3cc(OC)ccc3O)CC2)cc1 754139099 BJKXRDKQTLGRKU-IEBWSBKVSA-N 415.534 2.243 10 20 HECD COc1cc(N2CCN(C(=O)c3cn(-c4ccccc4)nn3)CC2)cc(OC)c1OC 759220615 GTAJPMNRKREIIX-UHFFFAOYSA-N 423.473 2.256 10 20 HECD C[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@]1=O 759867110 INWAYJYUZADQTE-MLNJSSBLSA-N 410.495 2.243 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc2c(c1)OCCO2 765903159 GOZMPAPJHFGGJO-UHFFFAOYSA-N 407.220 2.181 10 20 HECD COC(=O)c1[nH]c(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 769137662 APXIWYXWPHNKBK-INIZCTEOSA-N 412.490 2.050 10 20 HECD Cn1ccnc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 770302473 WHAOYRVWCRXNMJ-MOPGFXCFSA-N 424.549 2.211 10 20 HECD O=C(Cn1c2c(sc1=O)CCCCC2)NCc1ccc(N2CCOCC2)c(F)c1 772899724 VOSGREIJUDUHQI-UHFFFAOYSA-N 419.522 2.471 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773756790 NSNFAMGTODEWHS-AWEZNQCLSA-N 418.515 2.314 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)[C@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1Br 784384378 BSTJTGIWSQLDKL-GJAJDEHISA-N 410.246 2.477 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cn(C)c(=O)cc1C 785192564 NRYZZALJVPENLP-UHFFFAOYSA-N 422.279 2.149 10 20 HECD CO[C@@H](C)COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785396864 HQBASIJKNQHVQN-NSHDSACASA-N 410.404 2.293 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cnc(Cl)c(C)c3)cc2)CC1 786120138 ISSMGXPRIROXRZ-UHFFFAOYSA-N 422.938 2.190 10 20 HECD Cc1cncc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 789820993 RKTSWXKAUUEPDS-IYBDPMFKSA-N 414.481 2.075 10 20 HECD CO[C@H]1CCOc2c(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cccc21 790966021 NWAZNENEIGRBNR-XIKOKIGWSA-N 400.431 2.254 10 20 HECD CC1(C)CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793734967 WERFJPZWAYCPAG-MSOLQXFVSA-N 414.550 2.090 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 803563356 YSOMCLROJPYJNY-UYAOXDASSA-N 417.550 2.136 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1F 806878446 LHNHVNDHILNWQL-UHFFFAOYSA-N 420.828 2.131 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 807288709 ZRNURKBTPHBFOW-KNQAVFIVSA-N 408.546 2.154 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1 807690817 FRGSRQZASKPTLB-IBGZPJMESA-N 409.534 2.280 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NCc1nnc2n1CCC2 916235424 SZUNECYEKXIQRP-UHFFFAOYSA-N 424.427 2.079 10 20 HECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 916971010 QIVZNDCAXIOHRX-OALUTQOASA-N 420.573 2.329 10 20 HECD CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917834786 QBDCKKMZLTUFGY-IDCRMVTHSA-N 420.513 2.182 10 20 HECD C[C@@H]1CCCCN1[C@H](C)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918007657 QBBSVTIQURUINV-QWFCFKBJSA-N 415.582 2.450 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918295542 QFBGICDKGKVXDP-SFHVURJKSA-N 412.442 2.325 10 20 HECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 919730099 QOYJMOYTCWIUJH-UHFFFAOYSA-N 406.504 2.327 10 20 HECD Cc1cc(C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c(C)n1-c1ccc(F)cc1 1337819822 MWXHKSDJYCKVES-UHFFFAOYSA-N 414.481 2.443 10 20 HECD Cc1cnn(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1796327186 MEIIDQQDRLVZJU-QDMKHBRRSA-N 418.881 2.208 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3CCC(=O)N3)C2)cc1 1842737154 MLMINYRHUBDZGV-FQEVSTJZSA-N 420.513 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(N4CCCS4(=O)=O)cc3)CC2)cc1 15731553 RPBGXGUHUMCRRC-UHFFFAOYSA-N 415.515 2.198 10 20 HECD O=S(=O)(Nc1nc2c(s1)COc1ccccc1-2)c1cccc(-n2cnnn2)c1 727246141 IXRGREXSPXLXQX-UHFFFAOYSA-N 412.456 2.479 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1 727852446 ZOAAOPKVBGBNKS-ZDUSSCGKSA-N 407.467 2.159 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1 729063243 ICXYICDUWCVERI-CQSZACIVSA-N 409.446 2.414 10 20 HECD COc1ccc(N2CCCN([C@@H]3CC(=O)N([C@@H](C)c4cccnc4)C3=O)CC2)cc1 731218801 JSVCBTQLRLWPIL-LAUBAEHRSA-N 408.502 2.491 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2ccccc2F)CC1 736068830 CMPYXPYLLAMPIS-UHFFFAOYSA-N 402.491 2.409 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 741100331 ZSDFIDPBELETMV-OAQYLSRUSA-N 407.470 2.485 10 20 HECD COCC(=O)Nc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958072 JXROLVGIRIFRGU-UHFFFAOYSA-N 411.458 2.111 10 20 HECD O=C(CSc1nnc(S)s1)NCc1ccc(N2CCOCC2)c(F)c1 747361048 IGYGNHOREPTWFE-UHFFFAOYSA-N 400.526 2.211 10 20 HECD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747901837 DRBQKABGPXQVBP-CYBMUJFWSA-N 422.388 2.143 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3cnn(C)c3N)c2C)cc1 749376635 OCKAJVFUYGKDDX-UHFFFAOYSA-N 410.430 2.236 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(=O)N(C)OC)cc1 749629969 WLTHQSGGMIBZFX-UHFFFAOYSA-N 412.490 2.373 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3ccc(C(N)=O)o3)cc2F)C[C@H](C)O1 752003902 CYFUQWABFBSSCP-STQMWFEESA-N 404.442 2.131 10 20 HECD CO[C@@]1(C)C[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 752074231 DWBZHAGWVOGKKM-KNQAVFIVSA-N 407.530 2.414 10 20 HECD Cc1nnccc1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753526015 XUBJNAVGTPAZBF-UHFFFAOYSA-N 401.378 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cccc(F)c3F)CC2)cc1 756490855 SQEGZQMUZYOAOL-UHFFFAOYSA-N 404.413 2.408 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cncc(Br)c1 757172572 FADXDODEMSSEBN-UHFFFAOYSA-N 401.264 2.475 10 20 HECD COCc1nc(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 758578863 XFONHMBGPKRDNF-OAHLLOKOSA-N 402.520 2.230 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(-c4nc[nH]n4)c3)cc2)C1 767299000 PAXBEUMWBBSDBJ-GOSISDBHSA-N 404.474 2.103 10 20 HECD Cc1ncc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 769021905 DAXAWJZCOAZKRO-UHFFFAOYSA-N 413.547 2.238 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c1O 769255566 VXBFLBIKRKGPNA-UHFFFAOYSA-N 412.421 2.348 10 20 HECD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1ccc(N2CCSCC2)cc1 769358487 JBJUDUNHGJCVCB-UHFFFAOYSA-N 408.505 2.408 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)C3CCOCC3)cc2F)C[C@@H](C)O1 775456186 YNAHYSPEEYRHJY-IXDOHACOSA-N 407.530 2.460 10 20 HECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(Cc2cccc(C)c2O)CC1 775639307 SPTWAUFIFZDGNJ-UHFFFAOYSA-N 405.476 2.424 10 20 HECD CN1CCN(c2ccc(CN3CCN(S(C)(=O)=O)c4ccccc4C3)cc2)CC1 775748111 RHXREGUOWLFLKZ-UHFFFAOYSA-N 414.575 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)Cc3cccc(O)c3)CC2)cc1 778388169 CPDHZZYDGCTPDS-DOJUMQAQSA-N 423.513 2.353 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 779547418 KRRIBGVHOYTERA-POHAHGRESA-N 406.460 2.486 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(CCO)C1CCOCC1 780506122 DELSANSJXNJQQE-OAHLLOKOSA-N 413.465 2.440 10 20 HECD CC(C)(C)OC(=O)N(CC(=O)OCC(=O)c1ccc(O)c(O)c1)C[C@@H]1CCCO1 783888235 KAOUNGQKHIWEKG-AWEZNQCLSA-N 409.435 2.240 10 20 HECD COc1cc(Br)cc(CN2CCc3ccc(S(N)(=O)=O)cc32)c1O 792174410 HHGVEQZUVNEHAG-UHFFFAOYSA-N 413.293 2.373 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCN2Cc3ccccc3C2)cc1F 793862159 AGMRFCRJOATAFA-UHFFFAOYSA-N 412.509 2.420 10 20 HECD Cc1cc(Cn2nnc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2C)on1 794247603 TXYAHSWCAHIGOV-OAHLLOKOSA-N 410.478 2.259 10 20 HECD CC(C)(C)[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 800326256 HKTAEZPLPYKPJD-HNNXBMFYSA-N 416.444 2.241 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)c1ccc(N2CCOCC2)cc1 803309931 DVKBQHPAGMVZAY-OBZTUIKSSA-N 415.534 2.020 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC3CCC(OC)CC3)CC2)cc1 804318977 WLHXXXOPCSELJT-UHFFFAOYSA-N 403.523 2.102 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1cnc(Cl)c(F)c1 804958296 RGKYOQXETVEILA-UHFFFAOYSA-N 403.838 2.328 10 20 HECD CC[C@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007906 UOUHEPPRUJSLTR-HKUYNNGSSA-N 404.530 2.279 10 20 HECD CC(C)C[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCO1 808076090 MHQZPYCRYQDZLU-TZIWHRDSSA-N 417.550 2.192 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c[nH]nc3-c3ccccn3)CC2)cc1 809970580 DRUMJOGIUNQSPB-UHFFFAOYSA-N 420.517 2.422 10 20 HECD COc1ccc(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c(O)c1 813553380 BMCOLPRMILDINV-UHFFFAOYSA-N 405.472 2.040 10 20 HECD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)s1 918399162 MRASQOWXZOJNGA-SNVBAGLBSA-N 417.534 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(C(C)=O)cc3)CC2)cc1 919273629 WOUPOXJPLMKPTJ-UHFFFAOYSA-N 410.470 2.332 10 20 HECD CC(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920637231 BSXWRAPJIDQDIJ-GFCCVEGCSA-N 420.443 2.150 10 20 HECD Cc1cccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1842406760 GGAMAEYJNQEVSR-VQHVLOKHSA-N 409.442 2.037 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(C(=O)[C@H]3CCCO3)CC2)cc1F 303378515 VEXRHJSDNBXAPG-LJQANCHMSA-N 406.502 2.205 10 20 HECD COCC(=O)Nc1cccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 550490937 KCWRMYLHYLRJQR-UHFFFAOYSA-N 422.485 2.004 10 20 HECD CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 728022026 KSQBAYCGRQWLJO-YDIVSAOHSA-N 403.548 2.397 10 20 HECD CN(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C(=O)C1CC1 742753798 LJIIDGWGZOLUII-GOSISDBHSA-N 418.538 2.303 10 20 HECD CC[C@@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 746414920 WEPHLHXOARTWBO-OAQYLSRUSA-N 404.555 2.322 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3ccc(OC)nc3)CC2)cc1 747958556 XMJLSRULOOQHKA-UHFFFAOYSA-N 413.522 2.062 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)Cn2cc(Br)c(O)nc2=O)cc1 752760938 YQVPLXAWQMEAKL-UHFFFAOYSA-N 423.311 2.216 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N(C)C)cc2C)cn1 753521457 FRUUTZVQERAXHO-WHLCRQNOSA-N 403.552 2.293 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(-n4cnnn4)c3C)CC2)cc1F 753861867 AMCYTTLYMHSWRW-UHFFFAOYSA-N 411.441 2.473 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3cccc(N(C)C)c3)CC2)cc1 754068613 BYQUDIPFRUVVRP-QHCPKHFHSA-N 412.578 2.376 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cc2)C1 754127470 JVKXVCMWMTYILE-AFYVEPGGSA-N 412.534 2.145 10 20 HECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 759028203 RVHBHWACIIFYOG-UHFFFAOYSA-N 405.401 2.065 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)c1 760105306 RDCLOGCLNSFAAT-ZFWWWQNUSA-N 400.431 2.384 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cn(C)c(Cl)n3)n2)o1 764527675 PKCWYVDAGFEJIW-UHFFFAOYSA-N 415.884 2.227 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CCSC)NS(=O)(=O)CC 764896431 ZXAIUACHRQTMMK-QGZVFWFLSA-N 401.598 2.162 10 20 HECD CCOC(=O)[C@H]1CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767026007 DDQIEOFKNRKQPN-GOSISDBHSA-N 406.438 2.428 10 20 HECD CCn1nccc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 772947173 FOEIMXDWGBUUSO-UHFFFAOYSA-N 409.469 2.089 10 20 HECD CCCc1cc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)n(C)n1 778420555 XAIODEINWCAHBV-KHPPLWFESA-N 411.506 2.225 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc4c3O[C@@H](C)C(=O)N4)c2)CC1 781279024 WBYWPNSNLIDIBL-AWEZNQCLSA-N 408.458 2.327 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cnc1Br 785303778 LBOYTFYLCRXOSG-JTQLQIEISA-N 408.252 2.250 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cccc(N2CCCC2=O)c1 785423638 DUHJRILRKNMXNI-INIZCTEOSA-N 408.502 2.373 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccccc3Cl)CC2)cc1 785440790 CNHOTFXQLLSHTF-UHFFFAOYSA-N 414.937 2.367 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1(c2ccccc2)CC1 785863817 JPDTUQDIHQJSEE-UHFFFAOYSA-N 411.477 2.127 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cn2cc(Cl)ccc2n1 786502907 MEEOVROEFMNAON-UHFFFAOYSA-N 409.877 2.297 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 788459759 LUGISEXNBAAVOW-GOSISDBHSA-N 424.545 2.078 10 20 HECD O=C(Nc1cnns1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 789910700 JGRPUTRGIHDIBF-UHFFFAOYSA-N 421.416 2.205 10 20 HECD COc1ccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(O)c1 794369613 IHFAZFGJYVMWMI-KSZLIROESA-N 400.475 2.383 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)NCCCN3C(=O)CNC3=O)cc2Cl)C1 799923483 MLQSPXHBGKRDLW-AWEZNQCLSA-N 421.929 2.317 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(C(=O)C(C)C)CC2)cc1F 804854102 YFKXBJQLKRKKAY-UHFFFAOYSA-N 420.529 2.005 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(N(C)C)nc3)cc2F)C[C@@H](C)O1 804958021 GPTMNXUUUIIMKP-HUUCEWRRSA-N 422.526 2.379 10 20 HECD COc1ccc(CN2CC[C@@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2=O)c(OC)c1 805442260 RVOIZISOHBUZBH-IOMDMTNGSA-N 412.442 2.046 10 20 HECD COC[C@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 806779970 UOXOLIVMJNLGHX-IBGZPJMESA-N 415.490 2.139 10 20 HECD CN(c1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(Cl)c2nonc12 814390079 RMHCTNUBQGOQIJ-UHFFFAOYSA-N 401.853 2.105 10 20 HECD CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 817944170 YJYXHUDUIVWHFA-UHFFFAOYSA-N 423.432 2.419 10 20 HECD CS(=O)(=O)NCCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 915775687 WHWVUTZROFTRLO-UHFFFAOYSA-N 403.464 2.096 10 20 HECD CNC(=O)c1ccc(OC)c(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 916680302 GEAPLTOZOWKEKQ-UHFFFAOYSA-N 416.453 2.352 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1 918435043 YXCIFYLJEPXFMH-UHFFFAOYSA-N 407.478 2.072 10 20 HECD COc1cc([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(OC)c1OC 919815608 PKTPJAXILODSJX-NSHDSACASA-N 424.475 2.281 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)c1 1322899512 ZTWXHNKEAHODGS-VIFPVBQESA-N 412.851 2.425 10 20 HECD COC(=O)c1ccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)o1 1340731441 GIQGWNNOJOXJNK-UHFFFAOYSA-N 401.463 2.017 10 20 HECD CCCCC[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1783225441 OJQZLVOSZDOEKV-QVKFZJNVSA-N 405.495 2.153 10 20 HECD C[C@@H](Cc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802733706 ZFQPANZQMFSXAZ-RUGDWHBFSA-N 410.474 2.018 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3coc(Cl)n3)C2)CC1 1807627609 QULHKSADFJBQLG-UHFFFAOYSA-N 420.853 2.293 10 20 HECD Cc1cnoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846378 UPDLZTLKABKORR-CYBMUJFWSA-N 412.406 2.132 10 20 HECD COC(=O)c1sccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 23403779 WFPZNWKXYXXRBX-UHFFFAOYSA-N 410.517 2.192 10 20 HECD C[C@@H]1CCc2ccccc2N1C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 138536987 HRACQPUPYUPFBM-CYBMUJFWSA-N 418.471 2.288 10 20 HECD CCN(C)C(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 729179148 XUAXRPQXKCHITG-HXUWFJFHSA-N 422.529 2.410 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CC(=O)OC)CC3)cc2F)CC1 730133508 WJRFZIIIBYBARO-UHFFFAOYSA-N 420.529 2.452 10 20 HECD C[C@H](NC(=O)N1CCC[C@@H](N2CCCC2=O)C1)c1ccc(N2CCOCC2)cc1 732243937 WIQCDEJOGFFDCQ-FXAWDEMLSA-N 400.523 2.381 10 20 HECD CCc1nc(CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cs1 738307834 AZYVMDJJXFCKKE-UHFFFAOYSA-N 401.580 2.206 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594393 ULIAIDZEEBEBGN-VDZJLULYSA-N 424.492 2.419 10 20 HECD C[C@H]1C[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C(=O)N1c1cnn(C)c1 745919908 XHZDDXOPXFZDFT-MGPUTAFESA-N 410.522 2.354 10 20 HECD Cc1nncn1CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 746606536 GFFVYHMYPOYOGM-UVTDQMKNSA-N 421.573 2.446 10 20 HECD C[C@]1(c2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)NC(=O)NC1=O 748041336 YJSBQZNMMFSUAP-FDDCHVKYSA-N 423.469 2.268 10 20 HECD CCOC(=O)N1CCCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 748460003 GGLFNHUTMLVINK-KRWDZBQOSA-N 404.511 2.458 10 20 HECD Cc1occc1-c1nnc(SCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1N 748585202 DASLFMPGYNOMOC-UHFFFAOYSA-N 400.508 2.377 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN3CCS(=O)(=O)CC3)c2C)c1 749355745 VDMMUCLTFWLWMR-UHFFFAOYSA-N 403.548 2.171 10 20 HECD COC(=O)C[C@@H]1CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 749466007 PIHWWJROKXQTPY-JZXOWHBKSA-N 421.513 2.083 10 20 HECD COc1cc(C)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1 751213725 WJPKBHKDOYUPFI-UHFFFAOYSA-N 424.544 2.348 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 755228611 VUVJZJLUAZEBPG-UHFFFAOYSA-N 410.453 2.425 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(CC(C)C)c3CC)nc12 756366721 IAXLOWSAHXBRKJ-UHFFFAOYSA-N 415.450 2.384 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCC(O)(c3ccccc3)CC2)c1 760996854 ZPBSEHILQKSKQJ-UHFFFAOYSA-N 404.488 2.324 10 20 HECD NC(=O)COc1cccc(CNC(=O)NCc2cccc(Br)c2O)c1 765524961 CZBRRXCMULNJFD-UHFFFAOYSA-N 408.252 2.018 10 20 HECD O=C(NCc1ccncc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774114787 BMARFOLLZISDSV-UHFFFAOYSA-N 404.417 2.084 10 20 HECD COC(=O)[C@H](C)NC(=O)c1ccc(NCc2cccc(OC)c2O)c([N+](=O)[O-])c1 774523692 HPXGSBFFIUTOGW-NSHDSACASA-N 403.391 2.212 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](Cc1ccccc1)N(C)C 774917230 GJSWUDLQOVOYQL-JOCHJYFZSA-N 410.562 2.390 10 20 HECD COCCCN(C(=O)/C=C\c1scnc1C)c1c(O)nc(=O)n(CC(C)C)c1N 776742120 DCDJCHXJCCPYJM-SREVYHEPSA-N 421.523 2.035 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1 778602863 BFLDQOJINQSDPB-JTQLQIEISA-N 401.394 2.241 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)cc1 785428656 QPVBXJVORVRMKJ-JOCHJYFZSA-N 418.538 2.132 10 20 HECD COc1cc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(OC)c1OC 785481635 ITUDMJGAOVISPD-UHFFFAOYSA-N 415.490 2.053 10 20 HECD C[C@H](c1cccnc1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788932505 OIIMDSAFPQTIPH-LJQANCHMSA-N 421.545 2.203 10 20 HECD CS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789800780 PVFJZTQIAXSVHA-MRXNPFEDSA-N 409.527 2.023 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3C[C@@H](C)O[C@H](C)C3)cc2F)C[C@@H](C)O1 789835535 PORHZDDRYZIMOJ-FPCVCCKLSA-N 421.513 2.128 10 20 HECD C[C@H]1C[C@@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1C 789844400 HAZXPBXRPKMQAB-OWCLPIDISA-N 405.514 2.296 10 20 HECD COc1ccc(CNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c(O)c1 792829410 OJRJYJOJCFTRBJ-UHFFFAOYSA-N 412.534 2.408 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N(CCO)Cc1cccnc1Cl 792881466 JHZKKRGZNPYBQB-UHFFFAOYSA-N 422.888 2.415 10 20 HECD CN1CCCN(S(=O)(=O)c2cccc(NCc3cc([N+](=O)[O-])ccc3O)c2)CC1 796431429 YEDSPIWACNUIPU-UHFFFAOYSA-N 420.491 2.239 10 20 HECD COC(C)(C)C(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 798659443 SJJDFHPGIDRVOX-UHFFFAOYSA-N 413.473 2.405 10 20 HECD CS(=O)(=O)[C@H]1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 800709104 ACAYEPNDKVLJRJ-BBRMVZONSA-N 417.478 2.085 10 20 HECD C[C@H](NC(=O)C(=O)NCC(C)(C)[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803305348 LLGJTGOOCRJPSE-PXNSSMCTSA-N 417.550 2.412 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1c(C)noc1C 805168181 DCSWTKGXBLEOEW-UHFFFAOYSA-N 424.295 2.467 10 20 HECD CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCc4ccc(N5CCC(O)CC5)c(F)c4)[C@H]1[C@H]3C2 806457859 SMDKQICCJHNSNM-ALBMSPKDSA-N 403.498 2.352 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@H](C)C2)c1 808484256 NJJBEFKONUHAMG-NSHDSACASA-N 401.868 2.076 10 20 HECD COc1ccc(O)c(CNc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1 809679810 LRQMPYSYHMRZFS-UHFFFAOYSA-N 408.476 2.042 10 20 HECD CN(C)c1ccc(CN(CCN)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1F 809728454 XTVQDICOTSRXRF-UHFFFAOYSA-N 410.471 2.169 10 20 HECD CNS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)c1 811703489 SPHZMRAVPSZFAJ-UHFFFAOYSA-N 414.505 2.026 10 20 HECD CO[C@](C)(C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 812656127 GNVURERTNLQZBH-HLFMIMNKSA-N 422.497 2.414 10 20 HECD C[C@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccc(Cl)c2nonc12 814378847 VHRQXFFIOYQNJH-ONGXEEELSA-N 406.851 2.433 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C(F)(F)F)nn3C)cc2)CC1 857493957 GQRPJHRJWGESHQ-UHFFFAOYSA-N 409.412 2.037 10 20 HECD O=C(NCc1ccc(-n2cncn2)nc1)N(Cc1ccccc1O)C[C@H]1CCCO1 916395487 LDRGVTYTCPMQKU-GOSISDBHSA-N 408.462 2.259 10 20 HECD CCSc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccn1 919749907 FSTYVCPHKAFPGY-UHFFFAOYSA-N 405.545 2.358 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2c(F)cc(F)c(F)c2F)cc1F 1321676336 DXKJLSBJSCUQEB-UHFFFAOYSA-N 401.335 2.381 10 20 HECD CC[C@H](C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1793183216 KMZUNQJVDIEMHK-NASWQRNTSA-N 410.898 2.391 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)C(F)F 1816839694 AVYUWVNEHUXLMK-HOSRBBHYSA-N 422.388 2.497 10 20 HECD O=C(c1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427384 XILCAGNSVPCDNE-INIZCTEOSA-N 416.503 2.496 10 20 HECD COc1ccc([C@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843249102 WPJQNFZBSKOHMW-MSOLQXFVSA-N 423.469 2.122 10 20 HECD COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc(OC)cc3)CC2)cc1 2940720 KEUVHGRJVLRHJO-UHFFFAOYSA-N 418.515 2.216 10 20 HECD CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 7229077 ZYGIKNVFVDIBNB-QFIPXVFZSA-N 412.465 2.365 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-c2ccccn2)[nH]c1=O 116156131 RUAUXTKNMBVJIU-UHFFFAOYSA-N 408.433 2.343 10 20 HECD COc1cccc2cc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)oc12 727178366 VZVPDAWCEHRDBR-LCYFTJDESA-N 412.514 2.192 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c1O 729859211 MKTIWTCNZUEFAR-JOCHJYFZSA-N 409.442 2.016 10 20 HECD COc1cccc(CNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)c1O 731812309 ZVQKDVPAXSUEJJ-UHFFFAOYSA-N 407.474 2.208 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 734017029 XVCUYWMKCKRXGW-CYBMUJFWSA-N 405.432 2.292 10 20 HECD Cc1cc(C(=O)CN2CCN(C[C@H](C)O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 739391973 OLNKCEMRJRBEKE-KRWDZBQOSA-N 413.518 2.046 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CCO)c3cccs3)CC2)cc1 741083599 UNHIRYRAWRFHDQ-LJQANCHMSA-N 418.563 2.302 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 742283903 JOWOKJAVNQYPIA-CYBMUJFWSA-N 410.517 2.411 10 20 HECD COC(=O)Cn1ccc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 743165112 BZDPERQIBDIBIP-ZIAGYGMSSA-N 419.457 2.131 10 20 HECD COC(=O)c1csc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 749257464 WECGWPOTZUXPLG-ZDUSSCGKSA-N 410.517 2.411 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H]1[C@@H](O)C(F)(F)F 750638724 PREQFLHYONUZIJ-DLBZAZTESA-N 419.419 2.384 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)(C)CN(C)C 754357576 RWHOOIVWKJDBFH-FUHWJXTLSA-N 403.571 2.164 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(-n4ccnc4)cc3)CC2)cc1 758226046 XANHHNOEXNGFBZ-NRFANRHFSA-N 408.502 2.443 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 762267344 FPAJYLWCISNIJF-GFCCVEGCSA-N 405.432 2.031 10 20 HECD O=S(=O)(Nc1ccc(F)c(-n2nnnc2C2CC2)c1)c1cccc2nonc12 765097488 IEHGQIGOCOOPFQ-UHFFFAOYSA-N 401.383 2.016 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2COC(=O)C2)NC(=O)OC(C)(C)C)cc1 765684576 PGBKDEGRKDZLSZ-WMLDXEAASA-N 405.495 2.388 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)s1 766199800 IZPLDTAWSIPVHX-UHFFFAOYSA-N 419.322 2.331 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773084285 NQNQLRPMAAJMPT-LBPRGKRZSA-N 400.497 2.335 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21 784023588 DZFPPRVBQKKBBC-LJQANCHMSA-N 412.442 2.098 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCc2nn[nH]c2C1 787080799 YFVKCLZIWIZKJA-ZROIWOOFSA-N 419.557 2.433 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCc3c2cnn3C)cc1F 789587759 JWQDMXOJBBLIOT-KRWDZBQOSA-N 401.486 2.215 10 20 HECD O=C(c1c(F)ccc(O)c1O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 789955154 QURVGQSWMKSVTC-UHFFFAOYSA-N 420.871 2.099 10 20 HECD Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 797531896 ACIBXOXYELDHHM-UHFFFAOYSA-N 414.481 2.292 10 20 HECD CN(C)CC1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 799038426 PERSOFJJEZKBMQ-UHFFFAOYSA-N 409.533 2.469 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](OCCOC)C3)cc2F)CC1 802126362 QZVXOZRITUQGEI-LJQANCHMSA-N 422.545 2.305 10 20 HECD COCCc1ccnc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 804388071 NCGDHDQYFNVMOD-BQYQJAHWSA-N 424.501 2.123 10 20 HECD COC(=O)N1CCC(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 805834506 QTNRIFLFELFZDH-UHFFFAOYSA-N 404.511 2.442 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 806276649 HQRJEVYWCVMYSH-CYBMUJFWSA-N 420.564 2.143 10 20 HECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1[C@@H]1CCCO1 810024843 TWIVFYPQMSJHQJ-FPOVZHCZSA-N 405.514 2.168 10 20 HECD COc1ccc(N2CCCN(C(=O)CNS(=O)(=O)c3ccc(C)cc3)CC2)cc1 810180997 SNGXYVOVKZSXHU-UHFFFAOYSA-N 417.531 2.021 10 20 HECD COc1ccc(N2CCC(NC[C@@H](O)CS(=O)(=O)c3cccs3)CC2)cc1 812839654 FIIKABWXGJVGRI-QGZVFWFLSA-N 410.561 2.150 10 20 HECD CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 857555066 MCUBIULRDAANTF-SFHVURJKSA-N 417.531 2.153 10 20 HECD Cc1c(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cccc1-n1cnnn1 915317251 KSRKGLJIYMXACN-UHFFFAOYSA-N 407.478 2.471 10 20 HECD CCCCN(C)C(=O)C1CCN(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)CC1 917159619 AYPICDSCUNMGSP-UHFFFAOYSA-N 417.510 2.082 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(=O)n(Cc2ccccc2)n1 917707741 ZKPFXYXZAZQPEM-UHFFFAOYSA-N 422.460 2.197 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1-n1cnnn1 918456975 PZLSBMDUYOZWJE-UHFFFAOYSA-N 419.489 2.166 10 20 HECD NC(=O)[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 918601786 JHVVMCYYYBBNIM-KWJWQAOWSA-N 409.558 2.063 10 20 HECD O=C1c2ccccc2C(=O)N1CC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 1116441064 GROOWTRWJUXYIM-FQEVSTJZSA-N 408.454 2.326 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CCCCO1 1814505070 IJWKLJZKNSTWPJ-HUUCEWRRSA-N 415.450 2.091 10 20 HECD O=C([C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424841 PSJZUROQBSCXKY-QZTJIDSGSA-N 417.506 2.295 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 6980132 PVWQZXDOTSJKTE-UHFFFAOYSA-N 417.531 2.046 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc12 725828860 MGHAUYISOKSCKL-CQSZACIVSA-N 415.519 2.153 10 20 HECD O=C(CN1CCC[C@@H](C2OCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 726375896 KXGOIBSITCZCJH-OAHLLOKOSA-N 420.465 2.485 10 20 HECD COC(=O)c1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C=O)c1 726742006 FXKXTORBBPLGDO-UHFFFAOYSA-N 412.442 2.022 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CC[C@@H]2NC(=O)NC2=O)cc1 732114666 KIPNURZRHIXBSW-IBGZPJMESA-N 410.474 2.283 10 20 HECD O=C1CCCN1C[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 732450255 PXPYBIWAWGGPGH-SFHVURJKSA-N 418.513 2.349 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)cc2)C1 743895308 KYZYEJIGQHATIQ-KRWDZBQOSA-N 419.485 2.125 10 20 HECD CC[C@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 746414917 WEPHLHXOARTWBO-NRFANRHFSA-N 404.555 2.322 10 20 HECD CC(C)NS(=O)(=O)CCNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 746974035 XWDZHJZUKKLGSH-UHFFFAOYSA-N 422.551 2.385 10 20 HECD CCn1c(=O)n(CC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c2ccccc21 753740010 XVZWMPHBRFCGMS-UHFFFAOYSA-N 412.465 2.319 10 20 HECD O=C(CCSc1ccccn1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 755199361 RLAKXZPJCANSLB-UHFFFAOYSA-N 405.545 2.115 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(F)cc3F)CC2)cc1 756615383 BEXAFFAEMDBSPF-UHFFFAOYSA-N 404.413 2.408 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C[C@@H]3CCOC3)CC2)cc1 759767713 WVQCPZNJNSHEQJ-OALUTQOASA-N 404.555 2.322 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1OCC(F)F 762424592 LZRVIIPVWQIRCE-UHFFFAOYSA-N 419.428 2.422 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN4C(=O)OC[C@H]4C3)c2C)cc1 763715117 PQMWJGLPRUNDDZ-GOSISDBHSA-N 411.458 2.200 10 20 HECD Cc1cc(CC(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c(C)n1-c1ccc(Cl)cc1 764511874 CGZNBGOCKPEJDO-QGZVFWFLSA-N 400.866 2.053 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1F 768155041 COEUHGUHFGKPMT-UHFFFAOYSA-N 422.482 2.306 10 20 HECD CNC(=O)COc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 772067937 FSNGSIXGSBXFMS-KRWDZBQOSA-N 411.502 2.068 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2ccccc2OCC(=O)N2CCOCC2)c1O 774938964 RVHVBYSXLQNWMR-UHFFFAOYSA-N 417.418 2.159 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c(F)cc2N1 778619124 UCFVCQSUNLDKOD-UHFFFAOYSA-N 408.433 2.342 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1 778926701 FKHCPKYLUHZNSR-AWEZNQCLSA-N 404.850 2.295 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cnc(-c2ccccc2)nc1 780718073 GELRISXQCJOTMR-UHFFFAOYSA-N 410.499 2.459 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 781522097 ZDOOUVVAIHQSKB-UHFFFAOYSA-N 409.442 2.113 10 20 HECD COc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1-n1cnnn1 782017750 CAZNXVZDGZSTBJ-KRWDZBQOSA-N 409.446 2.198 10 20 HECD Cc1csc2c(=O)n(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc12 783080690 QKLFDRJIAMOFKW-UHFFFAOYSA-N 416.478 2.059 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)N3CCc4ccccc4C3)cc2)CC1 787321751 IXIDZUICNVSROB-LJQANCHMSA-N 420.557 2.418 10 20 HECD C[C@@H](c1cccnc1)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788932503 OIIMDSAFPQTIPH-IBGZPJMESA-N 421.545 2.203 10 20 HECD CC1(C)CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789843432 LCWXFZHZSUKWAI-MRXNPFEDSA-N 405.514 2.488 10 20 HECD O=C(Nc1cccc(N2CCC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 790910880 DFTNGUGCPXESNZ-LJQANCHMSA-N 423.469 2.275 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 792209779 IVFNEMHRAVYPMP-UHFFFAOYSA-N 405.458 2.118 10 20 HECD CC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793733248 LVQCQOJLISUFSK-IEBWSBKVSA-N 414.550 2.043 10 20 HECD COc1ccc(CNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)OC)c2)c(O)c1 794377859 LPSLILQWPNZYSW-UHFFFAOYSA-N 414.867 2.166 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ccccc21 803665018 RSFKBDAFUFJAAB-GOSISDBHSA-N 412.465 2.122 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(C(=O)N(C)C)CCCC2)cc1F 804851905 RSYQJPGXEGIDRR-UHFFFAOYSA-N 420.529 2.053 10 20 HECD C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nncn1C 805539839 COQPQUVCTDHMJV-JTQLQIEISA-N 408.461 2.301 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3nc(C)c(C)s3)CC2)cc1 807332776 FHIZEBXLVWBCRA-UHFFFAOYSA-N 416.547 2.166 10 20 HECD C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807671470 PMLAELNXABQNHP-JKSUJKDBSA-N 418.538 2.398 10 20 HECD C[C@H]1C[C@@H](C)CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808855256 VJCDSENLPDEHKD-KDURUIRLSA-N 412.578 2.339 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(C)[C@@H]3[C@@H]3CCCO3)CC2)cc1 810024776 RHVOWGWURRQACX-BVSLBCMMSA-N 403.567 2.068 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3noc(COC(C)C)n3)CC2)cc1 810119867 XJTUUWWWYOHSIX-MRXNPFEDSA-N 417.510 2.003 10 20 HECD Cc1nn(C)c2ncc(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)cc12 918456948 PPEFVQCSAHDGDJ-UHFFFAOYSA-N 406.490 2.472 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 920196461 VRFIDBJVICYIFJ-UHFFFAOYSA-N 422.485 2.127 10 20 HECD C[C@H](OC(=O)[C@]1(F)CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1117344685 CIQQFIFPDNJBMN-YTEVENLXSA-N 411.385 2.461 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C(F)(F)F)n[nH]c1C 1320519244 DGJJISZHSHJMKX-JTQLQIEISA-N 401.341 2.052 10 20 HECD Cc1nccn1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718964 NIEUTTANTHCRAZ-QDMKHBRRSA-N 418.881 2.208 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccn1 1846619783 ILYMNUYZKGNRKD-GFCCVEGCSA-N 404.854 2.026 10 20 HECD O=C1C[C@@H](NCc2ccc(N3CCOCC3)c(F)c2)CN1CCOc1ccccc1 237866832 CEKUBDFHWKSQGN-LJQANCHMSA-N 413.493 2.432 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCCS(=O)(=O)NCC3CCC3)cc2)CC1 303401383 OZQXSNJSUDTGDF-UHFFFAOYSA-N 422.595 2.442 10 20 HECD Cc1nnc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1C 733151536 FTRJUFUZKOXJFL-LCYFTJDESA-N 421.573 2.483 10 20 HECD COCC(=O)N[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 742799123 GQMWLRCXQXTZGR-KSSFIOAISA-N 413.465 2.160 10 20 HECD O=C(NC[C@@]1(O)CCSC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 747587021 RPQYOZDONPFLQL-SFHVURJKSA-N 401.479 2.424 10 20 HECD COc1ccc(-c2nnn(CC(=O)N(C)Cc3ccc(N(C)C)cc3)n2)cc1OC 749499583 SCPNKMDPIDGQTM-UHFFFAOYSA-N 410.478 2.082 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1O 750816935 DHFILLVRXRWOJA-UHFFFAOYSA-N 417.462 2.001 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4nc(C)c(C)s4)CC3)nc12 754350199 ZCRKSMOLHWUZOO-UHFFFAOYSA-N 416.507 2.007 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCCO[C@H]1CCOC1)c2[N+](=O)[O-] 757426697 YXDGHHTXIYXCKM-ZDUSSCGKSA-N 424.409 2.296 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@H](c4ccccc4)N(C)C3=O)CC2)cc1 761187544 WBDXGQDOIYVLLQ-NRFANRHFSA-N 408.502 2.453 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765014974 ZBZNASOBQITZNT-UHFFFAOYSA-N 410.477 2.054 10 20 HECD COc1cc(OC)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 767834977 BMYUBIHDPDUVOQ-UHFFFAOYSA-N 410.467 2.158 10 20 HECD COC[C@@H]1CCCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 768255766 IYMNNAHXZBXFLV-MOPGFXCFSA-N 402.539 2.346 10 20 HECD COCCCS(=O)(=O)N1CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 769843972 BPKLVCANIWHJJA-UHFFFAOYSA-N 408.520 2.038 10 20 HECD COCC1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CC1 770016669 PVFASOHMDHTWIK-UHFFFAOYSA-N 421.431 2.010 10 20 HECD Cc1cc(F)cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 770604130 WLPDWNAUKYOOIP-MRXNPFEDSA-N 412.465 2.091 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3O)CC2)cc(OC)c1OC 774028563 GSKCRKIZKMNQNO-UHFFFAOYSA-N 417.418 2.289 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1 776348672 CIXRMERMJQKEIM-KRWDZBQOSA-N 404.467 2.359 10 20 HECD CO[C@H]1Cc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc2C1 784689653 KALCAXBIKDZRJR-AOMKIAJQSA-N 423.513 2.453 10 20 HECD COc1ccc(C(C)=O)cc1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786261303 AHIAENMDIXVMTF-UHFFFAOYSA-N 423.513 2.425 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1coc(C2CCOCC2)n1 786717547 PHXXWZRRIBBMOC-UHFFFAOYSA-N 401.463 2.450 10 20 HECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 788008667 QXMSBYJBRMXZNL-UHFFFAOYSA-N 416.566 2.221 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)cc1 788928267 CWUZZNUILNTLKD-SJORKVTESA-N 402.539 2.055 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2nn(C)c3ccccc23)cc1 788978534 ZWVWVGJLJPOFSV-UHFFFAOYSA-N 407.518 2.395 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccn(CC(F)F)n3)CC2)cc1 789875632 WQTMLOBFWQSXIF-UHFFFAOYSA-N 407.465 2.099 10 20 HECD COCCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CC[C@H](C)C1 792466435 WTJDYLWBQNEIQK-ILWGZMRPSA-N 405.583 2.315 10 20 HECD CC(=O)Nc1ccc(NC(=S)NNc2ccccc2S(=O)(=O)N(C)C)cc1 793324766 BXTHMLWJJSUMAA-UHFFFAOYSA-N 407.521 2.209 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CC=CCC3)cc2F)CC1 793819267 MXUKFMYXPKRGKY-KRWDZBQOSA-N 402.514 2.056 10 20 HECD Cc1nn(CCS(C)(=O)=O)c(C)c1CN[C@@H](C)c1ccc(N2CCOCC2)cc1 797977562 UFFBKVXJPABVQV-INIZCTEOSA-N 420.579 2.232 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN(c2nccs2)CC1 798386313 PGCUELPOKHHNSV-UHFFFAOYSA-N 401.536 2.448 10 20 HECD CC1=C(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@@H](C)n2ncnc2N1C 798968077 AIONNMZZQBHRJO-MRXNPFEDSA-N 410.522 2.088 10 20 HECD Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 799262907 MIYJBOHYSCNUJT-CQSZACIVSA-N 408.458 2.493 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H](CN4CCOCC4)C3)CC2)cc1 802091852 WYJNAEFYMKAXFU-LJQANCHMSA-N 416.566 2.418 10 20 HECD C[C@H](NC(=O)C(=O)NCC[C@@H]1CCO[C@H](C)C1)c1ccc(N2CCOCC2)cc1 803298814 XAKAMGHWSKQTEI-FGTMMUONSA-N 403.523 2.022 10 20 HECD CC(C)[C@H]1C[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803300108 PLBZSIOWWLHMEM-XKGZKEIXSA-N 403.523 2.020 10 20 HECD Cc1cc(C(=O)NC[C@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1ccccn1 804498715 RROCXTZZYSXSPI-SJLPKXTDSA-N 404.536 2.327 10 20 HECD CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(C(=O)NCc2ccc(N4CCC(O)CC4)c(F)c2)[C@H]31 806457862 SMDKQICCJHNSNM-ROIJKSTQSA-N 403.498 2.352 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2 807097616 OHGYCFBGSASUQX-WOJBJXKFSA-N 407.518 2.258 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807674156 HGMULMHCRBNAJK-DYESRHJHSA-N 422.529 2.237 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1CN1C[C@@H](C)O[C@H](C)C1)c1ccc(N(C)C)cc1 807674744 QCNFSGLSDRFSCD-WIRSXHRWSA-N 416.566 2.030 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 808283379 IUIOQPBEIVFNKD-KBPBESRZSA-N 416.515 2.058 10 20 HECD COc1ccc(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)n1 811866102 FIYIZRKDWOIVIP-OAHLLOKOSA-N 400.479 2.496 10 20 HECD CN(C/C=C/C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC(F)(F)F 815730256 BMZNLCNGBYKCIN-NSCUHMNNSA-N 403.420 2.453 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCCC[C@@H]3N(C)C)CC2)cc(OC)c1OC 1116594739 NAMBYDVAXDRVCA-ROUUACIJSA-N 420.554 2.417 10 20 HECD C[C@@H]1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H](n2cncn2)C1 1261582492 VELQSRYJJJOLFD-AHRSYUTCSA-N 403.552 2.032 10 20 HECD O=C(NCCN1C(=O)COc2ccccc21)NCc1cccc(Br)c1O 1321978935 NFJGAHCFYZCDLZ-UHFFFAOYSA-N 420.263 2.380 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=CCCC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242035 HUHVOZBLJRPWQT-YEWWUXTCSA-N 420.893 2.455 10 20 HECD Cc1cncc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1794345463 IRUZGCQNXWRIJO-BCDXTJNWSA-N 410.474 2.081 10 20 HECD Cc1cnc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796599278 JXCZYSIRWFUZLE-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)Cl)CC2)c1cc(O)nc(O)c1 1816728870 XJGGAGIKFUOQBY-ZETCQYMHSA-N 418.809 2.007 10 20 HECD COCCNC(=O)CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 71853236 RJZMKZYIPJQLFN-UHFFFAOYSA-N 408.296 2.349 10 20 HECD CNC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 732207009 KANKKKRSNAJIIF-HUUCEWRRSA-N 419.481 2.247 10 20 HECD COCC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 732811256 PTTPEMOLLUIOEN-IAGOWNOFSA-N 407.530 2.414 10 20 HECD CCOC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 733848691 QEPGEISPMAPUOU-MOPGFXCFSA-N 402.539 2.346 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1 734501557 GPDBZXGZNYUDAD-UHFFFAOYSA-N 417.531 2.012 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2 734687636 NKGPCWGVLIKRQZ-QGZVFWFLSA-N 401.463 2.029 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](N4CCCC4)CC3)CC2)cc1 738336197 ZYUFTDMCSKGDHR-FQEVSTJZSA-N 400.567 2.294 10 20 HECD O=C(CSc1nnnn1C1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742802046 WCFDEDSTYVUGKG-LBPRGKRZSA-N 424.477 2.487 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)C1 751097459 KOKBEIWBAMMNPV-AWEZNQCLSA-N 400.410 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(C)c(NS(C)(=O)=O)c3)CC2)cc1F 753742083 MRCARAOXOQUXHT-UHFFFAOYSA-N 421.494 2.477 10 20 HECD COc1cc(N2CCN(C(=O)c3ccnc(-n4ccnc4)c3)CC2)cc(OC)c1OC 760088658 XZNVMPIWNNWEJD-UHFFFAOYSA-N 423.473 2.256 10 20 HECD COc1cccc(-n2c(C)nnc2SCC(=O)NCCc2ccc(O)c(O)c2)c1 762262631 ZWOIZBSCPFHPIV-UHFFFAOYSA-N 414.487 2.447 10 20 HECD Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NS(=O)(=O)c1cccc2nonc12 765058789 YNPFKGLBFFYRRH-UHFFFAOYSA-N 424.504 2.361 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCN3C(=O)CC[C@@H]3C2)c([N+](=O)[O-])c1Br 765658489 VDCNUDITEUOWLR-MRVPVSSYSA-N 415.200 2.085 10 20 HECD O=C(CSc1nnnn1C1CC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768911583 FVMJCAHVCYBTTB-AWEZNQCLSA-N 422.942 2.240 10 20 HECD COCCC(=O)N1CCC(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 769163562 CHBSETFYOKAJEZ-IBGZPJMESA-N 419.522 2.110 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(C)cc(F)c3)CC2)cc1 770601316 IYZJRCKPYIITDY-UHFFFAOYSA-N 414.481 2.020 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 773767444 MFKQCQHDAKZTBZ-SNVBAGLBSA-N 407.810 2.137 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1C 774753167 IITNFCZLUIBAOF-CLCXKQKWSA-N 405.514 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3cccs3)cc2F)C[C@@H](C)O1 775098782 FZSPQKFWHJMODE-GASCZTMLSA-N 419.522 2.476 10 20 HECD COc1ccc2nc(NN/C=C3\C(=O)NC(=S)N(CC(C)C)C3=O)c(C)cc2c1 777870019 ASVCJOZUWINKIS-OQLLNIDSSA-N 413.503 2.252 10 20 HECD CO[C@H](C)CCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 782437063 LAMOCJFWIMEWRZ-PMPSAXMXSA-N 410.486 2.414 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCOc3ccccc3)CC2)cc1 785589437 XTOYELRJVQLRTG-UHFFFAOYSA-N 411.502 2.319 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C 785597727 GZLPYKGCBDOJNA-FQEVSTJZSA-N 405.502 2.350 10 20 HECD COc1ccc([C@H](CO)N(C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788932276 MQURIYZXLKFWOI-NRFANRHFSA-N 411.502 2.104 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc4c(s3)CCC4)CC2)cc1F 789622139 LHFGGEMVMBYXMD-UHFFFAOYSA-N 404.467 2.067 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@]3(C)CCCS3)cc2F)C[C@@H](C)O1 789837371 ZBJODIBESJBFTO-ZSDSOXJFSA-N 423.554 2.457 10 20 HECD CC(C)OC(=O)CC[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 792043439 FHKUMHVOGYUKIL-FUHWJXTLSA-N 418.538 2.308 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@@H](N3CCCC3)C[C@H]2C)c1 795707139 YABCXUXRWPQKOG-VGSWGCGISA-N 401.551 2.486 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 798254141 FDGRMRVBFSHCPZ-UHFFFAOYSA-N 404.536 2.061 10 20 HECD CN(C)c1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ccccc2n1 803662767 GZNQSVURQAQIMH-UHFFFAOYSA-N 423.492 2.439 10 20 HECD CCc1cnc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 804317686 MHYXIARCCVKEJC-UHFFFAOYSA-N 416.547 2.158 10 20 HECD CCOC1CC2(CCN(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)C2)C1 805014054 OHUVFJPVWBXJGI-UHFFFAOYSA-N 416.566 2.418 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1nncn1C 805766476 KNGAQAXBEYAIBR-LJQANCHMSA-N 400.527 2.220 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C12CCC2 807609269 LJLSHDFPNCDGSY-YZGWKJHDSA-N 416.518 2.364 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccccc3F)cc2)C1 918001242 HNLHTPCKUVJIHW-KRWDZBQOSA-N 414.481 2.406 10 20 HECD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)s1 919729765 HJPYHBBXWARTPZ-CQSZACIVSA-N 423.560 2.260 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cnccn1)c1cc(O)c(O)c(Cl)c1 1793315111 FXXBULXTABDZJX-YOWGUQMCSA-N 416.865 2.036 10 20 HECD C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1812574367 CGKYJATULJZODL-OYVQIMPPSA-N 408.458 2.340 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817367179 RKSRLJFJFWPVFH-CYBMUJFWSA-N 423.498 2.258 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441755 OQJWWTSGLJAGBS-SJLPKXTDSA-N 408.502 2.419 10 20 HECD CCN(CC)c1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 727177509 LLYCAGYZLZYQGV-QINSGFPZSA-N 413.590 2.283 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](c4ccccc4F)C3)nc12 727435777 SUPBKILRBIZVHD-QGZVFWFLSA-N 400.410 2.324 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CCO)C3)cc2F)C[C@@H](C)O1 729544657 KNUKCCNCBBMITL-KSZLIROESA-N 407.530 2.150 10 20 HECD O=C(COC(=O)c1cncc(O)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 731915405 VYIDIOQJBJZHQG-UHFFFAOYSA-N 402.362 2.358 10 20 HECD O=S(=O)(Nc1ccc(NS(=O)(=O)c2cnc[nH]2)cc1)c1ccc(F)c(F)c1 736540254 WLOCOVTZXKPUFX-UHFFFAOYSA-N 414.415 2.290 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cccnc1-n1cncn1 737118371 UCENJVQDOWIUCE-UHFFFAOYSA-N 419.489 2.250 10 20 HECD CC1(C)Cc2cccc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)c2O1 738554522 CRNVFYIPFWTUNA-UKTHLTGXSA-N 412.558 2.151 10 20 HECD Cc1nc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)sc1C 743711777 VBDWKGDAEFYNPD-MRXNPFEDSA-N 401.536 2.461 10 20 HECD Cc1cc(C(=O)[C@H](C)N2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccc(OC(F)F)cc1 747835317 NQRBZAVRPHIHST-KBXCAEBGSA-N 421.444 2.453 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccc(O)cc3)CC2)cc1 749346730 GZVARTNOZSFJDI-UHFFFAOYSA-N 412.534 2.455 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3ncc(CO)n3C)cc2F)C[C@H](C)O1 750004712 CSFDZZXCXVOFKI-KBPBESRZSA-N 422.526 2.074 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754022369 MSYBAHKZKVFJSO-UHFFFAOYSA-N 410.515 2.204 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)ccn1 754924160 WBAXDHQFJKKDFX-UHFFFAOYSA-N 423.517 2.371 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@H](C)CC3)CC2)cc1 757662907 JIXDIOCEOBOVLY-IWAYRVGRSA-N 403.548 2.254 10 20 HECD COC(=O)c1ccc(C)c(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758222955 JPZRDARFMGZPAT-FQEVSTJZSA-N 414.502 2.352 10 20 HECD Cc1ccccc1NC(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 758275495 HXQHZSDHANZUKR-UHFFFAOYSA-N 402.432 2.303 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)C[C@H]3CCOC3)CC2)cc(OC)c1OC 759288986 VNYKFTKXJNBLFH-HZPDHXFCSA-N 407.511 2.359 10 20 HECD COC(=O)Nc1ccc(CNC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)cc1 759596095 MGXYQOPEKIUOCH-WEVVVXLNSA-N 400.387 2.149 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1C 760572322 QAPRLLYZSLERDO-INIZCTEOSA-N 422.503 2.277 10 20 HECD CCN(CCC(=O)OC)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 764346458 SCIWMPDVFBDTNL-UHFFFAOYSA-N 412.489 2.280 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC4(CCC4)C3)cc2F)C[C@H](C)O1 766269757 PKHFXWBKCHMWRK-IRXDYDNUSA-N 405.514 2.310 10 20 HECD Cc1cc(C(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 770168327 JWCJDBYFWBUKMC-GOSISDBHSA-N 403.442 2.492 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)nn1 773621367 XWUBLZSVQLIXRG-PBHICJAKSA-N 400.483 2.238 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccccc3F)cc2F)CC1 774802796 LKOSMBOKPIOCBD-UHFFFAOYSA-N 416.472 2.039 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](c3ccco3)N3CCCC3)ccc21 774872629 UWFUKEWHJFYLTA-FQEVSTJZSA-N 410.518 2.232 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@]34CCOC4=O)cc2F)C[C@@H](C)O1 779531036 WHISKZLMWAVFEQ-LRAJWGHMSA-N 405.470 2.430 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccccc3[N+](=O)[O-])CC2)cc1F 784160035 INHVMDRISCCJIS-INIZCTEOSA-N 405.426 2.304 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4cccc4)nc3)cc2)CC1 786256296 CZWQTCDOAHYMJN-UHFFFAOYSA-N 403.486 2.471 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(Cl)nc1 786612898 BHXYUARFNBGPLJ-UHFFFAOYSA-N 404.923 2.221 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](CO)O[C@H](C)C3)c2C)cc1 787314223 BFOBGNDAHNSMHG-BEFAXECRSA-N 400.475 2.145 10 20 HECD CN1CCC(n2ccc(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)n2)CC1 787472110 XMDZZCUAOUBDBV-UHFFFAOYSA-N 424.549 2.346 10 20 HECD C[C@H](NC(=O)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 788421760 ZKONWACMIXPVAM-HNNXBMFYSA-N 418.538 2.446 10 20 HECD O=S1(=O)CCN(c2ccc(CNC(=S)NCCc3ccc(F)cc3)cc2)CC1 789208810 OKYYCQQQTFNAJU-UHFFFAOYSA-N 421.563 2.267 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1C 789515412 FDAMJNZFGSABPT-UHFFFAOYSA-N 400.435 2.106 10 20 HECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)c3cccc(O)c3O)cc2)C1 790544985 AIYUVQGDOKQJQY-CQSZACIVSA-N 404.488 2.448 10 20 HECD COc1ccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c(O)c1 794369616 IHFAZFGJYVMWMI-KURKYZTESA-N 400.475 2.383 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2-c2ccno2)cc1 797431754 XRVIJYOHMVNALT-UHFFFAOYSA-N 408.461 2.019 10 20 HECD CC[C@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663611 UWPDAYJEEKVXQB-SFHVURJKSA-N 401.482 2.308 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1F 803664202 HIZOGSLSGCFKFL-LJQANCHMSA-N 412.509 2.241 10 20 HECD COc1c(C)cnc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1C 803664384 LVCZILAIAIXOBI-UHFFFAOYSA-N 402.470 2.187 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)cc1F 803664734 PWXKOUWEARGFPJ-UHFFFAOYSA-N 422.501 2.024 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 807652477 UOLRRAFMPLDJOL-UHFFFAOYSA-N 423.492 2.395 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN4c5ccccc5C[C@@H]4C3)nc12 810050921 SYSIDAZCFKFMOQ-QGZVFWFLSA-N 407.474 2.249 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)cnc1C 813698393 STOPLVJHHLDVEM-UHFFFAOYSA-N 415.265 2.123 10 20 HECD CN(CC(=O)Nc1cccc(C(=O)N(C)C)c1)Cc1ccc(N2CCOCC2)cc1 857758296 DDTOMVRLALTPFI-UHFFFAOYSA-N 410.518 2.296 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C3CCCC3)cc2F)C[C@@H](C)O1 917710032 AAUIOKPAMQXKAL-GASCZTMLSA-N 412.527 2.413 10 20 HECD Cc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918462495 BINWESACHVRILE-SFHVURJKSA-N 408.502 2.260 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2n[nH]c(CC)n2)cc1 1116570874 MHTYNHBNXPINGI-INIZCTEOSA-N 424.457 2.350 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)cc1C(F)(F)F 1320693267 XITFLBRAHGHOTH-ZDUSSCGKSA-N 400.353 2.359 10 20 HECD Cn1cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796932503 FOMDOTCBROHMCN-VBUUOAMHSA-N 419.485 2.070 10 20 HECD CC(=O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806250617 SDSNLXXPMQJIBN-CXAGYDPISA-N 417.849 2.055 10 20 HECD O=C(C1CCC1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898670 VNTSDXCUOVTZMK-MRXNPFEDSA-N 423.604 2.267 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NCc2ccc(N(C)C)cc2)CC1 7243804 DLACHLGGLMJESJ-UHFFFAOYSA-N 420.535 2.075 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 65715639 SCIRDDDFKYBULR-OAHLLOKOSA-N 413.474 2.356 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@]4(CCc5ccccc5C4)C3=O)CC2)cc1 69005046 XTRVWZZSPHYETQ-DEOSSOPVSA-N 420.513 2.254 10 20 HECD COCCN(C(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C)[C@@H]1CCS(=O)(=O)C1 303351152 FDVDMEUQLBWSLJ-LJQANCHMSA-N 415.515 2.242 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 542055358 FAYPBJJWTGDFHL-UHFFFAOYSA-N 404.492 2.434 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(c3ccccn3)CC2)n(C)c2ccccc12 671116819 ZIYMDHYHEZJWSS-UHFFFAOYSA-N 405.502 2.283 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1 734015333 HSKXVUUASACKPY-AWEZNQCLSA-N 422.478 2.257 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@@H]3c3ccco3)CC2)cc1 735095418 LTHLCIMIGSIBHT-HXUWFJFHSA-N 414.506 2.193 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CCO1 736720283 ADMPIVOKEGHURF-ZDUSSCGKSA-N 405.476 2.241 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2ccc[n+]([O-])c2)NC(=O)OC(C)(C)C)cc1 742750211 BEEPZLQJXQXUBO-SFHVURJKSA-N 400.479 2.382 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(N4CCCC4=O)c3)CC2)cc1 742927439 QZNHVNLZQHIXTM-UHFFFAOYSA-N 422.529 2.374 10 20 HECD O=C(CN1CCOC[C@H]1c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 743871332 BQEVQIKGQDNBRV-QFIPXVFZSA-N 413.493 2.352 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC1(C)OCCO1 758701537 MQGSRLNAJNKBHA-OAHLLOKOSA-N 409.502 2.375 10 20 HECD CCNc1nc(C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 759222655 DAQWPTQXDDAVQW-UHFFFAOYSA-N 408.549 2.048 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cccc(N4CCOC4=O)c3)no2)c1 762197978 FBBKLQFCGVALHF-UHFFFAOYSA-N 416.415 2.437 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(F)cc4nn[nH]c34)CC2)cc1 763974222 VARURSJDXGBOPK-UHFFFAOYSA-N 412.469 2.048 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](O)c3ccccc3Cl)CC2)cc1 764906446 XECNHXZWVZYOPO-HXUWFJFHSA-N 403.910 2.320 10 20 HECD CC(C)(C)NS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765031462 BPGGMPWYYQXXJW-UHFFFAOYSA-N 410.477 2.100 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@H](O)[C@H](O)c1nc2ccccc2s1 765729587 PLIIYPICIMWIFE-CABCVRRESA-N 423.288 2.475 10 20 HECD COc1cccc(O)c1CN1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1 768156471 KOEKRRLHDGLDRL-UHFFFAOYSA-N 421.475 2.124 10 20 HECD C[C@@H](NC(=O)N1CCC2(CCN(C)C2=O)CC1)c1ccc(N2CCOCC2)cc1 770345705 LWXBVTZEJXIFMK-QGZVFWFLSA-N 400.523 2.238 10 20 HECD COc1ccc([N+](=O)[O-])c(Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 771400998 YTSXAKVURQMCEA-UHFFFAOYSA-N 420.403 2.321 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCC(=O)Nc2cc(C)ccc2OC)c1 775369760 QNIZIYRQLGLAKO-AWEZNQCLSA-N 401.463 2.123 10 20 HECD Oc1cc2c(cc1CN1CCN(c3nnc(C(F)(F)F)s3)CC1)[C@H](O)CO2 776776844 HNTQXTWZYWNABC-GFCCVEGCSA-N 402.398 2.011 10 20 HECD C[S@](=O)Cc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 776848743 SUUJXFRNQBRDTE-LJAQVGFWSA-N 419.522 2.269 10 20 HECD CN(c1ccc(CNC(=O)NCC2CN(S(C)(=O)=O)C2)cc1)C1CCCCC1 777475819 XYRHIZMJGVVMDG-UHFFFAOYSA-N 408.568 2.146 10 20 HECD Cc1ccc(C(=O)N2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c(O)c1O 780893293 UZMHHOACODJMES-AWEZNQCLSA-N 401.438 2.330 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 781507320 QXWBFJGYEVIIJA-NSHDSACASA-N 402.403 2.012 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(O[C@H]2CCOC2)c1 785432827 JCTOVCKTZZYYLE-FQEVSTJZSA-N 411.502 2.161 10 20 HECD COc1ccc(OCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1C 786260081 WBKNMBLJBUTLTE-UHFFFAOYSA-N 411.502 2.367 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(F)ccc3F)CC2)cc1 787035390 CUZDXHWETOLNLS-UHFFFAOYSA-N 403.429 2.375 10 20 HECD CCN(CC)C(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 787175641 JULBUQKMBBNUNP-UHFFFAOYSA-N 424.545 2.476 10 20 HECD Cc1cc(F)cc2c1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CC2 788313875 WXOIHYHCVCWNPC-UHFFFAOYSA-N 411.477 2.172 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 788459766 LUGISEXNBAAVOW-SFHVURJKSA-N 424.545 2.078 10 20 HECD COC(C)(C)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789816275 CPKPMXANEWQYFA-ARFHVFGLSA-N 423.529 2.375 10 20 HECD Cc1ccc(-n2cnnc2)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 797839923 ZZIRPVKBOXSGQG-UHFFFAOYSA-N 411.487 2.063 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662318 AUZSIOJOAMGNSQ-DOTOQJQBSA-N 420.529 2.051 10 20 HECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)n2C 803687406 LXDSIZVGHWLWDB-UHFFFAOYSA-N 405.502 2.197 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1csc(N2CCCC2)n1)c1ccc(N(C)C)cc1 806334591 QGZMFHBYTWVPAN-HNNXBMFYSA-N 415.563 2.345 10 20 HECD O=C(NC[C@H]1COC2(CCCC2)O1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806691016 GGUNKSLBXYPXCE-SFHVURJKSA-N 414.458 2.316 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C[C@@H]2CCOC2)CC1 807100580 FSOQCVOAODPGGE-SFHVURJKSA-N 417.550 2.138 10 20 HECD Cc1noc(C)c1CO[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290485 WQZHCUXGBPEIFQ-FQEVSTJZSA-N 424.501 2.102 10 20 HECD CN(C)c1cccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)n1 808404395 YXDDMZLZKNCQAZ-UHFFFAOYSA-N 408.458 2.291 10 20 HECD O=C(CS[C@H]1CCS(=O)(=O)C1)Nc1c(-c2ccccn2)nc2ccccn12 820005762 BMQDNNOFJURAKN-ZDUSSCGKSA-N 402.501 2.255 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 1337826029 FKQQOGZNVBPBNN-HNNXBMFYSA-N 420.443 2.389 10 20 HECD Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cn1 1800715538 CSXCIAOGDUAQIW-BTTYYORXSA-N 404.854 2.050 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1onc2ccccc12)c1cc(O)nc(O)c1 1801003937 RMLSTTZDDLPPTD-BTTYYORXSA-N 408.414 2.200 10 20 HECD Cc1[nH]ccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725777 PDBCOHHPWXYPPT-NSHDSACASA-N 413.459 2.125 10 20 HECD C[C@@H](CN)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708878 SBPATEJRWCAQIU-WCBMZHEXSA-N 424.910 2.028 10 20 HECD O=C(c1cc(O)ccc1O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502022 GSJSTYFKENPLIX-UHFFFAOYSA-N 418.833 2.293 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(F)ccc3C)CC2)cc1 11900599 VIQHSUNKPGKHSH-UHFFFAOYSA-N 407.511 2.243 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCOC[C@H]3CCCO3)cc2F)C[C@@H](C)O1 734525444 HMDPNEMSRLJWGU-JFIYKMOQSA-N 409.502 2.434 10 20 HECD CSC[C@@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 736375745 MDRKJWGTDNKPGZ-OAHLLOKOSA-N 418.542 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)C(C)(C)C)cc2F)C[C@H](C)O1 749420812 NSCILUSXTSCPCK-GJZGRUSLSA-N 408.518 2.401 10 20 HECD CC[C@H](C)[C@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)C(=O)OC 749821051 OEZUWVCTTUHCBE-VFZGTOFNSA-N 407.492 2.356 10 20 HECD CSc1ccncc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 750253084 IOOKKKLPSKALDK-UHFFFAOYSA-N 400.504 2.237 10 20 HECD Cc1cc(S(N)(=O)=O)cc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1C 751634913 GVNZHBMSPHKOMA-UHFFFAOYSA-N 419.572 2.434 10 20 HECD CC(C)C(=O)NCCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 756057875 PVGOGSITTNFOHS-HOTGVXAUSA-N 408.518 2.401 10 20 HECD O=C(O)[C@H](Cc1ccc2c(c1)OCO2)NCc1ccc(N2CCOCC2)c(F)c1 756358731 CMTWDHNYSONRSF-KRWDZBQOSA-N 402.422 2.177 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1 760656328 MUKAUFQHSOJSPX-QGZVFWFLSA-N 400.483 2.068 10 20 HECD Cc1cc(=O)n(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1[N+](=O)[O-] 761861308 SDLRTZYAYQAGEM-UHFFFAOYSA-N 417.377 2.479 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCO[C@H](C4CC4)C3)CC2)cc1 765320165 GEGBYNYDPPUEAH-KNQAVFIVSA-N 416.566 2.464 10 20 HECD O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NCCc1ccc(O)c(O)c1 768901325 ZJEQMBZVOJEOTO-UHFFFAOYSA-N 401.507 2.415 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCC(CO)CC1 772602297 LNTNKINYMYIMAK-XBMUEBEBSA-N 402.539 2.081 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C)c1ccc(N(C)C)cc1 773854941 YCSXRSGJEAJKJX-ZDUSSCGKSA-N 400.454 2.409 10 20 HECD COC1(CO)CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 773934494 JZWGEYNIQACKQK-HNNXBMFYSA-N 422.481 2.262 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774361618 HSUVKWXKOYOHNC-UHFFFAOYSA-N 408.838 2.074 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccccc2O)cc(OC)c1Br 776040502 ICPXYBQVFZLGGP-UHFFFAOYSA-N 409.236 2.427 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](n2cncn2)C1 776876866 HJCWLXCWIZHEAR-HUUCEWRRSA-N 415.453 2.328 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](n2cncn2)C1 776876867 HJCWLXCWIZHEAR-LSDHHAIUSA-N 415.453 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nn3cnc4ccccc43)CC2)cc1 778222908 DJMFZQZXEJOKFY-ZHACJKMWSA-N 405.458 2.020 10 20 HECD Cc1ccc(C(=O)N2CCC[C@H](S(=O)(=O)N3CCc4ccccc43)C2)c(O)c1O 781019014 AUJRZDZPLKYWJV-INIZCTEOSA-N 416.499 2.403 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3cncs3)cc2F)C[C@@H](C)O1 782360643 XDNNCTRRSCGBMJ-OKILXGFUSA-N 421.494 2.298 10 20 HECD COC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785296215 MAOZROMOMOJGMY-SNVBAGLBSA-N 406.822 2.224 10 20 HECD COc1ccccc1N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785427908 HERKCJVRNKAUSD-UHFFFAOYSA-N 410.518 2.163 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCCOC[C@@H]1CCCO1 785567180 QBAJHVHCMFBMGM-NRFANRHFSA-N 417.550 2.337 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 789822464 WQYOXPIPCOTQPA-SOLBZPMBSA-N 421.513 2.131 10 20 HECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)CN1CCCC1 790189092 OYFBIXCRQJYMLZ-IBGZPJMESA-N 400.567 2.483 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc([N+](=O)[O-])c3OC)CC2)cc1 793247953 WLKNVSDTYGUKHE-UHFFFAOYSA-N 414.462 2.164 10 20 HECD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1ccc(N(C)C)cc1 796391452 KBNZCPJXTVZKHN-UHFFFAOYSA-N 405.520 2.394 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cnc4n3CCC4)c2C)cc1 802209837 RCDWVMFLCLQFAE-UHFFFAOYSA-N 414.487 2.364 10 20 HECD CN(Cc1ccccc1O)C(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl 802431516 GYDDEDYSSNTXLN-UHFFFAOYSA-N 415.874 2.305 10 20 HECD COCCC1(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCCC1 803308234 UYBFLXMNBUHGEE-GOSISDBHSA-N 417.550 2.414 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1F 803664271 IWXGZOZLPASELS-IBGZPJMESA-N 421.419 2.386 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H](N(C)Cc4ccccc4)C3)ccc21 803687955 SPJGNSXYKZXASI-QFIPXVFZSA-N 420.557 2.418 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 804317173 VDZUDPKLOZKBRP-UHFFFAOYSA-N 411.502 2.447 10 20 HECD COc1ccc(N2CCCN(c3ccc(C(C)=O)cc3S(N)(=O)=O)CC2)cc1 804363858 IQCQGXFGKBDHDD-UHFFFAOYSA-N 403.504 2.262 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 806845372 LTHCSQFQSFOHAQ-GOSISDBHSA-N 413.522 2.040 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1ccc([S@](C)=O)cc1 807098978 HOKVPGGYVQHELN-NDEPHWFRSA-N 401.532 2.073 10 20 HECD Cc1cnccc1OC1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807290223 FSCKXQRTDRTUMY-UHFFFAOYSA-N 420.513 2.452 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCC1CCN(c2ccncc2)CC1 807290231 GBIOOSDSOIEDGQ-UHFFFAOYSA-N 419.529 2.107 10 20 HECD CC(C)Cn1ccnc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807387556 NYQRGXNDLYJEPK-SFHVURJKSA-N 414.506 2.069 10 20 HECD COCC1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCOCC1 813590915 DSPLBNFLLMTKSL-UHFFFAOYSA-N 405.539 2.138 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)cc1 818674351 OICCEMLDHLDBFP-UHFFFAOYSA-N 411.549 2.001 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3nc4ccccc4[nH]3)cc2)C1 918002813 LQFYANIDBAMQFO-KRWDZBQOSA-N 420.517 2.307 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)cc4nccnc34)nc12 919595329 YWRBSMWCMFKILP-UHFFFAOYSA-N 411.349 2.051 10 20 HECD C[C@H](NC(=O)NCCN1C(=O)c2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 920866390 COEKWDSPTFWUME-INIZCTEOSA-N 422.485 2.180 10 20 HECD NC(=O)[C@H]1CC(C(=O)Nc2c(Cl)ccc3nonc23)=NN1c1ccc(F)cc1 1116851010 YJDGJZVYHTVSRF-CYBMUJFWSA-N 402.773 2.074 10 20 HECD COC(=O)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(C)cc1 1341587546 PJYFIUJQZAWNQV-MRXNPFEDSA-N 406.460 2.106 10 20 HECD Cc1c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cnn1C 13296903 DVLCLDIPZDSVCZ-UHFFFAOYSA-N 403.394 2.299 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F 45717030 KHZPMTLWIBJCKW-GOSISDBHSA-N 413.444 2.468 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)n(C)c2ccccc12 472779106 YXFRSUIGKHYLTK-UHFFFAOYSA-N 422.485 2.209 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2C(F)(F)F)SC1=S 727178295 UPJSZSFJNPLKFO-DHZHZOJOSA-N 410.464 2.456 10 20 HECD O=C(CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1 748335607 UAVPAGIFAPSVDY-UHFFFAOYSA-N 414.481 2.168 10 20 HECD O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1c(-c2ccccn2)nc2ccccn12 751300264 UUFQWHPICYWBQF-UHFFFAOYSA-N 404.430 2.199 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(N4C(=O)CCC4=O)c3)CC2)cc1F 753729641 DAPIMLLUFLJRGY-UHFFFAOYSA-N 411.433 2.450 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC([C@@]3(C)NC(=O)NC3=O)CC2)cc1 754362003 IXFLMFNOGKZMPZ-OAQYLSRUSA-N 401.511 2.053 10 20 HECD O=C(CN1CC(=O)N[C@H]2CCCC[C@H]21)Nc1cccc2c1C(=O)c1ccccc1C2=O 758772936 QTICYUQAHIPAFW-PKOBYXMFSA-N 417.465 2.144 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](N(C)C)CC3)cc2F)C[C@@H](C)O1 759978422 VKKKKQDXTBKLGK-GGPKGHCWSA-N 420.573 2.472 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnnc3/C=C/c3ccccc3)CC2)cc1 764496724 AHTQZJLTWRCRMD-KPKJPENVSA-N 404.474 2.201 10 20 HECD CCCn1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nn1 767047855 AVZIUUGHHDBORO-UHFFFAOYSA-N 418.409 2.259 10 20 HECD CN(C)C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 769861498 OJKXPJCVDYMJHL-CYBMUJFWSA-N 409.533 2.278 10 20 HECD CN1CCC[C@H](N(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 769914372 YAZBIPGRWWAIHP-AWEZNQCLSA-N 409.533 2.421 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1 774129923 QVEHIYLIBNVYGV-GOSISDBHSA-N 421.545 2.107 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC[C@H]3C)cc2F)CC1 774748447 BHPBBYXENWAPOZ-APWZRJJASA-N 404.530 2.279 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2cnnn2)cc1 783315386 BDHGDFPWUUMPKV-UHFFFAOYSA-N 407.478 2.104 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccccc2F)c2nccn2C)cc1 785605442 PKLMGPSCHQCCSL-LJQANCHMSA-N 409.465 2.147 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCc2ccccc21 789800077 KUHXUNUSFFHBPT-HXUWFJFHSA-N 411.477 2.424 10 20 HECD CCCN(C[C@@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814126 YOUDOCUPPAUQLF-SFHVURJKSA-N 421.513 2.086 10 20 HECD CCOC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 789816249 CKKGABFFJHSPDJ-MDZRGWNJSA-N 423.529 2.233 10 20 HECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N(C)C)cc1 793722516 UBFPZUWJMASGPH-HXUWFJFHSA-N 400.498 2.235 10 20 HECD COc1ccc(NCc2ccc(N3CCN(C)CC3)cc2)cc1NS(C)(=O)=O 802640033 ILNXVRVHVHYPTC-UHFFFAOYSA-N 404.536 2.431 10 20 HECD CCc1cnc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803301475 RJWVLPHFXCSDLP-OAHLLOKOSA-N 416.547 2.078 10 20 HECD COC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 804319845 TWPJZFTXXYDWKU-LJQANCHMSA-N 415.490 2.186 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCCC1=O 804775524 IDWHWBPUQNSBOL-UHFFFAOYSA-N 402.539 2.008 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(F)c(CN(C)C)c1 806041986 NNXYSKGYAQEOTD-UHFFFAOYSA-N 400.498 2.194 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1nnn(-c2ccn(C)n2)c1C 815797553 UQFGGYCSKOYIDJ-UHFFFAOYSA-N 419.283 2.440 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cn2cccn2)on1 815952446 LKRAWORQQHJCRI-UHFFFAOYSA-N 404.810 2.094 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1O 918123446 WXPDRBHCRQBCJQ-QGZVFWFLSA-N 412.490 2.102 10 20 HECD COc1ccc(N2CCCN(C(=O)Cn3nc(-c4ccccc4)oc3=O)CC2)cc1 918369143 JQAJCUKDXSKBFG-UHFFFAOYSA-N 408.458 2.251 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)c1ccccc1 918371570 HFYJLGKUTNEKAM-PXNSSMCTSA-N 422.529 2.213 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3cccc(F)c3)cc2)C1 921122486 JWULYMZKIKXQPR-YLJYHZDGSA-N 414.481 2.060 10 20 HECD C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1812574358 CGKYJATULJZODL-AMMHHYFNSA-N 408.458 2.340 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1822641655 FSQUHYSMXDBOPA-HGXZOFBTSA-N 402.476 2.221 10 20 HECD Cc1ccc(C)c(OCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1841879181 XMWSPGUBWTUUOA-UHFFFAOYSA-N 411.458 2.006 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCN(CC(=O)NC4CC4)CC3)c2C)cc1 105028148 FIOHLBZPYOVREI-UHFFFAOYSA-N 408.546 2.481 10 20 HECD C[C@]1(c2ccc(CNCc3ccc(N4CCOCC4)c(F)c3)cc2)NC(=O)NC1=O 727470449 DDRGHPYNBRZUMX-JOCHJYFZSA-N 412.465 2.007 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(N)c([N+](=O)[O-])c1 727767457 CXXAHURGLLVGCF-HNNXBMFYSA-N 411.462 2.117 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3ccc(Cl)nc3)CC2)cc1 734838347 XJNYLEOGJKFDGG-UHFFFAOYSA-N 401.942 2.235 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Nc3ccn(CCS(C)(=O)=O)n3)ccc21 741204254 QIRHLGCNOWURGB-UHFFFAOYSA-N 418.519 2.398 10 20 HECD COc1cc(CCNC(=O)NCc2cccc(OC)c2O)c([N+](=O)[O-])cc1OC 745363940 BDFCZJIAJYLPCI-UHFFFAOYSA-N 405.407 2.368 10 20 HECD COC[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(C)o1 746757665 QJHSACTYFWFOLU-IEBWSBKVSA-N 414.506 2.477 10 20 HECD CN(C[C@H](O)CN1CCOCC1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 751790826 UEMIHGGBWQIVMX-QFIPXVFZSA-N 418.582 2.290 10 20 HECD COC(=O)C1(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCCC1 754083987 ZBKVZOAKRGFEDW-HXUWFJFHSA-N 419.566 2.034 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(O)n1 755259687 WYMLJTLOQBCBSP-ZDUSSCGKSA-N 420.416 2.421 10 20 HECD C[C@H](NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cc(F)cc(F)c1O 756478214 GUFXOSTWSRVUOV-JTQLQIEISA-N 401.391 2.208 10 20 HECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)c(OC)c1 758171081 REQLCMRQVKIKOM-UHFFFAOYSA-N 418.468 2.492 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 758222967 JYHMNNWAGQHZQY-GOSISDBHSA-N 417.462 2.174 10 20 HECD CC(C)c1[nH]nc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1[N+](=O)[O-] 771537428 WCBHCCAISWAHNP-UHFFFAOYSA-N 405.430 2.472 10 20 HECD C[C@H](NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 775826143 CUAASFPMXAGJFK-HNNXBMFYSA-N 404.536 2.292 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F 776336266 RACVDIHWTFDMGG-HNNXBMFYSA-N 401.454 2.409 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 778296147 ZGUDIKIVOQLFDC-CRGNZNIYSA-N 415.534 2.220 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@@H]3CCO[C@H](C)C3)CC2)cc1 784251593 INAXNWRKKSGEHN-RTBURBONSA-N 404.555 2.322 10 20 HECD COc1ccc(CCS(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 788597024 WVJFMVDNLMNEGU-UHFFFAOYSA-N 408.495 2.333 10 20 HECD Cc1cc(Br)cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)c1O 789775462 UPZYQDUIFQAIPP-OAHLLOKOSA-N 403.342 2.463 10 20 HECD CC1(C)[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]2CCCO[C@H]21 789864155 MMTMCUNBTCMRHR-IPMKNSEASA-N 417.575 2.176 10 20 HECD COc1ccc(CNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c(O)c1 794371149 XHBUIHNOHHXOFT-UHFFFAOYSA-N 416.455 2.402 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCCc4nc(C)ncc43)CC2)cc1 806237246 PVBPTLHDLWUDOS-NRFANRHFSA-N 423.517 2.026 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCc2cccc(C(=O)NC)c2)cc1 807358847 KHJCNYANSPALLQ-UHFFFAOYSA-N 424.545 2.210 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc2[nH]ccc12 808941152 RBFQIBXYBOPGES-NSHDSACASA-N 411.414 2.052 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc4c(cn3)CCC4)CC2)cc1 818982314 DOHNPDFWEASPQR-MDZDMXLPSA-N 406.486 2.422 10 20 HECD Cc1cc(CC(=O)NC2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(Cl)cc1 880193665 AVEQAGBWHVTEMD-UHFFFAOYSA-N 402.926 2.356 10 20 HECD CNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 918032718 QOKIPSZEUKEHHN-KRWDZBQOSA-N 423.517 2.378 10 20 HECD Cc1ccc(CNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 918778001 VGRXNFGXOKWLIH-UHFFFAOYSA-N 405.495 2.368 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCOCC2)cc1 920927598 ZFWINEGJOUCBSA-HNNXBMFYSA-N 422.485 2.224 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](NC(C)=O)c1cccs1 1320394632 SZWYKQAONFFRMW-CABCVRRESA-N 420.487 2.017 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 726562203 FFGJXOXLMKWXHH-UHFFFAOYSA-N 417.531 2.392 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1OC 727947488 MUUUCTKVJYUZAM-UHFFFAOYSA-N 413.474 2.350 10 20 HECD O=C(NCc1nnnn1-c1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 730673613 ZHFHJSCCNXLDCU-GOSISDBHSA-N 408.462 2.259 10 20 HECD CN(Cc1ccc(N(C)C)cc1)Cn1nc(C[C@H]2CCS(=O)(=O)C2)n(C)c1=S 732497388 OCXOKOYTEOVRJB-MRXNPFEDSA-N 423.608 2.084 10 20 HECD C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1ccccc1SCC(=O)N1CCCC1 736269782 GSGNDKZTZRBSPO-HUUCEWRRSA-N 410.561 2.049 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1C 737134194 KGJWIAPHGFRTQX-UHFFFAOYSA-N 405.476 2.059 10 20 HECD CN(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C(=O)C1CC1 742753800 LJIIDGWGZOLUII-SFHVURJKSA-N 418.538 2.303 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cccc1N1CCOC1=O 743900968 VLLBKLJNJQYZBF-UHFFFAOYSA-N 414.437 2.412 10 20 HECD COc1cccc(CNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1O 745289912 BRAWYSRYDLTTMF-SFHVURJKSA-N 403.454 2.413 10 20 HECD CN1CCCc2cc(CNC(=O)NCCS(=O)(=O)Cc3ccccc3)ccc21 746982988 KLEAWHJILVDNSJ-UHFFFAOYSA-N 401.532 2.483 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(CO)CCCCC3)cc2)C1 752878840 GSWMOGQWMDOZOS-GOSISDBHSA-N 402.539 2.130 10 20 HECD CS(=O)(=O)c1ccc(OCCNC(=O)NCCCSc2nccs2)cc1 759581302 SPRXPSXDEOFTQI-UHFFFAOYSA-N 415.562 2.407 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)Nc1ccc(C)c(S(N)(=O)=O)c1 766271183 XLEBSQLJWKETIG-UHFFFAOYSA-N 403.504 2.432 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3cccs3)cc2F)C[C@@H](C)O1 775098784 FZSPQKFWHJMODE-HUUCEWRRSA-N 419.522 2.476 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785292882 BVIOJWCBBUKUSI-ZDUSSCGKSA-N 409.446 2.062 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 785424642 RXSIILKNKHSZIQ-QAPCUYQASA-N 418.538 2.131 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H]3OC(=O)c4ccccc43)cc2)CC1 786258534 ZJRMCWQNPRRQRT-OAQYLSRUSA-N 407.470 2.273 10 20 HECD COC(=O)CCc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 786304612 UIKUDVGWMYEJJA-UHFFFAOYSA-N 401.438 2.252 10 20 HECD CN(C[C@@H]1COc2ccccc2O1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910587 MKMCYBUANHGPDX-LJQANCHMSA-N 409.486 2.201 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSCC[C@@H]3C)CC2)cc1 791897538 QVLKRJNBGXRCHD-OZSKJFCKSA-N 403.548 2.254 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)Nc2ccc(O)cc2SC)c1 792702768 ZSNQQWALODZRJM-UHFFFAOYSA-N 411.457 2.488 10 20 HECD COc1ccc(CNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c(O)c1 794381733 SHJDKOKTZCRNRK-UHFFFAOYSA-N 414.277 2.497 10 20 HECD C[S@](=O)c1ccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 797902270 VDNRUMWFAOFWKY-NDEPHWFRSA-N 404.507 2.383 10 20 HECD Cc1ccc(N2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CC2)cc1 803687311 ZSZAVHXPCGEUJB-UHFFFAOYSA-N 406.530 2.342 10 20 HECD O=C(NCc1cscn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804021259 WZYBHPPSEYVPEY-LBPRGKRZSA-N 410.446 2.146 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@H](C(C)C)C3)CC2)cc1 804315958 WIIVDPFSQLHYLI-PXNSSMCTSA-N 403.523 2.100 10 20 HECD NC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1F 807513873 XLNSOPQDISTSAZ-UHFFFAOYSA-N 400.193 2.192 10 20 HECD Cc1onc(-c2cccnc2)c1C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21 808049905 JWYGGIDYSMCLSC-UHFFFAOYSA-N 412.471 2.498 10 20 HECD Cc1cnc(S(C)(=O)=O)nc1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 813402478 SNOPIOWNNQYQAG-UHFFFAOYSA-N 408.443 2.151 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)cc3F)cc2)CC1 813531673 LPIAFCCXJWHQFE-FQEVSTJZSA-N 419.884 2.497 10 20 HECD CCOc1ccc(CCN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1OCC 814315624 GSVIUUXKQZKSQZ-FOWTUZBSSA-N 419.547 2.399 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(-c2ccccc2)c1 916676403 LJGUPVANEZVADX-UHFFFAOYSA-N 410.499 2.037 10 20 HECD O=C(NCCCNc1ccccn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918209364 CPUWWUDCFMBRDI-UHFFFAOYSA-N 401.486 2.483 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccccc1-n1cncn1 918438282 LPNDXWMXAALMSE-UHFFFAOYSA-N 422.514 2.075 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3Cl)cc2)C1 918464440 VWCJRDGNUISYQL-OAHLLOKOSA-N 414.893 2.297 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 920635004 AXZCSHPTQVOFMD-LMOYCYGVSA-N 412.508 2.250 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cc3cccc(OCC(=O)NC)c3)CC2)cc1 1324627495 UDBAAOOOTCYNQW-UHFFFAOYSA-N 411.502 2.101 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769085 LBCIELWLNYVZEJ-IMCXFHMJSA-N 408.882 2.001 10 20 HECD Cn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1816305902 MJUZOSKQYZMIFT-HNNXBMFYSA-N 410.434 2.174 10 20 HECD O=C(Cc1cccnc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501264 SYLNTLSGCVQTDN-UHFFFAOYSA-N 401.850 2.206 10 20 HECD COC[C@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 23559830 SEXXZTKEMRJMQV-LBPRGKRZSA-N 405.426 2.251 10 20 HECD Cc1ccc2ncc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c(=O)n2c1 302982772 JWQOQCVJJHEHDO-UHFFFAOYSA-N 410.449 2.033 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)N2CCCc3ccc(S(C)(=O)=O)cc32)cn1 681656744 NWADJDPGZGRJKG-UHFFFAOYSA-N 413.503 2.300 10 20 HECD C[C@H](OC(=O)Cc1cnn(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 726000192 PPMWOYNSLWGOTQ-ZDUSSCGKSA-N 417.421 2.308 10 20 HECD CO[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 728056399 SXBWWZMBLIWFAH-QGZVFWFLSA-N 405.520 2.035 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4cncn4)nc3)cc2)CC1 731132285 XWFLOIGHNNWXGP-UHFFFAOYSA-N 419.489 2.154 10 20 HECD C[C@@H]1CCCCN1C[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 733806464 DFTPVPOIEIJLFO-CVEARBPZSA-N 409.552 2.490 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3c[nH]c4ncccc34)cc2F)CC1 734153092 MCWPOSLRVRODRW-UHFFFAOYSA-N 417.510 2.322 10 20 HECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1c(O)ccc2c1CCCC2 743716545 RMYIMSDGSGSSHA-LJQANCHMSA-N 406.490 2.176 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N1CCC(C(N)=O)CC1 743873043 HFGLCNJBCDZTOK-LBPRGKRZSA-N 412.328 2.089 10 20 HECD CCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 747967953 ZODYEULBUVLFLN-JENIJYKNSA-N 407.530 2.414 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccc(-n4ccnn4)c3)cc2F)CC1 755879721 XOSWXJUFZAGYPZ-UHFFFAOYSA-N 408.481 2.478 10 20 HECD CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)NCCCSc1nccs1 759589550 JXVAKDDQWFKAAD-CYBMUJFWSA-N 406.599 2.129 10 20 HECD CC1(Cn2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nn2)COC1 759958748 ONUWDRGAXAVLCL-MRXNPFEDSA-N 419.913 2.068 10 20 HECD COc1cc(N2CCN(C(=O)NCCCN3CCCCC3)CC2)cc(OC)c1OC 760104732 POVCWPVQKAWVML-UHFFFAOYSA-N 420.554 2.420 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CC[C@H](C(N)=O)O2)cc1 760204323 QMEAGDLBXFDAHE-PKOBYXMFSA-N 400.479 2.090 10 20 HECD COC(=O)CCCC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764585335 VHOGKTAVXOAQJD-UHFFFAOYSA-N 409.394 2.287 10 20 HECD O=C(Cc1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768439355 GFZVREGFQRWJRK-IBGZPJMESA-N 402.878 2.358 10 20 HECD Oc1cc2c(cc1CN1CCC[C@@H](CN3CCN(c4ccccn4)CC3)C1)[C@@H](O)CO2 768443502 FLKOGMYPDYSXPY-AVRDEDQJSA-N 424.545 2.247 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCO[C@]2(CCOC2)C1 771421730 NLZUJIYHUUBLCL-DENIHFKCSA-N 403.523 2.033 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1ccc(N2CCCC2=O)cc1 774754629 VTIXSOCKPJMMAD-UHFFFAOYSA-N 408.502 2.395 10 20 HECD C[C@H](NCC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl)c1ccc(N(C)C)cc1 775836014 XHMYVWGPFGNXIA-LBPRGKRZSA-N 410.927 2.343 10 20 HECD COC(=O)c1ccc(C)c(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 776283743 VFTGFXNZWQVIRB-UHFFFAOYSA-N 416.449 2.453 10 20 HECD CCOc1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 778301451 IKVWQVVJPHPYON-QXMHVHEDSA-N 410.474 2.332 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCSc1ccccc1 785425831 RTGDADKIWAGTBF-UHFFFAOYSA-N 413.543 2.390 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCCN(Cc3ccccc3)C2)cc1 785439571 RFWFZCQSDDWBIH-QFIPXVFZSA-N 408.546 2.492 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)cc4c[nH]nc34)CC2)cc1 785790434 DDQNNVDTPPYXAE-UHFFFAOYSA-N 408.458 2.386 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)cc(F)c1Br 785990115 YJIDUKMFXDGKAM-UHFFFAOYSA-N 415.190 2.436 10 20 HECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789861717 RLBBJRFDPBDMML-QZTJIDSGSA-N 418.607 2.093 10 20 HECD CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1CCCCN1C(=O)c1cccc(O)c1O 790945146 HJNDTFRPYLPAKW-AWEZNQCLSA-N 421.494 2.124 10 20 HECD COc1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)c(O)c1 794379705 VJEZTCVOFZGKCQ-AWEZNQCLSA-N 400.431 2.087 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccncc3C(F)(F)F)nc12 800238218 CEQCCQXCIAUYRK-UHFFFAOYSA-N 410.308 2.382 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(=O)(=O)NC)cc1 802610087 TZIWBNQWNOXNOO-UHFFFAOYSA-N 419.503 2.068 10 20 HECD Cc1nn(C)c(C)c1C[C@H](C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 807639101 TTWHIWMYKDFCKU-HNNXBMFYSA-N 411.550 2.341 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 808341721 KXJGVAUPXIFSMC-CTNGQTDRSA-N 417.550 2.015 10 20 HECD CC(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918122841 NCWWYATZXUIJNF-LJQANCHMSA-N 423.517 2.346 10 20 HECD COC[C@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 920890160 LOBBANVLRLEGHP-GFCCVEGCSA-N 423.447 2.114 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 921078864 ZGBLHEJOWLGCGS-LJQANCHMSA-N 408.502 2.470 10 20 HECD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)o1 1793516325 UEWUDSIOYNLTPD-FVCICTRLSA-N 420.849 2.170 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc2c[nH]nc12 1796604182 MGHGRONBUBKYTM-BJWYYQGGSA-N 421.457 2.243 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C2CC2)[C@@H]1c1cccnc1 1814165960 MQNFTRNPCGYBCA-ILDRUCAQSA-N 423.469 2.328 10 20 HECD O=C(Cc1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817620303 GXHWOZVGWZROAZ-MRXNPFEDSA-N 422.445 2.160 10 20 HECD CCC[C@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CCN1CCOC 673314311 DNJMAIHWIOLWFV-SFHVURJKSA-N 414.550 2.062 10 20 HECD Cn1c(NC2CCN(c3ccc(OC(F)F)cc3)CC2)nc2c1c(O)nc(=O)n2C 726593990 CPTKDBCCEKSGRO-UHFFFAOYSA-N 420.420 2.055 10 20 HECD COC(=O)Nc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccc1F 727617824 OHWNFRIBZLHOQR-UHFFFAOYSA-N 406.389 2.464 10 20 HECD Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 735651195 VZBCCZNLHUXWTC-QFIPXVFZSA-N 420.517 2.261 10 20 HECD COCCNS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N(C)C)cc2C)cc1 743213412 ZFAIOCMWXHKZJZ-UHFFFAOYSA-N 420.535 2.307 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCN(C(=O)C2CC2)C1 749733665 WYSAVZKVVAZDMF-QGZVFWFLSA-N 403.498 2.052 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)cn3)cc2F)C[C@@H](C)O1 751828462 WQNHJPMZEZDQNP-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1ccc(Br)cc1O 756706232 NVSUSFHAOOLGHE-TZMCWYRMSA-N 421.357 2.294 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H]3COc4ccccc4C3)CC2)cc1 758196706 DPRHJECGXVEKHI-KNQAVFIVSA-N 411.546 2.019 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 758692770 XIMBMMUBNFDSKJ-UHFFFAOYSA-N 420.491 2.276 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 758721305 AGQDTOVPZIKEJM-OAQYLSRUSA-N 422.529 2.371 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2nc(F)c(F)cc2F)CC1 759965116 GZMKYHGJWMMNTE-UHFFFAOYSA-N 421.467 2.346 10 20 HECD CN(C)CCOc1cc(CNC(=O)NCc2cccc(Br)c2O)ccn1 764798628 GJWJFCDXDDCOMK-UHFFFAOYSA-N 423.311 2.490 10 20 HECD C[C@H](C(=O)N(Cc1ccco1)Cc1ccccc1O)S(=O)(=O)C1CCOCC1 768110977 VYHDKTSWTMSPJN-OAHLLOKOSA-N 407.488 2.496 10 20 HECD O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCOCC2)c(F)c1 770226969 CCIRMCYNVAROQA-UHFFFAOYSA-N 420.506 2.259 10 20 HECD COCC[C@]1(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCOC1 770262268 RMFJQXHGPMBVFD-QYWGDWMGSA-N 409.502 2.434 10 20 HECD C[C@H](NC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1)c1ccc(N(C)C)cc1 773314093 ZHJTVGHTGTUPAE-ZDUSSCGKSA-N 418.510 2.377 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773845392 IJKJGGBYTQNGJJ-MRXNPFEDSA-N 424.501 2.041 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 774147535 BVXVXUDKPQKRCE-UHFFFAOYSA-N 411.867 2.014 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cccn2c(I)cnc12 778917552 FQRHEHSJFZAGLF-UHFFFAOYSA-N 409.183 2.280 10 20 HECD Cc1cncc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784766409 IHHXPVYAYITPAR-MRXNPFEDSA-N 402.882 2.468 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccc(Br)cc2)cc1 785439422 OXCQDIIWXTXDMO-UHFFFAOYSA-N 404.308 2.490 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)nc3)cc2F)C[C@@H](C)O1 785641367 WQLRXPFJRMLSHB-OKILXGFUSA-N 419.428 2.447 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc2ncccc2c1 789697237 RXVSUYBQVRSVDC-UHFFFAOYSA-N 418.497 2.346 10 20 HECD CC[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842637 FJVZXFKJAMEOON-DOTOQJQBSA-N 405.514 2.488 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1 792238272 NJAJHBSEYUKKDI-ZMZPIMSZSA-N 414.380 2.210 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2C 799251517 ZJZDCSKJMFRTRI-UHFFFAOYSA-N 410.474 2.095 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nnc2n1CCCCC2 803686699 GTOHNEWYCYCBRN-GOSISDBHSA-N 424.549 2.271 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC3CCC4(CC3)NC(=O)NC4=O)c2C)cc1 804733745 LYJXTAPNNVNKPF-UHFFFAOYSA-N 410.474 2.353 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1 807102982 KEXQYWWJNPKDMK-MRXNPFEDSA-N 401.429 2.247 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCCN(C2CCC2)C1 807289812 JSRUFSXNSLAFCX-UYAOXDASSA-N 410.562 2.448 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccncc1OCC(F)(F)F 809730260 HHFPHAIHNJPAMY-UHFFFAOYSA-N 424.423 2.364 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]1(c2ccccc2)CCC(=O)NC1 816825471 DTVVKFYEEKATSE-DEOSSOPVSA-N 407.514 2.330 10 20 HECD CCCCn1c(N)c(N(CCC(C)C)C(=O)/C=C\c2cnn(C)c2)c(O)nc1=O 917108320 IUMPYOHIBAJBPD-FPLPWBNLSA-N 402.499 2.157 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(c4cccc(F)c4)=NO3)cc2)C1 917835099 ZMINOVKQPREGSX-LAUBAEHRSA-N 424.476 2.337 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)C3CCCCC3)cc2)C1 918120715 BSSQGQJUVNTXMQ-AZUAARDMSA-N 402.539 2.129 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 918212468 UZLHVASSFVIMDJ-UHFFFAOYSA-N 401.486 2.247 10 20 HECD COc1ccc(N2CCCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1 918369655 PYCOHMTXMSYIAK-UHFFFAOYSA-N 405.564 2.480 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)cc1 918433881 IRYCFIWEJRGICL-UHFFFAOYSA-N 406.490 2.428 10 20 HECD O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)Nc1c(Cl)ccc2nonc12 1321103889 VUOPUTLJPJBVKO-UHFFFAOYSA-N 423.834 2.450 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1Cl)c1cc(O)nc(O)c1 1792402701 PWRXSGIQUQSGIS-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccco2)no1)c1cc(O)nc(O)c1 1796590290 UUYFQMXLIJTPMB-BTTYYORXSA-N 424.413 2.306 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2ccccn2)C1 1843096876 MPXJDUGMEFUQBN-UHFFFAOYSA-N 401.850 2.206 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCC(F)(F)C1 1847224784 STSORBPDLWMLSM-SUZFSSPVSA-N 422.428 2.454 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 10907305 WZEKCVDQFILUAH-UHFFFAOYSA-N 413.430 2.475 10 20 HECD CC(C)c1nnc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1C 726121206 YZQSGPZOSVGFQK-UHFFFAOYSA-N 407.515 2.323 10 20 HECD CCCOc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 727177329 GROCIVLJALOEHE-KAMYIIQDSA-N 400.547 2.226 10 20 HECD Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 727487633 SAPYMERMVSNNRD-UHFFFAOYSA-N 417.447 2.245 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1O 727762643 SLYYYDSTLADOMV-MRXNPFEDSA-N 404.488 2.118 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cccc(C(N)=O)c3)cc2F)CC1 730118279 QTZPNJKMLYWHDB-UHFFFAOYSA-N 413.497 2.066 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccc(CN2C(=O)CNC2=O)cc1 734512910 QIHPXPCJOOIOOX-UHFFFAOYSA-N 405.505 2.499 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cnn(C(C)C)c3)cc2F)CC1 742292993 GJWMVEQDLUIDSC-UHFFFAOYSA-N 409.531 2.224 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(C)CCCC[C@H]3O)CC2)cc1 748625827 VPEWPUSCTUCHMV-IFMALSPDSA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)[C@@H](C)Oc4ccccc43)CC2)cc1F 753739288 DOGAVZKYMWVAJI-OAHLLOKOSA-N 413.449 2.297 10 20 HECD COCc1nc2n(n1)C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)CC2 757778289 UPMWTLWHLBCHKE-QGZVFWFLSA-N 400.527 2.426 10 20 HECD O=C(O)CNC(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1 758162014 DJRITGIXRRFJOL-UHFFFAOYSA-N 419.242 2.314 10 20 HECD CCOc1ccc(NC(=O)CN2CCN(Cc3cc4c(cc3O)OCO4)CC2)cc1 765144109 STWYDGMYHHMPKQ-UHFFFAOYSA-N 413.474 2.276 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@H]2C1 766270672 KRYSXSGKAXTQFG-CABCVRRESA-N 417.465 2.096 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c(C)nn1 767314427 NQVIWPAIMVBZCG-UHFFFAOYSA-N 421.480 2.279 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccn(Cc2ccncc2)n1 768098459 JSPIPHWGUDDYDF-UHFFFAOYSA-N 402.505 2.020 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3nccn4cnnc34)[C@@H](C)C2)cc1 771205348 QUTUGMWJGTVCND-KRWDZBQOSA-N 422.537 2.391 10 20 HECD CN(CCc1cnccn1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 771461418 RNKKBYNMQGZKSL-UHFFFAOYSA-N 400.438 2.365 10 20 HECD Cc1cc(NC(=O)CN2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)no1 773626472 UPNRPGFDNBWOGK-MRXNPFEDSA-N 414.510 2.076 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc3c(c2)OCO3)cc1F 774415480 ZICYXGJTMVDTJL-UHFFFAOYSA-N 401.438 2.333 10 20 HECD O=C(NCc1nnc2n1CCCCC2)C(=O)N(Cc1ccco1)Cc1ccccc1O 775226476 SMZNRDIWKHWANE-UHFFFAOYSA-N 423.473 2.148 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(C(=O)C(F)(F)F)CC3)CC2)cc1 775855665 IQFSWWFFDBDLMF-UHFFFAOYSA-N 413.440 2.187 10 20 HECD O=C1NC(=O)C2(CCC(N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)N1 776222294 FBNXVYRHSAQAND-DMAKZNTKSA-N 408.449 2.367 10 20 HECD CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCc1ccc(O)c(O)c1)c1cnn(C)c1 776358015 XCMGRNWUAHBKDQ-QGZVFWFLSA-N 404.467 2.098 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 778528922 KXXBKRZDEXCLFO-UHFFFAOYSA-N 416.453 2.099 10 20 HECD CC[C@@]1(CO)CCCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 779546506 XJGCGFGOFSIKRK-JOCHJYFZSA-N 404.555 2.011 10 20 HECD COC1(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCC1 781730046 PEVAENWIAAFCHW-UHFFFAOYSA-N 420.487 2.037 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1 783264704 PTHGGFJIEMDMDT-IAGOWNOFSA-N 418.515 2.251 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 783318724 ZXRXQULELRTTFS-UHFFFAOYSA-N 423.517 2.319 10 20 HECD Cc1ccccc1-c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n(C)n1 785297667 RDUXVDGIOCIGLY-AWEZNQCLSA-N 408.458 2.493 10 20 HECD CC1CCN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 785519823 IGJLCFJGRCWKKZ-FQEVSTJZSA-N 417.550 2.138 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccccc2)c2nccn2C)cc1F 785599008 LRJFXMQZMHTHNV-LJQANCHMSA-N 409.465 2.147 10 20 HECD COc1cc(N2CCN(C(=O)Cc3ccccc3CO)CC2)cc(OC)c1OC 787520217 JCYGDVBWFDXNGC-UHFFFAOYSA-N 400.475 2.096 10 20 HECD CN(C)C1(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)Cc2ccccc2C1 788910390 ATGAQDBURXLJOS-UHFFFAOYSA-N 420.557 2.118 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1 788977743 MHPULZCIHBZJIS-STSQHVNTSA-N 417.550 2.334 10 20 HECD CC1(C)CCC(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789840820 NQYJQHLZKSVYQB-UHFFFAOYSA-N 405.514 2.488 10 20 HECD O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)c1c(F)ccc(O)c1O 789963187 DKZQVVLMPMQOMD-UHFFFAOYSA-N 408.451 2.068 10 20 HECD CCn1ccc(CN(C)C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 790992437 XAPKNQSPDFRHST-KTKRTIGZSA-N 410.518 2.380 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCC(=O)c3cnn(C)c3)cc2F)C[C@@H](C)O1 793119430 XZXQFVYNGAFTCU-GASCZTMLSA-N 402.470 2.452 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@@H]4[C@@H]5[C@H]6[C@H]7C[C@@H]5[C@H]3[C@@H]7C[C@H]64)cc2)C1 793133896 YQIUOBXPAAYTSM-DGJPAIRSSA-N 405.542 2.399 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1C(N)=O 796768974 OOBVCMMRIJQCQO-UHFFFAOYSA-N 424.501 2.210 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)CC3CCCC3)cc2)C1 798382987 FXQQHPHVIPXABP-UXHICEINSA-N 416.566 2.376 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CN(C)Cc2ccccc21)c1ccc(N2CCOCC2)cc1 803303161 YHXQFZMDTMKOAI-JTSKRJEESA-N 422.529 2.003 10 20 HECD CCC1(CC)[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1OC 804315063 DOOMDYZQDGYTAF-PMACEKPBSA-N 417.550 2.490 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCc3c(C)noc3C)CC2)cc1 804317947 UCFDZCVINGLMNR-UHFFFAOYSA-N 414.506 2.134 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCO[C@]3(CCSC3)C2)cc1F 804853415 XMZMYKDVGARDIB-HRAATJIYSA-N 423.554 2.459 10 20 HECD Cn1cc(CNC(=O)C(=O)NCCCSc2nccs2)c(-c2ccccc2)n1 806276362 NQUCQJDJWYHDIG-UHFFFAOYSA-N 415.544 2.458 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H]2C[C@@]2(C)NC(=O)NC2=O)cc1 806464955 PBPLJLSONGTBJW-DYESRHJHSA-N 401.511 2.195 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 809240313 VIKKPKAJLOHILS-MSOLQXFVSA-N 401.507 2.084 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC(O)(c4ccccc4)C3)CC2)cc1 811994509 BOZHITMEOJNIQS-UHFFFAOYSA-N 424.545 2.120 10 20 HECD CCC[C@]1(CO)CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 812016837 RPTRRADOJWLBBG-QFIPXVFZSA-N 404.555 2.011 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)s2)ccc1O 812270970 ASUKZFXHECBDRC-UHFFFAOYSA-N 416.424 2.181 10 20 HECD COCCOCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 919226264 LXECPDZBYAAZDX-UHFFFAOYSA-N 403.431 2.254 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CN(Cc2ccccc2)CCO1 919790134 LSJHRTDBUQXMHO-QHCPKHFHSA-N 424.545 2.223 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 16134835 KJGJUYJNWFAWIW-UHFFFAOYSA-N 417.531 2.094 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 108689459 YUZVLWSOWGEKSY-OAHLLOKOSA-N 423.560 2.162 10 20 HECD CCN1CCN(c2ccc(CNc3cnn(C)c(=O)c3Br)cc2F)CC1 301222137 CBPFOTLDBGXGCA-UHFFFAOYSA-N 424.318 2.436 10 20 HECD CCOCCN1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C[C@H]1CC 522007924 KMTLEGCTNPVEGJ-GOSISDBHSA-N 414.550 2.062 10 20 HECD C[C@@]1(c2ccc(CNCc3ccc(N4CCOCC4)c(F)c3)cc2)NC(=O)NC1=O 727470450 DDRGHPYNBRZUMX-QFIPXVFZSA-N 412.465 2.007 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1Br 729529978 QYYPIHZZZIOXLP-UHFFFAOYSA-N 413.293 2.335 10 20 HECD CCOc1ccc(OC)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 729785604 DGZGFKMZHAODBS-UHFFFAOYSA-N 413.474 2.185 10 20 HECD COC(=O)CCNC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731037263 ZIISUXHIWNKHTJ-UHFFFAOYSA-N 405.495 2.143 10 20 HECD CN1CCC(N2CC[C@@H](NC(=O)NCc3ccc(N4CCSCC4)cc3)C2)CC1 734269627 IOBIUYJPJCXNDJ-LJQANCHMSA-N 417.623 2.208 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CNc3ccccc3OC)CC2)cc1 735935318 ZAXOTBHSTWCJAP-UHFFFAOYSA-N 413.474 2.008 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)ccc1OC 743050009 NBJHOGLLNYCJPP-UHFFFAOYSA-N 408.461 2.140 10 20 HECD COC(=O)CSCCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594369 CCWIHXJUIQYAQE-ZDUSSCGKSA-N 417.478 2.462 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cnn(Cc2ccccn2)c1 746423869 XSMRWFJAPSIKTP-UHFFFAOYSA-N 405.458 2.166 10 20 HECD Cc1ccc(NC(=O)[C@H]2CCCN(CC(=O)NCc3ccc(N(C)C)cc3)C2)nc1 746457026 ICIQBVOFIQPQOY-IBGZPJMESA-N 409.534 2.423 10 20 HECD O=C1/C(=C/c2ccc([N+](=O)[O-])c(O)c2)SC(=S)N1CCCN1CCOCC1 748357389 BOMFPNDINHUQLW-PTNGSMBKSA-N 409.489 2.224 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCC[C@H]1O 748619668 UNDUDAWBTWOZGY-LRXVAGHRSA-N 402.539 2.129 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751228435 QZMGAENFKQPWPL-UHFFFAOYSA-N 421.494 2.224 10 20 HECD Nc1ncc(Cl)cc1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751994235 MYGFJMLQPOYDRG-UHFFFAOYSA-N 410.927 2.004 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 755235023 HAOCJDAUEAAOHF-CYBMUJFWSA-N 409.446 2.495 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](C)Cn3cccn3)CC2)cc(OC)c1OC 759236940 GPRHJTGMIRRQRZ-INIZCTEOSA-N 417.510 2.077 10 20 HECD CCOC(=O)C[C@@H](C)CNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 760370119 GPEMUEQTTCPUOD-MRXNPFEDSA-N 408.518 2.356 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)cc2)C1 761116351 AENWGFJBXPKDCV-UUOWRZLLSA-N 418.497 2.282 10 20 HECD O=C(NCCc1ccccn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774125192 XQGOOLDLSUKSTN-UHFFFAOYSA-N 418.444 2.127 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 776078097 ZNHOEOZZCOMEQB-PXNSSMCTSA-N 409.552 2.020 10 20 HECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 788009444 ZGBDEEREMSDEMH-INIZCTEOSA-N 416.566 2.473 10 20 HECD CN1C(=O)Cc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc21 789370727 PSUXWLDDRSSLAW-SFHVURJKSA-N 423.469 2.057 10 20 HECD CO[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789816629 DSQRWUBADDQKQU-DMPWYTOCSA-N 421.513 2.083 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCCCSc3nccs3)ccc2[nH]1 792342964 KDTIVNXJQRLJMA-UHFFFAOYSA-N 417.516 2.221 10 20 HECD COCCn1c(-c2ccc[nH]2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802432937 JNSPQBDGJNDVPY-UHFFFAOYSA-N 400.458 2.394 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)CC[C@H]3C)cc2F)CC1 805007937 VNEZMCLHGBGJFW-IAGOWNOFSA-N 404.530 2.231 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC[C@@H]1O 806444015 XSBMSGVWNLPNEJ-DYVFJYSZSA-N 401.429 2.454 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1F 810357370 SBPAVRCVIGARNL-UHFFFAOYSA-N 409.364 2.211 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccnc3-n3cccn3)CC2)cc1 914718723 CEFRBUXXJCBZNK-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc4c3OCCO4)CC2)cc1 918461099 QJIMSISQRDLRGL-UHFFFAOYSA-N 411.458 2.144 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)O 919730247 UXPXYYWNEAKJCT-UHFFFAOYSA-N 404.488 2.317 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)on1 1796932673 PTZQLXQSLHWIAU-ACHSLPGTSA-N 421.457 2.028 10 20 HECD NC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1F 726853826 UTZHUMDEHGDLBH-UHFFFAOYSA-N 411.389 2.391 10 20 HECD COc1ccc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2n1 727617141 RTGLRIMGWQBFFS-UHFFFAOYSA-N 420.469 2.335 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OC)c(NC(C)=O)c2)c1 729064936 WMXUCSWJTHBGRP-LLVKDONJSA-N 401.419 2.184 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 730322956 OFJHBPLZMCOALZ-KRWDZBQOSA-N 421.563 2.202 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c(C)n1-c1cccc(F)c1 730659143 YYLUOBXZTSHHNG-UHFFFAOYSA-N 423.404 2.044 10 20 HECD C[C@@H](NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)C(=O)N(C)C 731036768 PYBSJWKHNFEEHH-OAHLLOKOSA-N 418.538 2.057 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H](CS(N)(=O)=O)C3)c2C)cc1 731881132 FBDTYJLYPIKVFX-MRXNPFEDSA-N 405.520 2.243 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 734217249 UTQUXHYGQZDBSU-SJORKVTESA-N 406.502 2.109 10 20 HECD C[C@@H](NC(=O)N1CCN([C@@H]2CCCN(C)C2)CC1)c1ccc(N2CCOCC2)cc1 734665486 XMQCOASUHTUQLS-DENIHFKCSA-N 415.582 2.006 10 20 HECD O=C(Cn1c(=O)nc(O)c2ccccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 735518586 VFGQJXOSOTZDAY-MRXNPFEDSA-N 409.442 2.016 10 20 HECD CNS(=O)(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1 736986914 ZLWZOSOVAAOPBC-UHFFFAOYSA-N 418.519 2.061 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1O 737285860 LSWLMJBTFRABMG-UHFFFAOYSA-N 411.458 2.168 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc(F)cc4)n3)cc2)C1 737516800 DORXSSHWGGDNNJ-MRXNPFEDSA-N 422.464 2.038 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccccc1Cn1cncn1 743957829 BYBZCDXEPCGXFP-UHFFFAOYSA-N 405.458 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@@H](C)C(=O)N(C)c4ccccc43)CC2)cc1 745985460 JAWHGWNMHYUXMI-GOSISDBHSA-N 422.529 2.463 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CSCc3cscn3)cc2)C1 746826826 RICCRTWHCMYZBR-HNNXBMFYSA-N 404.561 2.394 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1 747605921 FQWIJVWLQVZNMG-UHFFFAOYSA-N 416.452 2.175 10 20 HECD CC(C)CONC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 750540308 XIJMXWQLMIJSPV-UHFFFAOYSA-N 409.420 2.419 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCc2ccc3c(c2)CCCN3C)cn1 753447667 XZXBHIMLBVHCNY-WRONEBCDSA-N 415.563 2.301 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@H]1C(=O)N(C)Cc1ccccc1O 753834606 MBGOHHIHJYEPBK-SHPPOPEUSA-N 410.392 2.336 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(C[C@H]4CCCO4)CC3)CC2)cc1F 753934027 YGTOMXIMAXKWNK-LJQANCHMSA-N 420.529 2.309 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCc4ccc(OC)cc4C3)CC2)cc1 754019246 RORHPGNZJGNAFD-JOCHJYFZSA-N 411.546 2.245 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 756094399 KNVDKTQBMGHECP-QIJZPMMNSA-N 424.545 2.480 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 757675478 KHIKEINYVCQBAW-LBPRGKRZSA-N 408.432 2.212 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCO1 764227698 GYGQVFVBMOLRDL-QGZVFWFLSA-N 422.545 2.087 10 20 HECD CCOCCCNC(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765056267 MSNKTVSRGYUIDU-UHFFFAOYSA-N 404.448 2.180 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)cc1F 767080607 MUUUVBUFSCMRKS-UHFFFAOYSA-N 415.512 2.132 10 20 HECD C[C@@H](O)CNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 769106397 LSUQPVVYYGVUTC-TZZQWBKVSA-N 415.334 2.147 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)c2cccc(O)c2)cc1 769691664 QIVASMPBUVWTSD-NRFANRHFSA-N 411.502 2.396 10 20 HECD CCC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nn[nH]n1 769958688 ZOTACPPQEVRCNE-GFCCVEGCSA-N 422.492 2.039 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCO[C@@H]3C)cc2F)C[C@@H](C)O1 771086722 MIGBRPAWQHETKW-JYYAWHABSA-N 408.470 2.024 10 20 HECD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1Br 774364181 SBMGAPPSGVDRFW-UHFFFAOYSA-N 409.236 2.166 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)N2CCCC2)c1 775087902 WTJYMQVDQJRCGS-JOCHJYFZSA-N 424.545 2.331 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCCOC(C)C)CC2)cc1 778287379 JPOTWRYSHFUYSG-KHPPLWFESA-N 403.523 2.174 10 20 HECD O=C(CNC(=O)c1cccc(O)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 779001002 OUDGBAGXGGAMLK-KRWDZBQOSA-N 417.893 2.262 10 20 HECD CCc1nc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 785412387 JFHGUEUAYSLFHU-UHFFFAOYSA-N 408.461 2.292 10 20 HECD Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 786225177 OQFSQKBVDSRPGA-RTWAWAEBSA-N 424.545 2.100 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)NCc3ccc(O)c(O)c3)n[nH]2)C1 787448230 CFUNCAGRDPWKBL-CYBMUJFWSA-N 402.451 2.475 10 20 HECD CC(C)(C)OC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788929499 KLWDWGISKIVVJJ-KRWDZBQOSA-N 401.507 2.093 10 20 HECD CCC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 789819952 PICFJUXHDYATNT-JFIYKMOQSA-N 421.513 2.083 10 20 HECD CCc1cnc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789861028 PFGXLFXTEFZRIB-UHFFFAOYSA-N 418.588 2.234 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@](C)(O)Cn1ccc(C)cc1=O 790811666 CFNWJIRTMJMFTM-LJQANCHMSA-N 423.307 2.425 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)c2cn(C)cn2)NC(=O)OC(C)(C)C)cc1 795249215 QGBAAIDRLRNGRA-INIZCTEOSA-N 423.539 2.030 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1 799773166 RSLVQPRPIVUKKF-UHFFFAOYSA-N 406.899 2.373 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](S(C)(=O)=O)CC3)CC2)cc1 800704681 LJIFBMGMISQDIX-LJQANCHMSA-N 409.552 2.273 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CN(C(=O)OC(C)(C)C)C2)cc1 804749002 GYNISFALZNIEAY-UHFFFAOYSA-N 418.538 2.227 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](N4CCCC4)C[C@H]3C)CC2)cc1 805014400 ZAFFQXGJFAYPIN-CTNGQTDRSA-N 415.582 2.085 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(C(=O)N(C)C)CCCC1 806263144 BYCRRZHSNZQZHV-UHFFFAOYSA-N 416.566 2.254 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1cccc2[nH]ccc12 806583502 WECQPPDGTUUTTR-UHFFFAOYSA-N 420.513 2.322 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](OCc2c(C)noc2C)C1 807098963 HCLYAJLSTUFLDI-IBGZPJMESA-N 414.506 2.100 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c2ccccc21 807100493 OCNVRALABPMUKL-FQEVSTJZSA-N 408.502 2.291 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1 807288013 RDMFUSMWGXSBOW-NRFANRHFSA-N 410.493 2.237 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 807289505 XEEDJWKCMFQGIU-UHFFFAOYSA-N 404.514 2.023 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H](c4ccccc4)OC3=O)cc2)C1 809617365 OJSIXVTYXIBQBC-HMXCVIKNSA-N 421.497 2.309 10 20 HECD COc1ccccc1CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334982 JIVJSVQREQTJFA-UHFFFAOYSA-N 402.516 2.179 10 20 HECD NC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 919970888 HXZBTTITBGNCHM-IBGZPJMESA-N 414.481 2.203 10 20 HECD Cc1cnn(CC2CC2)c1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1261647850 KGBXUFQBHGXTIP-UHFFFAOYSA-N 417.535 2.158 10 20 HECD CC(C)[C@@]1(CO)CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 1324148648 XFWMKIPGIHZOEM-PNCHPQGNSA-N 421.557 2.396 10 20 HECD COCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781754372 ZILXAZYRNZDRSC-HSZRJFAPSA-N 411.502 2.184 10 20 HECD COCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1793562936 RNIATJBMHBGYNB-BTTYYORXSA-N 408.882 2.430 10 20 HECD C/C=C(/C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499538 LOWIMTQVSOMPQM-WVVNNJFASA-N 421.548 2.228 10 20 HECD CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845399407 WTAAOBBJZMXUFP-GOSISDBHSA-N 422.529 2.436 10 20 HECD O=C(/C=C/c1cnccn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502321 LAQZPVGZPCBTGY-NSCUHMNNSA-N 414.849 2.072 10 20 HECD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847779546 XWGCTLKRBFMTDB-VJANTYMQSA-N 423.469 2.121 10 20 HECD Cc1cc(C(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 729342087 XGORFUIWJAELTN-ROUUACIJSA-N 417.531 2.297 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCCC[C@H]2CNS(C)(=O)=O)cc1F 731404504 NUYVAEVWZRHDHS-INIZCTEOSA-N 414.547 2.285 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1cc2c(nc1O)CCC2 733643899 AFYNZPRPDUSOPB-UHFFFAOYSA-N 400.454 2.251 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1 734072473 BMADGROQHZMVHV-UHFFFAOYSA-N 411.458 2.328 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 734214749 AVXYCDNPTIFYRW-WOJBJXKFSA-N 416.566 2.342 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 734667064 SRIDQPDOFZZRRQ-JOCHJYFZSA-N 409.490 2.115 10 20 HECD COCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741090734 MRTHOIOUYAPGHZ-UHFFFAOYSA-N 400.523 2.137 10 20 HECD CC(C)[C@H]1C(=O)NCCN1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905345 NKWABUDMIVMCHE-YOEHRIQHSA-N 410.465 2.423 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 746177466 NVMAMCGGNHLKAP-UHFFFAOYSA-N 409.439 2.391 10 20 HECD CN1CCN(S(=O)(=O)c2ccc(NCCCSc3nccs3)nc2)CC1 746461050 NOOBMKAYJIIBRN-UHFFFAOYSA-N 413.594 2.069 10 20 HECD CCCCN(CCO)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 746678844 XNOKWCTYYGCIHT-UHFFFAOYSA-N 407.536 2.019 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H]4[C@H](CCCN4C4CC4)C3)CC2)cc1 749513367 DHKOEVCDJBKDFP-XXBNENTESA-N 412.578 2.293 10 20 HECD Cc1ccc(C(=O)N2CCN(Cc3nc(-c4cccs4)no3)CC2)c(O)c1O 751533161 LLOQZTBDONQRRI-UHFFFAOYSA-N 400.460 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CC2)cc1F 753934023 YGTOMXIMAXKWNK-IBGZPJMESA-N 420.529 2.309 10 20 HECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NCc1ccc3c(c1)CCCN3C)C2=O 756957636 XOYNJMWXVQTUED-RSQQPWMTSA-N 412.534 2.432 10 20 HECD COc1ccc(CC(=O)O)cc1S(=O)(=O)NCCCSc1nccs1 761298065 WYDGXJORIFGNLW-UHFFFAOYSA-N 402.519 2.240 10 20 HECD Cn1cnn(-c2ccc(NC(=O)NCc3cccc(Br)c3O)cc2)c1=O 765330770 YCWPWTHGNFSACO-UHFFFAOYSA-N 418.251 2.361 10 20 HECD C[C@H](C[S@](C)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768448965 QIKTVMXYGHZMEC-NDHGSNPTSA-N 416.546 2.094 10 20 HECD O=C(N[C@H](CO)CC(F)(F)F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771197377 SHTJSIRBIZCNOV-JTQLQIEISA-N 424.422 2.298 10 20 HECD COC(=O)c1sc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc1Cl 771197908 VKUXWKILVXCJKP-UHFFFAOYSA-N 415.924 2.430 10 20 HECD O=C(COC(=O)c1ccnc(C2CC2)c1)NCc1ccc(N2CCOCC2)c(F)c1 783247499 MTHFAFMLFZPBLH-UHFFFAOYSA-N 413.449 2.408 10 20 HECD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785294041 KASGTHDXXDNWGJ-CQSZACIVSA-N 413.474 2.230 10 20 HECD CCOc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 787190734 BDICTJNHEZGQOX-KRWDZBQOSA-N 411.502 2.416 10 20 HECD COC(=O)[C@@](C)(CNC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1 787261500 KGRKLNMUFLRHBM-QHCPKHFHSA-N 411.502 2.453 10 20 HECD CN1C[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2C1=O 787378490 NZMYXBVKERYHFD-QFIPXVFZSA-N 407.514 2.381 10 20 HECD CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 788008792 UGSYUNFPTSLAMS-UHFFFAOYSA-N 420.529 2.051 10 20 HECD COc1ccc([C@@H](C)N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788324057 QYIGXHORYAHUJM-QGZVFWFLSA-N 411.502 2.368 10 20 HECD CCOc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 800013861 JXFAFXDFDZZQLF-QGZVFWFLSA-N 417.531 2.266 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)CCNS(=O)(=O)c2ccccc2)c1O 802660091 AWDWLFXQYINEHL-ZDUSSCGKSA-N 409.464 2.156 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(CC(C)C)C2)cc1F 804851656 KJIODEWLGJFIIA-SFHVURJKSA-N 406.546 2.382 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCOc1ccc(F)cc1F 804914277 TZJKNGAXVAAGIP-UHFFFAOYSA-N 401.460 2.215 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)cc2)CC1 805025097 IMYZYHUATQAILW-KRWDZBQOSA-N 416.566 2.301 10 20 HECD CN(Cc1ccon1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768710 ADLYFZMCIREZBI-ZDUSSCGKSA-N 408.405 2.020 10 20 HECD Cc1cc(C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1-c1ccc(Cl)cc1 807992177 ALMIQCTVWUFHPI-UHFFFAOYSA-N 400.870 2.384 10 20 HECD CCOC(=O)C1CCN(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)CC1 811704959 MNADONWGYGYXQN-UHFFFAOYSA-N 400.497 2.249 10 20 HECD COc1ccc(N2CCN(CCNC(=N)Nc3ccc(OC)c(OC)c3)CC2)cc1 849067199 NITFGVGBKGOPCU-UHFFFAOYSA-N 413.522 2.471 10 20 HECD Cc1oc(C)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C(=O)O 915216538 PGQKHQIDIKYYEC-UHFFFAOYSA-N 408.476 2.252 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCCc4nc(O)ccc43)cc2)C1 918119011 XNWALHUCUDRVDB-OXQOHEQNSA-N 423.517 2.366 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCCn2nc3n(c2=O)CCCC3)cc1 918218923 XYQUOSPIYWCFLV-UHFFFAOYSA-N 400.527 2.117 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(Cn2cccn2)cc1 919840837 ZAQATDNMUIGTOY-UHFFFAOYSA-N 410.499 2.419 10 20 HECD O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970506 HLOGLIWPBNPABT-UHFFFAOYSA-N 403.410 2.390 10 20 HECD CCOc1ccc(N2CCN([C@@H](C)C(=O)N3CCC(C(=O)OC)CC3)CC2)cc1 1253831552 FNMRRUHOVUBNGR-KRWDZBQOSA-N 403.523 2.007 10 20 HECD Cc1noc(N)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1788009218 NWGNWVWKAAPOAN-UHFFFAOYSA-N 423.429 2.433 10 20 HECD O=C(c1c(Cl)cncc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248788 NVCVXHUQFGJSFY-UHFFFAOYSA-N 423.256 2.325 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2coc(-c3ccccc3)n2)c1 116676998 FXYIHBSHXCZKIQ-UHFFFAOYSA-N 401.444 2.391 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCC(=O)N1CC(=O)Nc2ccccc21 437011797 XMJDYHBTAGBWHS-UHFFFAOYSA-N 408.458 2.244 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NCCc3ccccn3)CC2)cc1 726122781 RKFMOXCFSHGVTB-UHFFFAOYSA-N 413.591 2.309 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 727177580 MBKRCEUKTWTRHS-FLIBITNWSA-N 421.363 2.200 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1 729064141 PWRVOPMLAIWYLA-CYBMUJFWSA-N 411.458 2.417 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3cccc(F)c3)cc2)C1 731671743 OBEQVMVCPVWCLA-KRWDZBQOSA-N 405.495 2.147 10 20 HECD CCc1cc(NC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)n(C)n1 734935286 QGXVPEVPOWCCNC-UHFFFAOYSA-N 400.527 2.325 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 738336198 ZYUFTDMCSKGDHR-HXUWFJFHSA-N 400.567 2.294 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 738899526 MWSYUOFJJWGWMJ-UHFFFAOYSA-N 407.467 2.391 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743530001 CJIORZNGTGAVLF-UHFFFAOYSA-N 417.531 2.357 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cnn(Cc2ccccn2)c1 746362956 DIRHOZYNNWEGCO-UHFFFAOYSA-N 406.490 2.380 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)CN1C(=O)C[C@@H](Cc2cnn(C)c2)C1=O 746374145 JCWDTBYISQXFSK-HXUWFJFHSA-N 409.534 2.418 10 20 HECD O=C(COC(=O)c1cccc(Cl)n1)NCc1ccc(N2CCOCC2)c(F)c1 750163810 CWHKTBLTPGCOPM-UHFFFAOYSA-N 407.829 2.184 10 20 HECD C[C@H](Cn1ccnc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751064383 JMOLBSNNQTZEKC-GFCCVEGCSA-N 406.489 2.270 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(Cc2ccccc2)no1 752815541 KRHCRTSLWPYDRF-LBPRGKRZSA-N 416.459 2.229 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 753150613 PMQVYMVALMNHAD-YZPMEYCISA-N 415.534 2.221 10 20 HECD CCCN(CC(=O)OC(C)(C)C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 755316346 MVADEVYWJSMWQW-UHFFFAOYSA-N 405.539 2.398 10 20 HECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763878634 SQARIDZJZAQNGR-IZPCHGGPSA-N 410.495 2.101 10 20 HECD Cc1c(Br)cc(C(=O)NCc2ccc(N3CCOCC3)cc2)c(=O)n1C 765241089 HGRNJJKCYZLOAI-UHFFFAOYSA-N 420.307 2.223 10 20 HECD CNC(=O)COc1ccc(C(=O)NCc2cccc(Br)c2O)cc1OC 765763526 CRNZPQDDQSWMFP-UHFFFAOYSA-N 423.263 2.218 10 20 HECD Cc1c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1C1CCOCC1 766993352 MCGNPMWFKNUYLY-UHFFFAOYSA-N 414.506 2.424 10 20 HECD O=C(Cc1ccnc(O)c1Br)NCc1ccc(N2CCOCC2)cc1 772146982 WRUOVPGFTZFDEO-UHFFFAOYSA-N 406.280 2.245 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccoc3)cc2F)C[C@@H](C)O1 772575397 YUFRDYUROAASSL-HUUCEWRRSA-N 404.438 2.434 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccccn3)cc2F)C[C@@H](C)O1 774883846 GBXJSECHPJFYMW-XHSDSOJGSA-N 414.481 2.328 10 20 HECD CC(C)(C)OCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777955196 VQYICSPNVMPTEW-UHFFFAOYSA-N 401.486 2.374 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3cnc(C)s3)CC2)cc1 778241609 CJMBIVJFPKXBTC-HJWRWDBZSA-N 414.531 2.324 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c(C)s1 780914460 KAPWZXCYDACWJX-UHFFFAOYSA-N 410.517 2.231 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC([C@H]4CCOC4)CC3)CC2)cc1 784252646 SUCGTAYMXDTQQW-FQEVSTJZSA-N 416.566 2.275 10 20 HECD Cc1ncccc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768327 WFDFYJYVJMGNLP-INIZCTEOSA-N 402.882 2.468 10 20 HECD Cc1ccccc1CN1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785423691 GODBGGNQGMCRGF-UHFFFAOYSA-N 408.546 2.458 10 20 HECD Cc1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 785967633 BUULQBCLDVZKDC-GASCZTMLSA-N 419.453 2.138 10 20 HECD C[C@H]1OCC[C@@]12CN(CC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CCO2 791584764 HKSRRPMVOWIWQQ-OYLFLEFRSA-N 420.465 2.280 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2c(O)ccc(Cl)c2F)CC1 792157590 YZNQZOCDFBDZNF-UHFFFAOYSA-N 403.863 2.296 10 20 HECD CC(C)N(C)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248512 DQRNZDVQBIIZBI-KRWDZBQOSA-N 414.572 2.493 10 20 HECD COc1cccc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803297298 PXYDKKWRJJOGNB-KRWDZBQOSA-N 411.502 2.368 10 20 HECD C[C@H](NC(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 804313395 YRNJFQPOYNDDPD-HNNXBMFYSA-N 418.538 2.446 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(F)c(CN(C)C)c1)c1ccc(N(C)C)cc1 806042980 BQKDSXZSIRCTQB-OAHLLOKOSA-N 400.498 2.447 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1 807100965 PAWJQMUZKHWLEN-KRWDZBQOSA-N 420.517 2.478 10 20 HECD C[C@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 808280501 LXMHAWMBDXSERX-APWZRJJASA-N 404.507 2.364 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](CS(C)(=O)=O)c1ccccc1 816825542 GKLLFKOZVPULKA-OAQYLSRUSA-N 416.543 2.310 10 20 HECD O=C(CC1(CC(=O)N2CCOCC2)CCCC1)OCC(=O)c1ccc(O)c(O)c1 1343926289 JRZPPESSGLEADP-UHFFFAOYSA-N 405.447 2.023 10 20 HECD CC1=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CCO1 1827281945 IUGOEIRLZLMNGZ-GOSISDBHSA-N 415.490 2.420 10 20 HECD Cn1cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426856 KVDXSZIDTXIBIL-QGZVFWFLSA-N 412.490 2.378 10 20 HECD O=C(c1ccc(F)cn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501052 UBLJPSBCKUXQIP-UHFFFAOYSA-N 405.813 2.416 10 20 HECD Cc1cnn([C@H](C)C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1 1845502277 IINXLTICDYARNM-CYBMUJFWSA-N 418.881 2.334 10 20 HECD COc1ccc([C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847465989 KPKXNYMYIOCIHC-BVGQSLNGSA-N 411.458 2.121 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3ccc4nnc(C(F)(F)F)n4n3)cc2)CC1 302735459 ZDDXESGTAKAUKM-UHFFFAOYSA-N 419.411 2.424 10 20 HECD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)N1CCOc2cc(N(C)C)ccc21 475967650 VPFDTSHBXXASFW-LJQANCHMSA-N 410.453 2.396 10 20 HECD COc1ccc([C@H](CNC(=O)NCc2cc(OC)ccc2O)N2CCOCC2)cc1 734065113 PWWRHRCRYOQFPO-FQEVSTJZSA-N 415.490 2.282 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](OCC(F)(F)F)C3)nc12 738320700 PJIFWWILWKVWPZ-GFCCVEGCSA-N 402.373 2.155 10 20 HECD O=C(CCNC(=O)OCC(F)(F)F)NCc1ccc(N2CCC(CO)CC2)cc1 744325350 CYEDHCALYODIKX-UHFFFAOYSA-N 417.428 2.190 10 20 HECD CC(C)CO[C@H](C)c1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 744854783 MRXMJYNTZFBJCG-LLVKDONJSA-N 413.452 2.237 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnn(Cc3ccccn3)c2)cc1 746363918 CUEYAVKPSWRDJX-UHFFFAOYSA-N 406.490 2.428 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC[C@@H]3c3ccccc3)CC2)cc1 754052703 YBGBWXMCNNJJSD-ISKFKSNPSA-N 411.546 2.252 10 20 HECD COC[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C)o1 754347900 NDWAPXBNPCXWQJ-SFHVURJKSA-N 405.470 2.157 10 20 HECD NS(=O)(=O)c1ccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2O)cc1 756330520 XUFUYRVZMGROJU-UHFFFAOYSA-N 415.471 2.274 10 20 HECD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 758378997 CHBHOTXXNKFNDY-ZDUSSCGKSA-N 405.842 2.325 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c2C)cc1 758484663 OBSADYBKXOPJLT-AWEZNQCLSA-N 422.503 2.156 10 20 HECD COCCC1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC1 760828616 KTJWHDQODUKVQO-SFHVURJKSA-N 402.539 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(Nc4ccccn4)CC3)CC2)cc1 761120101 TUTFOILWOZEZLH-UHFFFAOYSA-N 409.534 2.315 10 20 HECD Cc1cccc(F)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 775277478 FAEWAVDPJDRQQJ-UHFFFAOYSA-N 402.425 2.005 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@@H](n2cncn2)C1 776857192 XCQXGHFOBLQOSU-MRXNPFEDSA-N 424.427 2.290 10 20 HECD CO[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 783022860 ZKCVRKFDVOKAIA-SFHVURJKSA-N 419.547 2.425 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 785296098 BNDWHCBKHZCLTN-NSHDSACASA-N 415.837 2.018 10 20 HECD C[C@@]1(CCCO)CCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855897 ZSEZCYBNYGKWBG-NRFANRHFSA-N 405.564 2.010 10 20 HECD COc1c(NS(=O)(=O)c2cccc3nonc23)cc(Cl)cc1C(=O)N(C)C 790098784 VNZZNLUETVBODU-UHFFFAOYSA-N 410.839 2.387 10 20 HECD CN(C)c1ccc(CNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1F 792104579 JCTGMTJNPLBBCM-UHFFFAOYSA-N 408.518 2.451 10 20 HECD CC[C@@H](C)NC(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 793663156 DHRNUHBIZQUSEG-QGZVFWFLSA-N 416.566 2.493 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4ccccc4c(=O)o3)cc2)CC1 797758548 RAHYODWFQQUWCP-UHFFFAOYSA-N 405.454 2.392 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)cc2Cl)C1 800719783 NOTQJFALPGAVQU-DYVFJYSZSA-N 419.913 2.022 10 20 HECD CC(C)N(CCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803312272 WPQYULIAEXALLK-IBGZPJMESA-N 418.582 2.326 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2ccccc2C1 803886258 IGKCNWHIPZACLP-IBGZPJMESA-N 418.541 2.242 10 20 HECD CCOC1CC(N(C)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 806333616 KUPFSHVZRPXOMR-UHFFFAOYSA-N 404.555 2.416 10 20 HECD CC(C)Cn1ccnc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807387555 NYQRGXNDLYJEPK-GOSISDBHSA-N 414.506 2.069 10 20 HECD CN(Cc1cscn1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769097 DCUFHYGLTZUFJZ-ZDUSSCGKSA-N 424.473 2.488 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCCN2CCCO[C@@H](C)C2)cc1 807927902 BYRMBULWLNKVMX-IBGZPJMESA-N 418.582 2.108 10 20 HECD O=C(NCCCO[C@@H]1CCOC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 808275767 JJUPKOGLOASQMC-LJQANCHMSA-N 404.507 2.365 10 20 HECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@@H]3C3CC3)CC2)cc(OC)c1OC 811764046 NLZOOKPFMLECQZ-FQEVSTJZSA-N 403.523 2.439 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2c(F)cccc2NS(C)(=O)=O)cc1F 1319547680 BMGDJNYQZIIIIO-UHFFFAOYSA-N 412.462 2.402 10 20 HECD Cn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)c1 1816305904 MJUZOSKQYZMIFT-OAHLLOKOSA-N 410.434 2.174 10 20 HECD C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825104039 XZLYBAZMLZQMEZ-GSTVFTAWSA-N 400.460 2.307 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)C1 1845806054 XQBAYTZTXIBUTQ-DJSGYFEHSA-N 406.891 2.443 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1 8171843 NAYDTCFJNKUPNN-UHFFFAOYSA-N 412.309 2.093 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)CCc3ccccc3)CC2)cc1 12069021 HILGTSKMJOMLLQ-UHFFFAOYSA-N 417.575 2.369 10 20 HECD Cn1cc(/C=C2\CCn3c2nc2scc(-c4ccccc4)c2c3=O)c(=O)n(C)c1=O 25251679 ULCGQYUHWGFMJN-GXDHUFHOSA-N 418.478 2.467 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)C[C@@H]2COc3ccccc3O2)n(C)c2ccccc12 579047156 PDJXOOQUSKINIM-MRXNPFEDSA-N 407.470 2.401 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(N3CCCC3=O)CC2)c1 729469143 ZBXBYOXOYITQFB-UHFFFAOYSA-N 415.534 2.014 10 20 HECD Cc1noc(COc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)n1 734017225 HKVGDBJPENBAFF-UHFFFAOYSA-N 418.431 2.286 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)c1 734064971 PAFCGJGBZWAUHW-UHFFFAOYSA-N 421.519 2.228 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccncc1F 741182041 UNOALTQKRBULFO-UHFFFAOYSA-N 410.428 2.406 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cn(Cc4ccccn4)nn3)cc2F)C[C@@H](C)O1 742556921 OLZYGMYJSDVNER-HZPDHXFCSA-N 424.480 2.404 10 20 HECD CCCCn1ncc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C 746366237 SEVMPXDUQWCTSN-UHFFFAOYSA-N 413.522 2.425 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)oc1C 751137680 UHUHFHAAAQVREP-OAHLLOKOSA-N 409.460 2.450 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1 752005165 NXEHCLLIZSOAKV-IIBYNOLFSA-N 401.511 2.053 10 20 HECD CN(C)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1 752624057 SSXVKBXGDSFBID-UHFFFAOYSA-N 416.956 2.245 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(C)o1 754747019 OFFVVUKVGWINKP-UHFFFAOYSA-N 422.868 2.200 10 20 HECD CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 760378029 LICPXRRHDOZTNM-MRXNPFEDSA-N 416.522 2.062 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCS(=O)(=O)c1ccccc1 761084406 GBBKVOQREGKUDA-UHFFFAOYSA-N 408.863 2.284 10 20 HECD C[C@@]1(c2ccccc2)NC(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 761126828 UVPVHKKIBNSNTI-HXOBKFHXSA-N 406.486 2.356 10 20 HECD Cc1noc(C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)n1 765665354 BZDARSILQAUCDS-UHFFFAOYSA-N 420.472 2.186 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1 768909960 FQLIAHODVAWHAZ-CYBMUJFWSA-N 421.471 2.213 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nnc(C(F)F)s3)CC2)cc1 778245905 MWWQQSYZIZHDBF-VOTSOKGWSA-N 423.445 2.328 10 20 HECD CCN(CCc1ccccn1)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778247799 ONOGODQZPFXRKW-VAWYXSNFSA-N 422.529 2.386 10 20 HECD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(O)c(O)c2)(c2ccccc2)CC1 778916470 IASAIUKPLKBKDP-UHFFFAOYSA-N 418.515 2.098 10 20 HECD COc1cccc(OC)c1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407810 PLFLYIJWVRIHMW-UHFFFAOYSA-N 419.503 2.173 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](C(=O)O)c1ccccc1 780607520 DKWZIZDJZQPVDT-IBGZPJMESA-N 401.438 2.412 10 20 HECD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296345 DMFDJLWSIPGCCR-ZDUSSCGKSA-N 411.458 2.441 10 20 HECD COCCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 787994188 MQJNORXGSRFMHB-UHFFFAOYSA-N 409.486 2.021 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1=O 789525295 LFZATPULAMSQSB-JOCHJYFZSA-N 408.546 2.444 10 20 HECD CS[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824228 HEWCXODIRNUYTJ-YALNPMBYSA-N 423.554 2.456 10 20 HECD COc1cc(CN2CC[C@@H](NC(=O)NCc3ccc(OC)cc3O)C2)cc(OC)c1 793096593 ANHWHLYZZLEDGA-QGZVFWFLSA-N 415.490 2.492 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cc4c(cc3C)OCO4)c2)CC1 794875646 SXFGFAYZMYBPEP-UHFFFAOYSA-N 417.487 2.193 10 20 HECD Cc1cnn(C)c1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 795802019 OKYAEQQTTBLAMM-UHFFFAOYSA-N 418.441 2.062 10 20 HECD CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C1CCOCC1 803304941 FSRXLHBEZHMFNU-OXQOHEQNSA-N 403.523 2.022 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H]1C 803310482 KLXUPOQGMLLRGX-WFXMLNOXSA-N 416.566 2.032 10 20 HECD Cn1ccnc1[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cccc(O)c1O 803548827 CCMFKESNKUHTOV-CQSZACIVSA-N 402.451 2.266 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 803564571 ODLXBXLCNVCIFL-LJQANCHMSA-N 400.567 2.480 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CCC[C@H]1OC 804109666 NQLDAWZTKFZKLM-BLLLJJGKSA-N 413.312 2.435 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)c3c(C)noc3C)CC2)cc1 804317500 FSRPGXKQVZTIHC-AWEZNQCLSA-N 414.506 2.305 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 804318354 IIZCRMRXSGUHKB-YLJYHZDGSA-N 416.566 2.111 10 20 HECD COc1cccc([C@@H]2CN(C(=O)C(=O)NCCCSc3nccs3)CCO2)c1 806282715 QZNWMAUZLCXNAW-INIZCTEOSA-N 421.544 2.350 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769415 UHEXUBVEIDLGJN-GDBMZVCRSA-N 411.449 2.010 10 20 HECD CC[C@@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1O 810225699 KJZFTRWWVDLQTM-NVXWUHKLSA-N 415.456 2.385 10 20 HECD COC[C@@H](C)[C@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 812811642 YTMBXCMYUIEOTE-CVEARBPZSA-N 402.495 2.356 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCc2nncn2C1 814320564 VWPWYLSPJFKQSS-CQSZACIVSA-N 409.412 2.012 10 20 HECD CC(C)[C@@H](NC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 920635152 DCLJKTAHSWIXFM-LJQANCHMSA-N 420.487 2.434 10 20 HECD Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920865394 AGFOKZSPNKSFDD-CQSZACIVSA-N 420.487 2.275 10 20 HECD O=C(COC(=O)c1ncc(Cl)s1)NCc1ccc(N2CCOCC2)c(F)c1 1116894201 FPQXUUMYZLOPEF-UHFFFAOYSA-N 413.858 2.245 10 20 HECD CN(C)S(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1 1323882610 MQFUBASZNNREJD-UHFFFAOYSA-N 408.499 2.044 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc([S@](C)=O)c3)CC2)cc1 735573901 JQWAHZJZDLGJAH-LJAQVGFWSA-N 416.547 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cccc(C[S@](C)=O)c3)CC2)cc1 735919810 UTXNJIDBCXVFRA-NDEPHWFRSA-N 401.532 2.334 10 20 HECD CCN1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc21 737144322 DPDWFFRVKPBVDO-UHFFFAOYSA-N 408.502 2.161 10 20 HECD COCCCNC(=O)[C@H](C)N1CCN(Cc2c(O)ccc3ccc(OC)cc23)CC1 738169232 GFOLJJZLYKHZPJ-KRWDZBQOSA-N 415.534 2.213 10 20 HECD CN(C)c1ccc(CNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1F 740702106 LZTFHCPMIOVMBW-MUUNZHRXSA-N 406.479 2.477 10 20 HECD Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741915033 RDRZVQDGFLHJRS-BEFAXECRSA-N 411.550 2.234 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n(C)n1 743975073 MOQIZDIQTBUBGL-ZDUSSCGKSA-N 407.421 2.054 10 20 HECD Cc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 746037524 FTTSXBCJRMSHPD-OKILXGFUSA-N 400.454 2.398 10 20 HECD COc1cccc(C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)n2nnnc2C)c1 746805286 PBNXRPTYSRHVDC-FQEVSTJZSA-N 412.469 2.295 10 20 HECD O=C1OCc2c1cccc2S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751238110 XEKQLHKNATXQTR-UHFFFAOYSA-N 416.499 2.044 10 20 HECD Cc1cc(C(=O)NCCC(=O)NC(N)=O)c(C)n1-c1cccc(Br)c1 753440917 HAWCZIUESLMAKX-UHFFFAOYSA-N 407.268 2.171 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 756396594 PPHQGQNDSOCDGK-AWEZNQCLSA-N 403.479 2.474 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3sc(C)nc3C)cc2F)CC1 757261244 OCILFOLJYDZESZ-UHFFFAOYSA-N 419.526 2.296 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)CC2)cc1F 759253534 BCCAFAMJQRDZHQ-UHFFFAOYSA-N 417.462 2.187 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 760570397 VHJMSDXLTLGMQM-UHFFFAOYSA-N 409.439 2.174 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cnn(CC(F)(F)F)c1 772349938 NOWVZSXZFDJTOG-UHFFFAOYSA-N 418.441 2.103 10 20 HECD C[C@H]1C(=O)N(C)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 778127424 NRTCFKXDTNQNKR-SEVUAYLXSA-N 423.585 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@H](C)[C@H](OC)C3(C)C)CC2)cc1 778420578 XQJPASOJXRHWBG-HXRQLVFQSA-N 415.534 2.076 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](C)C(=O)Nc4ccccc43)CC2)cc1 779224899 JNMUYEZVNZROFW-AZUAARDMSA-N 424.545 2.273 10 20 HECD Cc1ccc(S(=O)(=O)NCCCC(=O)OCC(=O)c2ccc(O)c(O)c2)cc1C 782385806 BDSSHNDOIGZIFE-UHFFFAOYSA-N 421.471 2.199 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(C)c1 786120482 NJNIWIAEQOZLTL-UHFFFAOYSA-N 417.531 2.151 10 20 HECD CC(C)C[C@@H](CCO)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789869598 WJZLQGSRMHHNIU-GOSISDBHSA-N 407.580 2.017 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)COc1ccccc1)c1ccc(N2CCOCC2)cc1 793685290 HGROMURLHLHHAB-MSOLQXFVSA-N 411.502 2.284 10 20 HECD C[C@@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)NCCF 800710831 XRIKKGVTEHPSKR-OLZOCXBDSA-N 402.417 2.030 10 20 HECD CC[C@@H](O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686988 SKXGTRFNVGBCSM-OAQYLSRUSA-N 409.530 2.485 10 20 HECD CN(C)CCCC1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803688693 YYPKEKQLDMTWCP-UHFFFAOYSA-N 400.567 2.266 10 20 HECD CN(Cc1ccc2c(c1)OCCO2)C(=O)C(=O)NCCCSc1nccs1 806276174 KAMITLRFTVOBHV-UHFFFAOYSA-N 407.517 2.171 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807310068 YHYLEGWYIMTZIY-RDTXWAMCSA-N 415.490 2.252 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@H](C4CCC4)C3)CC2)cc1 813610480 LGHPTUVXXFIOKD-HXUWFJFHSA-N 416.566 2.275 10 20 HECD CN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1(C)C 816505811 IXQCOYVZGGVZCP-UHFFFAOYSA-N 409.533 2.421 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1OC 816665913 ZYOGKUCJDWFRLN-UHFFFAOYSA-N 401.419 2.276 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(S(N)(=O)=O)cn2C)cc1 914455861 DWGNZOGYELWWEY-UHFFFAOYSA-N 416.503 2.174 10 20 HECD O=C(Cn1nc(-c2ccccc2)ccc1=O)NCc1ccc(N2CCOCC2)c(F)c1 917706831 UVWKAYMCQPXWMW-UHFFFAOYSA-N 422.460 2.202 10 20 HECD CC(C)C(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917836392 NGHNLBGNYQZHOP-QUCCMNQESA-N 414.550 2.042 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cccc1[N+](=O)[O-] 918333979 DOMKPPKUWSUCKJ-UHFFFAOYSA-N 403.460 2.068 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCCCO2 918336419 ZTVRNXZVTLPFIP-UHFFFAOYSA-N 416.499 2.013 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1 918777787 SAHOYAVCQUABCM-UHFFFAOYSA-N 404.448 2.151 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc1 1336289113 BRJHDZZFRGZWLV-UHFFFAOYSA-N 402.476 2.441 10 20 HECD O=C(Cc1cncnc1)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1786934002 XRFCOKMTCBXVNL-UHFFFAOYSA-N 419.441 2.273 10 20 HECD CC1=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CCO1 1796402933 DOJMMVWXCVQBSH-VBUUOAMHSA-N 422.485 2.112 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441750 OQJWWTSGLJAGBS-AEFFLSMTSA-N 408.502 2.419 10 20 HECD C[C@@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N(C)Cc1ccc(N2CCCCC2)cc1 16386874 YPRPZLXRNHKTKR-FXAWDEMLSA-N 407.580 2.143 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(F)c(C)c3)CC2)cc1 56966092 NLLBILWVGAEOMV-UHFFFAOYSA-N 407.511 2.243 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccsc3C(=O)OC)CC2)cc1 107136252 DEXQOQWBZUGUSG-UHFFFAOYSA-N 410.517 2.444 10 20 HECD CC(C)[C@H](CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCOCC1 139999789 VVIAWRYXHPRKIW-NQIIRXRSSA-N 404.555 2.240 10 20 HECD Cc1nc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)c2cnn(C)c2n1 480837767 AREWPKCVMXOKBU-UHFFFAOYSA-N 402.458 2.495 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCCC3)C2)n(C)c2ccccc12 570080402 RBJCXPMAZXNRJM-SFHVURJKSA-N 424.545 2.400 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H]3CN3CCCC3)CC2)cc1 729606868 JYABXLMZUNLKOZ-NRFANRHFSA-N 415.582 2.087 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)cc2F)CC1 730194603 NIJFVGUUABIKJA-UHFFFAOYSA-N 418.473 2.124 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)cc1 735257129 JPPNWSNALFRLSZ-UHFFFAOYSA-N 407.474 2.402 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1F 743598527 LMVXUSCDWQQLIT-KSSFIOAISA-N 416.501 2.399 10 20 HECD C[C@@H](NC(=O)N1CCO[C@@H](C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 746755548 FMYUADKEHMVXAI-VQIMIIECSA-N 419.522 2.336 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(N4CC=CC4)cc3)nc12 747704068 AZHUUDIIAPATCS-UHFFFAOYSA-N 408.414 2.345 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)s1 754040034 JNMOBXPUBPNTHL-UHFFFAOYSA-N 414.480 2.193 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H]1C 754388874 WMZSTBXDWISQGY-SQNIBIBYSA-N 406.546 2.082 10 20 HECD COc1ccc(O)c([C@H](C)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 756362194 JJBUACUQBAYHLJ-HNNXBMFYSA-N 406.504 2.273 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN(CC4CC4)C3)CC2)cc(OC)c1OC 759268394 RISZLFUGIQPFNI-QGZVFWFLSA-N 418.538 2.028 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnc1Cl 760092676 SRAJTEJLLCZGTA-UHFFFAOYSA-N 420.872 2.399 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@H]3CO)cc2)C1 762274281 YQYMSWRWUWHCEV-SIKLNZKXSA-N 422.529 2.190 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(OC(F)F)n(C)n1 768388858 KHOMHVKGYRWLCT-UHFFFAOYSA-N 403.769 2.196 10 20 HECD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913767 AOGGRIJUPGLADA-HNNXBMFYSA-N 407.858 2.321 10 20 HECD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 769692206 ZBOHFMHFNBKZDQ-AWEZNQCLSA-N 413.440 2.417 10 20 HECD CCOC(=O)CN(Cc1ccc(F)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769744160 KQMJQJAECKJIQY-UHFFFAOYSA-N 424.450 2.108 10 20 HECD COCCN(C(=O)NCc1ccc(N2CCC(C)CC2)cc1)[C@@H]1CCS(=O)(=O)C1 774207953 CLGCVVVXIOSZCH-HXUWFJFHSA-N 423.579 2.268 10 20 HECD COc1cc(CNCc2ccc([N+](=O)[O-])c(OC)c2O)ccc1OCC(=O)N(C)C 774976504 KUTAAOQKPCDTOO-UHFFFAOYSA-N 419.434 2.074 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](Cc1ccccc1)C(=O)O 780445778 RCNFQXCXKPYERT-GOSISDBHSA-N 401.438 2.157 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1F 781828761 YPNHEUULNNTZEY-LJQANCHMSA-N 400.498 2.458 10 20 HECD COC(=O)CCc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 786335853 QLBAGAFGLZIXTF-UHFFFAOYSA-N 407.470 2.423 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCc2ccccc21 788334611 XXSQSHFNPRENSV-FQEVSTJZSA-N 407.514 2.376 10 20 HECD COc1ccc(N2CCC(NC(=O)N(C)CCN3CCOC(C)(C)C3)CC2)cc1 788957883 QHXWLSPYEHTOGF-UHFFFAOYSA-N 404.555 2.416 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(OC(F)F)cn2)cc1 788977336 JFIUHWFPRJCWDJ-UHFFFAOYSA-N 406.433 2.462 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1 789836772 TZKQXKWVADSOGR-OAHLLOKOSA-N 413.474 2.252 10 20 HECD C[C@](O)(CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)(F)F 798406872 ZHQVAOHWBUNZFD-SFHVURJKSA-N 413.419 2.345 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 802173250 VMTIHJZPGPRLTI-HXUWFJFHSA-N 404.555 2.110 10 20 HECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H](C)CO1 803450994 BEVRCPUCFSJLFZ-KBPBESRZSA-N 411.449 2.009 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3CCOc4ccccc43)CC2)cc1 804082557 RDQHTHMOIYMWIC-GOSISDBHSA-N 423.513 2.416 10 20 HECD CSc1nnc(CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)s1 805025849 WOFVIAWAZGECDE-UHFFFAOYSA-N 419.576 2.429 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCCN4C)C3)cc2)CC1 805026225 GWVUTFXXMJFTOV-IRLDBZIGSA-N 412.578 2.482 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(S(=O)(=O)CC)C[C@H]2C)cc1F 805094113 JMLNDIPMRBYXHK-OAHLLOKOSA-N 414.547 2.237 10 20 HECD C[C@@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nncn1C 805539842 COQPQUVCTDHMJV-SNVBAGLBSA-N 408.461 2.301 10 20 HECD CN(C)C(=O)C1(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCCC1 806266445 YKMPGOGSDJHVRX-UHFFFAOYSA-N 414.550 2.008 10 20 HECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)C1 806457240 HBPRJMGOLSZUCL-XLAORIBOSA-N 422.545 2.036 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1 807695495 USHZTMUFWHIXJW-HXUWFJFHSA-N 421.545 2.425 10 20 HECD CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)OCC(=O)C(C)=O)cc2)cc1 808489096 CNZWIPOGUMVMJH-UHFFFAOYSA-N 405.428 2.201 10 20 HECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)nnn1Cc1ccccc1F 815369842 MKSFVWVWALNHSS-UHFFFAOYSA-N 424.480 2.437 10 20 HECD CN(CCO)S(=O)(=O)c1ccccc1CNCc1cc(Cl)c(F)cc1O 816550616 WPUMLSRTZJHMPI-UHFFFAOYSA-N 402.875 2.087 10 20 HECD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 917364421 GMZWFMHNKAYGHB-KZNAEPCWSA-N 400.475 2.075 10 20 HECD O=C(c1cncc(F)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543019 JPBSYOIUYVXZNU-UHFFFAOYSA-N 414.437 2.186 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)c1 6033876 PKOOWAIQYGFVGX-UHFFFAOYSA-N 419.485 2.341 10 20 HECD Cc1cc(-c2nc(C3(S(C)(=O)=O)CC3)no2)ccc1NC(=O)C1=S=CC=C1 438842609 PCYSRKUJTVRDKQ-UHFFFAOYSA-N 403.485 2.295 10 20 HECD CC(C)OC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 730675020 TVNBYMSONHJDLG-SFHVURJKSA-N 402.539 2.487 10 20 HECD CCOC(=O)C1CCN(S(=O)(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731356856 WZUGJZJBODPEPM-UHFFFAOYSA-N 415.531 2.281 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(C)c(=O)nc2O)cc1 732115366 XWPVCGWRMRSMHQ-UHFFFAOYSA-N 408.458 2.408 10 20 HECD O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1ccc(N2CCC(O)CC2)c(F)c1 743314941 USCYDJTZXCFMHL-UHFFFAOYSA-N 424.476 2.314 10 20 HECD CCN(CC(=O)NC1CCN(C(C)=O)CC1)Cc1cc(Br)ccc1O 744425159 CPZMUQLMGJPABX-UHFFFAOYSA-N 412.328 2.104 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCNS(=O)(=O)c1cccnc1 746272206 TYGLXMSQVVDOPD-UHFFFAOYSA-N 404.517 2.259 10 20 HECD CCN(CCS(C)(=O)=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 753643983 FFEGBVPAMRNFHV-AWEZNQCLSA-N 419.494 2.333 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C4CCOCC4)C3)cc2)C1 755060429 YKOIGQALZDEWPU-PMACEKPBSA-N 414.550 2.346 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1CN1CCNC1=O 755191901 KWVYNKYZXWTWPE-UHFFFAOYSA-N 423.517 2.265 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3nnnc3/C=C/c3ccccc3)CC2)cc1 758220868 CGMMVHAXOXXQSC-SQEWALACSA-N 420.517 2.035 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1F 759064024 ZSQBISHPXXSKKO-UHFFFAOYSA-N 409.439 2.395 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOCC4(CCC4)C3)cc2)C1 760096311 QMXUVTFABRKGGC-GOSISDBHSA-N 400.523 2.100 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)CC[C@H](CC(C)C)C3=O)CC2)cc1 760368244 GHLPCQNPRWAANI-QGZVFWFLSA-N 401.507 2.155 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@@H]4CCCCCN4C3=O)CC2)cc1 760952478 SMCWKEXXGGGVDB-FQEVSTJZSA-N 400.523 2.414 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1 761049181 MLGDOYDSKIOYFV-UHFFFAOYSA-N 422.485 2.047 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(Br)c3)nc12 762938266 ASWRRGILFOAMRE-UHFFFAOYSA-N 421.207 2.126 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 771457710 ASUJHSUQBOUGNM-BRSBDYLESA-N 406.546 2.080 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C(F)(F)F)cn1 772952792 FLLPAKCDBNSCRO-UHFFFAOYSA-N 408.380 2.192 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1 774356156 IWAQPHVEVIFBJG-UHFFFAOYSA-N 417.425 2.129 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC(C)(C)c3nc(C)cs3)CC2)cc1 779222365 LGIFHEIYGWFGKS-SFHVURJKSA-N 404.580 2.468 10 20 HECD CCN(CC)c1ccc(CN(C)[C@@H](C)C(=O)N(CC)[C@@H]2CCS(=O)(=O)C2)cc1 781624353 KMSFEVVVWAUWER-FXAWDEMLSA-N 409.596 2.389 10 20 HECD CCC(=O)Nc1cccc(CNC(=O)C(=O)NCCCSc2nccs2)c1 787077185 DJTYFJIHIGDDLS-UHFFFAOYSA-N 406.533 2.406 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc(OC)c1OC 787323981 RADWMAINOOZLOE-JKSUJKDBSA-N 419.522 2.056 10 20 HECD O=C(c1ccc(Br)cc1)N1CCN(C(=O)c2cccc(O)c2O)CC1 790621142 DQCICNQEXPDMKY-UHFFFAOYSA-N 405.248 2.459 10 20 HECD C[C@](O)(CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 801138400 WNDHZVBBDCCLCC-YKSBVNFPSA-N 409.530 2.388 10 20 HECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCN(C)CC2)cc1 801734458 BYVWFFPMFMLRPC-IBGZPJMESA-N 416.591 2.285 10 20 HECD C[C@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 803448029 GBMODNCIBDQAIQ-OKILXGFUSA-N 411.449 2.009 10 20 HECD CC[S@](=O)CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803471490 CPCXZWVKWBISSX-ZNNHIBJESA-N 413.451 2.101 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CCCn3ccnc3)CC2)cc1F 803664410 HURLHIKZJMFPCW-UHFFFAOYSA-N 415.513 2.423 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)C(=O)OC(C)(C)C 804254488 KLQCMWGKVSRIOY-UHFFFAOYSA-N 406.527 2.050 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1nc2c(s1)COCC2 807513072 SABFBORLOTXCDY-UHFFFAOYSA-N 402.259 2.483 10 20 HECD C[C@@H](NC(=O)C(=O)NCCN(C)Cc1ccc(F)cc1)c1ccc(N(C)C)cc1 807672906 KDXAGKLYIOXAFC-MRXNPFEDSA-N 400.498 2.317 10 20 HECD Cc1nc2ccc(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cn2n1 809896115 DVVJIRRZVMYVSY-MRXNPFEDSA-N 407.478 2.061 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(C2CC2)n1 815397922 NWGYYFHXHRTDOY-UHFFFAOYSA-N 408.502 2.423 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)CCC4)CC2)c1 915798510 HUWAAAOMVUHPHI-UHFFFAOYSA-N 417.487 2.296 10 20 HECD C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)Cc2ccccc2C(=O)O1 917833451 NWCFSAVTEYKZCZ-UUOWRZLLSA-N 421.497 2.176 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 918294927 NHPJRAZTNRTRHT-LJQANCHMSA-N 411.458 2.497 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H](C)n3nc(C)cc3C)nc12 919314797 MYNYCBKSJVDDKN-ZDUSSCGKSA-N 401.423 2.119 10 20 HECD O=C(CCc1cc(F)ccc1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 919749873 BZGNJEICLZAPHU-UHFFFAOYSA-N 408.470 2.449 10 20 HECD Cc1ccn2c(=O)c(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cnc2c1 919971361 SICHYTQOIJRZRH-UHFFFAOYSA-N 410.449 2.033 10 20 HECD CCOC(=O)C[C@@H]1CCCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 1320578195 GQLNDLLZIOLSIR-FQEVSTJZSA-N 404.507 2.345 10 20 HECD CCOc1ccc(N2CCN(CCC(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 1324369091 MVVBLRFPEDRARW-UHFFFAOYSA-N 423.561 2.341 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845094 YPPSRAVWBSSILF-LLVKDONJSA-N 413.356 2.474 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3ccco3)CC2)CC1 1837393008 QVYBMLAAHVMZKV-UHFFFAOYSA-N 415.446 2.012 10 20 HECD Cc1ccc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)cc2c1 1843683164 UULFHWDBDOXGCY-UHFFFAOYSA-N 406.442 2.413 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)o1 109701182 HMWJLOOFAZQQFN-KRWDZBQOSA-N 421.519 2.075 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CC[C@@H](C(=O)N(C)C)O3)ccc21 537128011 PUIUEVUAKFLKMK-XLIONFOSSA-N 401.507 2.270 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3(C)CCOCC3)cc2F)C[C@H](C)O1 726839834 SAQYCZUAXNKRNZ-HOTGVXAUSA-N 422.497 2.415 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1O 737286390 YKVWVNJZOOUWMT-KRWDZBQOSA-N 400.431 2.214 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CN1CCOCC1 738978686 WMQVPVSHALNABM-KZNAEPCWSA-N 422.545 2.207 10 20 HECD CN1N=C(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1=O 742748957 BMRRAJLHWPOSCJ-QGZVFWFLSA-N 417.510 2.043 10 20 HECD COC(=O)COc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753738447 KKGMXROZKRDSQR-UHFFFAOYSA-N 402.422 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)c3cccc(CS(C)(=O)=O)c3)CC2)cc1F 753739457 SCBCQQGPSCOZKK-UHFFFAOYSA-N 406.479 2.341 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C[C@@H](C)O)C3CCCCC3)CC2)cc1 754027399 JLPIVKZTCCSWCG-DENIHFKCSA-N 405.583 2.194 10 20 HECD COc1cc(CN2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc(OC)c1 756029186 BARSQEGLRWUUTN-KRWDZBQOSA-N 415.490 2.492 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 756092964 FTOYGBBWZAZWOE-RAUXBKROSA-N 410.518 2.091 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccn(CCc2ccncc2)n1 759033253 UDRGRCOMBZZUES-UHFFFAOYSA-N 416.485 2.152 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(C(C)=O)cn3C)CC2)cc(OC)c1OC 759199975 OLGUCZUXFIJKCX-UHFFFAOYSA-N 401.463 2.216 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)[C@@]12CCCO2 759321591 YAYIYHRAGRIZDF-SBHAEUEKSA-N 407.486 2.393 10 20 HECD CC(C)CCNC(=O)C1CCN(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)CC1 759594157 LQGZKQUWJNEMPI-GQCTYLIASA-N 418.490 2.055 10 20 HECD CC[C@H](C)NS(=O)(=O)Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 760271557 WSZPWKBNVBXNQC-LBPRGKRZSA-N 424.504 2.242 10 20 HECD COC(=O)[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)(C)C 760915238 FOEYQJISZBGVBH-AUSJPIAWSA-N 423.529 2.233 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NCc1cccc(Br)c1O 765770920 SLUADHPTOJNQDV-UHFFFAOYSA-N 419.279 2.205 10 20 HECD C[C@H](NC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccc(N2CCOCC2)cc1 767937857 ITAUBUZZSPPNKS-HSQYWUDLSA-N 416.566 2.261 10 20 HECD C[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)c(F)c1 773008641 WWACHPRWEPCIEO-AZUAARDMSA-N 418.557 2.400 10 20 HECD Cc1cc(N2CC[C@@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)n(C)n1 773030902 XUJAJSPNOFMSTO-MAUKXSAKSA-N 401.486 2.160 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCS(=O)(=O)c2ccccc2C1 773231398 CXVYKXPLKJENDZ-UHFFFAOYSA-N 415.515 2.022 10 20 HECD CCN(Cc1ccc2c(c1)OCCO2)C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 773448087 GJDLHKJLDSCHRF-YVMONPNESA-N 413.426 2.474 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cnc4onc(C)c4c3)c2)CC1 780407209 JBRRHIIPXNPNNZ-UHFFFAOYSA-N 415.475 2.001 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1 783264706 PTHGGFJIEMDMDT-SJORKVTESA-N 418.515 2.251 10 20 HECD CCOC(=O)c1sc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)nc1C 785432356 ARKIDJVROFAJGP-ZDUSSCGKSA-N 418.519 2.188 10 20 HECD CC(C)CN1CCC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 786328289 WDBLJYXEVDXLPO-UHFFFAOYSA-N 418.607 2.093 10 20 HECD Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931136 FZHWREMHXMGNAB-RTWAWAEBSA-N 419.529 2.483 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC(C)C)c(C)c2)cc1 797431687 VSVHIOLFBURLEM-UHFFFAOYSA-N 413.521 2.459 10 20 HECD COc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803659288 OTEXPFKGULNICI-UHFFFAOYSA-N 403.454 2.102 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)cc1F 803662910 JBVXXCPKSFMXDK-GOSISDBHSA-N 415.509 2.426 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H](c4nccn4C)C3)cc2)CC1 805025060 HQWHCVDSRAXPFP-IBGZPJMESA-N 409.534 2.289 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)[C@@H]1c1ccccc1 806276333 NBBIYRSXKDJTST-HOTGVXAUSA-N 404.561 2.303 10 20 HECD Cc1cc(-c2csc(NS(=O)(=O)c3cccc(S(N)(=O)=O)c3)n2)c(C)o1 918196597 YFTIMXUWWAGRFL-UHFFFAOYSA-N 413.502 2.468 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2ncsc2c1 918334578 ILZOJRHUUHMGOD-UHFFFAOYSA-N 401.513 2.461 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1c[nH]n2c1nc(=O)c1ccccc12 919752433 WOXXAMLCFVODMX-UHFFFAOYSA-N 421.432 2.082 10 20 HECD CS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970708 AHSOPAHQFLOSDI-UHFFFAOYSA-N 421.494 2.088 10 20 HECD CC1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CCC1 1782002557 KCNARIMNABTSDW-HXUWFJFHSA-N 408.882 2.385 10 20 HECD Cc1cnoc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1799085248 JINDRFVIYRGJRS-PLCSWTFUSA-N 413.430 2.065 10 20 HECD CCCNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 15692371 IHCNNPONJDDCDJ-LLVKDONJSA-N 410.382 2.442 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccccc4)n3)cc2F)C[C@@H](C)O1 117529346 UYKCTKCKDCZWPN-HZPDHXFCSA-N 424.480 2.409 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1OC 140295117 VMPJOAHJWXQHBX-UHFFFAOYSA-N 407.492 2.043 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@H]3CCCC[C@H]3C)CC2)cc1 733571767 PGROVPPAIUCEKM-XLIONFOSSA-N 404.507 2.482 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1 734072855 QTULLOLFHISKMO-UHFFFAOYSA-N 417.849 2.436 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN(C(=O)c4ccncc4)C3)CC2)cc1 741883237 KRAAKXOTNIRZCN-LJQANCHMSA-N 408.502 2.291 10 20 HECD COCCn1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1=O 742799089 UXXDKHIHQJFRMA-MRXNPFEDSA-N 421.444 2.495 10 20 HECD COCCN1CC[C@H](NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 743626816 NREPGVWNEDEOPR-HOTGVXAUSA-N 412.481 2.277 10 20 HECD CCC1(O)CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 743855725 XSCCPVYLNJWNKV-IAGOWNOFSA-N 407.530 2.292 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@]3(CCCc4sccc43)C2=O)cc1 749071758 SKBTYHQERGGIMT-NRFANRHFSA-N 412.515 2.214 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccc([N+](=O)[O-])c3N)cc2F)CC1 749382867 SQXXYQJCLGRJHH-UHFFFAOYSA-N 401.442 2.388 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@H](N(C)C)C3)CC2)cc1 749543524 RMONKRCVXNEBQB-CTNGQTDRSA-N 417.598 2.379 10 20 HECD Cc1noc(C)c1[C@@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 750268182 HKTHZZKQSSUFFR-CYBMUJFWSA-N 419.453 2.230 10 20 HECD CCOC(=O)c1sc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)nc1C 750276512 JFVXGQUSZOJVSZ-UHFFFAOYSA-N 418.519 2.464 10 20 HECD Cc1cncc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 751010025 BPKULRQBBKKQQA-HUUCEWRRSA-N 400.454 2.398 10 20 HECD Cc1ccc(C(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)c(O)c1O 751538589 SKYWBRZUJYYNAR-GOSISDBHSA-N 410.518 2.476 10 20 HECD CC[C@H](CN1CCCC1)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 758680109 MFFIULYFYHYRIQ-HXUWFJFHSA-N 417.598 2.381 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc4c3OCCO4)CC2)cc1 761009221 AVBQEKLSGIIACE-SFHVURJKSA-N 400.475 2.028 10 20 HECD COc1cccc(CNS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)c1O 763390523 UKSCJVXYXSQGSW-UHFFFAOYSA-N 408.451 2.254 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1C(F)F 765931053 NHIVEPBUIKPLDG-UHFFFAOYSA-N 403.183 2.081 10 20 HECD CS(=O)(=O)c1cccc(C(=O)N2CCN(Cc3c(O)cccc3Cl)CC2)c1 769452519 VMTPQXSVVJZLJJ-UHFFFAOYSA-N 408.907 2.407 10 20 HECD O=C1COc2ncc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2N1 770762051 YZFIWLZKQKFMIS-CYBMUJFWSA-N 418.400 2.413 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)nn1 773615417 XQDMBBLVHLPIOY-AWEZNQCLSA-N 400.483 2.238 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 773764070 VHPGDNOWYRHDIZ-LLVKDONJSA-N 408.451 2.039 10 20 HECD COc1cc(CN2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)cc(OC)c1OC 780961352 RDUGXFMVXWDXQO-UHFFFAOYSA-N 416.474 2.390 10 20 HECD CN(C)C(=O)c1ccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1 786323209 GQRXJAQOPLIBIY-UHFFFAOYSA-N 422.529 2.262 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N3CCCCC3)cc1)C2 786672607 IIUODRUCAIIBPB-FQEVSTJZSA-N 421.545 2.407 10 20 HECD CCN(CCCN1CCCC1)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 788314578 VDCOGYUDAVJOIC-UHFFFAOYSA-N 417.598 2.335 10 20 HECD COc1cc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(OC)c1O 789956715 SWLSEUZUOAQBQP-UHFFFAOYSA-N 414.502 2.477 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)n3)cc2F)C[C@@H](C)O1 792956101 JOTAPBXEXGWKII-CHWSQXEVSA-N 404.417 2.228 10 20 HECD COc1ccc(CNS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)c(O)c1 795357573 GUIXHXLXZYDAIQ-CYBMUJFWSA-N 411.451 2.434 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 797646453 ZKTSUEACPCJAHX-LBPRGKRZSA-N 405.476 2.173 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(Cc3ccccc3)CC(C)(C)O)ccc21 803688475 ZKMKUJPMQKFQTK-UHFFFAOYSA-N 409.530 2.485 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC4(CCCCC4)C3)CC2)cc1 804318330 HWBMPLPQLGHKHG-UHFFFAOYSA-N 415.534 2.342 10 20 HECD O=C(COC(=O)C[C@@H]1CCCC(=O)N1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808691999 RQDIFZWTBAOLTI-ZDUSSCGKSA-N 420.421 2.003 10 20 HECD COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 914907218 SSKPYZXTQWVUPH-QGZVFWFLSA-N 401.463 2.350 10 20 HECD CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 917658131 QKMLQZBGWFXSHD-GOSISDBHSA-N 411.568 2.483 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cn4ccsc4n3)cc2)C1 918117545 NQTPWYAUHHJUDO-OAHLLOKOSA-N 412.519 2.097 10 20 HECD COc1ccc([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918211339 JYIIFVWIZOVXMS-HXUWFJFHSA-N 403.454 2.204 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 918443351 WENFRZWREORIKH-UHFFFAOYSA-N 412.446 2.058 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1 918461480 DZVUNJZHJHKFHN-UHFFFAOYSA-N 424.501 2.074 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1795009967 IRSIHLLZYABNTM-GGPHIMKMSA-N 417.469 2.126 10 20 HECD O=C(CC1(O)CCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800720086 YYCPVHSBLNHSAF-BTTYYORXSA-N 408.882 2.308 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccco1)CC2)c1cc(O)nc(O)c1 1816722311 XBBKNLKXTIGQTG-JTQLQIEISA-N 400.416 2.082 10 20 HECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)nc2ccccc12 1843738970 XJHNLUJQSLXNCX-UHFFFAOYSA-N 418.453 2.480 10 20 HECD C[C@H](Cn1ccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846611739 PWXLNVBWAPFYJL-CYBMUJFWSA-N 418.881 2.101 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2 470530471 PTSGOYIMANEVAQ-GDLZYMKVSA-N 416.499 2.447 10 20 HECD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOc2cc(N(C)C)ccc21 475967649 VPFDTSHBXXASFW-IBGZPJMESA-N 410.453 2.396 10 20 HECD O=[N+]([O-])c1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c([N+](=O)[O-])c1 726967876 GQTNKZXYGSONFG-UHFFFAOYSA-N 406.420 2.350 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCCC[C@@H]3C3OCCO3)cc2F)CC1 732463093 PCJJKTINUQFSMM-HXUWFJFHSA-N 420.529 2.405 10 20 HECD CCN1CCC(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 740874520 MBLAGOHTVLATLS-HDICACEKSA-N 420.573 2.472 10 20 HECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)ccc21 743956841 WZUYZKGHWNACAQ-UHFFFAOYSA-N 407.470 2.435 10 20 HECD CCc1ncsc1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 747475528 DLQZBFXWABDLEZ-UHFFFAOYSA-N 419.526 2.241 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCN(C2CCCCC2)C1 748846540 QYLSNKNXMUDFOD-LJQANCHMSA-N 419.591 2.192 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1 749641616 CLQDFGWKJCZZPE-CYBMUJFWSA-N 420.487 2.399 10 20 HECD CC(=O)OC1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 753191728 TVDIZBJKHLTOMH-UHFFFAOYSA-N 406.438 2.428 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)cc1F 753395667 IFPBPOOIHNTDKX-UHFFFAOYSA-N 414.437 2.372 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H](CCO)c3ccccc3)CC2)cc1 754052805 ZRGWJQUSCCLQGR-ISKFKSNPSA-N 413.562 2.234 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)c(OC)c1 758170080 HXUYEFBWCXUWBQ-UHFFFAOYSA-N 404.441 2.102 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccn(C)c3)cc2F)C[C@@H](C)O1 764117107 DZTRHCWOTNTURQ-HUUCEWRRSA-N 403.454 2.251 10 20 HECD CCOc1ccc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c(O)c1 769452466 SGMYMJDMKSFLNJ-UHFFFAOYSA-N 418.515 2.152 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cc1 769674715 FKRNECYENZMKML-UHFFFAOYSA-N 413.478 2.128 10 20 HECD CCC[C@@](C)(O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 770215577 YZQNBEHJKVSFSZ-HXUWFJFHSA-N 422.503 2.019 10 20 HECD COC(=O)c1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772902114 SNKHJYZNXZGYGJ-UHFFFAOYSA-N 401.438 2.177 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1CS(C)(=O)=O)c1ccc(N(C)C)cc1 773845006 FTTCTLVEXYOESJ-AWEZNQCLSA-N 403.504 2.113 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccnc(Sc2ccccn2)c1 774361629 HYYCHPVLMHSQDU-UHFFFAOYSA-N 410.455 2.336 10 20 HECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2)[nH]1 775403244 HXZYAXKNUVKTQF-HNNXBMFYSA-N 422.485 2.438 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)ccc1-n1cnnn1 783318119 UILSZSQKMVLSTM-UHFFFAOYSA-N 421.505 2.412 10 20 HECD CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785293707 IBHJUSPTOURMSN-DPQIITEBSA-N 412.442 2.360 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN2CCC[C@H]2C1 788584773 QIBWMOSOYRPODA-CVEARBPZSA-N 424.339 2.246 10 20 HECD Cn1cc(-c2ccc(NC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nn2)cn1 788784637 AXDIRXBZXUWSMJ-UHFFFAOYSA-N 421.505 2.408 10 20 HECD CCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840841 OGMKBLOWJMNTMS-UHFFFAOYSA-N 413.493 2.282 10 20 HECD Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 792204810 DJINDXBRUQPNFG-UHFFFAOYSA-N 411.437 2.102 10 20 HECD COC(=O)COc1ccc(N(C)CCN(Cc2ccccc2)S(C)(=O)=O)cc1 792284260 VZYDSHJWEALPHN-UHFFFAOYSA-N 406.504 2.136 10 20 HECD O=C(NC[C@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 793793874 LELCSEQLAITWSA-RHSMWYFYSA-N 411.449 2.058 10 20 HECD COc1ccc(N2CCN(Cn3c(=O)oc4cccc([N+](=O)[O-])c43)CC2)cc1F 794633164 SRJJMPZLPXQBDU-UHFFFAOYSA-N 402.382 2.430 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(CC(F)(F)F)C1 803385453 BLOIDBZHKPOREH-HNNXBMFYSA-N 401.429 2.274 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@H](C4CCOCC4)C3)CC2)cc1 804318014 WAGJCQJRAGIJAM-GOSISDBHSA-N 415.534 2.055 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1F 804852235 CYYMKGVHVDMFPR-LZQZEXGQSA-N 403.498 2.362 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)CC1(C)OCCO1 807425075 KTGVXHHIJOQEIK-INIZCTEOSA-N 416.474 2.419 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1C 807512994 FMXNEYIQXNLMRM-UHFFFAOYSA-N 414.245 2.469 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(CCOc2ccccc2)CC1)c1ccc(N(C)C)cc1 807674219 IHQKUIRPCYOMTI-LJQANCHMSA-N 424.545 2.153 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)Cc3nncn3C(C)C)cc2F)CC1 813632314 BUKSEHIEPFRUKD-UHFFFAOYSA-N 417.533 2.482 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cnn(C)c3C)c2C)cc1 813956906 UBUUYBYCXWJLCV-UHFFFAOYSA-N 402.476 2.263 10 20 HECD CCC[C@@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 814433520 LBBIRAJQESAQFU-QGZVFWFLSA-N 421.561 2.319 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H]4[C@H]5CC[C@@H](C5)[C@H]4C3)CC2)cc1 818440029 RAHMQENWXGQIBY-PEQCFLBOSA-N 409.530 2.405 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3COc4ccccc4C3)cc2)C1 918123537 YROQJMLTDQSOHP-MOPGFXCFSA-N 408.502 2.191 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cncn4)nc3)cc2F)C[C@H](C)O1 918141040 RLTDXGAGORFATN-GJZGRUSLSA-N 410.453 2.345 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)Oc3ccccc3F)nc12 919075945 ZHGNLBNFLFTQDZ-NSHDSACASA-N 403.366 2.261 10 20 HECD CCOc1ccc(N2CCN(C(=O)COCCNC(=O)c3ccccc3)CC2)cc1 1116564381 KZXOEURXBBLMCA-UHFFFAOYSA-N 411.502 2.181 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(O)nc(CC(C)C)c1 1321360569 MCCFHEYEIHNVOI-INIZCTEOSA-N 402.447 2.301 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)C3=CCCC3)C2)CC1 1808969377 XKPRIIXHCZTKRP-UHFFFAOYSA-N 421.588 2.188 10 20 HECD C/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031739 JLYTZVTXCZWKKO-LZWSPWQCSA-N 403.479 2.071 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)C1 1845806055 XQBAYTZTXIBUTQ-PEYYIBSZSA-N 406.891 2.443 10 20 HECD Cc1cc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)ccc1[N+](=O)[O-] 51263578 HIOCATNDZGUFBZ-UHFFFAOYSA-N 419.488 2.419 10 20 HECD O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCc1ccccc1O 109676434 JHUQHICKOHPFPI-UHFFFAOYSA-N 418.393 2.276 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCNC(=O)c1ccc(F)cc1 303024865 RWYQVVQVMLLBLP-UHFFFAOYSA-N 414.481 2.234 10 20 HECD COc1ccc(CS(C)(=O)=O)cc1NS(=O)(=O)c1cccc2nsnc12 551951143 ASRUNWJWBUVKHJ-UHFFFAOYSA-N 413.502 2.045 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1O 727762640 SLYYYDSTLADOMV-INIZCTEOSA-N 404.488 2.118 10 20 HECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCC1 729598494 CJYAUJRVSKSOKK-FPOVZHCZSA-N 415.582 2.308 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nc(=O)ccn3C(C)C)CC2)cc1 729821266 HCSSGNCTRVWUSC-UHFFFAOYSA-N 402.520 2.274 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(OC)ccc2Br)c1 734072674 MYDAKUMKMALODI-UHFFFAOYSA-N 409.236 2.427 10 20 HECD CCOCCCN1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](C)C1 734660705 GCQHNBCZHIHBMJ-SIKLNZKXSA-N 418.582 2.459 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(CCn4cncn4)CC3)c2C)cc1 740738808 NRWMJHAHVBFXDI-UHFFFAOYSA-N 408.506 2.152 10 20 HECD C[C@@H](C(=O)NC(=O)NCc1ccccc1)N(C)Cc1ccc(N2CCOCC2)cc1 741737021 XVXGTOAPQNFWCF-SFHVURJKSA-N 410.518 2.370 10 20 HECD O=C(N[C@H]1CC(=O)N(C2CC2)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 750649551 CBURGVAUSLMUJH-KGLIPLIRSA-N 408.449 2.319 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(C(C)(C)C)nc3C)CC2)cc1 752159999 SMOZRCASCSTGMM-UHFFFAOYSA-N 414.506 2.461 10 20 HECD Cc1cc(C(=O)COC(=O)CCS(=O)(=O)N(C)C)c(C)n1-c1cccc(F)c1 753879264 QDVVKNJZEDIJKW-UHFFFAOYSA-N 410.467 2.241 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H]3CCC[C@H]3O)cc2F)C[C@@H](C)O1 755062701 KXXJUHAXMIRVAX-ONFYXGJMSA-N 407.530 2.148 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3C3CC3)cc2F)C[C@@H](C)O1 761127375 SMPIABAWOJSLTG-VWKPWSFCSA-N 405.514 2.166 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1 761995819 NSBDAJPHFYBTHD-UHFFFAOYSA-N 414.505 2.231 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 772600409 HQDWQYBUMLWJAH-OALUTQOASA-N 410.536 2.315 10 20 HECD N=C(NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(F)c1 772884889 RNIBTLLXOCEZOH-UHFFFAOYSA-N 422.407 2.103 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3n[nH]c4c3CCCC4)CC2)cc1 777178505 JATDSALOWMFWSK-UHFFFAOYSA-N 411.550 2.168 10 20 HECD Cc1cccc(CS(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c1 778812239 WPKGJCHCMGUAAG-UHFFFAOYSA-N 414.508 2.471 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)N(Cc2ccco2)Cc2ccccc2O)n(C)c1 778891683 SFGOYLAMZVZOFU-UHFFFAOYSA-N 417.487 2.417 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 782106151 ICJNFBRWCOSPCA-AWEZNQCLSA-N 401.438 2.487 10 20 HECD Cn1ccc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1=O 785412389 JLASKBYZPIAYRY-UHFFFAOYSA-N 420.468 2.310 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(OCC(F)F)c3)cc2)CC1 786256091 RQPFSFCPJGDACP-UHFFFAOYSA-N 418.444 2.324 10 20 HECD C[C@H](OC(=O)CCn1ccnn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787623718 KPSAQNICFUZICV-ZDUSSCGKSA-N 418.409 2.014 10 20 HECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 789839806 AIZMHDOJDBAXAC-UHFFFAOYSA-N 413.493 2.370 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789861716 RLBBJRFDPBDMML-MSOLQXFVSA-N 418.607 2.093 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)ccc2F)cc1C(=O)O 790052674 GXQXKTMLYHHBSS-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCOCC3)c(F)c1)CC2 792176779 LSOIHTFUYSVRIN-UHFFFAOYSA-N 405.495 2.133 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)ccc2[nH]1 792347566 LEXIRTFJSNVZNQ-UHFFFAOYSA-N 420.469 2.367 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3ccc(OC)cc3O)C2=O)c1 793076294 ODDRIHITMRTLTA-SFHVURJKSA-N 415.446 2.023 10 20 HECD CC[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793733241 LUPZDGXPROAWTF-MBSDFSHPSA-N 414.550 2.043 10 20 HECD C[C@@H](NC(=O)C(=O)NCCN1CCc2sccc2C1)c1ccc(N(C)C)cc1 793856705 CLJYGPCEXCJZAA-OAHLLOKOSA-N 400.548 2.166 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccc(Br)cc2)c(O)c1O 794360405 HXPWGRDSMIZEFT-AWEZNQCLSA-N 405.248 2.482 10 20 HECD CC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCCO1 799201286 UWBQADYPKXSTKP-GOSISDBHSA-N 419.547 2.425 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCN(CCN2CCOCC2)C1 802173249 VMTIHJZPGPRLTI-FQEVSTJZSA-N 404.555 2.110 10 20 HECD Cc1ccc(C(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)c(O)c1O 804354452 LIUXTOVXGNWJIM-UHFFFAOYSA-N 419.286 2.421 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1 806821503 NOBAQWPMVGZCFP-INIZCTEOSA-N 408.568 2.064 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1nc(C2CC2)cs1 806853927 RLSWAUMZMQXNHT-UHFFFAOYSA-N 418.494 2.376 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 807094884 DRJUAXBUSQVZNP-INIZCTEOSA-N 415.925 2.121 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)cc1 808291185 GAXQIQKDGPNUTH-OAQYLSRUSA-N 408.502 2.396 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)c3ncc(C)s3)CC2)cc1 808824308 PUAUEOHMPSXWSJ-HNNXBMFYSA-N 416.547 2.419 10 20 HECD O=C(CCn1c(=O)nc(O)c2ccccc21)NCc1ccc(N2CCSCC2)cc1 917386633 ILTSCSUQTLTXEY-UHFFFAOYSA-N 424.526 2.362 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(SC)n2ccccc12 1320154709 YNXHDFMWLAWPLM-ZDUSSCGKSA-N 415.471 2.372 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777848386 SHBSCNIMYBRNSM-PUXBEBEGSA-N 417.506 2.057 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1c(F)cccc1F 1796601444 JNFINVBOJMQIST-CLLJXQQHSA-N 403.385 2.337 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1ccns1 1816273319 KYDXVCABOOPKFX-LBPRGKRZSA-N 414.447 2.292 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O 303689656 LQOAVHAMIOQCKP-HXUWFJFHSA-N 410.522 2.357 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1 726725389 BKZDHGBOTUFFDQ-UHFFFAOYSA-N 424.501 2.121 10 20 HECD C[C@@H]1CN(C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 729599298 FGJPXGTVMRUNHB-KNKQGSTJSA-N 416.566 2.306 10 20 HECD C[C@@H]1CCC[C@@H](OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 733020786 HQAQQBJFVLEYKC-SJLPKXTDSA-N 422.497 2.417 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(N4CCOCC4)cc3)c2)CC1 739768702 XCJWXLTVAWUSHD-UHFFFAOYSA-N 408.502 2.477 10 20 HECD O=C(Nc1nncs1)C1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740920084 RGOJUAFPLRUXRO-UHFFFAOYSA-N 412.519 2.475 10 20 HECD Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 742051522 VLCULFAXTCCUAU-UHFFFAOYSA-N 403.460 2.068 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N1CCC[C@H](C(N)=O)C1 743874198 VXLKBWXZWXGUSS-STQMWFEESA-N 412.328 2.089 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)ccc21 746705883 JZVCQYUBRKRHRS-UHFFFAOYSA-N 406.530 2.384 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1coc(S(=O)(=O)NC)c1 755970513 FBXCDZHJXVBXMJ-UHFFFAOYSA-N 417.281 2.318 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccc(F)c(F)c3)CC2)cc1 756624143 PAYCYRBRSUBGQY-UHFFFAOYSA-N 404.413 2.408 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCN(Cc2cccs2)CC1 759588623 MUYOBEQZUDAYHO-XQRVVYSFSA-N 402.472 2.060 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCSC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 762024022 JGWSXCANMGXSMJ-AWEZNQCLSA-N 422.528 2.221 10 20 HECD CCN(CC(=O)N(C)C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 764192593 OMOIYMFLOKMXBT-CQSZACIVSA-N 407.470 2.199 10 20 HECD CC(C)OC[C@H](CO)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 764227031 CPVAGGVJYOMJHG-BQFCYCMXSA-N 411.518 2.367 10 20 HECD NC(=O)c1cccnc1N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768291575 PVNTWGNNWYMGHQ-UHFFFAOYSA-N 424.505 2.401 10 20 HECD O=C1[C@H](N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)CCN1c1ccccc1 769404859 RGCUPUDWISTSMK-XMMPIXPASA-N 420.557 2.446 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@@H]4CCCCO4)n3)CC2)cc1 771069497 VZTOUZZIJRPFCL-IBGZPJMESA-N 414.506 2.471 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@](OC)(C(F)(F)F)C3)nc12 781984753 KVUJUUNLZMCJPB-INIZCTEOSA-N 402.373 2.155 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cnc1Br 785303780 LBOYTFYLCRXOSG-SNVBAGLBSA-N 408.252 2.250 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 785434890 WNQLMJUXTQNHCY-UHFFFAOYSA-N 418.538 2.227 10 20 HECD CC[C@@H]1Oc2cc([C@@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)cc3)ccc2NC1=O 785438344 CLUZPONBCBQOIV-KUHUBIRLSA-N 424.501 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(OC)cc3O)CC2)cc1 785689838 YACFQCYUQHFXGN-MDZDMXLPSA-N 411.458 2.253 10 20 HECD COC(=O)[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[C@H]1C 787328791 UKJBEAWJYMXBQS-ZFWWWQNUSA-N 406.438 2.284 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1nnc2n1CCCCC2 788930213 PFHVVZNPUWFOAU-LJQANCHMSA-N 424.549 2.488 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H](CO)c2ccc(OC)cc2)cc1 788975530 QCFSEHUWNFMBGP-OAQYLSRUSA-N 413.518 2.350 10 20 HECD COCn1nc(C)c(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C 790023167 VHJFNFVDPJNVQK-KRWDZBQOSA-N 409.508 2.179 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@@H]7[C@H]5[C@H]3[C@@H]7C[C@H]64)cc2)C1 793133892 YQIUOBXPAAYTSM-AHXUMTQISA-N 405.542 2.399 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 793860567 BPJDYRMWMXFAHL-KRWDZBQOSA-N 412.509 2.459 10 20 HECD O=C1NC(=O)C2(CCC(NCc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)CC2)N1 796516694 VZBQYANWSGDNKV-UHFFFAOYSA-N 401.467 2.196 10 20 HECD CNC(=O)[C@@]1(C)CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 797525221 FTUATLPEALUJDA-SHACYNPGSA-N 419.481 2.247 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CN(C(=O)OC(C)(C)C)C1 804748130 GDPIEWIQYRSGNK-UHFFFAOYSA-N 418.538 2.225 10 20 HECD CC(C)N(CC(=O)N1CCCCCC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 804759739 DSURYZUHAZALJX-UHFFFAOYSA-N 411.524 2.017 10 20 HECD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NCCCSc1nccs1)C2 806961050 JXIFNAATPOJCQL-GJZGRUSLSA-N 411.597 2.008 10 20 HECD CCc1cnc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 807770688 RQXPQLFEHIOYAZ-HNNXBMFYSA-N 403.504 2.235 10 20 HECD O=C(COC(=O)c1cnn(CCF)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808569327 GZWSLDBYJSKOHS-UHFFFAOYSA-N 421.384 2.424 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCn2cncc2C1 812005867 NZSSHZZQONIHSK-UHFFFAOYSA-N 409.412 2.464 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3ncn(C)c3=O)c2C)cc1F 815270984 ZAOJYBOGAYWWRK-UHFFFAOYSA-N 414.437 2.253 10 20 HECD O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(N2CCSCC2)cc1 917383730 JZHIIHHHIJLHLB-RTBURBONSA-N 415.559 2.421 10 20 HECD C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)Cc2ccccc2C(=O)O1 917833449 NWCFSAVTEYKZCZ-KOSHJBKYSA-N 421.497 2.176 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cn1cc(C(N)=O)c2ccccc21 919565839 KKCJVJOKUWDHKT-UHFFFAOYSA-N 422.485 2.008 10 20 HECD COc1ccc(S(=O)(=O)N2CC(NCc3ccc(N4CCCC4)cc3)C2)cc1 1116696732 SUDHXGCGOLKJEB-UHFFFAOYSA-N 401.532 2.458 10 20 HECD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2c(Cl)ccc3nonc23)C1=O 1117507275 GBIFGODUUBJXJP-SFHVURJKSA-N 417.784 2.421 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cc(Cl)cc(C(N)=O)c3)CC2)cc1 1344517633 FOXWOLZFFDZPAR-UHFFFAOYSA-N 423.922 2.349 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cncs3)CC2)C1 1810543055 PAQBTVCHFSNMBI-UHFFFAOYSA-N 402.476 2.108 10 20 HECD C[C@]1(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CC1(F)F 1810549846 DZBCIHIOIJNGNW-GOSISDBHSA-N 409.433 2.383 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)C1CC1 1813719122 XDHUYVRFAAKSRT-ILDRUCAQSA-N 423.469 2.328 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCO[C@H](c3cccc(O)c3)C2)n(C)c2ccccc12 557934942 HTZWEVZDSANAMD-NRFANRHFSA-N 407.470 2.409 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 726716901 UWSJYQHBNRILEE-UHFFFAOYSA-N 412.490 2.425 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CCO)CC3)cc2F)C[C@@H](C)O1 730261219 VQCWANIPWUSPHL-CALCHBBNSA-N 407.530 2.150 10 20 HECD CCOc1cccc(CN2CCN(CCNC(=O)c3ccc(OC)cc3)CC2)c1O 736648106 OUQLPXIUNSBMLS-UHFFFAOYSA-N 413.518 2.347 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c1O 737285881 MFHXSICCAMQQTE-UHFFFAOYSA-N 419.865 2.447 10 20 HECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](CC)(c3ccccc3)C2=O)cc1 739922924 RKSNHIHCJSBPQA-QFIPXVFZSA-N 410.474 2.410 10 20 HECD Cc1cccc(C)c1NCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742050999 NURWPSCKKQZWCR-UHFFFAOYSA-N 401.532 2.267 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 753133464 NMSIGMKQVSIRNU-MRXNPFEDSA-N 405.520 2.114 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 755300968 HFKCXEHLSAPDMD-UHFFFAOYSA-N 422.473 2.208 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(F)cc(Cl)c1O 768959530 VAHRONDPNIPOQC-UHFFFAOYSA-N 412.870 2.350 10 20 HECD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)c1c(F)cccc1F 770043605 YCRTXQRRGVNKGA-WMLDXEAASA-N 414.430 2.284 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 772313980 MPNWFJFGVNIZQE-LJQANCHMSA-N 420.487 2.037 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccc(N(C)C)cc2)c1 772960227 OPMBYMTUERGLJL-LSDHHAIUSA-N 404.536 2.339 10 20 HECD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)ccc1N1CCSCC1 774357378 UDYRJVRBDBHEKB-UHFFFAOYSA-N 415.515 2.257 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCC[C@@H]3OC)CC2)cc1 774789554 TWRBJXLNYYKUDY-NQIIRXRSSA-N 404.555 2.322 10 20 HECD O=C(NCCc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 775126415 IZCSKTNULXLBOD-UHFFFAOYSA-N 401.894 2.152 10 20 HECD C[C@@H](NCC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl)c1ccc(N(C)C)cc1 775836013 XHMYVWGPFGNXIA-GFCCVEGCSA-N 410.927 2.343 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)c3cc(OC)cc(OC)c3)CC2)cc1 786440806 HMHQSBMZPVFRJY-FQEVSTJZSA-N 415.534 2.332 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1c(C)noc1C 789810666 BXPYCUZUHGJOSW-KRWDZBQOSA-N 418.469 2.151 10 20 HECD CN(CCc1nccs1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859375 CMPHXCUVGLXTHW-UHFFFAOYSA-N 404.561 2.014 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC([C@@H]2CCCO2)CC1 789862971 ZDTWFSRCNDPJEN-FQEVSTJZSA-N 417.575 2.274 10 20 HECD COCCNS(=O)(=O)c1ccc(CNCc2c(O)ccc(Cl)c2F)cc1 790962794 SFXQQQCKUFHBIY-UHFFFAOYSA-N 402.875 2.399 10 20 HECD CS(=O)(=O)C1(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 792967368 MMKFYJUJYZCJQT-UHFFFAOYSA-N 417.478 2.133 10 20 HECD CCN1CCC(CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 793816329 XNFSUHHLLYTJQH-UHFFFAOYSA-N 400.567 2.387 10 20 HECD CCN(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1ccco1 793847421 PJESYYIBKFFZNY-LJQANCHMSA-N 400.523 2.470 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(C)c(OC)c3)CC2)cc1 793872015 WKSFQPDENBDSLH-UHFFFAOYSA-N 411.502 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCC(F)(F)C3)CC2)cc1 797768131 KTZGLZGLPNIGCN-MWWKQMNYSA-N 407.461 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)NCC3(S(C)(=O)=O)CCCC3)CC2)cc1F 805839302 CNWJLULKTDNMJT-UHFFFAOYSA-N 413.515 2.023 10 20 HECD C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806493909 IBUUDWMRCPESBR-QFUCXCTJSA-N 413.566 2.157 10 20 HECD O=C(NC1CC(N2CCCCC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807551775 FQVGLWLBRPAHLI-SOAGJPPSSA-N 415.534 2.033 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H](O)C3CC3)cc2Cl)C1 807957021 VRKFJBNIZCMKFC-IFXJQAMLSA-N 407.942 2.422 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCCn2nc3n(c2=O)CCCC3)C2CC2)cc1 918077491 SLMITNVAJAQPKD-UHFFFAOYSA-N 412.538 2.211 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Cl)c(Cl)[nH]1 918643741 OFHNMNCRVFEIRP-UHFFFAOYSA-N 402.303 2.486 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3ccccc3)CC2)cc1 1319397846 TWQYNYXWMYPKOA-UHFFFAOYSA-N 417.531 2.103 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)[C@@H](C)c1ccc(C)cc1 1324120573 FYAZZDOETWYCLQ-GZRFBZBPSA-N 401.459 2.161 10 20 HECD Cc1nccn1CC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429047 PBEOVIYEXXHLBF-UHFFFAOYSA-N 421.457 2.446 10 20 HECD Cc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cn1 1795058622 BQEJATCRBVXCEQ-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(Cl)cn1 1796600915 PWAYVCMRNKFSSF-BTTYYORXSA-N 402.838 2.107 10 20 HECD O=C(Cc1ccc(F)cc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249061 RLAQQGNZCSIHAC-UHFFFAOYSA-N 419.840 2.345 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccncc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 11027171 DVXYKSYKIBVRHQ-UHFFFAOYSA-N 413.455 2.176 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1C(=O)NC2(CCCC2)C1=O 726526058 BIFOZXUCXJHMEA-OAHLLOKOSA-N 416.547 2.109 10 20 HECD Cc1cc(C(=O)NC2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)c(C)o1 727436947 LEZQZCBXXQXYHF-UHFFFAOYSA-N 412.534 2.473 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccccc3OC)cc2F)CC1 730391890 XCVHPIBAIWAOMR-UHFFFAOYSA-N 414.481 2.231 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H](O)Cc1ccccc1 747387160 FTYBIETYCACHFR-RBDMOPTHSA-N 424.545 2.180 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CC(=O)N1CCCC1 749901249 DEERBRMOAWPRHP-HNNXBMFYSA-N 419.481 2.343 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@]3(CCc4ccccc43)C2)c1 753855092 XROWFLBZHXYSRN-FQEVSTJZSA-N 402.472 2.078 10 20 HECD COC1(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCOCC1 758309403 YIZRPMUTXBEJGQ-UHFFFAOYSA-N 415.513 2.228 10 20 HECD COc1ccc(N2CCC(NC(=O)NCc3ccc4c(c3)C(=O)NCC4)CC2)cc1 758447265 CBECFLYABFBWJX-UHFFFAOYSA-N 408.502 2.449 10 20 HECD CC(C)CO[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 759566267 AQWGCNKHQPWANW-QUCCMNQESA-N 402.539 2.345 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1O[C@@H]1CCOC1 760109678 IRICAFPHLGQHJJ-LJQANCHMSA-N 407.470 2.485 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccn4ccnc4c3)cc2)C1 762269906 DUDHXKVSWDQRBM-GOSISDBHSA-N 406.490 2.035 10 20 HECD COc1ccc(CN2C(=O)C(=O)N(CN3CCCc4cc(OC)ccc43)C2=O)cc1 766338623 BVXTUMRJQGVRBH-UHFFFAOYSA-N 409.442 2.405 10 20 HECD CN1CCC[C@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC[C@@H]21 766878937 KRHXVYCQKGQYMJ-PXNSSMCTSA-N 404.530 2.413 10 20 HECD C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 771308860 BBCHZICQSJUAKW-IBGZPJMESA-N 417.598 2.300 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773856519 ITONDAHBVCFYKY-INIZCTEOSA-N 412.538 2.422 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(Cl)c1-n1cccn1 774364350 WNYFMVYTWUUDQI-UHFFFAOYSA-N 400.822 2.234 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccccn3)cc2F)C[C@@H](C)O1 774883844 GBXJSECHPJFYMW-OWCLPIDISA-N 414.481 2.328 10 20 HECD CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)O1 775459742 GPRIHMUAJPLUOQ-VQTJNVASSA-N 402.539 2.454 10 20 HECD Cc1ncsc1/C=C\C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 777099701 XUUQKPAVTWDOSU-PLNGDYQASA-N 419.478 2.300 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1cccc(F)c1 786674278 NWBMGDWFQKPFNY-UHFFFAOYSA-N 424.520 2.290 10 20 HECD CC1CCN([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C(C)C)CC1 787614154 CUPXVIZYYXKDCH-HXUWFJFHSA-N 406.546 2.381 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1 788940836 WEAIRNWLAIKWBV-LJQANCHMSA-N 411.502 2.447 10 20 HECD Cc1cc(Cn2nnc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2C)on1 794247599 TXYAHSWCAHIGOV-HNNXBMFYSA-N 410.478 2.259 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c(O)c1 797388985 JQJJLHTWSVWTIF-UHFFFAOYSA-N 400.822 2.495 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1 797675366 PYQTVOHMECSRRB-CYBMUJFWSA-N 420.491 2.463 10 20 HECD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 799428873 RFFGWHGPKUUCHL-HGZHAAGRSA-N 423.585 2.370 10 20 HECD C[C@H](O)C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccccc1 803665069 WFBDVUVXTICBDM-YJBOKZPZSA-N 401.482 2.179 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2nc(C)n(C)c2Br)c1 805011208 IRZZFPXYAADMFT-MRVPVSSYSA-N 404.286 2.245 10 20 HECD COCCOC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805026316 JMNSQNFFNYECJT-HXUWFJFHSA-N 417.550 2.051 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292772 YCROIWMBLIRMAW-LJQANCHMSA-N 420.513 2.083 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N(CCO)CC(F)F)cc2Cl)C1 807952411 HRSVTOQREWZMHY-ZDUSSCGKSA-N 417.884 2.279 10 20 HECD CC[C@@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)C1CCOCC1 807986362 VXNWQZPEJMTHFQ-HXUWFJFHSA-N 403.523 2.055 10 20 HECD CC(=O)N1C[C@H]2[C@@H](NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CCC[C@H]2C1 808237670 AWZLTDCFURJMRB-NSHGMRRFSA-N 418.513 2.109 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 809129392 AMJJYYRSRVJHTK-PGRDOPGGSA-N 403.523 2.054 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CCn3ncn(C)c3=O)c2C)cc1C 815271649 UMJFGKRSONEQJZ-UHFFFAOYSA-N 410.474 2.422 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 916590287 YGCNISFEYSDYGT-UHFFFAOYSA-N 407.444 2.168 10 20 HECD CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917834788 QBDCKKMZLTUFGY-YRXLECQKSA-N 420.513 2.182 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](O)COc1cccc(F)c1 918206956 RSOCHAGOQAKTGO-QGZVFWFLSA-N 421.444 2.041 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](O)c1ccc(Cl)cc1 1338288350 QCGXPGFWDDTSBQ-DOTOQJQBSA-N 407.850 2.465 10 20 HECD COC(=O)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC(C)C 1340273778 PMQWLYMCUHOUGS-CALCHBBNSA-N 423.529 2.187 10 20 HECD Cc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccc1O 1845356829 MJAKACZIMICSOR-VMPITWQZSA-N 424.453 2.348 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(N)=O)C2)cc1 1845994621 FEGFJJKKCQKIAK-UHFFFAOYSA-N 408.502 2.177 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(CCc4ccccc4)CC3)CC2)cc1 27576301 SPSGYTMQVHQYNJ-UHFFFAOYSA-N 422.573 2.204 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnc4c(c3)c(C)nn4C)CC2)cc1 726726223 PMCSLDKPNGHHHI-UHFFFAOYSA-N 422.489 2.009 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 733648227 SLZMZKXBSQXKQT-KKUMJFAQSA-N 415.531 2.062 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 734701832 KIDQJFDOOUVCCC-UHFFFAOYSA-N 403.504 2.028 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[S@](=O)[C@@H](C)[C@H]3C)cc2F)CC1 737050399 RMAQQHYDSKVPKJ-FYCBBRDGSA-N 410.559 2.019 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(O[C@@H]4CCOC4)cc3)ccc21 740496818 ZXOKNGPFYRIANH-HXUWFJFHSA-N 409.486 2.492 10 20 HECD Cc1c(F)cccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746039736 WAXODKOGTPJDDP-MRXNPFEDSA-N 412.465 2.091 10 20 HECD CCOC(=O)CCN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751062307 AOQUSXFRLZTSBT-UHFFFAOYSA-N 412.489 2.280 10 20 HECD CCC1CCC(N(CCO)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 753816520 XRFGVXCZRICADV-IQWMQGJTSA-N 419.610 2.441 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc1F 753933436 WEPTWNPZPJRLBZ-JKSUJKDBSA-N 406.502 2.313 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3c(C(C)(C)O)nc4ccccc43)CC2)cc1 758210778 RSAUIRBIZCGZQJ-IBGZPJMESA-N 424.545 2.455 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(OC)ccc3C(C)=O)CC2)cc1 758220984 BAQCSQAMIWJNFB-IBGZPJMESA-N 414.502 2.468 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc2c(c1)C(=O)NCC2 758691109 VCHOMQMUNPIRBG-UHFFFAOYSA-N 408.502 2.151 10 20 HECD O=C(NCCCSc1nccs1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 759590857 LYPSWVLNOROWAY-UHFFFAOYSA-N 408.509 2.460 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CS[C@@H]1CCS(=O)(=O)C1 761752227 FSAYQGDFYHOIAJ-CYBMUJFWSA-N 422.366 2.424 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(F)cc3C(=O)N(C)C)CC2)cc1 767635408 OBJDPGSQEJKZQO-UHFFFAOYSA-N 414.481 2.297 10 20 HECD Cc1cccc(C)c1NC(=O)CN1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440776 DLOJRGQIUSCGDV-FQEVSTJZSA-N 411.502 2.191 10 20 HECD CCc1ccc2c(c1)[C@@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N2 769807003 XRUZNTGTHVJXAC-CQSZACIVSA-N 417.487 2.182 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2 773739777 KCSKWRUHJDKCRA-CFJPQMKISA-N 405.472 2.114 10 20 HECD COCCN(CC(=O)N(C)C)Cc1cc(Br)cc(Br)c1O 775656385 GFKBJGGSJCTDGL-UHFFFAOYSA-N 424.133 2.454 10 20 HECD CS[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H]1N(C)C 776002089 RTQMVIRVSYDRSV-WOJBJXKFSA-N 423.538 2.378 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCc3ccc(O)cc3)CC2)cc1 778286174 VWHSAMNAJHNOMG-OUKQBFOZSA-N 423.513 2.355 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1 779626833 GIKPOQIUYNWSFU-GOSISDBHSA-N 404.488 2.125 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3cnn(C)c3)cc2F)CC1 780620174 ZVKRGJGAUFLBPF-UHFFFAOYSA-N 411.485 2.021 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)cc1 785424544 JZYCXONFDDKPRI-UHFFFAOYSA-N 412.509 2.289 10 20 HECD Cc1nc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 785670334 ORZDWLYRHVTMCU-ZDUSSCGKSA-N 424.473 2.454 10 20 HECD Cc1cc(CC(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)no1 785967635 BUULQBCLDVZKDC-HUUCEWRRSA-N 419.453 2.138 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccccc1N1CCOCC1 788330824 FEAOWVYMINTEMO-UHFFFAOYSA-N 411.502 2.284 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](c3cccc(F)c3)N(C)C)ccc21 803685644 HHQNCWXHWLLILI-NRFANRHFSA-N 412.509 2.243 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](C)[C@@H]3C)cc2F)CC1 805006659 AMFGCUNDLNUYLV-IRXDYDNUSA-N 404.530 2.231 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387386 ISZIDLHTUZHVCQ-UHFFFAOYSA-N 413.249 2.258 10 20 HECD CN(Cc1cscn1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769096 DCUFHYGLTZUFJZ-CYBMUJFWSA-N 424.473 2.488 10 20 HECD COCCOCc1ccc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 808389423 GZXVEUJAHZLKBN-UHFFFAOYSA-N 418.559 2.374 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COc3cc(F)cc(F)c3)CC2)cc1 810395378 PXAGSGTXNXLUTF-UHFFFAOYSA-N 405.445 2.291 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c(O)c1 815631618 KLTJOMYWXPTVJO-YJYMSZOUSA-N 411.458 2.417 10 20 HECD CCC(=O)N[C@H](C)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 914671619 AGXKTHCWRMBYDZ-CHWSQXEVSA-N 422.437 2.247 10 20 HECD CN(C)C(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918030085 MGQIRDCNSILKNP-SFHVURJKSA-N 423.517 2.412 10 20 HECD C=CC(=O)NCc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 919989331 TVAVZJJBGSVVAT-FQEVSTJZSA-N 420.513 2.121 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)c1 920637050 YGKQKWSCSHNGLD-BBRMVZONSA-N 410.492 2.102 10 20 HECD COc1cccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847038632 XAODLCMRZFVBAJ-VQHVLOKHSA-N 424.453 2.342 10 20 HECD COc1ccc(N2CCN(C(=O)c3nnn(-c4cccc([N+](=O)[O-])c4)c3C)CC2)cc1 105566689 WHBRRBVZICUWHC-UHFFFAOYSA-N 422.445 2.455 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccsc2C(=O)OC)cc1 139805809 GQMROHCLLVXHFN-UHFFFAOYSA-N 418.518 2.487 10 20 HECD CC1(C)Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2O1 147133707 UGVWDHQEWKRWHB-UHFFFAOYSA-N 411.458 2.285 10 20 HECD O=C(NC1=S=C(C(=O)Nc2nc(-c3ccncc3)n[nH]2)C=C1)Nc1ccccc1 433090889 JGKBKKQEXDCRDV-UHFFFAOYSA-N 405.443 2.232 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)N2CCN(c3ccccc3O)CC2)c(O)c1O 727005468 QNYAUFPJQOGOCK-AWEZNQCLSA-N 400.431 2.006 10 20 HECD COC(=O)CNC(=O)[C@@H](C)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731036493 MUTQJICHWYCMAN-CQSZACIVSA-N 405.495 2.142 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cs1 742270781 BZSCGLHPAZMNOQ-UHFFFAOYSA-N 410.517 2.192 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cn(Cc4ccccn4)nn3)cc2F)C[C@@H](C)O1 742556922 OLZYGMYJSDVNER-IYBDPMFKSA-N 424.480 2.404 10 20 HECD CNC(=O)[C@H](C)CN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747967468 NKQBHIQKOKVUQG-KGLIPLIRSA-N 407.470 2.103 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)c1O 748050514 FJCLDRBLUUKPHK-IYBDPMFKSA-N 405.514 2.356 10 20 HECD NC(=O)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)o1 752021824 UVVTZYLKGVDHQH-GFCCVEGCSA-N 408.405 2.448 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCC[C@@]12NC(=O)N(C)C2=O 753020404 IOOJTSIMKQFAGJ-IIBYNOLFSA-N 401.511 2.005 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058846 FMICKLQVHLARGN-HNNXBMFYSA-N 401.511 2.375 10 20 HECD Cc1cc(C(=O)CN2C(=O)N[C@@]3(CCOC3)C2=O)c(C)n1-c1ccc2c(c1)CCC2 755853237 YDKHBIHGRFDEQK-HSZRJFAPSA-N 407.470 2.476 10 20 HECD O=C(COC(=O)Cc1ccc(F)cc1F)NCc1ccc(N2CCOCC2)c(F)c1 756618691 MILUBSFCEIUCAQ-UHFFFAOYSA-N 422.403 2.343 10 20 HECD CCc1nnc(C)cc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759222877 MCSOECWTKNHXAN-UHFFFAOYSA-N 400.479 2.336 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 760294669 FEHSNRVZMZDAQK-OAHLLOKOSA-N 407.478 2.161 10 20 HECD Cc1n[nH]c(C)c1[C@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 763944459 HKXNSFKSYFOOSJ-CQSZACIVSA-N 404.536 2.071 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(C)c1 766322021 YZBHCHXXCTVQGU-UHFFFAOYSA-N 414.553 2.416 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1nc2ccccc2s1 766807559 DBLLUFXGPFPIIU-UHFFFAOYSA-N 401.513 2.461 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCCc4c[nH]nc43)CC2)cc1 766845900 MKVNEOWJGAKVEQ-FQEVSTJZSA-N 412.538 2.307 10 20 HECD CC[C@H](C)NC(=O)CN1CCN(Cc2cc(Br)cc(OC)c2O)CC1 768250702 ACADZOCADOKRFA-ZDUSSCGKSA-N 414.344 2.196 10 20 HECD O=C(COC(=O)c1coc(C2CCC2)n1)NCc1ccc(N2CCOCC2)c(F)c1 769622207 BTYVMVKBRSCBCZ-UHFFFAOYSA-N 417.437 2.391 10 20 HECD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2)[nH]1 775403245 HXZYAXKNUVKTQF-OAHLLOKOSA-N 422.485 2.438 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 778875813 UXAJOYKKOVNVOX-GASCZTMLSA-N 408.470 2.025 10 20 HECD CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NCc1ccc(O)c(O)c1 778916390 GQKJYVGHNBBFDH-INIZCTEOSA-N 404.488 2.031 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cn4c(n3)CCCC4)cc2F)C[C@@H](C)O1 779877084 BPRSAUNPVKTGLA-GASCZTMLSA-N 422.526 2.451 10 20 HECD O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 779879598 WIUCWCFMTFSUGA-UHFFFAOYSA-N 405.476 2.094 10 20 HECD C=CC(=O)NCc1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781270298 IBJNHBBYEYRMLV-UHFFFAOYSA-N 406.486 2.410 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3S(C)(=O)=O)c2)CC1 781270752 FKGYMEGRZXIKNY-UHFFFAOYSA-N 401.488 2.011 10 20 HECD O=C(Cc1ccc(S(=O)(=O)CC(F)F)cc1)OCC(=O)c1ccc(O)c(O)c1 783734048 RWDJGCUUDOJQLR-UHFFFAOYSA-N 414.382 2.105 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 784700045 ORVHKWYKGKLBOT-UHFFFAOYSA-N 417.487 2.267 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3c(F)cccc3F)cc2)CC1 786122075 MTOKEJDANXOXMX-UHFFFAOYSA-N 423.485 2.253 10 20 HECD CC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(OC)OC 788196388 FWULYMMPQHTWHC-ZDUSSCGKSA-N 414.505 2.382 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccnn3-c3ccccc3)CC2)cc1 792097539 SFZQJJOPFLDQRS-UHFFFAOYSA-N 405.502 2.433 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C1=C(C)OCCS1(=O)=O 798298469 PTMUEGDDWYJVAF-UHFFFAOYSA-N 404.282 2.180 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)CCc3ccccc3)nc12 801493664 LALORCGVMBYTCK-NRFANRHFSA-N 413.430 2.039 10 20 HECD COc1ccccc1OC[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665065 SMSYDVGDVAMZQW-OAHLLOKOSA-N 417.481 2.348 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807676355 FHDLUBICLDHGCJ-AEFFLSMTSA-N 410.518 2.334 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)O[C@](C)(c4ccccc4)C3=O)CC2)cc1 810024575 MMQJIVFGYWPHRD-HSZRJFAPSA-N 423.469 2.238 10 20 HECD C[C@@H]1CCCCN1[C@H](C)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918007656 QBBSVTIQURUINV-GGPKGHCWSA-N 415.582 2.450 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(O)n1)c1cc(O)c(O)c(Cl)c1 1795124980 WHHACNIPLNNSSW-CLLJXQQHSA-N 417.849 2.417 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2CCCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990906 KSECUKQMXFYCHY-UZLBHIALSA-N 410.474 2.398 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccccc1S(=O)(=O)N(C)C 10588392 MUMIJKAUDZBSJE-UHFFFAOYSA-N 404.536 2.345 10 20 HECD Cc1nc2ncnn2c(C)c1CCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 16134859 ZDALAKYVKCVXGK-UHFFFAOYSA-N 408.506 2.169 10 20 HECD CN(C)c1ccc(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1 237126744 KFXQRMMWIOBDGY-UHFFFAOYSA-N 403.548 2.204 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)C1CCCC1 727105267 YFRRIOQFXDWGTD-VQIMIIECSA-N 414.550 2.090 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCC1 729598496 CJYAUJRVSKSOKK-TZIWHRDSSA-N 415.582 2.308 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)CNCc2ccc(N3CCCCC3)cc2)c1 729686173 DTKVWHMLXGKNLA-UHFFFAOYSA-N 416.547 2.313 10 20 HECD COc1cc(C=O)ccc1OCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 736196046 MCANZPIVXIVBFR-UHFFFAOYSA-N 412.486 2.412 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 737134543 NGCPLOTVYCPOIX-UHFFFAOYSA-N 401.375 2.059 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1O 737286021 QDXVSLOYYLBQGL-OAHLLOKOSA-N 413.474 2.049 10 20 HECD COC(=O)COc1cccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1 739773738 JYHDZSAPDYHSPN-UHFFFAOYSA-N 411.458 2.192 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc2c(=O)[nH]c3ccccc3n12 748850758 JHEMHYMCXTWPCB-UHFFFAOYSA-N 422.514 2.388 10 20 HECD CNC(=O)Cc1noc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)n1 749789742 AALVKVAWIGBGIF-UHFFFAOYSA-N 415.494 2.336 10 20 HECD C[C@]1(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO[C@@H]1C1CC1 753123199 XOBGWSXGXSTGLG-JUXOCIIHSA-N 400.523 2.145 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN(C4CCCC4)CC3)CC2)cc1 754041495 BCILCUMQUGJYTI-HSZRJFAPSA-N 416.610 2.128 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H]1CCCS(=O)(=O)C1 758663127 NLEQHUJYVJXRPX-CQSZACIVSA-N 417.478 2.133 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](Cc3nc(C)no3)c3ccccc3)nc12 759927100 DKBOAFIBLYVJJQ-QGZVFWFLSA-N 422.445 2.377 10 20 HECD CNS(=O)(=O)c1cccc(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)c1 765265370 GWROHEFSCDWBCP-OAHLLOKOSA-N 407.511 2.421 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 768118422 ZFRCCEJBTVHRPE-UHFFFAOYSA-N 412.465 2.165 10 20 HECD Cc1cccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 770958806 DJKBGSWAVDTQSQ-UHFFFAOYSA-N 402.432 2.303 10 20 HECD CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774322639 KYEMCVDROSTFKE-UHFFFAOYSA-N 420.557 2.493 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(-c2ccccc2)n1 777828220 JYKZRFTUFLRBRL-UHFFFAOYSA-N 400.822 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccn(CC(F)F)n3)CC2)cc1 778306169 PVCZKYWQCNOEMX-SREVYHEPSA-N 419.432 2.000 10 20 HECD CCCCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(C)C 788314184 ZOUYEHSCDYYQGP-WOJBJXKFSA-N 417.550 2.239 10 20 HECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 793808683 LZWKPKCYEZHHBL-OAHLLOKOSA-N 406.490 2.135 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccccc3-n3cccn3)CC2)cc1 794753221 CMCVHWBJEICQLU-FQEVSTJZSA-N 408.502 2.443 10 20 HECD Cc1nnc(COCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 795361176 VFWSHKBZMNCWIS-STQMWFEESA-N 408.499 2.432 10 20 HECD CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 798153192 MORGWZRRQRZNOX-LJQANCHMSA-N 402.539 2.042 10 20 HECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H](C)C1 804379475 LVOJHLXJHYMSFQ-CYBMUJFWSA-N 409.533 2.421 10 20 HECD CCOC(=O)N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804851592 HZOCXLQWZABZQE-MRXNPFEDSA-N 422.501 2.025 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2nncn2-c2ccccc2)cc1F 804852236 DBMMJKIJKYQJGH-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CN(C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1)S(C)(=O)=O 804967607 ZITWPWXVVHPFEY-SFHVURJKSA-N 408.568 2.100 10 20 HECD CC[C@H](NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1)C1CCOCC1 807986361 VXNWQZPEJMTHFQ-FQEVSTJZSA-N 403.523 2.055 10 20 HECD CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@H]1CCOC1 812388511 DRRTVPCQHPUCME-OAHLLOKOSA-N 408.462 2.304 10 20 HECD Cc1cc(C)n([C@@H](C)CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 918337516 LUTIDHOJYRZASP-KRWDZBQOSA-N 404.536 2.002 10 20 HECD CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920195222 NBGGVVQCTWMQGX-UHFFFAOYSA-N 424.501 2.435 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)nc1-c1ccccc1 1342916665 RGODYTMJQOVPGY-KRWDZBQOSA-N 409.442 2.403 10 20 HECD Cc1cnoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846379 UPDLZTLKABKORR-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD CCc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cn1 1847033990 TXAMRHVMZJVGDF-RMKNXTFCSA-N 423.469 2.291 10 20 HECD C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccnc1 1847675400 OOUFFQRBWDAUNX-CQDKDKBSSA-N 404.854 2.024 10 20 HECD COC(=O)c1c(C)cccc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 116222364 NNMNLBXSERYALW-UHFFFAOYSA-N 404.488 2.301 10 20 HECD Cc1cn(C)c(CC(=O)N2CCc3ccncc32)c1C(=O)N1CCc2ccncc21 427079698 ZLEJYYLCEFDJJO-UHFFFAOYSA-N 401.470 2.458 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1 463956178 XMVUAIOVMNISMU-IBGZPJMESA-N 415.515 2.331 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc1 728514183 UBOYDUZPMFRENU-UHFFFAOYSA-N 424.545 2.339 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc(Cc3ccccc3)ns2)c1 730594399 PWADOSBUTWRTQU-UHFFFAOYSA-N 404.473 2.458 10 20 HECD COCCOc1ccc(-n2nc(C)c(C(=O)NCc3cc(OC)ccc3O)n2)cc1 735116414 KXITZUUVWJROGV-UHFFFAOYSA-N 412.446 2.245 10 20 HECD CN1CC(=O)N(CCCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801352 PSLJYTGUNLQGDN-AWEZNQCLSA-N 424.448 2.047 10 20 HECD CC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 743322897 MADSHJRDPYQSTM-MDZRGWNJSA-N 420.529 2.497 10 20 HECD COC[C@](C)(O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 745315848 CAWJSJRPNSBONL-NRFANRHFSA-N 403.431 2.004 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1 745994140 ZYGURQAOCRZJMC-CYBMUJFWSA-N 420.487 2.382 10 20 HECD CC(=O)N(C)c1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 746037527 HBJDSQBXBZTRCV-INIZCTEOSA-N 424.501 2.322 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(F)cc1F 747011642 FAQPDLROFSQRLQ-UHFFFAOYSA-N 409.364 2.211 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1nc(Cc2ccccc2)no1 750326313 DWDKIOBQGUXPAS-UHFFFAOYSA-N 407.474 2.496 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)C4)cc2F)C[C@@H](C)O1 752005809 UUXQQBHUTVVIML-IYBDPMFKSA-N 418.513 2.251 10 20 HECD CNC(=O)CCCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 753210374 YBNZGHUGEKSKLU-AWEZNQCLSA-N 407.470 2.247 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)ccc1C 754040298 NMSNXZGNMYTNNK-UHFFFAOYSA-N 422.478 2.440 10 20 HECD C[C@](O)(CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 755628128 FXLGGHJEALSMJF-QFIPXVFZSA-N 413.497 2.110 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(C(=O)NC4CC4)cc3)no2)c1 761519680 DDXTXVIEKXJUBO-UHFFFAOYSA-N 414.443 2.373 10 20 HECD O=C(NCc1ccc(F)cc1)C1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440016 QYZNNVODIFLSBU-FQEVSTJZSA-N 400.450 2.486 10 20 HECD CCC(CC)n1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 770861621 XHBFROBMYAOPKU-UHFFFAOYSA-N 404.536 2.409 10 20 HECD CNC(=O)COc1cccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)c1 772217564 AIEJKONAUQZODG-UHFFFAOYSA-N 413.543 2.224 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 773764071 VHPGDNOWYRHDIZ-NSHDSACASA-N 408.451 2.039 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1C 774222495 LLQPJBIZFKEYQN-UHFFFAOYSA-N 412.490 2.303 10 20 HECD COC(=O)/C=C1\SCC(=O)N1CCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 775256189 WXQKRHUUYCNPTH-IEOAWGNMSA-N 419.547 2.154 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOCC4(CCCC4)C3)cc2)C1 776124319 QUGCMNJUOMQJEN-IBGZPJMESA-N 414.550 2.491 10 20 HECD CC[C@H]1Oc2cc([C@@H](C)NC(=O)C(=O)NCc3ccc(N(C)C)cc3)ccc2NC1=O 785438342 CLUZPONBCBQOIV-AUUYWEPGSA-N 424.501 2.356 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)N(C)c3ccccc3)CC2)cc1 787638452 MLTWQSBQVHTCMZ-LJQANCHMSA-N 424.545 2.375 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)cc1 788975554 QTZUHUHCVGIEMR-DYESRHJHSA-N 405.564 2.320 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H]3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 789818733 KOJVMUCTOUJJEW-INMHGKMJSA-N 421.513 2.129 10 20 HECD Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)cc1 789967468 QFOJIIGKDURUBH-AWEZNQCLSA-N 422.478 2.376 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C 790958182 LFKORQVJBSEMQS-MRXNPFEDSA-N 400.479 2.397 10 20 HECD COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c(O)c1 794376264 DPBPKYABEWGKTF-HXUWFJFHSA-N 405.454 2.453 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)cc1C 795612664 XHVDQRRDFBJEBF-UHFFFAOYSA-N 424.529 2.222 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686227 DCVTVOPSZXLNFP-SFHVURJKSA-N 415.534 2.123 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)CCc3cccn3C)CC2)cc1 804317710 NFNLDDJUCAXVGZ-KRWDZBQOSA-N 412.534 2.256 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCc4ccccc4OC3)CC2)cc1 804318557 NRTYSLRYGYBKFP-IBGZPJMESA-N 423.513 2.290 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]4CCC[C@H]43)cc2F)CC1 805007588 MOWRKCRHCGMPRB-UYAOXDASSA-N 416.541 2.375 10 20 HECD COC(=O)Cc1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807387539 NAMFZUUOQSZNNM-UHFFFAOYSA-N 421.247 2.125 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CC[C@]2(CCOC2)C1 807769529 GXXNKJGYALQUND-VFNWGFHPSA-N 423.460 2.012 10 20 HECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 807831227 RIJGGPABDMYPLU-MRXNPFEDSA-N 418.538 2.084 10 20 HECD CC(C)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cccnc1 809248019 LYDFEMIVVQFWNF-JOCHJYFZSA-N 424.545 2.433 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(Cl)c2c(c1)OCO2 916676763 QUSCWLPNWKJQQO-UHFFFAOYSA-N 422.890 2.234 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(C(F)(F)F)cn1 918340056 JZCKYUMUAGVSTE-UHFFFAOYSA-N 413.421 2.265 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc1 1116347886 DGSPUXDWBQJOBF-UHFFFAOYSA-N 403.504 2.419 10 20 HECD C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319947122 FVWMXEWMEPUBKD-MRXNPFEDSA-N 420.554 2.418 10 20 HECD Cn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1794917407 YWRHUSKBCSFWEG-GGPHIMKMSA-N 419.485 2.070 10 20 HECD C[C@]1(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CC1(F)F 1846985588 WBOBJMNMAHXABZ-LJQANCHMSA-N 416.428 2.028 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1O 729859795 WFZNRVABWVPNEM-CQSZACIVSA-N 410.517 2.240 10 20 HECD CCCN(CCC)S(=O)(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730269175 QZARJCNTLHJESL-UHFFFAOYSA-N 400.564 2.424 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1 734284302 XHXSPGDPVKXLTM-QFIPXVFZSA-N 416.566 2.308 10 20 HECD NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)cc1 740919381 QBHSFCABKNQHSW-UHFFFAOYSA-N 405.502 2.194 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccccc3[N+](=O)[O-])CC2)cc1 742940821 ZABLBCCEUAUBSQ-UHFFFAOYSA-N 413.478 2.225 10 20 HECD CC(C)c1ncc(Cl)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 743868920 HTFJUMBYNKUHIA-UHFFFAOYSA-N 422.938 2.418 10 20 HECD CN1CCC(O)(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745904422 PZADHLFTHUSGPO-OAHLLOKOSA-N 412.481 2.013 10 20 HECD COc1cccc(CNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1O 749118539 PFLROWJRKNHDKX-CQSZACIVSA-N 420.491 2.156 10 20 HECD Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227019 ABZWJOSYXPQSNM-UHFFFAOYSA-N 423.466 2.482 10 20 HECD COC(=O)C[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 754538097 JZQKNNBEYZIKBA-LJQANCHMSA-N 406.438 2.332 10 20 HECD CCN1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 754749760 UOIQWZYVPKHLTH-KAMYIIQDSA-N 423.585 2.420 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nc(C)c(C)s3)CC2)cc1 755035895 ISVJFHNBFSKWHP-HHHXNRCGSA-N 407.561 2.366 10 20 HECD O=C(COC(=O)Cc1cccc(F)c1F)NCc1ccc(N2CCOCC2)c(F)c1 756487392 ASFVTSFDSPFHIE-UHFFFAOYSA-N 422.403 2.343 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN(CC4CC4)C3)CC2)cc(OC)c1OC 759268393 RISZLFUGIQPFNI-KRWDZBQOSA-N 418.538 2.028 10 20 HECD CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 760378027 LICPXRRHDOZTNM-INIZCTEOSA-N 416.522 2.062 10 20 HECD Cn1nc(Br)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 760391589 BZCNFHIDPUDHLM-UHFFFAOYSA-N 411.275 2.213 10 20 HECD Cc1cc(C(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1F 761260617 YGLWYYCKZSYRBL-UHFFFAOYSA-N 408.451 2.147 10 20 HECD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 769320448 PKWSKUXKDAJKLT-RBBKRZOGSA-N 414.594 2.336 10 20 HECD COc1ccc(N2CCN(Cc3c(C)nn(C)c3N3CCOCC3)CC2)cc1F 770304882 CJKNZYOYMVMJFJ-UHFFFAOYSA-N 403.502 2.035 10 20 HECD C[C@H](NC(=O)N1CCN([C@H](C)C(=O)N2CCCC2)CC1)c1ccc(N(C)C)cc1 773613351 QBKNHPZSVCBFAN-ZWKOTPCHSA-N 401.555 2.152 10 20 HECD CSC[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 773741139 SCGSUWFXMRYBPD-ARLBYUKCSA-N 420.531 2.052 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1O 774876991 HITPQSJYFNFPTN-UHFFFAOYSA-N 420.510 2.122 10 20 HECD C[C@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 777720573 HVEQOMGYUZDAQU-HTAPYJJXSA-N 418.559 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4n[nH]cc4c3)CC2)cc1 778227427 XMCCPHYZKZBLBT-CMDGGOBGSA-N 405.458 2.415 10 20 HECD C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)NCc1ccc(N2CCSCC2)cc1 780309970 ZPKDROIDZSCWJJ-QGZVFWFLSA-N 406.596 2.226 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)c1 787484129 ARBVRGPIHSQYDW-CYBMUJFWSA-N 412.446 2.055 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 788910558 LZKPSPGMPUGCLF-UHFFFAOYSA-N 422.445 2.004 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 789800724 NYDKFHYMJCNACH-KKSFZXQISA-N 411.477 2.498 10 20 HECD C[C@@H](c1ccccn1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842706 GWGRHZUOCUVTIG-HNNXBMFYSA-N 414.481 2.018 10 20 HECD COc1ccc(N2CCN(CCN[C@@H](C)c3ccc4c(c3)OCC(=O)N4)CC2)cc1 796727140 KLZYGWXOHJVLFJ-KRWDZBQOSA-N 410.518 2.499 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 798167808 RFNQMDZPDYMCQO-UHFFFAOYSA-N 407.448 2.018 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 803297951 KWJJCNKZBZLESF-OAHLLOKOSA-N 416.909 2.407 10 20 HECD CCCCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803620621 ABDVZOXHENCTGO-HXUWFJFHSA-N 400.567 2.456 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N(C)Cc1ccccc1 803688333 PDSKMCHSTTYWGQ-SFHVURJKSA-N 408.546 2.322 10 20 HECD Cc1ccc2[nH]cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c(=O)c2c1 804276506 AESYDUSVJMHDCH-QGZVFWFLSA-N 418.497 2.468 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H](OCC4CC4)C3)CC2)cc1 804315255 ITHDWFBNNOQBQM-NRFANRHFSA-N 415.534 2.198 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(CCc2ccccc2)CC1 806282285 JSMSRABJPDFKGI-UHFFFAOYSA-N 418.588 2.128 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(C)[C@H]3[C@H]3CCCO3)CC2)cc1 810024778 RHVOWGWURRQACX-KSEOMHKRSA-N 403.567 2.068 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2c(I)cnn2C)c1 815835346 PYVPTRLLPJNHIU-QMMMGPOBSA-N 401.204 2.230 10 20 HECD CCCCCN(C(=O)/C=C\c1cnn(C)c1)c1c(O)nc(=O)n(CCCC)c1N 917110365 RIIXFHGTOBURDI-KTKRTIGZSA-N 402.499 2.301 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1Cl 918306088 RBSUWGQQOBTQPD-UHFFFAOYSA-N 402.882 2.363 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(F)c(F)c1 918438537 GQMALCLRTNKBGW-UHFFFAOYSA-N 407.392 2.320 10 20 HECD CC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1786455519 WRBAIDFFSMOEQA-RBOXIYTFSA-N 410.898 2.391 10 20 HECD C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387010 YUOZZOWLWBCGMT-XLIONFOSSA-N 402.539 2.360 10 20 HECD COC(=O)c1cn([C@@H]2CCCN(C(=O)NCc3c(C)c4ccccc4n3C)C2)nn1 472235612 BBBJCTNILFDIET-OAHLLOKOSA-N 410.478 2.412 10 20 HECD COc1ccc(CCNC(=O)[C@H](C)OC(=O)c2ccc(C)c(O)c2O)cc1OC 727005458 PWLLSRDXJNMBOW-ZDUSSCGKSA-N 403.431 2.328 10 20 HECD CC(=O)NCCCc1ccc(-c2csc(NS(=O)(=O)c3ccnn3C)n2)cc1 727245303 HCSUGESTQBOUAV-UHFFFAOYSA-N 419.532 2.413 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCN3CCCCC3=O)cc2F)CC1 730133736 TVUMQQLQBDUFNL-UHFFFAOYSA-N 419.545 2.169 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Nc1ccn(CC(=O)N(C)C)n1 743136577 LMZWRYCDWGGTDK-UHFFFAOYSA-N 424.299 2.493 10 20 HECD CNC(=O)C1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCC1 744403559 SNWWPWRVDSRJOE-UHFFFAOYSA-N 405.454 2.049 10 20 HECD CC(C)OCCN1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 746415350 OPEDIAKTTVHQHH-UHFFFAOYSA-N 422.545 2.039 10 20 HECD CN(C)c1ccc(CNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc1 748325603 RBOKKAIJRLCTEV-UHFFFAOYSA-N 409.534 2.291 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1C 748775911 JBQLRXIUIDIKPJ-ZDUSSCGKSA-N 407.421 2.054 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cc(C(N)=O)c[nH]2)NC(=O)OC(C)(C)C)cc1 749401961 FXFMCFPSQGTAKK-QGZVFWFLSA-N 415.494 2.175 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1F 752010023 LLBYVCMVSXAZCC-BTYIYWSLSA-N 419.501 2.192 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCCS(=O)(=O)C1 758658866 RHURALXMTAYFMR-CYBMUJFWSA-N 405.314 2.263 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccn(Cc3ccccn3)n2)cc1 759027756 NXRGEQNQXJZUOL-UHFFFAOYSA-N 406.490 2.428 10 20 HECD COc1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 759247944 SABORRZLZKOAON-AWEZNQCLSA-N 421.475 2.480 10 20 HECD COc1cc(N2CCN(C(=O)[C@@](C)(O)Cc3ccccc3)CC2)cc(OC)c1OC 760087392 YTXBHHXUYLEFDM-QHCPKHFHSA-N 414.502 2.355 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3c(C)nc4sccn34)nc12 761915294 UKYDGWZTHXGRSS-UHFFFAOYSA-N 400.464 2.261 10 20 HECD COc1ccc2c(c1)CCCN2Cn1nc(C[C@H]2CCS(=O)(=O)C2)n(C)c1=S 766341773 PSVHSZSYPBUNDE-CQSZACIVSA-N 422.576 2.347 10 20 HECD CCN(CC)C(=O)C1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCCC1 769716488 KOEHNJZDOYPFLC-UHFFFAOYSA-N 411.524 2.065 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(C)nc3-c3ccccc3)nc12 772170274 UHVVJZMJHCJKAA-UHFFFAOYSA-N 421.413 2.369 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](C)c2ccc(N(C)C)cc2)c1 772960224 OPMBYMTUERGLJL-HUUCEWRRSA-N 404.536 2.339 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1Cl 774363821 MQLFOZVCHVIPIM-UHFFFAOYSA-N 408.838 2.074 10 20 HECD C[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774537191 JJBBOBBEDMCOBX-QGZVFWFLSA-N 413.493 2.416 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)N=c2cc[nH]n2Cc2cccc(C)c2)cc1 784563349 GEECSJGOTVKOJZ-UHFFFAOYSA-N 422.485 2.288 10 20 HECD O=C(COC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1)c1ccc(O)c(O)c1 784647149 PYVGUXJMINXKLU-UHFFFAOYSA-N 419.333 2.399 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cc1 785428587 NRBXWFSKFDYZND-UHFFFAOYSA-N 412.509 2.242 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(c4cccc(F)c4)=NO3)cc2)CC1 786657406 XKEIERSKRZMRNS-JOCHJYFZSA-N 424.476 2.304 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSCC[C@H]3C)cc2F)C[C@@H](C)O1 789822415 WNRZXEYOZUDHRJ-OAGGEKHMSA-N 423.554 2.410 10 20 HECD NC(=O)c1cc(Cl)nnc1N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1 795240796 HMOJJHPFJVWGLM-UHFFFAOYSA-N 411.849 2.052 10 20 HECD CCOc1ccc(NCc2c(O)cccc2OC)cc1S(=O)(=O)N1CCOCC1 796404964 DUGIZNHRJPBKJD-UHFFFAOYSA-N 422.503 2.433 10 20 HECD CO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H](C(=O)O)C1 797709669 GIUCZZBNFQEYHP-BFIPOCKSSA-N 423.485 2.213 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 804008206 KFAGNQBIGSBJJD-FQEVSTJZSA-N 423.513 2.438 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCN(C)C[C@H]3C)cc2)CC1 805025667 SVVOAEKRLGXKNN-WIYYLYMNSA-N 400.567 2.338 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCCN(C2CCC2)C1 807289809 JSRUFSXNSLAFCX-AZUAARDMSA-N 410.562 2.448 10 20 HECD COc1ccc(CS(C)(=O)=O)cc1NCc1ccccc1OCC(=O)N(C)C 809695420 KYOAYTXOQUHWQZ-UHFFFAOYSA-N 406.504 2.319 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCCN4c5ccccc5C[C@H]4C3)CC2)cc1 810051284 YGOVDUFKMVGKBD-QFIPXVFZSA-N 420.557 2.481 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(N(C)C)nc3)n2)c[nH]1 811822227 BTGRIQYSIVPLIV-UHFFFAOYSA-N 407.477 2.187 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)[C@H](O)c3ccccc3)CC2)cc1 812016889 STVFDKPQHHMBPF-AVRDEDQJSA-N 412.534 2.239 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cnccc3OC)cc2F)CC1 814417622 DQUNGYQXWCLECK-UHFFFAOYSA-N 401.486 2.371 10 20 HECD COc1ccc(N2CCN(CC(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)cc1 916985255 ZUGLZDFROVPVAX-UHFFFAOYSA-N 422.529 2.026 10 20 HECD COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NCCc1ccc(O)c(O)c1 917356225 ZIYMKLRVGRVXQL-INIZCTEOSA-N 418.515 2.317 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)cc2)C1 918373324 VZFKTZCBSOMERG-AWEZNQCLSA-N 422.445 2.103 10 20 HECD CCN(Cc1nnnn1-c1ccc(S(C)(=O)=O)cc1)c1ccc(OC)c(OC)c1 921062016 RMVVPXMNFLVKIB-UHFFFAOYSA-N 417.491 2.110 10 20 HECD Cc1cc(NC(=O)c2ccc(C3=S=CC=C3)s2)n([C@@H]2CCS(=O)(=O)C2)n1 1254501473 POFDQLHIRCHXOJ-GFCCVEGCSA-N 407.542 2.491 10 20 HECD COc1cc(N2CCN(C(=O)Cc3c[nH]c4cnccc34)CC2)cc(OC)c1OC 1327963925 ACALXICPAWSKTL-UHFFFAOYSA-N 410.474 2.480 10 20 HECD COc1ccc(N2CCN(C(=O)NCCC(=O)N3CCC[C@@H](C)C3)CC2)cc1F 1343742267 GGKZMKGQEXXBGY-MRXNPFEDSA-N 406.502 2.315 10 20 HECD Cc1ccn(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1800715717 MMWZTNCIJCOVCY-QDMKHBRRSA-N 418.881 2.208 10 20 HECD CC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806250619 SDSNLXXPMQJIBN-GUYCJALGSA-N 417.849 2.055 10 20 HECD Cc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)s1 1807912792 KQYVDJSDYGBSKK-UHFFFAOYSA-N 416.503 2.416 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)CC2)c1cc(O)nc(O)c1 1816720273 ILNGZCAHICMKEB-UPJWGTAASA-N 414.487 2.221 10 20 HECD O=C(c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055450 LEIJRLBGSQAKIJ-UHFFFAOYSA-N 423.947 2.017 10 20 HECD C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 55341941 MWRMKWDZQMKRRV-PBHICJAKSA-N 403.504 2.329 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 57372401 PCBHMJAPTMHOJG-HUUCEWRRSA-N 410.453 2.345 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3[C@H]4C[C@H]5[C@H]([C@@H]4O)[C@@H]4C[C@H]5[C@H](O)[C@H]43)ccc21 555544123 MLOBBGUBEUMCKI-SVOKVVGVSA-N 410.514 2.105 10 20 HECD COc1ccc(S(N)(=O)=O)cc1NC(=S)NCCCN(C)c1ccccc1 726451058 KTBKJLYQZHVYTP-UHFFFAOYSA-N 408.549 2.156 10 20 HECD CN(C)C(=O)CCN1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 731544418 WPSHLCYVURWMNK-UHFFFAOYSA-N 415.582 2.369 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn4nccc4c3=O)c2C)cc1 732863898 DQIOWBFBABZFFI-UHFFFAOYSA-N 419.441 2.033 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCCO)[C@@H]3CCc4ccccc43)nc12 733895123 QXDPXJZQLRLQHZ-LJQANCHMSA-N 410.474 2.484 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)cc1F 737166753 QNZVTEYUDAOPLW-UHFFFAOYSA-N 400.410 2.103 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1NC(C)=O 741096721 DCHGJBPLWANIRU-UHFFFAOYSA-N 408.458 2.285 10 20 HECD CCOc1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(=O)OC)c3)n2)cc1 743046439 HWYJLAZMNDZKLN-UHFFFAOYSA-N 422.488 2.379 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3nn(-c4ccccc4)cc3O)cc2)C1 743316243 PHNZGNCLJZAERL-QGZVFWFLSA-N 419.485 2.210 10 20 HECD O=C(CCNC(=O)OCC(F)(F)F)NCc1ccc(N2CCC(O)CC2)c(F)c1 744325649 SGYZQZSPNQCHCH-UHFFFAOYSA-N 421.391 2.082 10 20 HECD CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NCc2ccccc2O)c1 751151051 PTIBYNQSAPWNEG-UHFFFAOYSA-N 420.306 2.037 10 20 HECD Cc1oc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1S(N)(=O)=O 756031783 ADLOTLSKBGVNCM-QGZVFWFLSA-N 421.519 2.123 10 20 HECD CCCC(=O)N1CCC[C@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759240147 IFPZAPAISWORJN-KRWDZBQOSA-N 419.522 2.152 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)[C@@H]3CCCOC3)CC2)cc(OC)c1OC 759295971 CDAYFBUBCSXJRK-JKSUJKDBSA-N 407.511 2.359 10 20 HECD Cc1noc(C2CN(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)C2)n1 765468763 YCXVRGDJAHKSDH-CHWSQXEVSA-N 403.458 2.440 10 20 HECD COc1ccc(S(=O)(=O)N2CCCN(Cc3c(O)cccc3OC)CC2)cc1 770356418 VUUMUSYINRDIBS-UHFFFAOYSA-N 406.504 2.306 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCc3cnccn3)cc2F)C[C@@H](C)O1 771464774 QBSJUZLPINLVFR-IAGOWNOFSA-N 415.513 2.020 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnn(CC(F)(F)F)c3)CC2)cc1 772452005 OZLYSUJCWVFBGT-UHFFFAOYSA-N 418.441 2.355 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)ccc21 773028198 YPABPFGVJXGEAK-HNNXBMFYSA-N 408.502 2.269 10 20 HECD COc1ccc2nc(NN/C=C3/C(=O)NC(=S)N(CC(C)C)C3=O)c(C)cc2c1 777870018 ASVCJOZUWINKIS-DHDCSXOGSA-N 413.503 2.252 10 20 HECD CC(C)[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 778241335 JTCGEEZJVMUPKA-LZJOCLMNSA-N 407.530 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCCOC(C)C)CC2)cc1 778287380 JPOTWRYSHFUYSG-ZHACJKMWSA-N 403.523 2.174 10 20 HECD CCN1CCN(C(=O)Cc2ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)cc2)CC1 779529354 PAUFAZABESXADS-POHAHGRESA-N 409.486 2.456 10 20 HECD COc1cc(OC)cc(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786442574 OTOHMFOZZJKPNZ-UHFFFAOYSA-N 417.481 2.432 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](c1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803308336 WKBSGPVEFXEHOG-KKSFZXQISA-N 408.502 2.363 10 20 HECD CCc1cc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)on1 803449016 LLJZXZLYCSZCRP-UHFFFAOYSA-N 422.432 2.240 10 20 HECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664318 KLIBWQMVTGOYMJ-KRWDZBQOSA-N 401.438 2.157 10 20 HECD CN(CCNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)CC(F)(F)F 804139140 LORHRECSAQYMMG-UHFFFAOYSA-N 414.472 2.246 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC(C)(C)c3nc(C)no3)CC2)cc1 806332790 BABGRVVVQKHRGP-UHFFFAOYSA-N 416.526 2.133 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1nc(C2CCOCC2)cs1 807023585 AOJFETGZMRKAPS-LLVKDONJSA-N 405.476 2.134 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O 807102000 WVCSCZVWSOFANU-NRFANRHFSA-N 422.529 2.331 10 20 HECD C[C@H](CO[C@@H]1CCOC1)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 808280504 LXMHAWMBDXSERX-VQIMIIECSA-N 404.507 2.364 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3nc(C4CC4)cs3)CC2)cc1 808302523 PHJQLYMNGAMQRO-UHFFFAOYSA-N 414.531 2.384 10 20 HECD CC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 914037664 SADQBUGKBXAXDT-QINSGFPZSA-N 423.585 2.420 10 20 HECD Cc1cc(C(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c(C)n1-c1ccccn1 914847325 HIANFVJIUVMLAY-UHFFFAOYSA-N 409.490 2.474 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccccc3CN3C(=O)CNC3=O)CC2)cc1 916688306 UJOAMABUGBEOHU-UHFFFAOYSA-N 423.473 2.101 10 20 HECD CCOC(=O)[C@H]1CCCCN1C(=O)CN1CCN(c2ccc(OCC)cc2)CC1 1319846926 HCTLHADSOFTIEX-HXUWFJFHSA-N 403.523 2.152 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccnn1C[C@H]1CCOC1 1320718817 XVWHIXFIMGBFJI-MRXNPFEDSA-N 403.458 2.217 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1c[nH]c2cccc(OC)c12 1338287532 KNIQKLAUGUAPDW-INIZCTEOSA-N 412.442 2.421 10 20 HECD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)ccc1C 1796604421 FAXROWARDIJMPY-BJWYYQGGSA-N 411.458 2.375 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933131 RLGJMJJZSQBKRN-HURGMSJPSA-N 408.502 2.464 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1cc(O)nc(O)c1 1817845002 TUIMADHGNZWBPO-INIZCTEOSA-N 422.445 2.160 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnco2)CC1 1824732651 JVOUSAPOTFLEJL-HNNXBMFYSA-N 400.435 2.028 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)Cn1nc(CCC(N)=O)n(C)c1=S 16878255 RVISORYWZVEXAF-UHFFFAOYSA-N 402.568 2.449 10 20 HECD CC(=O)N(C[C@H]1CCCN1C(=O)C(=O)NCc1c(C)c2ccccc2n1C)C1CC1 563994223 BKBKTHQOCZEKIX-GOSISDBHSA-N 410.518 2.105 10 20 HECD O=C1CC[C@]2(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)SCCN12 726564585 NQVFTGRZURAPTL-LJQANCHMSA-N 411.474 2.439 10 20 HECD C[C@@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 726707626 FCPNQIWTRZVOQB-GOSISDBHSA-N 422.529 2.468 10 20 HECD Cc1ccc(C(=O)OCCOCCOC(=O)c2ccc(C)c(O)c2O)c(O)c1O 727005299 NCXCCINUAPDOEW-UHFFFAOYSA-N 406.387 2.156 10 20 HECD COc1ccc(N2CCCN(C(=O)CCc3nc(-c4ncccn4)no3)CC2)cc1 727707977 IALFVBROGMAVFA-UHFFFAOYSA-N 408.462 2.207 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2F)CC1 730235418 XEPLDELQKFWCPK-UHFFFAOYSA-N 401.442 2.388 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCO)CC(C)(C)C)cc2F)C[C@@H](C)O1 730378674 SYUUZOZIMVIRKK-CALCHBBNSA-N 409.546 2.396 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(CC(=O)NC4CC4)CC3)cc2)CC1 731121086 LMXQVLIQZAEGHE-UHFFFAOYSA-N 413.566 2.029 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4cc[nH]n4)C3)cc2)C1 734272118 DHMWOOPTSJFUNT-QZTJIDSGSA-N 410.522 2.201 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1 740494279 BGPQRUIMMKUBNI-SUMWQHHRSA-N 400.431 2.384 10 20 HECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743955516 KKRWLFWGDWDFNW-UHFFFAOYSA-N 411.502 2.466 10 20 HECD Cn1cc(S(=O)(=O)NCCN2CCCc3cc(OC(F)(F)F)ccc32)cn1 744386942 ILPOYMSSKGBJMP-UHFFFAOYSA-N 404.414 2.050 10 20 HECD Cc1noc(C(F)(F)F)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 746136566 YXDQKTWOBNCDJI-UHFFFAOYSA-N 417.409 2.167 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c(C(F)(F)F)n[nH]c3C)CC2)cc1 746593469 OWCNBOHQRQLDPC-UHFFFAOYSA-N 411.428 2.298 10 20 HECD COC[C@@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1ccco1 746741432 MWBALXNSQNGTRS-HXUWFJFHSA-N 416.522 2.487 10 20 HECD Cn1cc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc1Cl 751359848 KWUNQMCUZLKXLJ-ZDUSSCGKSA-N 419.334 2.375 10 20 HECD CCOC(=O)C1(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 751564643 QXHFRFMUEYFXGB-UHFFFAOYSA-N 403.523 2.057 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3ccc(C(=O)N(C)C)cc3)CC2)cc1F 753856667 DTBMAFCMYPXPJD-UHFFFAOYSA-N 414.481 2.297 10 20 HECD COc1ccc(N2CCN(Cn3cc(C)n(-c4cc(C)on4)c3=O)CC2)cc1F 754013167 MZMCMBHGKMYRDI-UHFFFAOYSA-N 401.442 2.171 10 20 HECD C[C@@H](Sc1ccccn1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 754224212 LAYXNCLMVDZGOQ-OAHLLOKOSA-N 405.545 2.113 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 756415119 KPTPPAWGNXGRJJ-INIZCTEOSA-N 411.502 2.417 10 20 HECD COC(=O)CCSc1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 756780939 IBMXHIXVANBJGV-UHFFFAOYSA-N 418.471 2.311 10 20 HECD Cc1c(Cl)cccc1NC(=O)CNC(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 759591015 YUICQCZUVPNFAL-VURMDHGXSA-N 418.833 2.371 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)CC2)cc1 760910232 UHPRCKYIYURCFB-VSKRKVRLSA-N 416.566 2.464 10 20 HECD C[S@](=O)Cc1ccccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 762665563 OAZYLSFFRUWSRH-NDEPHWFRSA-N 400.500 2.404 10 20 HECD CCN1C[C@H](C)N(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H]1C 766250385 LCMOJYGIYWONEM-ZIFCJYIRSA-N 401.555 2.012 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 769561786 DYFYYXITAJNUSA-UHFFFAOYSA-N 406.442 2.346 10 20 HECD CCSCc1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)no1 770223503 QTQQMHFQBLVAIF-UHFFFAOYSA-N 404.536 2.488 10 20 HECD CCN(CC)c1ccc(CNC(=O)N(CCOC)[C@H]2CCS(=O)(=O)C2)cc1F 774212918 VYUOVLBWMRUHOE-INIZCTEOSA-N 415.531 2.017 10 20 HECD COc1ccc([C@@H](CCO)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 774848969 URARPVXZVQTEDE-JOCHJYFZSA-N 413.518 2.066 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1O 775052117 SOYZZHCSUZXWLF-INIZCTEOSA-N 414.462 2.301 10 20 HECD Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 777975956 MHBCBPNVNLSNQA-UHFFFAOYSA-N 409.439 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3ccccn3)C3CC3)CC2)cc1 778220022 PDBKIZUPCJXJCL-VAWYXSNFSA-N 420.513 2.486 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1OC 779493909 UDCYAJSKMFNFJL-XBXARRHUSA-N 412.442 2.113 10 20 HECD CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc(S(C)(=O)=O)c1 779529377 PHIFDCNIDFYAGF-ALCCZGGFSA-N 405.428 2.330 10 20 HECD C[C@@H]1CCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783917982 BMHSHTYGVUPNNJ-CYBMUJFWSA-N 409.533 2.469 10 20 HECD Cc1cncc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 784766408 IHHXPVYAYITPAR-INIZCTEOSA-N 402.882 2.468 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1 785294427 MONSPQQIBAZGBE-MRXNPFEDSA-N 411.502 2.422 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(-n2cncn2)cc1 785401901 YYEBPZHZVNEGMO-MRXNPFEDSA-N 406.490 2.169 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 787827760 CUXNJSPRIVUTBY-MRXNPFEDSA-N 410.518 2.386 10 20 HECD CC(C)[C@H](NCc1c(O)ccc(Cl)c1F)C(=O)N(C)Cc1nnc2n1CCC2 793247950 WJKKHRLAQBCSEX-SFHVURJKSA-N 409.893 2.495 10 20 HECD C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 793908440 IBRMDEQRGBXYBS-KRWDZBQOSA-N 400.567 2.312 10 20 HECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c(O)c1 794381084 KLIIPVADHWXZIP-UHFFFAOYSA-N 422.478 2.257 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)NC(=O)OC(C)(C)C 804043086 KXEXOJIYCNLTQV-HNNXBMFYSA-N 418.538 2.273 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)[C@@H](C)C1 804852383 ABYJMZYRLXKEND-QFBILLFUSA-N 406.546 2.477 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@@H]3C3OCCO3)cc2)CC1 805024041 FOMJGJKAEVHAFK-HXUWFJFHSA-N 415.534 2.293 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1ccc(N(C)C)cc1 807670952 JWGGTNOSMRCCDH-IAGOWNOFSA-N 416.566 2.331 10 20 HECD CN1CCN(c2ccc(CN3CCCC[C@H]3COC(=O)N[C@H]3CCOC3)cc2)CC1 809710483 XFAMYHYALTXQIB-UNMCSNQZSA-N 416.566 2.308 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)c1 811704174 XCWZVTVGABMZIK-UHFFFAOYSA-N 422.503 2.494 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3COc4ccccc43)CC2)cc1 813891944 POQDLHQRSCUKQC-ZGKFYVQTSA-N 421.497 2.192 10 20 HECD Cc1cc(C(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(C)n1-c1ccc(F)cc1 838933403 VQAPMEHYWWKDHP-UHFFFAOYSA-N 421.432 2.431 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCc1nnnn1C1CC1)c2[N+](=O)[O-] 898095379 RHECAHJDJQLTJF-UHFFFAOYSA-N 419.353 2.049 10 20 HECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 918079954 NMFZUTKCUUXCGA-KRWDZBQOSA-N 403.866 2.251 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)c(OC)c3)CC2)cc1 918460607 FRSQPDHCKIUVSQ-UHFFFAOYSA-N 413.474 2.390 10 20 HECD CN(CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)c1cccs1 919971029 GDTSXAAQPAFIEF-UHFFFAOYSA-N 405.495 2.237 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)cc1 1799700423 LGYLJLOBJZWTIQ-FUEIOIHSSA-N 424.453 2.474 10 20 HECD C[C@H](CN)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817228287 OWMKKDVUFPGSRI-QMTHXVAHSA-N 421.885 2.375 10 20 HECD CC1(C)Cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c2O1 1843300498 BWHOWFDULIGXAW-UHFFFAOYSA-N 423.469 2.337 10 20 HECD CCCS(=O)(=O)NC1CCN(C(=O)NCc2c(C)c3ccccc3n2C)CC1 472225558 QOXFMCZNOZQJIZ-UHFFFAOYSA-N 406.552 2.490 10 20 HECD COc1cccc(CNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1O 729561315 KZBGIEAMRUIJPG-UHFFFAOYSA-N 409.439 2.402 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c[nH]nc3-c3cccnc3)CC2)cc1 730421408 YIPBHXJHEFOFKF-UHFFFAOYSA-N 420.517 2.422 10 20 HECD COc1cccc(CNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c1O 731225615 INBYCQLJEZEZFK-UHFFFAOYSA-N 414.487 2.473 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1 734017449 IRIWYGCWNVVAFI-YEJXKQKISA-N 403.479 2.154 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1Cl 737279062 UBAMPTXAXGRNNK-UHFFFAOYSA-N 408.838 2.334 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NC(C)=O)c2C)cc1 748120457 DPSKXIPMBOEPNG-ZDUSSCGKSA-N 400.431 2.131 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(F)c3cccnc23)SC1=S 759117269 LPOJABLIPZUVNS-LCYFTJDESA-N 411.505 2.124 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@H](Cc4ccncc4)C3=O)cc2F)C[C@@H](C)O1 761097529 JCMMCGFBWPRIJM-ZRGWGRIASA-N 412.465 2.497 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN([C@@H]2CCC[C@H]2O)CC1 765531992 AWAVWKWWYBZTOW-HZPDHXFCSA-N 412.328 2.332 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)cc1 774733089 PQSWYVJQEDRMHO-UHFFFAOYSA-N 416.952 2.429 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(OC)nc3C)CC2)cc1 778326461 PPVRKLJMKCMVJJ-PKNBQFBNSA-N 410.474 2.251 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](OCCO)C3)cc2F)C[C@@H](C)O1 780311114 FCWAWCAHLCAQBX-SOLBZPMBSA-N 409.502 2.122 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2CCN(C)C(=O)C2)cc1 780649006 QKSWESGVGROWMO-UHFFFAOYSA-N 410.518 2.068 10 20 HECD CCOc1ccc(OCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786263253 VKMREVVMGWGODX-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC3CCC4(CC3)OCCO4)cc2)CC1 787411524 IMGFOOVKZBXAGG-UHFFFAOYSA-N 415.534 2.341 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cccc1N1CCNC1=O 787501268 MZOGMAQONIKESZ-UHFFFAOYSA-N 419.485 2.156 10 20 HECD CO[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789816639 DSQRWUBADDQKQU-ZMPRRUGASA-N 421.513 2.083 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)cc1SC 792701926 HXCFAMUPDYYEBS-UHFFFAOYSA-N 402.519 2.213 10 20 HECD CC(C)[C@H](NCc1cc(Cl)cc(F)c1O)C(=O)N(C)Cc1nnc2n1CCC2 793247515 QAUGNPYFRKDVMW-KRWDZBQOSA-N 409.893 2.495 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](CCN(C)C)C(C)(C)C)CC2)cc1 804319613 QARDBYLGDPYBNA-FQEVSTJZSA-N 418.582 2.263 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2CN2CCCC2)cc1F 804853068 SEMPIFLPYKVFGP-SFHVURJKSA-N 404.530 2.375 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NC[C@@H](N1CCOCC1)C(F)(F)F 804967443 SEDCLYWIKKEPMV-QGZVFWFLSA-N 400.445 2.349 10 20 HECD COc1cccc2c(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)n[nH]c12 809793719 LWBLTVMTEXKHNK-UHFFFAOYSA-N 407.474 2.170 10 20 HECD CN1CC[C@]2(CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 817043631 NTDSRYVJLFRXNB-IBGZPJMESA-N 421.544 2.422 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCC3CCOCC3)CC2)cc1 1318604363 LQMYLIJHZZCEJH-UHFFFAOYSA-N 404.555 2.323 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(-c2cccc(C)c2)c1C 1342917246 UUIZZQNYECXFGE-KRWDZBQOSA-N 424.457 2.200 10 20 HECD CC(C)(C)[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712820 VUCLUOZVUHYRKK-IPJQOSJUSA-N 410.898 2.410 10 20 HECD O=C(c1ccccc1O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441268 JTXGOWJVJULJKK-UHFFFAOYSA-N 418.453 2.002 10 20 HECD COC(=O)NCC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845399358 SZEHVNBSTNJIDG-UHFFFAOYSA-N 424.501 2.267 10 20 HECD CCCCC[C@H](C)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1846024406 ZZDAAESTVRQURW-AWEZNQCLSA-N 411.593 2.267 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1c(I)cnn1C 560082711 FRFUQBVRDPASLG-UHFFFAOYSA-N 412.231 2.130 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)n(C)c1 728979417 HMASLMPWLXSAQH-ZDUSSCGKSA-N 409.508 2.261 10 20 HECD CC(C)CN1C(=O)/C(=C/NCc2ccccc2CN2CCCC2)C(=O)NC1=S 730999769 LGEGUJAMZUYATH-LDADJPATSA-N 400.548 2.155 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)c2)CC1 739765967 KVTDHIXUKVGIEW-UHFFFAOYSA-N 401.398 2.270 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1cc2ccccc2[nH]1 742497208 FEGAOMLTUDIPJX-UHFFFAOYSA-N 406.486 2.393 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCCCn3ccnc3C)CC2)cc1 743567144 MPSAFLOXWOWWIB-UHFFFAOYSA-N 414.554 2.102 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)OC(C)(C)C)cc2F)CC1 743633597 PFUIXMMWBVLUFH-UHFFFAOYSA-N 408.518 2.499 10 20 HECD CC[C@@H]1CO[C@H](C)CN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 747297096 GECGTDMUKXQEAT-NVXWUHKLSA-N 419.547 2.424 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3nnc4n3CCCCC4)CC2)cc1F 753832477 BHSMZYOATMMGHA-UHFFFAOYSA-N 402.474 2.184 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(C)o1 754817797 WZUKYENTJXHLPT-UHFFFAOYSA-N 412.439 2.033 10 20 HECD COc1ccc(N2CCN(CCN[C@@H](C)CS(=O)(=O)c3ccccc3)CC2)cc1 756479930 PHGVQJMQENMLPO-IBGZPJMESA-N 417.575 2.269 10 20 HECD COc1cc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)cc(OC)c1OC 758941773 QSQKBOBGJLEAKM-UHFFFAOYSA-N 406.504 2.443 10 20 HECD COCC1(O)CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 759285131 CRCWKLFVKTWDRD-HZPDHXFCSA-N 409.502 2.122 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)CN(CCc4ccccc4)C3=O)cc2)C1 761118630 IEOXWJXMYRCSTF-HXUWFJFHSA-N 420.513 2.395 10 20 HECD Cc1cc(S(=O)(=O)NCCCSc2nccs2)ccc1OCC(=O)O 761298116 XHYRXAGALAFOGH-UHFFFAOYSA-N 402.519 2.376 10 20 HECD C[C@@H](c1ccsc1)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 765830351 SXCZLLRLBNRVGY-ZDUSSCGKSA-N 409.533 2.344 10 20 HECD Cc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1-c1n[nH]c(C(F)(F)F)n1 769562812 PLIHVDQXIVLMKE-UHFFFAOYSA-N 421.383 2.227 10 20 HECD COc1ccc(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 774535957 DLAPBFGGKKBILY-QGZVFWFLSA-N 411.502 2.068 10 20 HECD C[C@H](NC(=O)N1CCC(C(=O)N2CCN(C)CC2)CC1)c1ccc(N(C)C)cc1 776242765 BBXFRJOLDBSIQJ-KRWDZBQOSA-N 401.555 2.009 10 20 HECD COCCOc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccn1 777406781 YPAXAYCERKYIFL-UHFFFAOYSA-N 403.454 2.137 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC(Cn2cncn2)CC1 777458915 KTKMMQVUJQPHIA-UHFFFAOYSA-N 400.552 2.453 10 20 HECD Cc1cnn(-c2c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(C)nn2C)c1 777564331 MPJFPNWCFVDBQY-UHFFFAOYSA-N 412.469 2.128 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1cccc(OC)c1O 781517253 OGPADTZHHVYJFT-UHFFFAOYSA-N 408.357 2.111 10 20 HECD C[C@@H]1CCCCN1C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785423290 VPYWLJXYVIRHRR-UYAOXDASSA-N 400.567 2.482 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785434863 VNCGPSCKNYLMSR-XMSQKQJNSA-N 408.546 2.396 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(C)s3)cc2F)CC1 787017776 SDDPHMJELDQNOV-UHFFFAOYSA-N 418.538 2.270 10 20 HECD CC(=O)CC(C)(C)CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 788149044 MPZLSYRLCZRMJV-UHFFFAOYSA-N 408.470 2.217 10 20 HECD CCS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319575 LXQBGDWEBIIKNL-LJQANCHMSA-N 405.564 2.274 10 20 HECD CNC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(C)c1 797023379 ZMACFQFJLJSQBY-HNNXBMFYSA-N 412.490 2.002 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)cc1 804316661 HLSKBJUUTZYICZ-HXUWFJFHSA-N 409.486 2.290 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1 806282426 KRWGAJNZEMWIDB-UONOGXRCSA-N 409.533 2.449 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(N(C)C)Cc2ccccc2C1 807298067 RWVGINPSYMODCK-UHFFFAOYSA-N 409.530 2.346 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807674748 QDRCTRMOUSRUQR-ZIFCJYIRSA-N 416.566 2.473 10 20 HECD O=C(N[C@H]1CCc2ccccc2OC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807695370 NKGHNAVWWDIXAW-VQTJNVASSA-N 424.497 2.410 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NOC/C=C\Cl 811866147 JWFJIZFXIGZOSN-KTAJNNJTSA-N 420.876 2.426 10 20 HECD NS(=O)(=O)c1ccc2onc(NCc3ccc(N4CCC(CO)CC4)cc3)c2c1 820630127 UAAYNBZTFNLFGP-UHFFFAOYSA-N 416.503 2.296 10 20 HECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 916971009 QIVZNDCAXIOHRX-KDURUIRLSA-N 420.573 2.329 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CO[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 1318924426 UATYXWUEENSCMT-ZWKOTPCHSA-N 407.511 2.240 10 20 HECD CC(=O)N/C(C)=C/C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788429148 VZUSAPGBKKPVDI-JLHYYAGUSA-N 424.457 2.280 10 20 HECD O=C(c1ccc2ncccc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249569 ZMAFAZOSYDNKPV-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(c1ccc(O)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038108 AMXVPDOUKIBFTR-WEVVVXLNSA-N 410.426 2.039 10 20 HECD CN(C1CC1)S(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 521404885 JNBNLBMFJCMIGA-UHFFFAOYSA-N 424.529 2.275 10 20 HECD COc1ccc(CCNC(=O)[C@@H](C)OC(=O)c2ccc(C)c(O)c2O)cc1OC 727005457 PWLLSRDXJNMBOW-CYBMUJFWSA-N 403.431 2.328 10 20 HECD Cc1cc(C(=O)CN(CCO)CC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 731842967 LRIIOZNGWBBUMQ-UHFFFAOYSA-N 421.563 2.265 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 743554094 XMYOSUHMQYRODS-CQSZACIVSA-N 421.473 2.484 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(=O)N1CCOCC1 752968285 PNSCJQPOQGZBDT-HXUWFJFHSA-N 402.539 2.360 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CC(=O)N(CC(F)(F)F)C3)CC2)cc1 753455803 CGHHHIQMPKRCDQ-UHFFFAOYSA-N 400.401 2.038 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)C[C@@H](C)O)CC2)cc1 754043064 NXIXOKKNPZSKSF-NFBKMPQASA-N 413.562 2.061 10 20 HECD O=C1CN(c2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2Cl)CCN1 755013224 OFYACCGTVQJYDE-UHFFFAOYSA-N 404.854 2.052 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3cccc([N+](=O)[O-])c3)nc12 756530660 YZPYXOHGEDVAGP-UHFFFAOYSA-N 414.374 2.196 10 20 HECD O=C(CSc1nnnn1CC(F)(F)F)NCc1c(O)ccc2c1CCCC2 769562649 JZVPLISKVBLPKL-UHFFFAOYSA-N 401.414 2.228 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)c1 770122629 VJQVGXYLTSMERV-OAHLLOKOSA-N 414.487 2.418 10 20 HECD CC(=O)CCCC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 772370128 FAMNSWNFKZPKFF-HZPDHXFCSA-N 408.470 2.358 10 20 HECD CCC[C@]1(COC)CCCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 773956856 BNQUNGHLQHIBJB-FYYLOGMGSA-N 405.583 2.459 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ncc(Cl)s3)CC2)cc1 773986551 CBCPYYXRGRQPRL-SANMLTNESA-N 413.952 2.403 10 20 HECD COCCN(C(=O)NCc1ccc(N2CCC(C)CC2)cc1)[C@H]1CCS(=O)(=O)C1 774207950 CLGCVVVXIOSZCH-FQEVSTJZSA-N 423.579 2.268 10 20 HECD CC(C)OCCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774773216 RGRZIUSOESGFEA-UHFFFAOYSA-N 413.465 2.304 10 20 HECD C[C@H](NC(=O)CCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(N(C)C)cc1 775406307 WSQXPORQHXTBBT-SFHVURJKSA-N 409.534 2.454 10 20 HECD O=S(=O)(C1CCOCC1)N1CCC(NCc2cc(Cl)cc(F)c2O)CC1 776208420 DDOMOIYEMMTTST-UHFFFAOYSA-N 406.907 2.248 10 20 HECD Cc1cc(C(=O)NCC(=O)N2CCOCC2)c(C)n1-c1ccc(Br)cc1 776501206 QVYDLMDWAKHOLA-UHFFFAOYSA-N 420.307 2.445 10 20 HECD C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2)C1 778915729 UVFGXZDEPGHNBM-CQSZACIVSA-N 404.488 2.448 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)cc1 785428657 QPVBXJVORVRMKJ-QFIPXVFZSA-N 418.538 2.132 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCCC[C@@H]12 789836743 VXOINFAJYWBKBM-BPAFIMBUSA-N 417.525 2.440 10 20 HECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 789984461 RGQJHNPPHUHFEE-WSTZPKSXSA-N 414.550 2.090 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 793689937 QLLPNXMSWGVRSU-HNNXBMFYSA-N 400.928 2.094 10 20 HECD Cc1n[nH]cc1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248362 AHKJRORYDHCUDD-MRXNPFEDSA-N 423.539 2.328 10 20 HECD CN(C)S(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3ccoc3)n2)cc1 795555862 XZRBEUSXQWYQSI-UHFFFAOYSA-N 413.502 2.454 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)NC(=O)OC(C)(C)C)cc1 796730501 RRHTUXLWBQBPAR-HNNXBMFYSA-N 418.454 2.380 10 20 HECD COc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)c1 798334108 NHUHXUHREQPLLK-UHFFFAOYSA-N 416.455 2.402 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N[C@H]1CCCOCC1 803448753 WZTAZFVQNFZUTO-AWEZNQCLSA-N 411.449 2.058 10 20 HECD CCS[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 803659047 JHMZIFMRHQJWBU-GFCCVEGCSA-N 423.514 2.364 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCCN4C4CC4)C3)ccc21 803685826 MLYZGLKSYKZURY-UGKGYDQZSA-N 410.562 2.161 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3)ccc21 803688532 SPTXTSKBYOLQDL-JOCHJYFZSA-N 420.557 2.418 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3C[C@H](OC(C)C)C3(C)C)CC2)cc1 804317202 WCZYUWFVXBTQND-UXHICEINSA-N 417.550 2.489 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804854206 ZGGIQPGAMGPPIG-INIZCTEOSA-N 407.486 2.090 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccnn3C)cc2Cl)C1 807955418 WGZHPHQGLDLFIY-OAHLLOKOSA-N 417.941 2.285 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)c3ccc(Cl)cc3)nc12 811281629 ISMDLNUWDRPJNZ-HNNXBMFYSA-N 405.794 2.042 10 20 HECD CN1CCCc2cc(CNC(=O)c3c(I)cnn3C)ccc21 814108004 CKRCYZOSFSFKDL-UHFFFAOYSA-N 410.259 2.337 10 20 HECD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)c1 884665457 URRXHAFQJPANGP-UHFFFAOYSA-N 424.529 2.256 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccnc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917180767 GLQHENXEPVJIKQ-OKILXGFUSA-N 418.425 2.438 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(OC)c(OC)cc1OC 1320149252 IQPNQWJIXJCUFX-AWEZNQCLSA-N 419.430 2.028 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@](C)(CO)C3)cc2F)C[C@@H](C)O1 1322912744 WPJXTXBNQJYCHT-YVHKJVDXSA-N 407.530 2.150 10 20 HECD Cc1nc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)s1 1796599508 SWDULXARWGVNBN-BTTYYORXSA-N 402.476 2.132 10 20 HECD O=C(Cc1cccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602611 RMAIPNLNBRPLHE-QDMKHBRRSA-N 417.412 2.266 10 20 HECD O=C(C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)c1ccccc1 1810543100 VJVHQCYGIYRYJC-UHFFFAOYSA-N 423.469 2.221 10 20 HECD O=C(c1c(F)cccc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250238 AFYVNNDEBQIYGC-UHFFFAOYSA-N 405.813 2.416 10 20 HECD Cc1cc(C)c2c(N)c(C(=O)OCC(=O)NC(=O)NCC(F)(F)F)sc2n1 14152154 ABTGHXVDXCUFPH-UHFFFAOYSA-N 404.370 2.040 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](NC(C)=O)C3CCCC3)cc2F)CC1 303340492 VYKUNPLPSVZUFX-NRFANRHFSA-N 404.530 2.279 10 20 HECD CCN1C(=O)CO[C@H](C(=O)N2CCOc3cc(N(C)C)ccc32)[C@H]1c1ccccc1 463957992 LWEMLOJNMFNNEO-YADHBBJMSA-N 409.486 2.467 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1 727359641 XCBNYGODLGEJBU-UHFFFAOYSA-N 412.471 2.469 10 20 HECD CCCN1CCC(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 732204380 UXVFXZPBMSBQHC-UHFFFAOYSA-N 406.546 2.085 10 20 HECD CC(C)[C@@H]1C(=O)NCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 734276759 RQSKHWAEYCEAMB-QGZVFWFLSA-N 410.465 2.423 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1 734527442 UUKPYNGEZWCSGO-UHFFFAOYSA-N 424.549 2.157 10 20 HECD CCc1nc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2o1 737144258 CJBYWFYMYVHJGE-UHFFFAOYSA-N 408.458 2.482 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)NCC2CC2)cn1 742175056 KBWXBYAENSQDEB-UHFFFAOYSA-N 416.547 2.243 10 20 HECD Cc1c(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 747810580 XYYAEFKQEHIRSW-SFHVURJKSA-N 410.474 2.464 10 20 HECD C[C@H]1CC[C@@H](C)N1CCN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 748988578 CWOVMUIJDBKQCV-OYRHEFFESA-N 415.626 2.201 10 20 HECD COCCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C1CCCC1 749563783 OAFZIJTUKQTJKC-UHFFFAOYSA-N 404.555 2.418 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 753446262 JMFOZAWGFVAUGV-XDBZFTIUSA-N 407.515 2.123 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1 755898048 LJMCYJKNSSINBS-UHFFFAOYSA-N 410.584 2.487 10 20 HECD COC(=O)CS(=O)(=O)Cc1ccc(CN[C@@H](C)c2cc(OC)ccc2O)cc1 756756667 JUNHUHJATVKOQP-AWEZNQCLSA-N 407.488 2.339 10 20 HECD C[C@@H](CCS(C)(=O)=O)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 762106600 RACBIQHKEVQQDQ-ZDUSSCGKSA-N 419.494 2.379 10 20 HECD Cc1cc(O)c(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1C(C)C 765444977 KJJMJZXXENIYOP-UHFFFAOYSA-N 406.552 2.372 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(Cc2cc(Cl)ccc2O)CC1 768156030 IZFGUJDXWFLOJG-UHFFFAOYSA-N 411.867 2.460 10 20 HECD CC(C)N1C(=O)c2ccc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2S1(=O)=O 773739855 FOQKUVZFOLPRKA-LBPRGKRZSA-N 418.471 2.012 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccnc1OCc1ccccc1 774364141 QBYIZOZCBJAMFL-UHFFFAOYSA-N 407.426 2.369 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CC(C)(C)OC)CC2)cc1 778287995 CHTUWYKNQIKDFH-DVQDXYAYSA-N 403.523 2.220 10 20 HECD Cc1ccc(C(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)c(O)c1O 780915964 BUHFLUDSRDNEAF-UHFFFAOYSA-N 409.442 2.472 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2Br)c(O)c1O 781006857 PFVKUTRVBDSJAU-CQSZACIVSA-N 405.248 2.482 10 20 HECD O=C(Nc1c[nH]nc1-c1ccccn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 782780780 IDZZLFVNUJDLFQ-MRXNPFEDSA-N 421.457 2.324 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)CN1C[C@@H](NC(=O)OC(C)(C)C)CC1=O 782926886 PMTLAVSGKMLMGC-SFHVURJKSA-N 418.538 2.038 10 20 HECD NS(=O)(=O)[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 783414416 QEPZNAPKUDLLIK-QGZVFWFLSA-N 415.475 2.320 10 20 HECD CC(=O)[C@@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398487 IMSKGIVUGCSOOW-LLVKDONJSA-N 408.388 2.236 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccccc1Cn1cccn1 785638664 BYHIWSOXKWNGFQ-UHFFFAOYSA-N 405.502 2.272 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccnc(N2CCCCC2)c1 786466828 YWXXSOPHGIWNHU-UHFFFAOYSA-N 419.576 2.443 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(Cc2cccnc2)CC1 788314035 WYBXQOUVQPITON-UHFFFAOYSA-N 422.529 2.016 10 20 HECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC12CCC2 789798937 KGUBRTLEQXUDIT-MRXNPFEDSA-N 403.498 2.317 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(F)(F)CC3)cc2F)C[C@@H](C)O1 789818379 JOQQHEYFSJCDGJ-OKILXGFUSA-N 413.440 2.313 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCSC3)cc2F)C[C@@H](C)O1 789825436 LRYQFNPRZVPXMV-LZWOXQAQSA-N 409.527 2.019 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@]3(C)CCCS3)cc2F)C[C@@H](C)O1 789837362 ZBJODIBESJBFTO-LRAJWGHMSA-N 423.554 2.457 10 20 HECD CN(CC[C@H]1CCCCN1C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859624 BVQTUDNNSIRGNS-LJQANCHMSA-N 418.607 2.189 10 20 HECD CC(C)[C@@H](NCc1ccc(N(C)C)c(F)c1)C(=O)N(C)Cc1nnc2n1CCC2 793247749 SJLXBMIXNOVXSI-HXUWFJFHSA-N 402.518 2.202 10 20 HECD C[C@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@@H](C)S1(=O)=O 794159644 FNHRIFONBLNALT-GASCZTMLSA-N 410.561 2.049 10 20 HECD CCCN(CC)C[C@@H](C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 794216984 ALRJUYKQYYHTEO-TZZQJPOUSA-N 416.566 2.137 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)c3ccc4c(c3)OCO4)nc12 795921154 GGXYVZCOMLHDKL-LLVKDONJSA-N 413.386 2.187 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@H](C)CC3(C)OCCO3)cc2)CC1 805025196 KMUGKCOENVDLSB-GOSISDBHSA-N 417.550 2.445 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3sc(C)nc3C)CC2)cc1 805257802 CYUNHIRKFDZMLV-UHFFFAOYSA-N 416.547 2.166 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 806281076 MOGHEONBXCVDFC-ZDUSSCGKSA-N 413.565 2.179 10 20 HECD COc1ccccc1OCCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290076 OVNHNOWDOFWFMQ-UHFFFAOYSA-N 409.486 2.225 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(-c2nnco2)c1 807385634 OJEVZOQCVNCPPL-UHFFFAOYSA-N 417.219 2.460 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NCc2cccc(OC)c2O)s1 807565532 MYZAOUIJMMPZAD-GHMZBOCLSA-N 407.496 2.277 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(-n3cccn3)nc2)C2CC2)cc1 918457431 SLLVTGBXXFCXFP-UHFFFAOYSA-N 404.474 2.463 10 20 HECD O=C(CNC(=O)c1cccc(Cl)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970594 OCSVSWPYUPEBGF-UHFFFAOYSA-N 419.884 2.486 10 20 HECD CCNC(=O)CN1CCCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 920456067 QEENATVGXBKEKO-UHFFFAOYSA-N 412.534 2.387 10 20 HECD Cc1ccn(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)n1 1788424165 BRNMDCZIUKVCFB-UHFFFAOYSA-N 421.457 2.446 10 20 HECD CSc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1O 1843250414 WEXKZKDSMOLIIS-UHFFFAOYSA-N 415.471 2.051 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCOc1ccc(S(C)(=O)=O)cc1 437002946 ATCJHNPMJRETOD-UHFFFAOYSA-N 404.488 2.351 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)c1 729061929 MDAOCWNQYDJDNF-NSHDSACASA-N 404.419 2.243 10 20 HECD CC(=O)N1CCc2cc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)ccc21 743049234 DKHCEVXMIFVDQT-UHFFFAOYSA-N 403.489 2.253 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCN(CCOC)C1 745832284 DDDYHHOYJQVEPG-HNNXBMFYSA-N 400.317 2.407 10 20 HECD COc1ccc(C[C@H](CO)CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1O 745839302 WLRIFBWCPZRGDS-IBGZPJMESA-N 411.502 2.427 10 20 HECD Cc1ccc(S(=O)(=O)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 754943743 HUIKXNXIMBVKDE-UHFFFAOYSA-N 420.506 2.369 10 20 HECD O=C(C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O)OCc1ccccc1 756338450 KYKGSUWAJMBZKT-IBGZPJMESA-N 416.449 2.339 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@]4(CCOC4)C3)CC2)cc1 757109575 DRKNZHKOHQBKJF-JOCHJYFZSA-N 402.539 2.029 10 20 HECD CCN1CCN(CCCCNC(=O)NCc2cccc(Br)c2O)CC1 764763455 LXARDPAWARJDEU-UHFFFAOYSA-N 413.360 2.372 10 20 HECD CCS(=O)(=O)N(C)CCCN[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 764944406 KFPMCELDAMDCIG-HNNXBMFYSA-N 403.976 2.499 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440718 CILYZXXWTLCBEX-NRFANRHFSA-N 411.502 2.137 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnnc3C(C)(C)C)cc2F)C[C@H](C)O1 768523214 YQCQUWGMFWNHKN-KBPBESRZSA-N 404.490 2.040 10 20 HECD CCOCCN(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 772449689 UQPNGZMBDCIPRR-UHFFFAOYSA-N 416.501 2.120 10 20 HECD COc1cc(O)c(CNCc2ccc(OCC(=O)N(C)C)c(OC)c2)cc1OC 775997224 AAWXSNKNWWITDT-UHFFFAOYSA-N 404.463 2.175 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 784028546 SVYVQLJFLJRBBP-UHFFFAOYSA-N 423.469 2.419 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](c3ccccc3)n3cccn3)cc2)CC1 786659467 KXOYUAIMJBPYMB-QHCPKHFHSA-N 417.513 2.457 10 20 HECD CCN(CC)c1ccc(CNc2ccc(C(=O)N3CCS(=O)(=O)CC3)cn2)cc1 786776487 NKEQYESDXNCZGO-UHFFFAOYSA-N 416.547 2.411 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(Cl)n1 788599837 NRNCBCJLYVFXCP-HNNXBMFYSA-N 422.938 2.224 10 20 HECD CCS[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789812203 KJRHYSWUIXPKFH-IRXDYDNUSA-N 423.554 2.459 10 20 HECD O=S(=O)(C[C@H]1CCCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792747364 JRXVTRZLCGJDNS-AWEZNQCLSA-N 422.469 2.388 10 20 HECD CC1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793733312 MDHCYANMBSEVEW-SFHVURJKSA-N 414.550 2.043 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(Cn4cccn4)on3)cc2F)CC1 794296188 LMAJVPNRNIJBMF-UHFFFAOYSA-N 412.469 2.130 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C4CC4)c3)cc2)C1 795397520 QVEAHURHRNFFSF-GOSISDBHSA-N 421.501 2.062 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)ccc3cccnc23)cc1 797430864 BMZLFUFFVKCXFS-UHFFFAOYSA-N 406.489 2.220 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCC3(C)C)CC2)cc(OC)c1OC 806897348 SEHMZGMQMKRNQG-SFHVURJKSA-N 419.522 2.056 10 20 HECD CS[C@H]1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 807204866 JCXGIKHEXLNDLR-HKUYNNGSSA-N 405.564 2.272 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 807287033 GPBDXPCENYWXIL-GOSISDBHSA-N 420.517 2.081 10 20 HECD Cc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)c1 807289722 GDEVSCUXVRXWFW-UHFFFAOYSA-N 404.514 2.336 10 20 HECD COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807513046 QUJQGPGLQDAGAR-UHFFFAOYSA-N 400.218 2.377 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1 917997846 URNMWQJUSNTQSO-UHFFFAOYSA-N 406.533 2.209 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](CNC(N)=O)C3)cc2F)C[C@@H](C)O1 918219307 IKCOFOVKGFZLRB-BFYDXBDKSA-N 421.517 2.029 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2OCCC(N)=O)C2CC2)cc1 918455865 GEKJPJJRVTVJBY-UHFFFAOYSA-N 424.501 2.137 10 20 HECD CNC(=O)[C@@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccccc1 919077060 RKODAAOQPRVAKB-NRFANRHFSA-N 420.469 2.249 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCCC[C@H]3N(C)C)CC2)cc1 1318438362 AURWWOFIVJPSKV-FCHUYYIVSA-N 417.598 2.379 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)SCC(=O)N2 1327669808 UQANXKCXEBYMMP-AWEZNQCLSA-N 416.455 2.046 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccn1 1796322179 AJHQHIZVVYQEAT-VYMNDLDVSA-N 423.469 2.093 10 20 HECD CN(C)c1ccc(CNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 32413396 QMBAVEFHVSAUKH-UHFFFAOYSA-N 401.532 2.442 10 20 HECD CNS(=O)(=O)[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 733279482 XETLXMKMMJUHQU-SFHVURJKSA-N 405.520 2.257 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](c4nnc5ccccn45)C3)nc12 738317781 NSNNIAFRZJYJJN-AWEZNQCLSA-N 421.461 2.034 10 20 HECD COC(=O)Cn1ccc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 743165609 JRCDWXNFORVVNR-UHFFFAOYSA-N 423.420 2.448 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(C)CCCC[C@@H]3O)CC2)cc1 748625829 VPEWPUSCTUCHMV-RBBKRZOGSA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(C)CCCC[C@@H]3O)CC2)cc1 748625830 VPEWPUSCTUCHMV-UNMCSNQZSA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H](C)C(=O)N3CCCC[C@@H]3C)CC2)cc1F 753894015 QXQTXUPPLABZHK-JKSUJKDBSA-N 406.502 2.455 10 20 HECD COC(=O)[C@H]1CCC[C@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759225625 RRCRYOHZSDYBDT-HOTGVXAUSA-N 420.506 2.340 10 20 HECD C[C@@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)c1ccc(N2CCOCC2)cc1 765136305 LGANQWTVZIXXSU-VQIMIIECSA-N 419.522 2.336 10 20 HECD C[C@H](NCCCN1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765798532 UZLOWROBIASUFE-DLBZAZTESA-N 408.974 2.415 10 20 HECD Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 766250759 WFEDWDKGSDVFEE-UHFFFAOYSA-N 412.446 2.303 10 20 HECD COC(=O)C1(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 766835099 SZKFTERWJOAMPO-LBPRGKRZSA-N 421.405 2.285 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(C)c3-c3ccccc3)nc12 775123307 ZOFBPPAGGWWOBK-UHFFFAOYSA-N 421.413 2.369 10 20 HECD C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1 775456187 YNAHYSPEEYRHJY-ZACQAIPSSA-N 407.530 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CO)c3ccccc3)cc2F)C[C@H](C)O1 782058376 TZHQNEWOOKRSPA-XGHQBKJUSA-N 415.509 2.379 10 20 HECD Cc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 783186348 TYGRRFRRKNQEBA-NRFANRHFSA-N 424.545 2.401 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(N2CCOCC2)ccn1 784413528 MRPKYDUXMCKDPH-UHFFFAOYSA-N 410.518 2.057 10 20 HECD C[C@H](OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)NC1CC1 785413966 RPXCTTWGPHNJKM-JTQLQIEISA-N 410.473 2.078 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)nc3C(F)(F)F)cc2)CC1 786656129 KSTPPWHKCVRDFL-UHFFFAOYSA-N 409.412 2.037 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCc3nc(C)ncc3C2)cc1 786669498 AXOWHYYPZGNLOJ-LJQANCHMSA-N 409.534 2.263 10 20 HECD COc1ccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 786756826 BJVJGOLWJOYNJK-OAHLLOKOSA-N 415.465 2.165 10 20 HECD CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788910501 LPDLTZQHWHESLB-WCZIJOHHSA-N 405.564 2.099 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 788951272 OSXXATPWZQFLKA-NRFANRHFSA-N 422.529 2.066 10 20 HECD CO[C@@]1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1(C)C 789847797 VHUGIKKIDWTXHL-UWJYYQICSA-N 405.564 2.176 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1 792238269 NJAJHBSEYUKKDI-BBATYDOGSA-N 414.380 2.210 10 20 HECD CC(=O)N1CCC[C@H](CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 792836194 UIAQOLGDIGYVPX-JTDSTZFVSA-N 420.529 2.497 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(OC)ccc2Cl)cc1 797431297 LGIJQQNNOUPDOA-UHFFFAOYSA-N 405.885 2.026 10 20 HECD COc1ccc(CNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c(O)c1 797611606 WGMPRXAOBOEFDH-UHFFFAOYSA-N 422.507 2.039 10 20 HECD C[C@H](NC(=O)C(=O)N1CCc2ccccc2CC1)c1ccc(N2CCOCC2)cc1 803310972 KTGXKZMHFOTPGN-SFHVURJKSA-N 407.514 2.328 10 20 HECD C[C@H]1CO[C@H](C)CN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450997 BEVRCPUCFSJLFZ-UONOGXRCSA-N 411.449 2.009 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H](OC(F)F)C3)CC2)cc1 804316811 KGQSFNUBFWVLRD-KRWDZBQOSA-N 411.449 2.010 10 20 HECD CN(C[C@@H]1COc2ccccc2O1)C(=O)C(=O)NCCCSc1nccs1 806276120 IDYLDWBULCHBNE-CYBMUJFWSA-N 407.517 2.040 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC(C)(C)c3nc(C)no3)cc2F)CC1 806750478 SQHQQGOVUITIAD-UHFFFAOYSA-N 404.490 2.394 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1nc(O)c2sccc2n1)c1ccc(N(C)C)cc1 807671868 UGGJFDGTZGQTFR-GFCCVEGCSA-N 413.503 2.299 10 20 HECD CN(CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1ccc(F)cc1 807809474 LKJNGHBUUHJBNK-UHFFFAOYSA-N 400.498 2.098 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc1 906481149 UBEWVYNNAKNGCE-RTBURBONSA-N 424.611 2.020 10 20 HECD Cc1ccc(NCCCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1 918118294 YARSFEFWYBAQIZ-LJQANCHMSA-N 424.549 2.393 10 20 HECD CC(C)n1cnnc1SCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969327 VCXRGBFNURPGOG-UHFFFAOYSA-N 403.552 2.476 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cc2ccccc2nc1O 1320141834 BISSRBLLDBTJFG-KRWDZBQOSA-N 410.426 2.185 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(COC(C)(C)C)on1 1324136152 KCRIQVWBPTZUNS-HNNXBMFYSA-N 406.435 2.305 10 20 HECD CN(C)c1ccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1325453550 QTXCZCOOKSXRJP-FQEVSTJZSA-N 423.561 2.496 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993076 SGOSUFWQDPGKFK-NWUWZPLHSA-N 422.485 2.254 10 20 HECD CCN(C)[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831073712 STIWIIJQNDTAOK-QAPCUYQASA-N 418.538 2.066 10 20 HECD CCO[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 149020344 YCIGUQJUEVYVKC-OAQYLSRUSA-N 404.555 2.418 10 20 HECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 580114437 WEDNIYJVLIYAQQ-UHFFFAOYSA-N 412.534 2.210 10 20 HECD COC(=O)c1ccc(-c2ccc(/C=C3/SC(=S)N(CC(N)=O)C3=O)o2)cc1 727175946 JGCTVNVHLWMCHK-RIYZIHGNSA-N 402.453 2.420 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)cc2F)C[C@@H](C)O1 729497576 VERGULQEHGXEEW-PSBWJHGTSA-N 420.529 2.102 10 20 HECD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N(CC)CC)cc1 729523581 QQSHCMIGXSLFKF-HXUWFJFHSA-N 407.522 2.437 10 20 HECD CCC[C@@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 732204826 DXHFQGXETUSNQE-ZMPRRUGASA-N 423.529 2.377 10 20 HECD Cc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1S(C)(=O)=O 739766085 NBMDGTZHAAQIJU-UHFFFAOYSA-N 415.515 2.353 10 20 HECD CCOc1ccc(N(C)CC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 739922421 KLOFCCOHBXSUPE-UHFFFAOYSA-N 417.531 2.055 10 20 HECD COc1ccc(N2CCCN(c3ccc(S(=O)(=O)NCC4CC4)cn3)CC2)cc1 742395290 NYYCATUXULIIDO-UHFFFAOYSA-N 416.547 2.495 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 745778543 DIMPXHXVASKAHW-VQTJNVASSA-N 417.598 2.157 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(CN4CCCC4=O)cc3)ccc21 747018258 YHWCQONLGWLBSN-UHFFFAOYSA-N 420.513 2.446 10 20 HECD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NCc1ccccc1O 751150999 MIODOYUFRCEDEN-UHFFFAOYSA-N 424.544 2.354 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(OCC(F)F)n3)nc12 760603489 UXLZHGPEKIUNQX-UHFFFAOYSA-N 422.344 2.008 10 20 HECD CN(C)CCCC1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 767006309 ZCTBXIHIRCETNB-UHFFFAOYSA-N 420.573 2.332 10 20 HECD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc2c(c1)CCCN2C 771628686 JMDPGSGWSNSOLW-QGZVFWFLSA-N 405.495 2.142 10 20 HECD CC(C)N(CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)C 774792086 ZCOBUCHPGGHMMH-UHFFFAOYSA-N 406.596 2.091 10 20 HECD CCOc1ccc2c(c1)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)CCO2 775346517 CCDGTCHABXGRQQ-MRXNPFEDSA-N 406.460 2.416 10 20 HECD COC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc(O)c2O)CC1 776331512 XUDRPZCZIHWBDX-KRWDZBQOSA-N 404.850 2.423 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3cnccc3C)CC2)cc1 778420264 UDIDEHSIXQOBKP-GIFJBRJJSA-N 408.502 2.481 10 20 HECD C[C@H](C[S@](C)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 784212587 HPWQKRWFUXHCAX-MUDIAHQHSA-N 407.458 2.108 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)N3CCc4ccccc43)cc2)CC1 786686595 XLEBYELLTUIYNR-GOSISDBHSA-N 406.530 2.423 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)Cc3ccco3)cc2F)C[C@H](C)O1 787953009 LYQGLQWCIZVCFF-PMPSAXMXSA-N 417.481 2.396 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCc2ccccc21 789799614 KUHXUNUSFFHBPT-FQEVSTJZSA-N 411.477 2.424 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nccs1 789843398 KONPFYZEHKZTPP-INIZCTEOSA-N 420.510 2.127 10 20 HECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(C)c1 789856964 ZLLSTKQOZRIGHU-UHFFFAOYSA-N 413.543 2.489 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(O)c1 792893739 YUKBUERIMZQLGZ-QGZVFWFLSA-N 412.490 2.102 10 20 HECD C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793916090 WQOGEVXNDMOREI-IYBDPMFKSA-N 406.546 2.381 10 20 HECD COc1ccc(CN=c2cc(NCc3ccc(OC)cc3O)n3[nH]cnc3n2)c(O)c1 795285568 RXQIGXWJCYOBMM-UHFFFAOYSA-N 422.445 2.199 10 20 HECD COCCN(C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@@H]1CCOC1 803677347 NAULAHZUOUEMHP-OAQYLSRUSA-N 417.550 2.336 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCc2ccccc2C1)c1ccc(N(C)C)cc1 803885336 LNRYIZXCNFITGU-ROUUACIJSA-N 408.546 2.493 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C3CC3)[C@H](C)C3CC3)cc2F)CC1 805009549 LSMVJWMFVBIBOW-MRXNPFEDSA-N 416.541 2.373 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292057 UFXOPEDCSPOLQN-GOSISDBHSA-N 413.518 2.117 10 20 HECD Cc1cnc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 808483115 LIOFRNOBXQDREO-HNNXBMFYSA-N 402.520 2.124 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 809139541 YNRWQIONDPRZSV-FQEVSTJZSA-N 405.539 2.049 10 20 HECD CN1CCN(c2ccc(CNc3cccc(S(=O)(=O)N(C)C)c3)cc2F)CC1 1320918000 UEOALBHNAQVNTI-UHFFFAOYSA-N 406.527 2.440 10 20 HECD Cn1cncc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788426864 YIWXHEBQZYIYRF-UHFFFAOYSA-N 407.430 2.288 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cc(=O)cco1 1800715476 ONUCITMZYXOBFN-CLLJXQQHSA-N 418.833 2.270 10 20 HECD Cc1nocc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826044631 MYUYBMFUSLHIIZ-QGZVFWFLSA-N 414.462 2.336 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1 1828892144 GHKDYDZGDXJTSW-QZTJIDSGSA-N 415.490 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C)C[C@H]3c3ccccc3)CC2)cc1 255954604 UQUUQMHICYEXBM-QHCPKHFHSA-N 408.546 2.333 10 20 HECD COC(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1C(=O)OC 610336139 DPDSWCMCPPDSAO-UHFFFAOYSA-N 407.429 2.065 10 20 HECD CCOC(=O)c1nnc(NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)s1 610724866 XWFMWTZYMVYKCL-UHFFFAOYSA-N 402.457 2.183 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1 729064972 XFMGWJGDWRMSTG-LLVKDONJSA-N 415.837 2.451 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(-c4ccccc4C)c3)nc12 732682722 NWHIGTUGEXYABU-UHFFFAOYSA-N 421.413 2.463 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC(C(=O)Nc2nncs2)CC1 734689282 XLEDOVJNCJVLAW-UHFFFAOYSA-N 402.524 2.473 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3ccc(F)cc3)cc2)C1 734942761 QYDHESTWAGOIDO-FXAWDEMLSA-N 414.481 2.060 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 746288281 VYSHXLAZMDLJRN-QGZVFWFLSA-N 418.515 2.167 10 20 HECD CN1CCCc2cc(CNC(=O)c3cc4c(=O)n5ccccc5nc4n3C)ccc21 746813499 UZLMNKKSBPQRSZ-UHFFFAOYSA-N 401.470 2.499 10 20 HECD CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCc1ccccc1O 748349622 INCLJZNEMBLYQB-KRWDZBQOSA-N 408.545 2.417 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cccc([N+](=O)[O-])c3C)nc12 748472244 QNFIJUQMFHRYSG-UHFFFAOYSA-N 414.374 2.114 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CC[C@H](S(=O)(=O)NC)C3)c2C)cc1 750213805 CQWPOWDOPRTQGJ-IBGZPJMESA-N 419.547 2.299 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3COc4ccccc4C3)CC2)cc1 758196708 DPRHJECGXVEKHI-SIKLNZKXSA-N 411.546 2.019 10 20 HECD COc1cc(N2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)cc(OC)c1OC 758935939 NDAPMPUVOVAOHC-UHFFFAOYSA-N 416.434 2.046 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1 758954289 OSIHDMBOGSRQMD-UHFFFAOYSA-N 415.457 2.136 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@](C)(C(=O)OC)C3)cc2F)CC1 760168166 MRNHJHYKCNSPSW-OAQYLSRUSA-N 406.502 2.062 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cccc4nonc34)cc2F)C[C@@H](C)O1 765166689 KMEPYLJBQBPKQI-CHWSQXEVSA-N 420.466 2.454 10 20 HECD CC(=O)Nc1ccccc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 766431205 DZYOCVNKOZMIOS-LJQANCHMSA-N 408.502 2.206 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO[C@H]1C1CC1 767955929 QKNJWCACJBQLGP-GREBRCKQSA-N 414.550 2.393 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCc4cc(O)ccc4C3)cc2)C1 770302483 WSABABMMIBKWCX-UXHICEINSA-N 422.529 2.451 10 20 HECD CNC(=O)COc1cccc(CC(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 772072743 YBCOWDWUQOLCAZ-UHFFFAOYSA-N 411.502 2.148 10 20 HECD Cc1nn(C)c(-n2cccn2)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 778872548 WBMFTEMJBNTSMH-UHFFFAOYSA-N 408.506 2.053 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](CC(F)F)C(=O)O)cc2F)C[C@@H](C)O1 780445842 TZGLXBAYNHKGJL-WDMOLILDSA-N 403.401 2.347 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](C)O[C@H](C4CC4)C3)CC2)cc1 792056911 ITXNUYKHARCHQL-UTKZUKDTSA-N 402.539 2.026 10 20 HECD COCc1ncc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)s1 794821744 GPQZOUOMZGYZRB-UHFFFAOYSA-N 404.536 2.240 10 20 HECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 798927049 OKMYQLAMFZCTLQ-JOCHJYFZSA-N 423.513 2.453 10 20 HECD CCCCN(CC(=O)Nc1cc(S(N)(=O)=O)ccc1OC)Cc1ccccc1O 801595648 HFMGQFRXXZPQCE-UHFFFAOYSA-N 421.519 2.289 10 20 HECD CS[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803306587 WJCGBEBOWNZKLS-KVSKMBFKSA-N 405.564 2.491 10 20 HECD CC(C)n1cc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 803310349 JCDVOKMCDBACAJ-IRXDYDNUSA-N 413.522 2.355 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512077 KCPIGCADKPMQGE-UHFFFAOYSA-N 417.270 2.357 10 20 HECD CCO[C@H]1C[C@@H](NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)C12CCC2 807607851 KVCUVPXVAREOGR-UXHICEINSA-N 415.534 2.198 10 20 HECD CC(=O)C(=O)COC(=O)CCc1nc2ccccc2n(CCc2ccccc2)c1=O 808484537 QDUGVQGSCHLHLF-UHFFFAOYSA-N 406.438 2.273 10 20 HECD CC(C)(C)c1ccn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(=O)c1 810018102 QOUGQKXZFYXWDJ-UHFFFAOYSA-N 401.482 2.438 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 811186521 QBIDHWDGCKLKKL-AWEZNQCLSA-N 403.504 2.111 10 20 HECD CN(C)S(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 917361361 FALFGAZQBVXLDX-SFHVURJKSA-N 418.515 2.464 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ncc4ccccc4c3=O)cc2F)C[C@H](C)O1 917711303 FVHGEOGAIYWMLE-HOTGVXAUSA-N 424.476 2.466 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918285117 ZJCXGWNLBVYMNR-UHFFFAOYSA-N 401.438 2.316 10 20 HECD O=C(CN1Cc2ccc([N+](=O)[O-])cc2C1)NCc1ccc(N2CCOCC2)c(F)c1 1318854066 TTWZFOBBQPYKIJ-UHFFFAOYSA-N 414.437 2.203 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@](CO)(C(C)C)C3)CC2)cc1 1327599066 KBXSBUCWEXFLCD-HSZRJFAPSA-N 418.582 2.257 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1nccc2occc12 1796600569 OOWIYEZSLMURHM-BTTYYORXSA-N 408.414 2.200 10 20 HECD COCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1813754652 PVMRJHXKUHTILQ-VIFPVBQESA-N 411.867 2.080 10 20 HECD O=C(CCCc1ccccc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248793 OEKPAOZZJWCNQS-UHFFFAOYSA-N 413.449 2.472 10 20 HECD CCc1oncc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501050 SVAWPDDGMINDIR-UHFFFAOYSA-N 405.838 2.432 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 23748176 VODXYJAYOLSVIT-JOCHJYFZSA-N 412.465 2.317 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2c(O)ccc3ccncc23)CC1 27531430 CRZVNJICNBQUMD-UHFFFAOYSA-N 402.476 2.052 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCC[C@@]34NC(=O)NC4=O)ccc21 465374236 MTJSYCDMYPEGHI-KSFYIVLOSA-N 412.490 2.013 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CCC[C@]34NC(=O)NC4=O)ccc21 465374238 MTJSYCDMYPEGHI-ZHRRBRCNSA-N 412.490 2.013 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCO[C@@H](COc3ccccc3)C2)n(C)c2ccccc12 579998675 KBQNXNFBLRTCBP-LJQANCHMSA-N 421.497 2.409 10 20 HECD Cc1ccc(C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCCCO3)c(O)c1O 727005980 YJIDJPKRRBPQIR-UHFFFAOYSA-N 416.386 2.073 10 20 HECD CN(Cc1ccccc1O)C(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21 743312365 PFKZWBSKIITFJQ-UHFFFAOYSA-N 401.488 2.212 10 20 HECD CC(C)[C@H]1C(=O)NCCN1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905342 NKWABUDMIVMCHE-PBHICJAKSA-N 410.465 2.423 10 20 HECD COc1ccc(N2CCN([C@H]3CC(=O)N(c4ccccc4F)C3=O)CC2)cc1F 753977584 FWHGVLBUJGXQAF-SFHVURJKSA-N 401.413 2.428 10 20 HECD COC(=O)c1sccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754040280 MGFMHBNEWJSVGR-UHFFFAOYSA-N 414.480 2.193 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](N4CCCC4)CC3)CC2)cc1 754043669 UGWQSWUPCYQCJU-JTHBVZDNSA-N 416.610 2.128 10 20 HECD CC(=O)N1CC[C@@H](CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 754843630 ZZPLEYMROOMFBF-FCEWJHQRSA-N 420.529 2.449 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1 755300838 FLCKOEPKYYMPHW-UHFFFAOYSA-N 422.473 2.174 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] 760855612 JNWMJHLXUMLDGF-UHFFFAOYSA-N 405.476 2.393 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(OCC(F)F)nc3)cc2)C1 761386668 WQAMZYGJEFBCJO-INIZCTEOSA-N 418.444 2.357 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(-c4ccccn4)noc3C)nc12 767560246 KXFZDNNQRBLYBQ-UHFFFAOYSA-N 423.385 2.327 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCCC4(C3)OCCO4)cc2F)C[C@@H](C)O1 768042144 ZIINQPXIQHDKTB-IYBDPMFKSA-N 407.486 2.488 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@H]4CCCO4)n3)CC2)cc1 771055563 GEUDAZJWTLJKNA-GOSISDBHSA-N 400.479 2.081 10 20 HECD CCc1cc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cc(O)n1 771055651 IGLJCBFVMOGJQI-UHFFFAOYSA-N 423.473 2.300 10 20 HECD C[C@@H](NC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccc(N(C)C)cc1 773275371 DFYLNSUBSWWVKJ-MRXNPFEDSA-N 424.549 2.410 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccc(OCC(=O)N(C)C)cc1 773745587 MIMFUGUGFQYXSG-CYBMUJFWSA-N 422.428 2.404 10 20 HECD COCC1(C)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 774180218 QAOYYMRCXHEVJE-GOSISDBHSA-N 402.539 2.346 10 20 HECD COCc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 774746680 UBYUIYIUKLUQOO-GOSISDBHSA-N 417.531 2.013 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(OC)cc1 775197619 NREZNFZTOFUQPQ-OAQYLSRUSA-N 411.502 2.416 10 20 HECD C[C@@H](CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nccs1 784576957 WQQKIURLLUZIFL-HNNXBMFYSA-N 406.527 2.471 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc([C@H](C)O)cc3)CC2)cc1 793636393 KDWCSOMXQHOHEU-KRWDZBQOSA-N 411.502 2.104 10 20 HECD Cc1nnc(COCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 795361174 VFWSHKBZMNCWIS-BETUJISGSA-N 408.499 2.432 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@H]3C[C@@H](C)O)CC2)cc1 796382874 JIJHIIFBRHRCET-HJNYFJLDSA-N 405.583 2.194 10 20 HECD CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797389177 TWYLORIHQSYUSI-UHFFFAOYSA-N 408.357 2.111 10 20 HECD COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)C1 802451099 CVHJIPREODHEAC-UHFFFAOYSA-N 408.506 2.277 10 20 HECD COCCN(Cc1ccco1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317657 LEJHDTMPIVHXRU-UHFFFAOYSA-N 415.490 2.048 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)[C@H]2C1 808237667 AWZLTDCFURJMRB-BJLQDIEVSA-N 418.513 2.109 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC4(CCC4)[C@H]3[C@@H]3CCCO3)CC2)cc1 810092430 ALBBBCCODIKFKV-ACIOBRDBSA-N 415.578 2.212 10 20 HECD Cn1nnc2c1C[C@@H](C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 810449803 OBOHPLMLKCMYBA-KBPBESRZSA-N 405.449 2.307 10 20 HECD COc1ccc(O)c(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1 813488945 JSCXBMJVRRUJLW-UHFFFAOYSA-N 405.472 2.040 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](C3CC3)C(C)(C)CO)cc2F)C[C@@H](C)O1 815248528 CETSZNFHZPRHHO-MCFFVMPBSA-N 421.557 2.442 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)C3CCCCC3)CC2)cc1 916196483 IMMIZCBIQQAOQW-JOCHJYFZSA-N 418.582 2.448 10 20 HECD Cc1nnc(S[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 917768359 LIKUXHKVSKGONQ-SNVBAGLBSA-N 407.455 2.195 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cnn(C[C@@H]2CCCO2)c1 918220467 JLXAREDFSVQDMW-KRWDZBQOSA-N 403.458 2.360 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1 919654478 LTTZEOBROGGKAV-PKOBYXMFSA-N 401.555 2.062 10 20 HECD O=C(CCn1cnc2ccccc2c1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971167 IQBLNIVDXINUBT-UHFFFAOYSA-N 424.476 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3ccccc3F)CC2)cc1 920254795 QDVYJCVTTLKHGW-ZHACJKMWSA-N 411.477 2.398 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1116419779 RWFXDYCAHYAGBU-FQEVSTJZSA-N 423.579 2.328 10 20 HECD CCS(=O)(=O)Cc1ccc(NC(=O)C2=CC=S=C2NC(=O)c2ccco2)cc1 1630087747 WTXOPBDZBUIBLC-UHFFFAOYSA-N 418.496 2.188 10 20 HECD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)n1ccnn1 1791099726 AXGLQCMEMCZUME-ZDUSSCGKSA-N 422.445 2.093 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccncc1Cl 1796600754 JSZOWLAFPHVBKP-CLLJXQQHSA-N 402.838 2.107 10 20 HECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)on1 1816471105 GNOCPBWOZVFVEC-CYBMUJFWSA-N 412.406 2.132 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)n(C)c2ccccc12 472810410 MMNHJKIGRXYTLN-UHFFFAOYSA-N 408.506 2.205 10 20 HECD COC(=O)c1ccc(O)c([C@@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)c1 726797075 ZTAAXLOKEOZUDK-QGZVFWFLSA-N 409.402 2.187 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1 727752854 DCYWGXICWJRDPX-HXUWFJFHSA-N 414.531 2.365 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1 728760474 HYJCRDGZNYLVCZ-UHFFFAOYSA-N 415.405 2.448 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](N4CCCCC4)C3)cc2)C1 730905406 XJZDQOYZGIAGRI-PZJWPPBQSA-N 413.566 2.158 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1CN1CCOCC1 734701513 BYHNIVKSOXZNQB-UHFFFAOYSA-N 410.518 2.148 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC[S@@](=O)C(C)(C)C)cc2F)CC1 735110868 MKVJLZUOVZIAFY-MUUNZHRXSA-N 412.575 2.314 10 20 HECD Cn1c(=O)nc(O)c2cc(S(=O)(=O)Nc3nc(-c4cccs4)cs3)cnc21 740758368 DYTDHYIWVKFGFH-UHFFFAOYSA-N 421.485 2.020 10 20 HECD CCS(=O)(=O)NCc1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 741660939 RWMMBKPXJVKJIH-UHFFFAOYSA-N 417.531 2.097 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N1CCC[C@@H](C(N)=O)C1 743874195 VXLKBWXZWXGUSS-CHWSQXEVSA-N 412.328 2.089 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1 748850912 ACIMYUBCJDBSGQ-UHFFFAOYSA-N 410.879 2.379 10 20 HECD CN(C)c1ccc(CNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1 751072509 FBKCLJUVNRSSAX-UHFFFAOYSA-N 403.571 2.179 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1 752005164 NXEHCLLIZSOAKV-IERDGZPVSA-N 401.511 2.053 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)o1 754792191 ICBSKCFEJHHYCO-CYBMUJFWSA-N 408.476 2.251 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@]3(C)CCOC3)cc2F)C[C@@H](C)O1 755122714 ZZUBUICFLIDAQT-PZPWOCDFSA-N 408.470 2.025 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccn(-c4ccccc4)n3)nc12 757168822 MSMPLFSDSBLHDV-UHFFFAOYSA-N 421.413 2.083 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(C(N)=S)cc3)CC2)cc(OC)c1OC 759406031 PZJPZMXJVIFYSP-UHFFFAOYSA-N 415.515 2.309 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](N(C)C)CC3)cc2F)C[C@@H](C)O1 759978425 VKKKKQDXTBKLGK-NSHGMRRFSA-N 420.573 2.472 10 20 HECD CCCN(CC(C)(C)O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 762266734 SKEGYXKBTWVTOA-UHFFFAOYSA-N 406.571 2.400 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCC[C@@H]1N1CCOCC1 763586077 FXCUYPJXLVNOEJ-FPOVZHCZSA-N 420.529 2.105 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(C4OCCO4)c3)CC2)cc1 764238784 ZUPZBJFJWWWGPK-UHFFFAOYSA-N 411.502 2.293 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)CC2)cc1 768970227 OYKCWEXHERLAQO-HSZRJFAPSA-N 422.485 2.102 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3=CCCCC3)cc2)C1 774685506 IAJAXQQQOGTXHZ-LJQANCHMSA-N 412.534 2.011 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@](C)(O)C(F)(F)F)cc2F)CC1 776134898 KHEYJGQYVGMIOH-KRWDZBQOSA-N 406.424 2.080 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(OC(C)C)CC3)CC2)cc1 778259788 CAQJBACRKYLEAB-CMDGGOBGSA-N 415.534 2.316 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccnn1-c1ccncc1 780047176 JSUTVRSGXSEMAR-UHFFFAOYSA-N 422.514 2.075 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3ccccc3)OC)CC2)cc1 781028679 JRPCAOGAPJFZAN-SEYXRHQNSA-N 409.486 2.490 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1 785424427 PKJSAVJZTMOUPP-NRFANRHFSA-N 408.546 2.397 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccnc(N2CCCC2)c1 786501181 SADAUNKOEJGCCC-UHFFFAOYSA-N 405.549 2.053 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 787738988 SUMTUHROWMXLTR-NRFANRHFSA-N 422.529 2.157 10 20 HECD Cc1nc(Cl)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 789369459 BSBYQSNPKRXUKY-UHFFFAOYSA-N 402.882 2.477 10 20 HECD CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NCc1ccc(N2CCOCC2)cc1 795494827 SMYHIVWSEWVAQK-LJQANCHMSA-N 419.522 2.165 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4ccc(C)cc4C3)CC2)cc1 796429627 JTKRONORLLHTIB-JOCHJYFZSA-N 411.546 2.381 10 20 HECD CN(C)S(=O)(=O)C[C@H](NCc1cccc(Br)c1O)C(F)(F)F 796452988 AGQIGRNTDHALFW-JTQLQIEISA-N 405.236 2.067 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)cc1 797431100 HMHRZUDFSAGZKR-UHFFFAOYSA-N 411.505 2.202 10 20 HECD CS(=O)(=O)[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 800709106 ACAYEPNDKVLJRJ-CZUORRHYSA-N 417.478 2.085 10 20 HECD CCC(CC)N(CCOC)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804318356 IMFHSKPLJTYUFA-UHFFFAOYSA-N 405.539 2.444 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2cn(C)nc2C(F)(F)F)C2CC2)cc1 807573872 AQOWKDPTMRYBAI-UHFFFAOYSA-N 423.439 2.312 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCOc1cccc(C(F)(F)F)n1 807870204 PELHKYBEBZAPME-UHFFFAOYSA-N 424.423 2.320 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](OC)C(C)C 808378396 MWXDHAOOUZKNTN-OAHLLOKOSA-N 401.301 2.290 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c(O)c1 811484775 KDWWSNABUSVEEU-UHFFFAOYSA-N 400.456 2.149 10 20 HECD CN(C)c1ccc(CN(C(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)C2CC2)cc1 914485418 UJMBHGZTYDUMMP-UHFFFAOYSA-N 422.441 2.448 10 20 HECD CC(=O)N1C[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)Oc2ccccc21 917708295 DAKDOYVUSCIKLU-OAQYLSRUSA-N 413.449 2.093 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCCn3ccnc3C)CC2)cc1 918198022 RFMSIWXPLZOLHK-UHFFFAOYSA-N 414.554 2.102 10 20 HECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 918267405 RYSKZRVLYDSBTC-UHFFFAOYSA-N 410.518 2.482 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)on1 919037810 JVUCROOAVWODIJ-ZIAGYGMSSA-N 405.426 2.209 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Cn2cncn2)cc1 919968809 LABKDEJCSYWLBA-UHFFFAOYSA-N 405.502 2.465 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Cn2cncn2)cc1 919970892 IAIZSJUDZIIEEI-UHFFFAOYSA-N 409.465 2.357 10 20 HECD COC(=O)C[C@H]1C(=O)NCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 921208466 CPJUKODWQWUYEN-SFHVURJKSA-N 409.446 2.404 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2ccccc2)CCOCC1 1320275025 WAUPWYHMJZSWBG-SFHVURJKSA-N 413.470 2.437 10 20 HECD CCOC(=O)C1=S=c2nc(NC(=O)c3ccnn3-c3ccccc3)sc2=C1C 1585276176 LVDMGMHOOUKNIY-UHFFFAOYSA-N 412.496 2.485 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1ccncc1)c1cc(O)nc(O)c1 1794408320 UDHSANCJQSLMDY-BCDXTJNWSA-N 410.474 2.163 10 20 HECD CCN(CC)C(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 5452740 MVWCDFVNDCNKBK-UHFFFAOYSA-N 410.382 2.395 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 148449646 WKSFLBOEGUQDDY-MRXNPFEDSA-N 417.531 2.312 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccncc2OCC(F)F)n(C)c2ccccc12 580304223 HYMDMBCIBRENBE-UHFFFAOYSA-N 416.428 2.458 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccnc(N3CCCCCC3)c2)c1 730592327 FOKVXNNAWBUIQO-UHFFFAOYSA-N 418.519 2.469 10 20 HECD CC[C@H](C)CS(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 733314276 NILMRJXIPDZUBU-INIZCTEOSA-N 421.542 2.408 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(CC[S@](C)=O)CC3)c2C)cc1 742182470 KIWSMFKNUJIXOW-NDEPHWFRSA-N 403.548 2.239 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(Cn2cncn2)c1 743957811 BHAHXGLIXPPDTI-UHFFFAOYSA-N 405.458 2.166 10 20 HECD CC(C)(C)OC(=O)CCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745691573 LHUGKLDPQHFGNV-QGZVFWFLSA-N 418.538 2.309 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)CN1CCN(C)CC1 745810179 YMNFTYXHMIFKSY-AWEZNQCLSA-N 413.360 2.322 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(CC(F)F)c3)cc2)C1 746031850 JAEVYBWUPCLRLI-CQSZACIVSA-N 406.437 2.172 10 20 HECD CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCc2ccccc2O)CC1 748487118 YCUVOVJOGRZKFI-UHFFFAOYSA-N 416.909 2.442 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCC4(CC3)NC(=O)N(C)C4=O)c2C)cc1 749241534 VPCUTBIVSGLEPX-UHFFFAOYSA-N 410.474 2.259 10 20 HECD Cc1[nH]nc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1[N+](=O)[O-] 749732083 ATWRROQWKDJXFO-UHFFFAOYSA-N 413.356 2.412 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)o1 751237685 TUOCYKAYOQHYJD-UHFFFAOYSA-N 422.503 2.144 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2C)c1nc(-c2nc[nH]n2)no1 752656966 BGNIEVPVWBONCL-MRXNPFEDSA-N 410.482 2.434 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1F 752727595 YRVZGYVKYZCOFY-UHFFFAOYSA-N 412.465 2.165 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 755249551 SDNRGDJUZIXKFD-UHFFFAOYSA-N 412.490 2.474 10 20 HECD CC(C)Oc1ccc(N(C)Cc2nnnn2-c2ccc(S(C)(=O)=O)cc2)cc1 759913507 DWWSYJFXCSDPJH-UHFFFAOYSA-N 401.492 2.489 10 20 HECD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765783451 OHTBNAWIBURDJG-IRXDYDNUSA-N 410.465 2.471 10 20 HECD O=C(NCc1nnnn1CC1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 770507953 ZCDVEDKFLAMRED-UHFFFAOYSA-N 421.452 2.153 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F)c1ccc(N(C)C)cc1 773090212 WANYEYYKXZZMDL-GFCCVEGCSA-N 415.512 2.303 10 20 HECD O=C(NCc1cccnc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774122665 HPEFFOCKPCMDGA-HNNXBMFYSA-N 404.417 2.084 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(C(=O)N3CCOCC3)c2)c1O 774975074 OBYKCDKMNKOEGX-UHFFFAOYSA-N 401.419 2.071 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 778875823 UXAJOYKKOVNVOX-HUUCEWRRSA-N 408.470 2.025 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 780417971 ZNSHMTKDBNOWEL-FUHWJXTLSA-N 416.522 2.014 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3CCO[C@@H](C(C)C)C3)nc12 781791128 RWEBHGJYCJKSPS-XJKSGUPXSA-N 405.451 2.496 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@H]3CCO[C@@H](C)C3)CC2)cc1 784251590 INAXNWRKKSGEHN-OALUTQOASA-N 404.555 2.322 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCc3nc(C)ncc3C2)cc1F 786676625 XUTQMWGDKGGUEL-KRWDZBQOSA-N 413.497 2.060 10 20 HECD COCCOc1ccc(F)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 786843218 GNMSEUKZKODTEM-UHFFFAOYSA-N 424.494 2.166 10 20 HECD COCc1ccccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 787506437 VAFZUEQRGLVEPC-UHFFFAOYSA-N 411.502 2.243 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(N2CCCC2=O)c1)c1ccc(N(C)C)cc1 788226035 RUQBNARFNLRRQB-INIZCTEOSA-N 408.502 2.373 10 20 HECD C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789844396 HAZXPBXRPKMQAB-BZUAXINKSA-N 405.514 2.296 10 20 HECD COc1cc(O)c(CNCCNS(=O)(=O)c2ccc(Cl)cc2F)cc1OC 799736306 MQCQTJDGTZQFSD-UHFFFAOYSA-N 418.874 2.270 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2C)ccc1O 800842318 WEJGUOMTMPKMEB-UHFFFAOYSA-N 424.422 2.428 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)NCc2ccc(N(CC)CC)cc2)cn1C 804957297 GTIQELCTJMFYOA-UHFFFAOYSA-N 421.519 2.096 10 20 HECD COc1cccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 805475178 LTMCOAPCMYSWCC-LJQANCHMSA-N 424.545 2.471 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCc4ccccc4OC3)CC2)cc1 807695000 KAPWYKVVMTUKOU-LJQANCHMSA-N 423.513 2.244 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ncccc4F)n3)CC2)cc1 809464868 NJASTFCIVCPCQM-UHFFFAOYSA-N 411.437 2.094 10 20 HECD O=C(CCc1nc2ccccc2oc1=O)NCc1ccc(N2CCOCC2)c(F)c1 917707744 ZXENBCBUVMIKBV-UHFFFAOYSA-N 411.433 2.413 10 20 HECD CCOC(=O)C1=S=c2nc(NC(=O)c3ccnn3CC3CCC3)sc2=C1C 1616284454 GVSYRVQBWUVMFA-UHFFFAOYSA-N 404.517 2.296 10 20 HECD Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1795279408 AHQMKABFLHQXLN-CLLJXQQHSA-N 404.854 2.050 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 726631954 KQZWKCQLGXUNJN-UHFFFAOYSA-N 403.504 2.050 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 727170604 USHPCTBWHUNUIU-UHFFFAOYSA-N 401.419 2.478 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1C(=O)O 728015544 SBLOQJAIVNQWMA-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CON(C)S(=O)(=O)c1ccc(C(=O)NCCCSc2nccs2)cc1 733973281 YGMFFSDOHKFGJX-UHFFFAOYSA-N 401.535 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)N3[C@@H](C)CC[C@H]3C)CC2)cc1 741018382 RIXRJUNDYGSFGL-FGTMMUONSA-N 403.523 2.148 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3cc4ccccc4nc3O)CC2)cc1 742920338 OFSFZKKLKGVLPV-UHFFFAOYSA-N 420.513 2.430 10 20 HECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C1 743606048 RKFMTIRMFGLKER-INIZCTEOSA-N 408.502 2.448 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)OCCNS(=O)(=O)c1cnn(C)c1 744832661 HVMUEQXIRRGQDG-UHFFFAOYSA-N 408.505 2.024 10 20 HECD Cn1cc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c(C(F)(F)F)n1 752914576 SCGLKALUXBELQT-UHFFFAOYSA-N 403.342 2.233 10 20 HECD C[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@]1=O 759856424 CQNOYZGDAZYQCV-IZPCHGGPSA-N 410.495 2.243 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)CN(Cc4ccccc4)C3=O)CC2)cc1 761186704 STKVXBHEKYWISY-UHFFFAOYSA-N 408.502 2.282 10 20 HECD CNc1c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cccc1[N+](=O)[O-] 765394850 FRRIEDABVQKPTG-UHFFFAOYSA-N 404.448 2.124 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)c1O 768150423 ALONJTVGXVYHSP-UHFFFAOYSA-N 411.867 2.460 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)[C@H]1CN(C)CCO1 770436483 VWQSOPYBRLIXCY-BLLLJJGKSA-N 400.317 2.405 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CN4CCC(C)CC4)n3)CC2)cc1 771054329 AAXJYCPFZIYREF-UHFFFAOYSA-N 413.522 2.201 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)c1 771593934 BHCVJGNYKMBJDQ-UHFFFAOYSA-N 423.838 2.160 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccn1 774883842 GBXJSECHPJFYMW-OAGGEKHMSA-N 414.481 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(C)nc(C(F)(F)F)n3)CC2)cc1 778611447 JZSMRJDLJJMNPD-UHFFFAOYSA-N 423.439 2.364 10 20 HECD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 779499276 MFIKUSPZBWNFFC-CSKARUKUSA-N 404.488 2.255 10 20 HECD O=C(NCCc1cscn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786623728 HUMHXTWDAKSEEE-CYBMUJFWSA-N 424.473 2.188 10 20 HECD CN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1cnn(C)c1 786699822 QNTSNPDPPHAUPN-QGZVFWFLSA-N 419.434 2.165 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(N(C)C)c1)c1ccc(N2CCOCC2)cc1 786898213 IBZRNLHRNQEKEY-QGZVFWFLSA-N 410.518 2.083 10 20 HECD Cc1nccn1-c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 787477798 MDEBDCGPDWCWFF-UHFFFAOYSA-N 418.501 2.109 10 20 HECD CSCc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788333242 QNSHQAVMXZJYMQ-UHFFFAOYSA-N 413.543 2.319 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)cc1C 788338958 WCDQCBWHMGKUDD-ZDUSSCGKSA-N 400.431 2.187 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccccc1 788931344 DMQBTWSMNVWTLC-VXKWHMMOSA-N 406.530 2.465 10 20 HECD COc1cc(OC)c(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(OC)c1 790101219 JXDKHFMDBYPAIS-CQSZACIVSA-N 415.490 2.272 10 20 HECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1NC(=O)N(C)C 794422243 MEKBUXRSWAYFKO-UHFFFAOYSA-N 406.464 2.418 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1 796679507 GOGXXMBXQGZVHH-UHFFFAOYSA-N 414.437 2.445 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1 797531989 BQOCGWYFOVWPGB-OAHLLOKOSA-N 413.474 2.362 10 20 HECD CCN(CCOCCO)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 800429141 GFYJPEDHSJGGOL-HNNXBMFYSA-N 410.470 2.120 10 20 HECD Cc1ncc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803300046 DZQRDNBAKMCVAP-AWEZNQCLSA-N 402.520 2.124 10 20 HECD CC1CCN([C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 803542304 VLDJVGSUOLGNET-ICSRJNTNSA-N 417.550 2.136 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCCN(c4ccccc4)CC3)ccc21 803685657 HNPDCHJFAKEVFC-UHFFFAOYSA-N 406.530 2.424 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)c1nnc2ccccn12 804101078 KXBZAZFLQPEKPK-HNAYVOBHSA-N 408.506 2.486 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 804736285 PGRXEVQPKIEMCD-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COCc1csc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n1 806853223 JIMNVWLKCWOSKZ-UHFFFAOYSA-N 406.533 2.098 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN([C@H](C)c2nccs2)CC1 807103716 VNACWNKGCFIYQD-MRXNPFEDSA-N 415.563 2.039 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1ccc(N(C)C)cc1 807675664 ZNSIISGAATZEJN-HOTGVXAUSA-N 415.563 2.292 10 20 HECD Cc1nonc1CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807956506 OZFQOMGASYCHNY-GFCCVEGCSA-N 405.886 2.200 10 20 HECD CCNS(=O)(=O)c1ccc(F)c(C(=O)C(=O)CC(C)(C)CC(=O)OCC)c1 808094907 JUAIKDCHSGTOTP-UHFFFAOYSA-N 401.456 2.245 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(C=O)c[nH]3)cc2F)C[C@@H](C)O1 815255794 YWPWMLLLZLBQSJ-OKILXGFUSA-N 417.437 2.053 10 20 HECD O=C(C[C@H]1CCCS(=O)(=O)C1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835077 JQIBCHGDGIJJAM-RHSMWYFYSA-N 414.955 2.341 10 20 HECD CCN(CC)c1ccc(CNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)cc1 916503434 UACSUPASVCBLSN-HXUWFJFHSA-N 411.481 2.408 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OC(F)F)cc1 920195427 RODNQVOZXYGEEN-UHFFFAOYSA-N 405.401 2.380 10 20 HECD Cc1ncccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598936 MWDGWPYYFIMXRQ-BCDXTJNWSA-N 410.474 2.081 10 20 HECD C[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC=CCC1 1803283223 FYTHBQXESDUBIA-YYQBIWNASA-N 421.588 2.231 10 20 HECD CC(C)C1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CCC1 1803412599 ZUNHWXXAJSPONU-QDMKHBRRSA-N 423.604 2.311 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CC1(F)F 1818836432 MRYGXGLVHGRSFM-ZYHUDNBSSA-N 407.377 2.177 10 20 HECD Cc1cc(C2=NN=C(NC3CC3)SC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 8161440 UZZWNFVHHMXWLH-UHFFFAOYSA-N 403.533 2.300 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21 489814297 WZPIIESVSAARIF-NRFANRHFSA-N 413.518 2.368 10 20 HECD COc1cccc(CNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1O 729858800 CGAMZVACFJKIBC-UHFFFAOYSA-N 418.515 2.434 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NCCS(=O)(=O)N2CCSCC2)cc1 730500011 MLEDQYXVAIXVMQ-UHFFFAOYSA-N 407.561 2.203 10 20 HECD CCOc1ccc(N(C)CC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1 739926624 IWGOQVUEOLEJTI-UHFFFAOYSA-N 411.502 2.310 10 20 HECD O=C(CN1CCOC2(CCCCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 743852642 SLESUIPJXNZKPH-UHFFFAOYSA-N 405.514 2.314 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)o1 748055141 YHRAZHQIOOVOJM-UHFFFAOYSA-N 410.517 2.488 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 758226772 ZNWBOIMZNNRHHL-MRXNPFEDSA-N 405.426 2.304 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)cc(OC)c1OC 759101037 HYQNQMSFSXYJKR-UHFFFAOYSA-N 410.467 2.362 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccccc3F)CC2)cc(OC)c1OC 759887131 UGUDGPLWWKGTBL-UHFFFAOYSA-N 417.481 2.290 10 20 HECD COc1ccc(C(=O)N2CCN(Cc3cc(OC)c(OC)cc3O)CC2)cc1OC 768440908 VGXUPSPJUKFWGZ-UHFFFAOYSA-N 416.474 2.385 10 20 HECD OC[C@H](c1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768445025 DZGMCDDPYFWJJB-QUCCMNQESA-N 404.894 2.323 10 20 HECD CN(C)c1ccc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1 769452736 ZUEDHUYLXVURQE-UHFFFAOYSA-N 401.532 2.114 10 20 HECD C[C@H](C(=O)Nc1c(-c2ccccn2)nc2ccccn12)S(=O)(=O)C1CCOCC1 769697249 CQGWAJUGIMTXBG-CQSZACIVSA-N 414.487 2.317 10 20 HECD C[C@@H](OC(=O)C1(CCO)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 770537147 TYVMSGROZQIAAU-CYBMUJFWSA-N 407.422 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4ccncc4)n3)CC2)cc1 771066788 JRFRUCUWDNHRBW-UHFFFAOYSA-N 407.474 2.150 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCN1c1nccn2cnnc12 771206075 XOVNQZXZMQRORA-QGZVFWFLSA-N 420.521 2.145 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cn3)cc2F)CC1 773236049 NOOHZANRFCYTJA-UHFFFAOYSA-N 419.888 2.271 10 20 HECD COC(=O)CCCN1C(=O)/C(=C\c2ccc(OCC(=O)OC)cc2)SC1=S 782192634 AAZKOZTXWFQKGE-GXDHUFHOSA-N 409.485 2.393 10 20 HECD O=C(OCCn1ccccc1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785412671 KSECVVCRTURPIM-UHFFFAOYSA-N 420.468 2.273 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(Cl)nc3)CC2)cc1 786614529 OLXSZWLARMSXRR-UHFFFAOYSA-N 402.882 2.099 10 20 HECD C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 787914951 RCXKAIKFNYBMCJ-CALCHBBNSA-N 406.546 2.382 10 20 HECD Cc1cccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)c1 788324072 RJJFPRPIALGQBB-OAQYLSRUSA-N 407.514 2.464 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN2CCC[C@@H]2C1 788584776 QIBWMOSOYRPODA-JKSUJKDBSA-N 424.339 2.246 10 20 HECD Cn1ncc2c1CCC[C@@H]2NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 789592516 WANYCKLZPZDEOZ-SFHVURJKSA-N 408.458 2.441 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)CCC(F)(F)F)CC2)cc1 790135966 WPLIRIUEYHOOQV-UHFFFAOYSA-N 409.474 2.079 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCN(CC(F)(F)F)C1 792207038 PVTXZVYYIWTSRK-CQSZACIVSA-N 403.420 2.287 10 20 HECD Cc1ccc(N2CCOCC2)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 797782550 DJXNMODNCKCOGU-UHFFFAOYSA-N 405.476 2.161 10 20 HECD CS[C@@H](C)CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449164 QDZHAJVXQKSWSP-LBPRGKRZSA-N 401.479 2.241 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O)CC1(C)OCCO1 807425076 KTGVXHHIJOQEIK-MRXNPFEDSA-N 416.474 2.419 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1 810165208 ZOEHCKPXNQFINA-UHFFFAOYSA-N 417.531 2.330 10 20 HECD CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc(N2CCOCC2)cc1 813331077 GDJHMGPKFFREMB-UHFFFAOYSA-N 418.563 2.452 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c1 813660998 XCCVFGQOKVXAKE-UHFFFAOYSA-N 418.515 2.481 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cccnc1OCC(F)F 820787023 DZBOHSAWBHLZQO-UHFFFAOYSA-N 413.446 2.041 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3c4ccccc4C[C@@H]3O)CC2)cc1 916196824 PVDRVCLHUUFQRK-XZOQPEGZSA-N 424.545 2.165 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)COc1ccccc1 918213191 HZTBXESTXMRJLZ-SFHVURJKSA-N 417.481 2.026 10 20 HECD COCCOC(=O)Nc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 920302706 HIKUUIHMWBRCFE-UHFFFAOYSA-N 423.447 2.211 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CCCC1 1795413906 QOQXMJAIGSQUNG-QDMKHBRRSA-N 409.577 2.065 10 20 HECD CCC(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808468814 YNWOJZPXRQTZQK-JTSKRJEESA-N 419.485 2.290 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](CNS(N)(=O)=O)C3)c2C)cc1 730571863 VMACLRLRMUKQMV-GOSISDBHSA-N 418.563 2.090 10 20 HECD CCC(CC)[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCC1 742051034 PATBROBXLUWQPS-OAQYLSRUSA-N 407.530 2.416 10 20 HECD C[C@@H](NC(=O)[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc(N2CCOCC2)cc1 746168804 QUBXIOGLAODHGQ-DVECYGJZSA-N 409.530 2.337 10 20 HECD O=C1/C(=C\c2ccc([N+](=O)[O-])c(O)c2)SC(=S)N1CCCN1CCOCC1 748357390 BOMFPNDINHUQLW-RVDMUPIBSA-N 409.489 2.224 10 20 HECD O=C(N[C@H]1CCN(C2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751062347 DAWUHJNATZZTMY-ZDUSSCGKSA-N 407.517 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3Cc4ccccc4CN3C(C)=O)CC2)cc1F 753739759 YFQXRWHQMMCRMK-NRFANRHFSA-N 411.477 2.456 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)o1 754806136 RFZJYERCGBYMHT-HNNXBMFYSA-N 409.460 2.450 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(OC(C)C)n3)nc12 755003388 ILJRREUCFPGGAC-UHFFFAOYSA-N 400.391 2.151 10 20 HECD CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 755328119 CVGBPGWECXRSDV-IUODEOHRSA-N 410.517 2.488 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 759381054 YNMCARXMWLEPLF-AWEZNQCLSA-N 415.465 2.498 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3ccc(OC)nc3)ccc21 759824893 RBJVEDUSYNGWIH-UHFFFAOYSA-N 417.487 2.427 10 20 HECD CCN(CC(=O)Nc1cc(-n2cnnn2)ccc1F)c1ccc(OC)c(OC)c1 760828990 MELFQRNXRFRTAQ-UHFFFAOYSA-N 400.414 2.284 10 20 HECD CC(C)c1cc(=O)n(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 762199877 XOHVXLSUFSFVLJ-HZPDHXFCSA-N 416.497 2.436 10 20 HECD Cc1cc(C(=O)CN2CCO[C@H](C)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766967940 BDOKVYCEMNQFNG-GDBMZVCRSA-N 405.520 2.033 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(OC)c3F)CC2)cc1F 770751949 WOLZFMZKUVSTOC-UHFFFAOYSA-N 405.401 2.269 10 20 HECD C[C@@H](NCC(=O)NC[C@H]1COc2ccccc2O1)c1ccc(N2CCOCC2)cc1 775255466 QZTCJJNYFAQKAX-XLIONFOSSA-N 411.502 2.130 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCCC[C@H]3O)CC2)cc1 779330132 IWRGQRGNZJVVLY-SIKLNZKXSA-N 418.582 2.400 10 20 HECD CC[C@](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)(C(N)=O)C(C)C 781931545 XTPVQYSVHOWIQU-JOCHJYFZSA-N 423.425 2.390 10 20 HECD CN(C)C(=O)COc1ccc(C(F)(F)C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 784752921 DPCOLEXLBPSYLR-UHFFFAOYSA-N 423.368 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)c2nnc3n2CCCCC3)cc1 786055066 IMCGSODSAQBPQD-MRXNPFEDSA-N 412.538 2.344 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)COc3ccc(F)cc3F)cc2)CC1 786256236 BYPBRQCTOSXZLW-UHFFFAOYSA-N 403.429 2.329 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3[nH]c(SC)nc3=O)c2C)cc1 787487053 KFXBAGCKBSQWAU-UHFFFAOYSA-N 400.460 2.370 10 20 HECD O=C(CN1CCOC[C@H]1[C@@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796344020 FQYWJOMUENIZEK-SFTDATJTSA-N 420.465 2.280 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c(O)c1 797389225 VYINCZLRPLVNPY-UHFFFAOYSA-N 417.425 2.390 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 807354956 MCYNXMWDVDTIIB-UHFFFAOYSA-N 403.523 2.341 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C(=O)N1c1ccccc1 807654046 KRSQPVARHYUXTM-OXQOHEQNSA-N 408.502 2.021 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2COC3=O)cc1 920482077 GLNUDCBXHHWXLW-UHFFFAOYSA-N 410.473 2.310 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc4c(cn3)OCCC4)CC2)cc1 1320003639 IDBQBFAZJOYUBP-UHFFFAOYSA-N 410.518 2.357 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C)c1Cc1ccccc1 1326505681 NBSVUYNAUVVUDX-SFHVURJKSA-N 423.469 2.326 10 20 HECD Cc1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)[nH]1 1793773793 GUGLCIUPIPLMSI-CLLJXQQHSA-N 404.854 2.348 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1cc(O)nc(O)c1 1817848593 ROIRQMJBQMFPCN-ZIAGYGMSSA-N 417.491 2.417 10 20 HECD C/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831343802 JTFYAUBCTPCWQW-TYMUOXQOSA-N 423.604 2.433 10 20 HECD CCN(C(=O)COC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@H]1CCS(=O)(=O)C1 5643806 BPMFCWWXMRGBAB-IBGZPJMESA-N 418.515 2.287 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c(C)c1 729061331 ATDUTGPGXGMCPZ-ZDUSSCGKSA-N 416.430 2.077 10 20 HECD C[S@@](=O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 735054357 ZLINYWWJQQSQJU-PFQQOQBSSA-N 402.588 2.224 10 20 HECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741100264 WMNCMHYLVBWWNR-UHFFFAOYSA-N 408.458 2.285 10 20 HECD Cc1cc(C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1-c1cccc(Cl)c1 742180987 OUIZBBKGXZGYGS-UHFFFAOYSA-N 410.923 2.417 10 20 HECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1c(O)ccc2c1CCCC2 743716544 RMYIMSDGSGSSHA-IBGZPJMESA-N 406.490 2.176 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCN1CCO[C@H](C)C1 745792656 QPBSDMPIQDNFFI-CYBMUJFWSA-N 400.317 2.407 10 20 HECD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccccc1O 748354939 PVSAOWVDIJKQNU-MRXNPFEDSA-N 403.460 2.468 10 20 HECD COC(=O)c1c(F)ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1F 749184294 ZCSBJLNURJOCKO-UHFFFAOYSA-N 412.414 2.405 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1 752022964 JBKROOFTUPAACQ-HTAPYJJXSA-N 415.538 2.395 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 753985457 HUIQWBWHNWFAHE-UHFFFAOYSA-N 406.552 2.202 10 20 HECD CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 754567805 DKZSAFILVQPXEV-PKOBYXMFSA-N 404.555 2.231 10 20 HECD C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1ccc(Br)cc1O 756706229 NVSUSFHAOOLGHE-JSGCOSHPSA-N 421.357 2.294 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CCN([C@H]2CCC[C@H]2O)CC1 767938333 WYRCRBNMLMOHGW-LEWJYISDSA-N 418.607 2.417 10 20 HECD COc1cccc(O)c1CN1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 768194589 BWLVIZDETZIVEO-UHFFFAOYSA-N 402.516 2.396 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)Cc2ccc(N3CCOCC3)c(F)c2)cc1 769498072 DVUZDPJHWLVMLN-UHFFFAOYSA-N 421.538 2.381 10 20 HECD C[C@H](NC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1)c1ccc(N(C)C)cc1 773610717 FTIAVVOQWJBOER-IBGZPJMESA-N 423.561 2.457 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(N3CCCS3(=O)=O)cc2)c1O 775067821 FIVKQDNDZFUXCY-UHFFFAOYSA-N 407.448 2.139 10 20 HECD O=C(N[C@@H]1CCn2ccnc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 779218419 YVFMAXHKVPQNOY-GFCCVEGCSA-N 418.500 2.196 10 20 HECD Cc1ccc(C(=O)N2CCC(CC(=O)N3CCC(N(C)C)CC3)CC2)c(O)c1O 780914403 IWYDSHFOUWQHEK-UHFFFAOYSA-N 403.523 2.201 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C[C@H](C)O)[C@H](C)CO)c2C)cc1 785537508 QHZCUVMHLYHKKW-CVEARBPZSA-N 402.491 2.127 10 20 HECD COc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OC)c1OC 787307879 VKHGUYLNDMWKND-AWEZNQCLSA-N 415.490 2.272 10 20 HECD CC1CCN(CCNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 787665256 YOPNJZBAKKXAPK-UHFFFAOYSA-N 400.567 2.387 10 20 HECD CN(CC[C@@H]1CCCCN1C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859623 BVQTUDNNSIRGNS-IBGZPJMESA-N 418.607 2.189 10 20 HECD C[C@@H]1CC(=O)C[C@@H](C(=O)NCc2ccccc2O)[C@H]1C(=O)NCc1ccccc1O 791138789 HCACSOHCXAQTTQ-IQVOZAENSA-N 410.470 2.262 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](C)(O)Cn1c(C)cccc1=O 792226414 SHIBJAHBAJWHCV-IBGZPJMESA-N 423.307 2.425 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 793642546 KLIHPYSFLZBXKM-UZLBHIALSA-N 412.486 2.270 10 20 HECD COc1cncc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 799184952 QZNIRTSSGIKXQE-UHFFFAOYSA-N 402.520 2.423 10 20 HECD CCOCCCn1c(COC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802614415 CBTAAWRCCQCWEI-UHFFFAOYSA-N 407.490 2.325 10 20 HECD CCc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 804034853 CKTZOYRFUCCSKF-QGZVFWFLSA-N 417.531 2.278 10 20 HECD COCCO[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805024976 YMRPXNDTTVRQFE-NRFANRHFSA-N 417.550 2.193 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)c1ccc(N(C)C)cc1 807670203 BSTJHTDFKFUVHG-QRWLVFNGSA-N 400.498 2.488 10 20 HECD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 917364420 GMZWFMHNKAYGHB-KURKYZTESA-N 400.475 2.075 10 20 HECD C[C@H]1CN(c2ccc(CNC(=S)NCCCN3CCOCC3)cc2F)C[C@@H](C)O1 917581141 OBNVVRBUOBEPHP-CALCHBBNSA-N 424.586 2.126 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918369843 XCYGBDSFRXDWBY-UHFFFAOYSA-N 417.531 2.264 10 20 HECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCCC[C@H]1C 920636512 WMXJUFZQCHXHED-CXAGYDPISA-N 412.508 2.346 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)CN(C)C2)c1ccc(N2CCOCC2)cc1 920924471 BZJJJXHUCKRPCE-INIZCTEOSA-N 408.502 2.285 10 20 HECD Cn1cc(N2CC[C@H](NC(=O)NCc3ccc(N4CCSCC4)cc3)C2)cn1 1328687335 QWBVXIJNHMNNLW-KRWDZBQOSA-N 400.552 2.051 10 20 HECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc1C 1799720492 GCAHHVXLOMWCJC-BJWYYQGGSA-N 411.458 2.375 10 20 HECD CN1CCC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)C1 1800718501 WXRVHJUMKUKBGW-DMRZNYOFSA-N 421.925 2.345 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(O)cc2)C1 1844942330 XZJREILREKTKND-UHFFFAOYSA-N 418.453 2.002 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2)cc1 6129608 ZULGDLUWORYVNZ-MRXNPFEDSA-N 416.449 2.494 10 20 HECD CCc1cc2c(=O)n(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)cnc2s1 104994321 XYMLIUWJAWRGKE-UHFFFAOYSA-N 412.515 2.378 10 20 HECD COc1ccc(F)c(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1 560436786 HOULQXGGYQXEAN-UHFFFAOYSA-N 408.480 2.350 10 20 HECD Cc1c(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)n(C)c2ccccc12 576732097 NAWALQGQDUBBNR-SYJLOODJSA-N 413.518 2.288 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(-n4cnnc4)cc3)CC2)cc1 725878908 LEECWOWMTXIMDG-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CCCC3)cc2)C1 726097114 DVRXCESZSILIPU-MJGOQNOKSA-N 402.539 2.360 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc4c3OCCO4)CC2)cc1 726728627 WXPKBXPNQHYSDF-UHFFFAOYSA-N 411.458 2.190 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CCCCNC1=O 726869696 NBYGXWRIGMGPOO-SFHVURJKSA-N 405.454 2.001 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C3CCC(OC)CC3)CC2)cc1 734665424 NNNYBHTWNXOSCQ-UHFFFAOYSA-N 404.555 2.416 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)C2(C(N)=O)CCC2)NC(=O)OC(C)(C)C)cc1 747905821 BRMUHOJSBDIQTH-MRXNPFEDSA-N 404.511 2.090 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2CCCC3)cc1C(=O)O 748641919 VJMHTTMPTFGMCE-UHFFFAOYSA-N 424.500 2.436 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)cc(Cl)c3O)nc12 751733175 ZXIYTGPKNLNXFS-UHFFFAOYSA-N 409.757 2.467 10 20 HECD CC1([C@H]2CCCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)OCCO1 753109871 UJBJSMJACNNATA-KRWDZBQOSA-N 421.513 2.471 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 753782245 ODYNUUZUBPPGMM-ZFVVBOAOSA-N 423.435 2.354 10 20 HECD CCN1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C[C@@H]1C 754506563 DWMRUTHSWNINPH-ZDUSSCGKSA-N 409.533 2.421 10 20 HECD COc1cc(N2CCN(C(=O)CCCCCNC(C)=O)CC2)cc(OC)c1OC 759238671 OLXFPHSDRONYJQ-UHFFFAOYSA-N 407.511 2.058 10 20 HECD COc1cc(N2CCN(C(=O)c3cccnc3-n3cccn3)CC2)cc(OC)c1OC 759240269 JTXXYXSXSZVFRE-UHFFFAOYSA-N 423.473 2.256 10 20 HECD O=C(NCCCSc1nccs1)NC[C@@]1(N2CCOCC2)CCSC1 759567837 AWEIHIGNHHENKJ-INIZCTEOSA-N 402.611 2.132 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cn(-c2ccccc2Br)nn1 762273864 DSEZQVBTSCNFNN-UHFFFAOYSA-N 403.236 2.414 10 20 HECD NS(=O)(=O)c1cccc(NCc2cccc(Br)c2O)c1[N+](=O)[O-] 764934791 LYJJAQFJJBUWMI-UHFFFAOYSA-N 402.226 2.322 10 20 HECD CCOC(=O)c1c(NC(=O)CN2C[C@@H](O)C[C@H]2CO)sc(C)c1-c1ccccc1 764980649 LXNIMTDPKKMOCC-HOTGVXAUSA-N 418.515 2.266 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)cs1 766206084 DUYFYEMSBZZFGF-UHFFFAOYSA-N 406.279 2.481 10 20 HECD Cn1c(=O)oc2cc(S(=O)(=O)NCc3cccc(Br)c3O)ccc21 766207582 QCEKNLRQIAECJS-UHFFFAOYSA-N 413.249 2.078 10 20 HECD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440193 UCISVULOEJYISO-XOBRGWDASA-N 415.465 2.102 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1 769378312 BDLHSAKGTZLYOG-UHFFFAOYSA-N 416.591 2.157 10 20 HECD Cn1cnnc1Sc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 769651994 ANFQHSXSJLWFOO-UHFFFAOYSA-N 419.488 2.296 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4nc[nH]n4)cc3)CC2)cc1 771288572 TWAJBKQBCDOAKL-UHFFFAOYSA-N 406.490 2.032 10 20 HECD Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 772124185 QCDURXNRNHNWME-UHFFFAOYSA-N 403.460 2.068 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N(C)C)cc1 773083826 IHUYTKVUNJLPAJ-AWEZNQCLSA-N 423.560 2.233 10 20 HECD O=C(NCc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774441131 YZTYYRPGYIAHNE-UHFFFAOYSA-N 405.857 2.248 10 20 HECD COc1cc(O)c(CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1OC 776174105 IPXJGEUFPIZHAQ-GOSISDBHSA-N 413.518 2.397 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776248702 KCXSKHCDDJIQIH-UTKZUKDTSA-N 412.534 2.487 10 20 HECD COC(=O)c1ncsc1S(=O)(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1 777678627 VPBLDRPDSAKQQO-UHFFFAOYSA-N 421.504 2.041 10 20 HECD COc1ccc(N2CCN(C(=O)c3c(C)nn(C)c3-n3cc(C)cn3)CC2)cc1F 777807125 HPNODHCYMGFZOL-UHFFFAOYSA-N 412.469 2.333 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4nccnc4c3)CC2)cc1 778241884 FUCMYAXPCAESCX-HJWRWDBZSA-N 417.469 2.482 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1 779610791 AUENVTMXLVEERE-FQEVSTJZSA-N 401.532 2.477 10 20 HECD CCO[C@@H]1C[C@@](CO)(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 780337597 DXTCTDKGCFBASX-NBCNXNJRSA-N 405.539 2.450 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cc(Cl)cc3c2OCC3)SC1=S 782887366 MKWVIUKTZADQLS-WQLSENKSSA-N 418.949 2.025 10 20 HECD CS(=O)(=O)Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)oc2ccccc12 783375674 REXCGHTYVWTTHF-UHFFFAOYSA-N 404.396 2.428 10 20 HECD CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295104 RJPCVGDEZFRCSE-CYBMUJFWSA-N 424.461 2.018 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1 786300384 BLYXWPVMKBFACZ-UHFFFAOYSA-N 410.518 2.119 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3n[nH]c(CO)n3)c2C)cc1 787486109 LJBNFXATSOWWHN-UHFFFAOYSA-N 400.460 2.466 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(N2CCCC2=O)c1 788224115 MMCNLPXVFCAWCP-UHFFFAOYSA-N 408.502 2.120 10 20 HECD C[C@@H]1CC(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)C1 789835082 NYTUIJQUWLVGEQ-GJZGRUSLSA-N 405.514 2.344 10 20 HECD Cc1cccc(F)c1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789847377 QNWJDPRHQOLCSK-UHFFFAOYSA-N 417.456 2.167 10 20 HECD COCC1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789867001 BGJDAEIGSMNHFG-UHFFFAOYSA-N 405.564 2.131 10 20 HECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 790908301 NKPNGDUPFRTRFT-QGZVFWFLSA-N 411.506 2.169 10 20 HECD CN(CCCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 798383648 WGBJCAKYRPZNCJ-LJQANCHMSA-N 401.555 2.016 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCOC3(CCSCC3)C2)cc1F 803662274 AJBBBPLGYWZAOD-OAHLLOKOSA-N 409.527 2.069 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1cnn(C)c1 807101278 RFTYZXHHQISCBI-NRFANRHFSA-N 423.492 2.456 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccccc1 807289377 RSHUFJJFPYRHRH-YADHBBJMSA-N 404.514 2.241 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 807611374 FCPFMROZFPAAFA-ZCNNSNEGSA-N 415.534 2.054 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C 807667423 SXXZEDSRVUXGCD-UHFFFAOYSA-N 406.527 2.131 10 20 HECD CCC[C@@]1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 812010545 QWOZXYSWLLDDFN-PGRDOPGGSA-N 402.539 2.082 10 20 HECD CS(=O)(=O)N1CCN(CCN[C@@H](CCc2ccccc2)c2ccccc2O)CC1 815576243 MUSKUZPXJQPFPB-NRFANRHFSA-N 417.575 2.233 10 20 HECD O=C(NCCC(=O)OCC(=O)c1ccc(O)c(O)c1)NC12CC3CC(CC(C3)C1)C2 916615877 QXTVVUPPVCDCFA-UHFFFAOYSA-N 416.474 2.482 10 20 HECD CCc1cccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 916676735 PONUXQSRXSBXAB-UHFFFAOYSA-N 402.516 2.179 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(-n2nccn2)nc1 918308248 IJULVDSIEXQVDB-UHFFFAOYSA-N 419.489 2.250 10 20 HECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cccc1[N+](=O)[O-] 918309969 IIVCREQEHZZAGE-UHFFFAOYSA-N 412.446 2.337 10 20 HECD COc1ccc(N2CCCN(C(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 918369616 MKMSZTGOXUWUHD-UHFFFAOYSA-N 412.446 2.072 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(OCC(F)(F)F)n2)c1 1324853497 SGYISQHGDNXMRR-UHFFFAOYSA-N 419.381 2.030 10 20 HECD CC(=O)N/C(C)=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1801229273 WOOVFVFHBNKGPQ-SWPZASQDSA-N 421.881 2.043 10 20 HECD O=C(CC1CCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1828107112 OMEUVBBPMJZTSI-LBPRGKRZSA-N 402.476 2.365 10 20 HECD O=C(c1cncc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250223 ZHQRTBMLNJIKAH-UHFFFAOYSA-N 422.363 2.037 10 20 HECD COc1cccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1846095638 DOCLMIJGSSXMJA-VOTSOKGWSA-N 409.442 2.032 10 20 HECD Cc1nnc(S[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 5993188 GPJYGWMPIAHYKX-JTQLQIEISA-N 407.455 2.195 10 20 HECD Cc1c(CNC(=O)N[C@@H]2CCCN(c3nccn(C)c3=O)C2)n(C)c2ccccc12 543650311 CKHWNCUXFWIZKD-MRXNPFEDSA-N 408.506 2.049 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCNC(=O)c3cccs3)cc2F)CC1 730192528 FAEHXOQNTFQYGC-UHFFFAOYSA-N 418.538 2.465 10 20 HECD O=C(Nc1ccc2c(c1)C(=O)NCC2)C(=O)N(Cc1ccco1)Cc1ccccc1O 735388863 ABNYHRPZIKVJOD-UHFFFAOYSA-N 419.437 2.439 10 20 HECD COc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1OCC(N)=O 735519243 PMUMDSDGGOSWHK-KRWDZBQOSA-N 414.458 2.086 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1 737208089 VAQQTBZMGCMKDM-HNNXBMFYSA-N 413.474 2.049 10 20 HECD C[C@@H]1Oc2c(cccc2C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)NC1=O 739768074 KJDGTJVPXOZURW-ZDUSSCGKSA-N 408.458 2.360 10 20 HECD Cc1cc(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1[N+](=O)[O-] 742027675 UKHMZGBGPWYZDU-UHFFFAOYSA-N 403.413 2.215 10 20 HECD CN(C)c1ccc(CN(C(=O)Nc2ccn(CCS(C)(=O)=O)n2)C2CC2)cc1 743207797 SMQYKQPRWPMTSO-UHFFFAOYSA-N 405.524 2.190 10 20 HECD Cc1[nH]nc(C(F)(F)F)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746590749 MZAGPTVWQBFZSI-CYBMUJFWSA-N 409.412 2.369 10 20 HECD O=C(NC[C@H]1CCN(C2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751065204 NXYXNZRLZHDBKB-CYBMUJFWSA-N 421.544 2.469 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)C1 756326918 LSADWMYEIUOXNU-MOPGFXCFSA-N 404.507 2.175 10 20 HECD C[C@@H](NCc1ccccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1O 756592004 RIPFJAUUCXGWJR-OAHLLOKOSA-N 407.511 2.318 10 20 HECD COC(=O)c1cn([C@@H]2CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)C2)nn1 761226280 NUGWZENPPUWEDT-MRXNPFEDSA-N 414.466 2.410 10 20 HECD COc1ccc(CNC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 772777713 XUNIBFYAGVOTBC-PPGNKHEKSA-N 401.415 2.376 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4nc(C)cn4c3)CC2)cc1 774152233 GWDAVASHAJNCED-UHFFFAOYSA-N 407.474 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3cnc(C)s3)CC2)cc1 778241607 CJMBIVJFPKXBTC-CMDGGOBGSA-N 414.531 2.324 10 20 HECD C[C@@H](C[S@](C)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 784212582 HPWQKRWFUXHCAX-JWNZJDHWSA-N 407.458 2.108 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccccc1CN1CCOCC1)c1ccc(N(C)C)cc1 785442243 IYEDZXXZDDHNME-GOSISDBHSA-N 424.545 2.078 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 789818731 KOJVMUCTOUJJEW-BFYDXBDKSA-N 421.513 2.129 10 20 HECD CS(=O)(=O)Nc1cc(C(=O)NCc2ccc(O)c(O)c2)cc(C(F)(F)F)c1 792237913 KWEJIMBFSDSHNL-UHFFFAOYSA-N 404.366 2.418 10 20 HECD CCOc1cccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 799919693 SSJNFDCLNGJJAR-UHFFFAOYSA-N 410.517 2.121 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 801547973 ICRXHIKQLKCGAF-HNBVOPMISA-N 400.475 2.073 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(C)c2ccccc2C1)c1ccc(N2CCOCC2)cc1 803307392 CZTUGUTWHXNKSF-GOSISDBHSA-N 422.529 2.179 10 20 HECD CCc1nn(C)c(CC)c1CNC(=O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 804853290 WFTREORZCYNMRV-UHFFFAOYSA-N 417.529 2.463 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)cc1F 804853418 XMZMYKDVGARDIB-IIBYNOLFSA-N 423.554 2.459 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCCN4C)C3)cc2)CC1 805026226 GWVUTFXXMJFTOV-RBBKRZOGSA-N 412.578 2.482 10 20 HECD C[S@](=O)c1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807385571 NCHOAJVTSZMHSB-DEOSSOPVSA-N 411.277 2.147 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](C)CC1(C)OCCO1 807421951 YHEIHTPHJYWVTI-QGZVFWFLSA-N 405.539 2.395 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C3CC3)C(C)(C)CO)cc2F)C[C@@H](C)O1 815248527 CETSZNFHZPRHHO-DMPWYTOCSA-N 421.557 2.442 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 816482682 OXXDISPNYXMSRT-UHFFFAOYSA-N 403.863 2.296 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 917913795 VWPNLUZXLHTZKO-UHFFFAOYSA-N 422.528 2.425 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC[C@@H]3CCCC[C@H]32)c1 920637053 YGKQKWSCSHNGLD-XJKSGUPXSA-N 410.492 2.102 10 20 HECD C[C@H](OC(=O)CO[C@@H]1CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1318911076 RGAFPVMXGNYSHL-DZGCQCFKSA-N 423.421 2.138 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncnc1-c1ccccc1 1338287830 NCYPIIZGOWSQFS-KRWDZBQOSA-N 407.426 2.459 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncncc2c1)c1cc(O)nc(O)c1 1798127429 ICLZUIVFNLPYSE-BJWYYQGGSA-N 419.441 2.002 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1)c1cc(O)nc(O)c1 1799743370 FURUMDIRLLUARM-MUJYYYPQSA-N 403.385 2.337 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cncs3)C2)CC1 1808703307 UZSWXAIRHFTTAJ-UHFFFAOYSA-N 402.476 2.108 10 20 HECD COCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824060871 WHFIFTWUXKQCKW-QGZVFWFLSA-N 405.495 2.153 10 20 HECD CCSc1ncccc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1840989353 DPUGRYJVCYOPDT-UHFFFAOYSA-N 414.487 2.131 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CN3CCCCCCC3=O)cc2F)CC1 216968136 GSKMQFWGGFKFHW-UHFFFAOYSA-N 404.530 2.377 10 20 HECD Cc1c(CNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)n(C)c2ccccc12 472135481 ZIBOYJGELGTLKZ-MGPUTAFESA-N 405.520 2.022 10 20 HECD O=C(c1cccc(NS(=O)(=O)c2cccc3nsnc23)c1)N1CCC[C@H](O)C1 625085810 IVFUMJMKKALFIP-AWEZNQCLSA-N 418.500 2.089 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(N4CCCC4)nn3)CC2)cc1 726880335 XSKFCAVRKWYALT-UHFFFAOYSA-N 424.549 2.028 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 728977837 FGTOXGHMROYWPT-JTQLQIEISA-N 405.432 2.377 10 20 HECD C[C@H]1CN(C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 729599296 FGJPXGTVMRUNHB-JQVVWYNYSA-N 416.566 2.306 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)c3cccs3)cc2F)CC1 730235864 PXVNXZBBUWJFTE-OAHLLOKOSA-N 418.538 2.464 10 20 HECD CN(C)c1ccc(CNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1 732672334 HFYYXGSIPDBEBQ-UHFFFAOYSA-N 422.473 2.113 10 20 HECD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NCCCSc2nccs2)c1 733973987 BYPIGBZDCPGBJL-UHFFFAOYSA-N 403.526 2.445 10 20 HECD CCOC(=O)C(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 735818879 VLECEHPJSDCFNV-UHFFFAOYSA-N 401.438 2.081 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@](C)(CO)C3CCCCC3)CC2)cc1 754043556 SHZDYEPMRLMMPF-JTHBVZDNSA-N 405.583 2.099 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCCCN2CCN(c3ncccn3)CC2)c1 756534948 NKUZAJNRDVCSTH-QGZVFWFLSA-N 413.522 2.222 10 20 HECD COC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 757640110 XBRBNSBTCKBMOE-LJQANCHMSA-N 424.501 2.174 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(Br)c3)cc2)C1 758175308 BLRIRGIDCRYTEA-OAHLLOKOSA-N 417.307 2.476 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cnn(C)c1C(F)F)c1ccc(N2CCOCC2)cc1 758982500 LMZDAKKQFOMCAO-GFCCVEGCSA-N 407.421 2.010 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@H](N(C)C)C3)CC2)cc(OC)c1OC 759293357 KHRKTDAMECKNND-SJORKVTESA-N 420.554 2.417 10 20 HECD C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 759568352 MSZUNQWRFZYZRT-HHXXYDBFSA-N 414.506 2.293 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)/C=C/c2ccc(O)c(O)c2)cc1 759581437 VQUPBSKSZXAQGX-ONNFQVAWSA-N 419.455 2.477 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2cccc(Br)c2O)cc1 765733430 YLSMAMJQLJYGMU-UHFFFAOYSA-N 413.293 2.335 10 20 HECD COC(=O)C1(NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCCC1 767505348 DIIBKGHQDLQQPH-HZPDHXFCSA-N 421.513 2.131 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnnc3C(C)(C)C)cc2F)C[C@@H](C)O1 768523215 YQCQUWGMFWNHKN-OKILXGFUSA-N 404.490 2.040 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](CN2CCN(C)CC2)c2ccccc2)c1O 774942278 OZTKDZMBNHVRJS-GOSISDBHSA-N 400.479 2.387 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C/c3scnc3C)CC2)cc1 777102433 NBYJKOXRVXDVBL-BQYQJAHWSA-N 401.488 2.365 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@]2(C1)C(=O)Nc1ccccc12 777466248 VNZPDBCTCMPFLM-QHCPKHFHSA-N 406.486 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H](c4cc[nH]n4)C3)CC2)cc1 778244080 OPOLFLPWQANWRA-GIFJBRJJSA-N 423.517 2.029 10 20 HECD CC[C@@]1(CO)CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 779537419 SYSMFHQLTLOAQK-PGRDOPGGSA-N 402.539 2.082 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 785394546 BUZYDJYMFBJHIR-INIZCTEOSA-N 406.490 2.135 10 20 HECD Cc1cc(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)no1 785963224 UBQQQMIZPMOIQX-UHFFFAOYSA-N 404.378 2.483 10 20 HECD CN(Cc1ncnn1CC(F)F)C(=O)NCc1ccc(N2CCSCC2)cc1 786971795 CQQLVTAYAKRCJH-UHFFFAOYSA-N 410.494 2.438 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(Cc2ccncc2)CC1 787433563 PPRYXJBCHVLSFR-UHFFFAOYSA-N 410.518 2.307 10 20 HECD Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 800600898 GSQSBFQUYGYCOV-UHFFFAOYSA-N 416.409 2.134 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCC[C@H]1c1ncc[nH]1)c1ccc(N2CCOCC2)cc1 803307176 XUXKIBATVCXZAZ-LPHOPBHVSA-N 411.506 2.177 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](OCC(F)(F)F)C2)cc1F 803663224 LLLKHTAJXWBVPY-CYBMUJFWSA-N 405.392 2.078 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C)C(=O)OC(C)(C)C 804179264 BUHBTDBWUZXLSK-UHFFFAOYSA-N 420.554 2.473 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCC[S@@](=O)C(C)(C)C 806198383 NBIKAQPNXYTLPN-MUUNZHRXSA-N 407.580 2.299 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 806279675 WHDANJCZLZXLLJ-HRCADAONSA-N 408.593 2.074 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N(Cc1ccco1)C[C@@H]1CCCO1 807291871 PIJVQRKOJOOHJD-NRFANRHFSA-N 409.486 2.480 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCC[C@H]2COC(=O)N[C@H]2CCOC2)c1O 809707707 MGHAXJMGBRTZBK-GJZGRUSLSA-N 409.439 2.179 10 20 HECD C[C@@H](c1ccccc1)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 813589548 CFNFIYFALCAYAB-MGPUTAFESA-N 414.481 2.119 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCc2c(nnn2-c2ccccc2)C1 814286193 BCALUSJGURTSSU-UHFFFAOYSA-N 418.501 2.372 10 20 HECD Cc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)sc1C(=O)O 915357706 DIQPROCWXCWGAG-UHFFFAOYSA-N 410.517 2.412 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNc3cnccn3)cc2F)C[C@H](C)O1 918211379 LTFLIYMKSTYWGT-GJZGRUSLSA-N 402.474 2.141 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1-n1cnnn1 919969640 VHRYYMLQPCUOCH-UHFFFAOYSA-N 410.453 2.001 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ncc(C(N)=O)cc3Cl)cc2F)CC1 1324809309 NXENFTMNOKNRSX-UHFFFAOYSA-N 419.888 2.045 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)c(F)cc1F 1796604474 KKOIQPYARZQVFK-ZSBIGDGJSA-N 421.375 2.476 10 20 HECD Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2c1 1843663636 KEBOBZLPRAAROR-UHFFFAOYSA-N 418.453 2.480 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1NC(C)=O 60750440 YAUZHCXUPYJVOQ-UHFFFAOYSA-N 410.474 2.291 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1OC 410378380 CENKGBPLEQNPML-UHFFFAOYSA-N 406.460 2.136 10 20 HECD O=S(=O)(Nc1ccc(NS(=O)(=O)C2CC2)cc1)c1ccc2c(c1)OCCO2 727353183 QNJREMQJPODQQF-UHFFFAOYSA-N 410.473 2.163 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCS(=O)(=O)N1CCSCC1 730550789 IOBQNBNGTWLQDH-UHFFFAOYSA-N 413.590 2.264 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccc3ccccc3c2)c1 731830639 XTSKWUIXSPSQHT-LJQANCHMSA-N 400.456 2.380 10 20 HECD COc1ccc(O)c(CNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1 734066199 JRLNWJLBFNNGNW-UHFFFAOYSA-N 402.470 2.161 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](OCCO)C1 734485689 PYGBMWRSPFDWTQ-NVXWUHKLSA-N 422.481 2.262 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cnn(CC(=O)NCCN(C)C)c1 741714795 TUAVGPWBXXGAQQ-UHFFFAOYSA-N 414.535 2.282 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)OC)c2)cc1 743261899 XZBFVSOPEPPUPV-UHFFFAOYSA-N 415.493 2.144 10 20 HECD O=C(NCCCN1C(=O)COc2ccccc21)NCc1ccc(N2CCOCC2)cc1 743561291 ZYGFUNXZMOBWGW-UHFFFAOYSA-N 424.501 2.138 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cnn(Cc2ccncc2)c1 746363045 JDTAUKFYVFFEEJ-UHFFFAOYSA-N 406.490 2.380 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](CO)C(C)(C)C)cc2F)C[C@@H](C)O1 749467424 ZBQLUTBITFBUJR-JXXFODFXSA-N 409.546 2.394 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)NCCOC)cc1 750861268 AUGRQNOKAFPGQX-UHFFFAOYSA-N 406.504 2.369 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C4CC4)n(C)n3)CC2)cc1 753088434 PIVWLXFQXHYYIA-KTKRTIGZSA-N 409.490 2.150 10 20 HECD COc1ccc(N2CCN([C@@H](C)C(=O)N3CC(=O)Nc4ccccc43)CC2)cc1F 753858686 ZYLFXXYTMZUIHG-HNNXBMFYSA-N 412.465 2.330 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cnn(-c3ccccc3)n2)C2CC2)cc1 755211308 IBONFMBTXDQDCI-UHFFFAOYSA-N 404.474 2.463 10 20 HECD Cc1cc(C(=O)COC(=O)c2coc(S(N)(=O)=O)c2)c(C)n1-c1ccccc1 757768848 PZCCDGZFNJZQHP-UHFFFAOYSA-N 402.428 2.374 10 20 HECD COCCC(C)(C)CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 760122752 BOGHIEVRIUEOIR-KTKRTIGZSA-N 403.523 2.079 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)c2)CC1 769846666 BGZIMQWHEONGTL-UHFFFAOYSA-N 403.504 2.401 10 20 HECD CCOC1CC(O)(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 770697481 CWNCIIQPPVSQEL-FNMUINPESA-N 413.465 2.486 10 20 HECD NC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c(F)c1 774119036 XBDCOSJOWVBZJX-UHFFFAOYSA-N 411.389 2.391 10 20 HECD O=C(NCc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 774465463 KAXPSTUECCAOGP-UHFFFAOYSA-N 406.530 2.151 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1 775373248 PXADNSVUPNLENA-CQSZACIVSA-N 421.519 2.249 10 20 HECD COCCOc1ccc(Br)cc1NC(=O)C(=O)NCc1ccccc1O 778133882 GRDBGNHHPGSHSQ-UHFFFAOYSA-N 423.263 2.435 10 20 HECD CS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ccc(O)c(O)c2)c1 778925197 INQWDSQHIKVBTR-UHFFFAOYSA-N 400.250 2.194 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)c(F)cc3F)cc2)CC1 786122757 YWYSMIPPJOVTJL-UHFFFAOYSA-N 423.485 2.420 10 20 HECD CCOc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 787193838 TYIPRUJUIJWUDC-UHFFFAOYSA-N 411.502 2.495 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(C)c(N2CCNC2=O)c1 787492946 CUAZZPPQSQXFFS-UHFFFAOYSA-N 409.490 2.154 10 20 HECD C[C@@]1(c2ccccc2)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788313054 OQJFIYAPNKWXBV-XMMPIXPASA-N 407.514 2.330 10 20 HECD CCS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799078 IAGNCQXLJWQFSQ-KRWDZBQOSA-N 423.554 2.413 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)cc1 797431678 VKFZVEBMUWHEDK-UHFFFAOYSA-N 411.505 2.077 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=S)NCCNS(C)(=O)=O)cc2Cl)C1 799898916 YVAFWFDKITZKOB-CYBMUJFWSA-N 419.016 2.090 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)CCc3ccccc3)nc12 801493665 LALORCGVMBYTCK-OAQYLSRUSA-N 413.430 2.039 10 20 HECD COc1ccc(N2CCN(C(=O)CN3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2)cc1 802019501 KNFCCMISKOFEKW-NHCUHLMSSA-N 421.545 2.398 10 20 HECD Cc1cc(C(=O)COC(=O)CN(C)CC(=O)NC(C)C)c(C)n1-c1cccc(F)c1 803693818 ZSMIAWIYJZVDIK-UHFFFAOYSA-N 417.481 2.416 10 20 HECD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804060155 MUYODYRLNPYAJN-UXHICEINSA-N 415.534 2.033 10 20 HECD CC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C1CCOCC1 807982579 GBDCIUINTSNZFQ-OALUTQOASA-N 404.507 2.221 10 20 HECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 808237669 AWZLTDCFURJMRB-NLWGTHIKSA-N 418.513 2.109 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1cccc(N(C)C)n1 808401796 OYVQDPQZNYXHMA-UHFFFAOYSA-N 409.534 2.413 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809531922 MIPJMWLBRBBRMW-HNNXBMFYSA-N 414.506 2.006 10 20 HECD CCS(=O)(=O)NC1CCN(Cc2cc(Br)cc(OC)c2O)CC1 809736285 MYYIDGNGWXSFMC-UHFFFAOYSA-N 407.330 2.067 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1 918304290 OBJNCBYBJAIGGY-UHFFFAOYSA-N 403.504 2.143 10 20 HECD Cc1noc(C)c1CCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918994155 PYKOTLATRNDZHL-UHFFFAOYSA-N 419.453 2.059 10 20 HECD COCCN1C(=O)/C(=C\Nc2ccc(OC(F)F)c(Cl)c2)C(=O)NC1=S 920978000 PHCKKPQGHQXEQK-CLFYSBASSA-N 405.810 2.127 10 20 HECD COc1ccccc1NC(=S)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920995162 TXJNKUWPRLCMHL-UHFFFAOYSA-N 405.545 2.417 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(cc1Cl)NC(=O)C2 1116646660 LXIKPISLFYZOFO-HNNXBMFYSA-N 418.833 2.150 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ccnnc3O)CCC2)cc1)c1cc(O)nc(O)c1 1788427768 OQUIHYDMXCLAHS-UHFFFAOYSA-N 421.413 2.050 10 20 HECD Cc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795202132 ASOCTVACSRWHAW-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1806837932 QMVOUDILPMRDDD-YVEFUNNKSA-N 424.379 2.160 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccn2)CC1 1827219824 FQKKQLCVNAAZGE-LJQANCHMSA-N 424.501 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nncn3CC(F)(F)F)CC2)cc1 51972352 ABKNFQDXYSLQCP-UHFFFAOYSA-N 415.441 2.290 10 20 HECD CCN(CC(=O)NCc1cccs1)C(=O)CN(C)c1ccc(OC)c(OC)c1 64517405 JQGUOJPKHNWLNZ-UHFFFAOYSA-N 405.520 2.366 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)C3CCCCC3)cc2)C1 727940217 DRSKKGDZIZIGHF-ICSRJNTNSA-N 402.539 2.129 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCC3CCN(C)CC3)CC2)cc1 728740803 HZZAFFCEYCHKIZ-UHFFFAOYSA-N 417.598 2.238 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCCCSc2nccs2)cc1 733972885 ARCDNZOSMBLCSV-LBPRGKRZSA-N 415.562 2.117 10 20 HECD Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 735633052 MNYITIYGMLVGIA-OAQYLSRUSA-N 424.480 2.057 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCCC3)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 735846704 ABLXYTZYHXOIEC-UHFFFAOYSA-N 418.475 2.081 10 20 HECD COc1ccc(C(=O)NCC(=O)NCCCSc2nccs2)cc1[N+](=O)[O-] 736680367 ILMPUTFXVLTCFU-UHFFFAOYSA-N 410.477 2.088 10 20 HECD C[C@](CO)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 741054241 LNJGEZVDBFZKSD-JOCHJYFZSA-N 407.530 2.199 10 20 HECD CC(=O)N1CCC(N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 742204684 PKEQTOSFUKLIFN-CQSZACIVSA-N 419.481 2.390 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)n1nnc(-c2ccccc2)n1 742556837 LGIKOFJARXVNSD-OAHLLOKOSA-N 410.453 2.193 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCS(=O)(=O)CC1 742807191 XUXPLBVTLSEXQY-CQSZACIVSA-N 402.463 2.198 10 20 HECD CSCc1noc(CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 747414926 KKGVOJKPJRPCCP-UHFFFAOYSA-N 404.536 2.390 10 20 HECD Cn1c(=O)oc2cc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 751136129 DBORVXGCBXMXNG-OAHLLOKOSA-N 418.471 2.207 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)CCc3ccccc3)cc2)C1 753122631 SSPQYVOGTDMXLH-IRLDBZIGSA-N 424.545 2.181 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1 753642429 DFTRNPYIONTKKA-ZDUSSCGKSA-N 424.544 2.234 10 20 HECD COc1cc(N2CCN(C(=O)NCc3nc(C4CC4)no3)CC2)cc(OC)c1OC 759258717 OUDFTAUUVOQTTN-UHFFFAOYSA-N 417.466 2.005 10 20 HECD COc1ccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759879384 TZWXVKDXYREXJU-UHFFFAOYSA-N 415.490 2.482 10 20 HECD COC(=O)c1cn([C@H]2CCN(Cc3c(O)ccc(C(=O)c4ccccc4)c3O)C2)nn1 760529474 AYHQCJVLVZZPLD-HNNXBMFYSA-N 422.441 2.154 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(S(C)(=O)=O)cc1 765979120 INSQUKLOTHLEBE-MRXNPFEDSA-N 422.572 2.176 10 20 HECD CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773746167 ZAGMEOMGLQOQRQ-HIFRSBDPSA-N 421.519 2.138 10 20 HECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 785625777 WXGZGSDUYJIXCM-FQEVSTJZSA-N 411.502 2.152 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3O)cc2)CC1 786257797 TZBJWVSUOQZGQP-UHFFFAOYSA-N 422.407 2.405 10 20 HECD C[C@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 787003583 YUTLGKAQTMVPOL-KRWDZBQOSA-N 420.529 2.057 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Cc1cccs1 788312552 JAVXDEUALVPHAE-INIZCTEOSA-N 401.532 2.196 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@@H](c2cccc(O)c2)C1 788934325 VVUJQGUGTWCQFC-OAQYLSRUSA-N 409.486 2.209 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 793745680 XKYUUVKWEZOCGX-QGZVFWFLSA-N 416.566 2.080 10 20 HECD COC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C 798045928 RACBPKJTNYQSHR-LLVKDONJSA-N 401.419 2.270 10 20 HECD NS(=O)(=O)Cc1cccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 800718175 CASNTTKPBRHNEO-UHFFFAOYSA-N 403.504 2.059 10 20 HECD COC1(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCC(C)CC1 803317590 TVMHWAKBWUNOAD-OTQYULQBSA-N 417.550 2.412 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)cc1F 803661681 JQRRCIVMBGIJMD-MRXNPFEDSA-N 416.472 2.432 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1 806040153 DWYGWJJJSWILMN-SWLSCSKDSA-N 412.328 2.102 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)CC2)cc1 806620540 ZAGHXLBGCSBSLS-SIKLNZKXSA-N 415.582 2.085 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccn(C)n3)cc2Cl)C1 807956614 QXSAFKIMCKSROO-OAHLLOKOSA-N 417.941 2.285 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1 808095013 ONZDSJQKIUSADH-UHFFFAOYSA-N 413.492 2.494 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 808346870 RISOUQPSNQTBTJ-FPOVZHCZSA-N 417.550 2.015 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC2CCN(C3CC3)CC2)cc1 809866817 ZBYXYGSJFKKBQS-UHFFFAOYSA-N 400.567 2.482 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3c(C)nn(C)c3C)CC2)cc1 916197995 DXGFTEFTPJBVNM-UHFFFAOYSA-N 400.527 2.379 10 20 HECD CC(=O)Nc1ccc(OC[C@H](O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1 917019918 MLGZONCZEPSXKF-JOCHJYFZSA-N 413.518 2.353 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)N1CCc2ccccc2C1 917918933 VWRSAIOWERGDOU-UHFFFAOYSA-N 405.495 2.055 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc(OC)c3)CC2)cc1 920253757 GXKWHWJNMNIATF-ZHACJKMWSA-N 409.486 2.225 10 20 HECD Cc1nc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 1116580611 WNTKNNZXUGUCHJ-IHRRRGAJSA-N 405.474 2.098 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(CC(F)(F)F)nc1C 1320693077 UKPUVMZLGUNZJQ-ZDUSSCGKSA-N 415.368 2.069 10 20 HECD Cc1cccnc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598929 LWRTUWCSFKGKIS-BJWYYQGGSA-N 410.474 2.081 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cocn2)CC1 1826161682 BKRBXFRMXGPPGJ-MRXNPFEDSA-N 400.435 2.028 10 20 HECD Cc1ocnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829432718 ZPCSFKWRHSWQPM-MRXNPFEDSA-N 414.462 2.336 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2cccs2)C1 1843064447 FANGEOQZKYGHTH-UHFFFAOYSA-N 422.510 2.287 10 20 HECD O=C([C@@H]1CC=CCC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441093 LSSLEURUMWADFP-QGZVFWFLSA-N 406.486 2.339 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@]2(F)Cl)C1 1846443309 ARSSOXBJWHLRTM-DYZYQPBXSA-N 403.237 2.493 10 20 HECD COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)cc1F 301590164 XQGTXWODWGAPEM-UHFFFAOYSA-N 409.439 2.473 10 20 HECD CN1CCN([C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)c2ccccc2)CC1 727755705 DAZCHKMLCQKEEC-QHCPKHFHSA-N 408.546 2.128 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H](O)COc1ccc(F)c(F)c1 729599553 HSMPPMYOKIXHGL-KRWDZBQOSA-N 421.444 2.041 10 20 HECD CC(C)(CNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1)NS(C)(=O)=O 731765842 PDXUCPVLUJAEAZ-UHFFFAOYSA-N 417.491 2.485 10 20 HECD CNS(=O)(=O)[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 733279481 XETLXMKMMJUHQU-GOSISDBHSA-N 405.520 2.257 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)cc1 735389193 GKPAQVLXQBKGIQ-UHFFFAOYSA-N 408.502 2.416 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCc1cc(=O)c(O)co1)c2[N+](=O)[O-] 735962222 FPELVZMYGRWKCZ-UHFFFAOYSA-N 421.317 2.386 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc(-n4cccn4)n3)CC2)cc1 736458829 LBRXTPBRCMTAHI-UHFFFAOYSA-N 420.517 2.218 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 746355124 RMGVBGKQCUJBSB-CHWSQXEVSA-N 417.485 2.045 10 20 HECD Cc1nccn1CCCN(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 747388417 LALNPMMNRQDMDJ-LJQANCHMSA-N 412.538 2.125 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@]12CCCO2 759318197 HMTXLGHMQYLPJD-SJBKTWHCSA-N 421.513 2.313 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@@H](Cc4ccncc4)C3=O)cc2F)C[C@@H](C)O1 761097518 JCMMCGFBWPRIJM-CLCXKQKWSA-N 412.465 2.497 10 20 HECD O=C(Cc1ccccc1Cl)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768444810 YMRWEMKZPLPTNV-LJQANCHMSA-N 402.878 2.358 10 20 HECD CCC(CC)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774601019 LDDJMGPLCDHEDZ-UHFFFAOYSA-N 401.429 2.463 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(Cc2ccsc2)CC1 774748958 BMTQKURVJJPTHD-UHFFFAOYSA-N 400.548 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3cscn3)CC2)cc1 778243866 FINOXDQCYNGCDH-FPLPWBNLSA-N 400.504 2.015 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 779547419 KRRIBGVHOYTERA-UXBLZVDNSA-N 406.460 2.486 10 20 HECD Nc1ccc(N(C(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)C2CCCCC2)cc1 784059357 JHDCHWVQXNMEDI-UHFFFAOYSA-N 416.503 2.221 10 20 HECD CCN(CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)C(=O)OC(C)(C)C 786659785 PDMQRFPZMZIJDR-UHFFFAOYSA-N 418.538 2.228 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)c1ccc(N(C)C)cc1 787635588 FFZFIDCZHCGZCW-FOIQADDNSA-N 400.498 2.488 10 20 HECD COc1cccc(CN=c2cc(NCc3cccc(OC)c3O)n3[nH]cnc3n2)c1O 795084713 GNVRYKYRJDEBKQ-UHFFFAOYSA-N 422.445 2.199 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](c2ccccc2)C1 803688724 ZUKPSDCZZJQOIJ-QFIPXVFZSA-N 406.530 2.201 10 20 HECD Cc1cc(=O)oc2cc(N(C)C(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc12 805355100 VHZBKOAVNRJONF-UHFFFAOYSA-N 402.428 2.455 10 20 HECD Cc1nc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)sc1C 807674489 LVBIXBZAUXKMIF-HNNXBMFYSA-N 415.563 2.352 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 807912678 MUFVDAIZVRWZKZ-QGZVFWFLSA-N 413.497 2.030 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCC(C(=O)NCCCN3CCCC3)CC2)c1O 809731701 NZUNNDIBJNDRNM-UHFFFAOYSA-N 420.510 2.123 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H](CO)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815273401 RFTCDFLJTNXUGH-QGZVFWFLSA-N 419.547 2.019 10 20 HECD O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(N2CCSCC2)cc1 917383788 MTCYKPWJUYOFET-ROUUACIJSA-N 401.532 2.031 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 920635645 JESKBZXVURMMRN-XSEXMBABSA-N 424.519 2.250 10 20 HECD CN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N(C)C)cc3)cc2F)CC1 1262187754 WOQJVTUCXHHLRZ-UHFFFAOYSA-N 406.527 2.440 10 20 HECD C/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1781702793 BRMOQYNGKVBPEL-CCUDJZOASA-N 408.882 2.455 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnnc2ccccc12 1796601253 KQBCQTZGRJPEIS-QDMKHBRRSA-N 419.441 2.002 10 20 HECD O=C([C@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428200 LLXWCEIVIUBWNB-QZTJIDSGSA-N 415.490 2.419 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)COc3cccc(OC)c3)CC2)cc1 11853472 XZWVOFDUILJTTO-UHFFFAOYSA-N 413.518 2.411 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cc(C(F)(F)F)cnc3O)ccc21 726293803 NKTIQVCRHGMLHZ-UHFFFAOYSA-N 408.380 2.443 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729036244 MJOOJTNUYLJTOG-CYBMUJFWSA-N 415.446 2.115 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)cc2)CC1 731131294 JQHUWWLXJNSMDL-UHFFFAOYSA-N 419.489 2.154 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1 734692844 KHBZPDPUHZYPMD-HHHXNRCGSA-N 410.879 2.188 10 20 HECD CN1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 740837792 RFGMWWWKPMFAFD-JLHYYAGUSA-N 409.558 2.030 10 20 HECD CCC(=O)N[C@H](C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742752979 IEYFPUBZBSTSCF-PBHICJAKSA-N 406.527 2.349 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742948486 ULJLVYIWZLQJNO-OAQYLSRUSA-N 416.566 2.115 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)N1CCC[C@@H](C(N)=O)C1 743874197 VXLKBWXZWXGUSS-QWHCGFSZSA-N 412.328 2.089 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2cc(Cl)ccc2-n2cncn2)c(O)c1O 750620461 YWCMJRUCDFFGQB-UHFFFAOYSA-N 402.794 2.436 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H](Cn2ccnn2)C1 752651724 PEAXNYTYGZDQIB-GOSISDBHSA-N 400.552 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@H](NC(N)=O)c3cccs3)CC2)cc1F 753740066 ZDQBTZIJQQEHPQ-HNNXBMFYSA-N 406.483 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)NC[C@@H](C(C)C)N3CCOCC3)CC2)cc1F 753834764 VNSIZTZPCHQDHP-IBGZPJMESA-N 408.518 2.023 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H](N4CCCC4)CC3)CC2)cc1 754043667 UGWQSWUPCYQCJU-GGAORHGYSA-N 416.610 2.128 10 20 HECD CCOC(=O)N[C@H](C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)C(C)C 760088621 JOWDPRMQZUYQNZ-SFHVURJKSA-N 423.510 2.132 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(Br)n3)nc12 763769949 AQJWGUQAGSVAAD-UHFFFAOYSA-N 421.207 2.126 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NCc2cccc(Br)c2O)c1 766199493 DJOWIASMERHLBY-UHFFFAOYSA-N 400.250 2.420 10 20 HECD CCCn1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 769022839 GPBLGNLSXHHHGA-UHFFFAOYSA-N 424.549 2.080 10 20 HECD Cc1ccc(C(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)c(O)c1O 770476086 HEKYMKLUWSSXHP-INIZCTEOSA-N 414.458 2.010 10 20 HECD COc1cccc(OC)c1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 772446029 HLARWMFPYYXLEQ-UHFFFAOYSA-N 410.467 2.158 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](O)Cc3ccccc3Cl)CC2)cc1 772510703 MJGPYMRVXWNHPW-OAQYLSRUSA-N 417.937 2.190 10 20 HECD COc1ccccc1CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 775053583 MVUAWZZKUQFYOS-QGZVFWFLSA-N 411.502 2.068 10 20 HECD COCc1cccc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778238292 YUKUCLSIBHTTGR-KHPPLWFESA-N 423.513 2.363 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc(OC)c(F)c3)CC2)cc1 779219516 UCBWQKJOVKKLEQ-HXUWFJFHSA-N 417.525 2.458 10 20 HECD CCOC(=O)[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 779403350 GKOKPMIRUXLWAJ-FQEVSTJZSA-N 402.516 2.315 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCCCSc1nccs1 781534885 QMPFFXUWGOQJDD-UHFFFAOYSA-N 409.489 2.175 10 20 HECD COCCCN(CCO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 782972753 TUFRNOCKTJKARK-OAHLLOKOSA-N 401.454 2.297 10 20 HECD O=C(COC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc(O)c(O)c1 783824669 QGBALLKDQPTKGR-INIZCTEOSA-N 413.426 2.141 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1)c1ccc(N(C)C)cc1 785477749 ABSAZCBHECIPHT-GOSISDBHSA-N 424.545 2.078 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](c3ccccc3)c3nccn3C)ccc21 785601460 VFLIHVWEEVYXMD-NRFANRHFSA-N 417.513 2.325 10 20 HECD CO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 786657000 PKRZOBSUDZVPJX-FQEVSTJZSA-N 413.543 2.360 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2cccnc2-n2ccnc2)cc1 787444932 VORKXRNSIOOCHZ-UHFFFAOYSA-N 420.517 2.388 10 20 HECD Cc1cc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n(C)n1 791152960 ABZGTEORYRYKDA-UHFFFAOYSA-N 404.382 2.342 10 20 HECD O=S(=O)(c1ccnc(NCc2ccc(N3CCOCC3)c(F)c2)c1)N1CCCC1 791408415 SHJRSARCROLHSL-UHFFFAOYSA-N 420.510 2.454 10 20 HECD C[C@@H](OC(=O)Cn1cccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792668033 OKAHTJUEMVJOBB-CYBMUJFWSA-N 403.394 2.229 10 20 HECD C[C@H](Nc1cccc(C(=O)N(C)CC(N)=O)c1)c1ccc(N2CCOCC2)c(F)c1 793566206 SBIAOFWSSAPEKD-HNNXBMFYSA-N 414.481 2.393 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 795932880 OUQHLLVKIOTSEV-HNNXBMFYSA-N 405.520 2.168 10 20 HECD C[C@H](NC(=O)N1CCC[C@H](S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 800702116 IPCZLXGTSYFCQQ-LPHOPBHVSA-N 409.552 2.193 10 20 HECD CCOC1CC(CCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804320249 YZGSRBANCAVGKI-UHFFFAOYSA-N 403.523 2.102 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(F)(F)Br)CC2)cc1 805837450 HTHUBWUFPFGBIM-OAHLLOKOSA-N 422.314 2.098 10 20 HECD CN(C)C(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806458460 YLQNWXRIVIVTDR-KRWDZBQOSA-N 422.501 2.425 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1OC1CC1 806526180 QVVSJZFEHZIROD-UHFFFAOYSA-N 400.500 2.393 10 20 HECD CN(Cc1ccccc1)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290605 ZFAWTEKMOGUVRR-QHCPKHFHSA-N 418.541 2.412 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F 808114167 STASDGGFBLSNHA-UHFFFAOYSA-N 408.860 2.284 10 20 HECD CCCN(CC)C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 811980367 YWUZZIHEONUNOA-HKUYNNGSSA-N 403.571 2.308 10 20 HECD Cc1cc(C(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1C 919730231 UBAOSKGBNZKQIK-UHFFFAOYSA-N 404.488 2.317 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](C)Sc3nnnn3C3CC3)CC2)cc1 1116419432 JVAJJVZFMOQXSY-CQSZACIVSA-N 402.524 2.236 10 20 HECD CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1806328394 AYFTVAKLHNJVRS-VGOFRKELSA-N 419.485 2.290 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C)[C@@H](C)N3CCOCC3)cc2F)C[C@@H](C)O1 729597460 POQLRPYFRSXJAB-BRSBDYLESA-N 422.545 2.348 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC[C@H](NS(C)(=O)=O)C3)cc2)CC1 731049016 WNJLXWUUABPESD-SFHVURJKSA-N 408.568 2.146 10 20 HECD CCN(C1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1)S(C)(=O)=O 731350057 FWYQOTPBZSEDNT-UHFFFAOYSA-N 404.536 2.375 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCN1CCOCC1 733995418 JPFJQGFOTKYDKH-INIZCTEOSA-N 421.497 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4cc(F)c(F)cc4c3=O)CC2)cc1 734095213 VZSNLFKJBCOZQB-UHFFFAOYSA-N 414.412 2.032 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 735745412 HVZVLAWSOCHBTM-MRXNPFEDSA-N 405.476 2.253 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccccc3CO)cc2F)CC1 737043575 HPTQXQPPVUXTHG-UHFFFAOYSA-N 400.498 2.459 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)OCCO2 751239334 GYSCKLMQVHPCHE-UHFFFAOYSA-N 418.515 2.145 10 20 HECD O=C1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CN1CC(F)(F)F 753080885 PHWNJEBDQVAJNJ-UHFFFAOYSA-N 402.442 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1F 753884826 UGUCFLGFUUVJBF-UHFFFAOYSA-N 422.482 2.144 10 20 HECD CSc1ccccc1NC(=O)CN(C)C(=O)COC(=O)c1ccc(C)c(O)c1O 754929883 CVLJOIPKYUAZMP-UHFFFAOYSA-N 418.471 2.382 10 20 HECD Cc1nn(C)c(C)c1OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 758423905 VMAYRRQQEDGCMH-OKILXGFUSA-N 404.486 2.485 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)NCc1cccc(Br)c1O 766201960 YAZNJBDAYRVRBG-YPMHNXCESA-N 406.298 2.306 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(O)c(Br)c2)c1 768296968 VBDWBMDRDIHKPF-UHFFFAOYSA-N 415.265 2.162 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1 769027676 NJGJMLIRCTVESL-ASSNKEHSSA-N 403.479 2.469 10 20 HECD COc1cccc(CNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c1O 770034227 JYMCJGWOUXCCIQ-UHFFFAOYSA-N 414.277 2.497 10 20 HECD C[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CN(C)CCO1 770107072 GRMLXPKJZVTTAZ-KSSFIOAISA-N 412.481 2.275 10 20 HECD COc1ccc(O)c(CN2CCN(S(=O)(=O)c3ccc(F)c(F)c3F)CC2)c1 775643479 YULBPPLJBVSSEC-UHFFFAOYSA-N 416.421 2.325 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@H](C)[C@@H]3C)CC2)cc1 778285959 RRGDIHNCJSMXGA-LZDOZHLXSA-N 403.548 2.252 10 20 HECD CC(=O)N[C@@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 779378318 NAGRSIGPZGADKW-HXUWFJFHSA-N 422.437 2.104 10 20 HECD CCO[C@@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 780311892 LZXNZJVVQICGHC-DENIHFKCSA-N 423.529 2.152 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@H]3CCO[C@H](C)C3)CC2)cc1 784251589 INAXNWRKKSGEHN-MOPGFXCFSA-N 404.555 2.322 10 20 HECD C[C@H]1CCCN(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 787677138 UXVORGLQAXDTCG-IBGZPJMESA-N 400.567 2.483 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCN3CCc4ccccc43)ccc21 787689054 RCOFGCUUWMNNKM-UHFFFAOYSA-N 406.530 2.254 10 20 HECD C[C@@H](CN1CCOCC1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 789337110 YRXGZGZLMDHQGQ-INIZCTEOSA-N 421.497 2.053 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@](C)(O)CC3)CC2)cc1 792003631 BBHYJWWKRIWFKS-QFIPXVFZSA-N 404.555 2.154 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1 792703245 RELUKPLXSLIVTA-UHFFFAOYSA-N 406.482 2.426 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 793862429 KQZOEYOFPRSOFS-GOSISDBHSA-N 412.509 2.493 10 20 HECD CO[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnn(C)c1 798397334 AMFLFDHLINBWQB-KRWDZBQOSA-N 412.412 2.279 10 20 HECD O=C(Cn1ccc(C(F)(F)F)cc1=O)NCc1ccc(N2CCOCC2)c(F)c1 799963572 PWGQNGKCDBYACE-UHFFFAOYSA-N 413.371 2.159 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)c1ccc(N2CCOCC2)cc1 803309932 DVKBQHPAGMVZAY-QLIIJSOBSA-N 415.534 2.020 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCOC4(CCSCC4)C3)ccc21 803687233 YJQGSNIOTIIKKO-GOSISDBHSA-N 417.575 2.246 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOC[C@H]3[C@@H]3CCCO3)cc2F)CC1 806749839 GHHMUOFQBIPXBR-SFTDATJTSA-N 420.529 2.057 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807386753 HRLKZURPKBJANQ-UHFFFAOYSA-N 423.263 2.435 10 20 HECD CCN(C)C(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 808079435 FZRIMAGEQBLRKM-UHFFFAOYSA-N 403.504 2.416 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnn(-c4ccccn4)c3N)cc2F)CC1 815492321 LAOJMTCTYYIBDK-UHFFFAOYSA-N 423.496 2.061 10 20 HECD COc1ccc(N2CCN([C@H](C)C(=O)N3CCN(c4ccccc4O)CC3)CC2)cc1 856903317 NWNRKRIBAXSPCY-LJQANCHMSA-N 424.545 2.260 10 20 HECD Cn1cnnc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 915193641 KGYKADRJTZABTD-WQLSENKSSA-N 407.546 2.174 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H](C(=O)NC3CC3)c3ccccc3)cc2)C1 917940811 OLXQRWQTNKGTBZ-KNQAVFIVSA-N 406.530 2.498 10 20 HECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(OC)c1 918309965 IADLVBCMHKLFDP-UHFFFAOYSA-N 413.474 2.138 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H](C)S(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 919346772 CFDVRNKCLLIIKB-CQSZACIVSA-N 421.471 2.024 10 20 HECD Cc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccc(O)nn1 920888712 YTGRIRXZRRDTBQ-CQSZACIVSA-N 408.462 2.004 10 20 HECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1N1CCCC1=O 1319962249 IOCBRBGGNGDMDP-UHFFFAOYSA-N 403.460 2.451 10 20 HECD COc1ccc(C[C@@H](CO)CNCc2ccc(N3CCN(C)CC3)c(F)c2)cc1O 1323761653 QXGVGBUQQRHCRV-LJQANCHMSA-N 417.525 2.233 10 20 HECD Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808496297 HRRIIGBADBKGBM-KXBFYZLASA-N 422.441 2.423 10 20 HECD COC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824604361 QHYJXQNGYISJOM-WMLDXEAASA-N 405.495 2.009 10 20 HECD CC(C)(C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423821 JMKXFEZGTOYCKQ-VQIMIIECSA-N 419.522 2.133 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843963997 KBWSFOSLXULLNI-WMZOPIPTSA-N 408.502 2.419 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1cccn1 1846619784 ILYMNUYZKGNRKD-LBPRGKRZSA-N 404.854 2.026 10 20 HECD C[C@@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)C1CCCC1 727198648 ADCDFSFWCNPFFK-INIZCTEOSA-N 403.523 2.339 10 20 HECD Cc1ccc(F)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 728015364 PPAVPBDLXQUHJX-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1 728221418 TZUWNOISNIGZTM-UHFFFAOYSA-N 415.515 2.336 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 734270891 ZIDZSDDBNLUORF-YQQAZPJKSA-N 406.502 2.107 10 20 HECD CCn1c(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2ccccc21 744407795 AGYYQSKSLREEBL-UHFFFAOYSA-N 402.476 2.106 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cn1 747750286 OPDPNPWXTGNICX-UHFFFAOYSA-N 408.461 2.183 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3C3CCOCC3)CC2)cc1 754234873 RDTCJQZBZARAJB-FYYLOGMGSA-N 403.567 2.069 10 20 HECD COc1ccc(N2CCN(CCCNC(=S)NC[C@@H]3CCCCO3)CC2)cc1 758183732 JUEXXQYFDGXJHD-FQEVSTJZSA-N 406.596 2.241 10 20 HECD CCn1c(=O)n(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 758195661 BTBBVNUYCTYVFG-IBGZPJMESA-N 410.518 2.015 10 20 HECD COC(=O)c1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759221631 COYPYHFXVFBGDN-UHFFFAOYSA-N 414.458 2.461 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnn(-c4cccnc4)c3)cc2F)CC1 759417239 UEIKBMVODUDOKQ-UHFFFAOYSA-N 408.481 2.478 10 20 HECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 759570275 RXHDDXIPIPBMMP-RXVVDRJESA-N 424.549 2.477 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3Cc4ccccc4C3)CC2)cc1 762671399 GBWCUDULVKTACY-KHPPLWFESA-N 405.498 2.184 10 20 HECD C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(-n2cnnn2)c1 765241841 DTBDVUNBOGINLR-LPHOPBHVSA-N 405.506 2.215 10 20 HECD CSC[C@H](CCO)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 765256867 IWPBDIUCSUGDMQ-LBPRGKRZSA-N 416.546 2.098 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3csc(NC4CC4)n3)CC2)cc1 769086825 QQEJJYQPYXDUEZ-UHFFFAOYSA-N 401.536 2.278 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCN(c2ccc(F)cc2)CC1 772771785 ZBNIEUOVFUAJOB-WAPJZHGLSA-N 400.406 2.142 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2 773739779 KCSKWRUHJDKCRA-OIJAAMDRSA-N 405.472 2.114 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)c([N+](=O)[O-])c2)cc1F 773958191 QUTCGYGUDUZZPJ-UHFFFAOYSA-N 424.454 2.158 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccn1 774884003 GWEFEWOUYKSKOF-SFHVURJKSA-N 421.545 2.107 10 20 HECD COc1ccccc1C(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775649464 RUAAZSJKYDKOOE-UHFFFAOYSA-N 408.546 2.405 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)cc1F 776126613 DTUBXHSJEJQOLA-HNNXBMFYSA-N 410.490 2.327 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1cccc(I)c1 776280586 USDQLZZHSSDEAR-UHFFFAOYSA-N 413.167 2.498 10 20 HECD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 779498928 GUPRCOGDLZIVJF-VURMDHGXSA-N 405.495 2.170 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c1 790392787 AARZSPVMYOXZIW-PRCFCKQXSA-N 418.534 2.195 10 20 HECD CC[C@@H]1CCCCCN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793716324 CEDLQTYOPAKVEQ-RTBURBONSA-N 414.550 2.186 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC(=O)NC1CCCCC1 793763390 YNCSRAUWDAOKFP-UHFFFAOYSA-N 416.566 2.445 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NC[C@H]1CC=CCC1 793820367 RXENFLUAPZJUSW-IBGZPJMESA-N 410.562 2.307 10 20 HECD C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793826581 RSAGXPGSTDPTHM-DLBZAZTESA-N 411.502 2.153 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c(O)c1 797390865 WZYGBAKYPFXXEZ-UHFFFAOYSA-N 416.384 2.334 10 20 HECD CCCCN(CC(=O)c1c(O)nc(=O)n(CC(C)C)c1N)Cc1ccccc1O 801596040 MXDRSPUXDIINGP-UHFFFAOYSA-N 402.495 2.378 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1ccc(O)cc1OC(C)C 802722158 RAWTUVMGHJQBKM-UHFFFAOYSA-N 415.489 2.392 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCN(C(C)(C)C)CC1)c1ccc(N2CCOCC2)cc1 803311523 WMJGSENFAZLNNL-GOSISDBHSA-N 416.566 2.033 10 20 HECD Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)NCCCCN(C)C)c2)c(O)c1O 803642665 BTJMTJWXJMQUHF-UHFFFAOYSA-N 421.519 2.279 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(CCO)[C@@H]3CCc4ccccc43)ccc21 803689225 MZCAKLDSPFPFSH-JOCHJYFZSA-N 407.514 2.194 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](CCN(C)C)C(C)(C)C)CC2)cc1 804319614 QARDBYLGDPYBNA-HXUWFJFHSA-N 418.582 2.263 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C(F)(F)F)O[C@H](C)C2)cc1F 804853471 QFFGFPDSKCRXEV-WBMJQRKESA-N 419.419 2.466 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccc(F)cn1 806725905 XRDFKQYGJQJWFM-UHFFFAOYSA-N 410.243 2.354 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 807101110 UOXVZONDMOIYPP-MRXNPFEDSA-N 418.538 2.145 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccnc1OCC(F)F)c1ccc(N(C)C)cc1 807676351 FFVGDSUJKBMIKC-CYBMUJFWSA-N 406.433 2.285 10 20 HECD COC[C@@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770500 LMBPOGLEABIGMZ-HOCLYGCPSA-N 411.449 2.010 10 20 HECD Cc1ccccc1-n1cc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1 808390223 PQWLNLGRLBNIFM-UHFFFAOYSA-N 411.531 2.100 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cc(C)n(-c3ccccn3)c2C)NC(=O)N[C@@H]1C 914908181 XVZCJEPSBXSDCR-CYBMUJFWSA-N 412.446 2.164 10 20 HECD CCOC(=O)[C@H]1CCCN(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 917926464 FQJJHQLGBLAGPR-KRWDZBQOSA-N 409.552 2.237 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccncc1Br 1116646678 MDWBNZCPZFVDLJ-ZDUSSCGKSA-N 409.236 2.160 10 20 HECD CCOc1ccc(N2CCN(CC(=O)Nc3cccc(S(C)(=O)=O)c3)CC2)cc1 1323176591 GMCYTKDXSBMDGW-UHFFFAOYSA-N 417.531 2.250 10 20 HECD CC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816721951 VQUVRJVGBXAKRS-ZDUSSCGKSA-N 406.826 2.369 10 20 HECD Cn1c(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cc(=O)n(C)c1=O 24907628 KIBMMRLEEJQLBS-QGZVFWFLSA-N 412.515 2.419 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C3CCN(C(=O)N(C)C)CC3)cc2F)C[C@H](C)O1 108287642 UFJXBMPSXLYRRB-HOTGVXAUSA-N 420.529 2.449 10 20 HECD Cc1nc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c(Br)n1C 323308571 CISXPGFTMINGQA-UHFFFAOYSA-N 401.330 2.378 10 20 HECD CCS(=O)(=O)N1CCN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 486074365 NZARHEMGNVRTKJ-UHFFFAOYSA-N 407.536 2.012 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cc12 725828859 MGHAUYISOKSCKL-AWEZNQCLSA-N 415.519 2.153 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cccc(Cl)c3)cc2)CC1 726977203 YLZOXYPYUULPLF-UHFFFAOYSA-N 414.936 2.053 10 20 HECD O=C(CNC(=O)NCc1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)cc1 727374582 IDXTVDIYEHSPIF-UHFFFAOYSA-N 416.909 2.292 10 20 HECD COC(=O)CN(CC(=O)OC)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 731475335 HPMGWFONHXEBGN-UHFFFAOYSA-N 406.866 2.465 10 20 HECD CC[C@H](C)[C@](C)(O)CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 732883327 RBFXZDXLMNRIIP-PGRDOPGGSA-N 406.571 2.304 10 20 HECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCCCSc1nccs1 733971699 BUMQYUXNXAWNHC-UHFFFAOYSA-N 402.505 2.245 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 734275648 ABZKIYGJRAASSZ-CQSZACIVSA-N 410.465 2.424 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc12 741802802 SEOFSCACSNCQBJ-CYBMUJFWSA-N 419.482 2.053 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3cc(C)ccc3OC)cs2)cn1 743045855 CAORPBAKWUORNT-UHFFFAOYSA-N 422.488 2.297 10 20 HECD CCCN(C)C[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 745784706 YVAPRFOXQOQAFA-HXUWFJFHSA-N 417.598 2.191 10 20 HECD COc1ccccc1N1CC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 749960698 IKMXMLFCEBCQFN-AWEZNQCLSA-N 419.503 2.029 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H](Cn2ccnn2)C1 752647772 DTRNLSNIUZMPON-QGZVFWFLSA-N 416.501 2.000 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(S(C)(=O)=O)cc1 753295593 ZBODBDCASVUWSG-INIZCTEOSA-N 402.516 2.347 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3c3cn(C)nc3C)CC2)cc1 754058476 AWTJLASFVZVZKJ-OFNKIYASSA-N 413.566 2.057 10 20 HECD Cc1ccc([C@H](C)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c(O)c1C 756441681 MQVOVVNIPKISDP-SFHVURJKSA-N 418.563 2.207 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)C1 757622299 HMNPJZBHWKLOIQ-CQSZACIVSA-N 400.410 2.366 10 20 HECD CCn1cc(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 758490079 FRUZRLAEAWGQPE-UHFFFAOYSA-N 410.396 2.258 10 20 HECD COc1cc(Cl)cc(CN2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1O 761182458 FHWNRPWRFIOBNW-UHFFFAOYSA-N 415.899 2.166 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 766402423 DHCYEJCIMXRPHO-UHFFFAOYSA-N 405.426 2.172 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnn(-c2ccccc2)c1 768707198 GAAMPOWYUBAHHK-UHFFFAOYSA-N 423.448 2.103 10 20 HECD COc1ccc(N2C[C@H](C(=O)NCc3cccc(OC)c3O)CC2=O)c(OC)c1 769507373 IGJCFMYFBUHRPT-CQSZACIVSA-N 400.431 2.087 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(C)c(S(N)(=O)=O)c3)c2)CC1 770285351 BJGALKPMYNIORT-UHFFFAOYSA-N 402.520 2.037 10 20 HECD O=C(Cn1ccc2ccsc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 774846137 NPVUFGSBCLMIQQ-UHFFFAOYSA-N 401.463 2.355 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N(C)C)c1 774949993 TYPGHHFTXVLSLZ-NRFANRHFSA-N 412.534 2.139 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCc4c(O)cccc43)CC2)cc1 778275535 KXCNEERUCBEBDL-VIOKTNGOSA-N 421.497 2.409 10 20 HECD CN(CCN1CCN(C(=O)OC(C)(C)C)CC1)C(=O)/C=C/c1ccc(O)c(O)c1 779511758 KGKHTFZHZCTUAE-SOFGYWHQSA-N 405.495 2.122 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 785296128 BSMAKJIOXQSPFV-AWEZNQCLSA-N 411.458 2.020 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C(=O)C2CC2)CC1 786650342 RMKWAZWGQIVQAF-UHFFFAOYSA-N 401.507 2.038 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 786722512 AWVJVERHPIQONA-UHFFFAOYSA-N 412.446 2.404 10 20 HECD C[C@H]1C[C@H](C)CN(CCCCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 787914956 RCXKAIKFNYBMCJ-IRXDYDNUSA-N 406.546 2.382 10 20 HECD CN(C)Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 788629857 DTKODIGECLICDY-UHFFFAOYSA-N 421.538 2.327 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc2c(s1)CCC2 789371418 ZDCHSGIOOPMICH-UHFFFAOYSA-N 400.504 2.066 10 20 HECD COCCC(C)(C)CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789828798 YQBARBHRWDLJBD-HOTGVXAUSA-N 423.529 2.234 10 20 HECD Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2=O)cc1 790240243 BHCGQIAXBXZOBW-QFIPXVFZSA-N 422.529 2.432 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccccc1OCCN(C)C)c1ccc(N(C)C)cc1 803213675 GYFGPBFEYHLDPH-QGZVFWFLSA-N 412.534 2.187 10 20 HECD COCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccco1 803301807 ZEOMPPRNRWAJTI-QFBILLFUSA-N 415.490 2.187 10 20 HECD CC[C@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@@H](C)S1(=O)=O 805396654 PNLAOEPCHHXZER-CVEARBPZSA-N 424.588 2.439 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(Cc2cccc(F)c2)CC1 807096788 KHTYAQZRRCMNGY-UHFFFAOYSA-N 412.509 2.161 10 20 HECD CNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807954469 SQTUAVBPSAZKOC-CQSZACIVSA-N 422.957 2.081 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 915922994 RXJCWNNOVXKPLG-VQTJNVASSA-N 405.539 2.440 10 20 HECD Cc1cc(N(C)C)ccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918308072 DLHUVBQAWSYUCG-UHFFFAOYSA-N 410.518 2.495 10 20 HECD CCN(CC)c1ccc(CNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)cc1F 1116575900 WKSINLZNZOHTIS-UHFFFAOYSA-N 407.511 2.439 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 1336532907 ZHKGUJOKNFXJMW-UHFFFAOYSA-N 403.504 2.004 10 20 HECD Cn1ccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1795251010 GQKILIOCSJLTEZ-CLLJXQQHSA-N 404.854 2.050 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796001509 GPAXRPIYRJXUDB-OBSCOMINSA-N 409.914 2.376 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848387 GXIRMCBKCBXBDM-NHYWBVRUSA-N 415.450 2.137 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1 5621744 KMXKXHKECPIFFV-UHFFFAOYSA-N 413.430 2.038 10 20 HECD Cc1cc(NC(=O)CN2CCN(Cc3cc(C(C)(C)C)cc(O)c3O)CC2)no1 28747354 MRCXZQFBDZTQGN-UHFFFAOYSA-N 402.495 2.448 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 248052201 NPQOILKMUVTZGP-MOXQZVSFSA-N 407.514 2.442 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)ccc1OC 610316401 VRBQJYKQNXSVDY-UHFFFAOYSA-N 406.460 2.136 10 20 HECD COc1ncnc(OC)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 731975634 KZONQZJGSWZXFU-STQMWFEESA-N 404.442 2.177 10 20 HECD O=C(CN1CCCC2(CCOCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 741802836 UJDZCVWBPUESDL-UHFFFAOYSA-N 405.514 2.171 10 20 HECD CC[C@H](CN1CCCC1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 758713519 UTZJROQHFHIRDZ-RBUKOAKNSA-N 401.555 2.062 10 20 HECD Cc1c(Cl)cccc1NC(=O)CNC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759591011 YUICQCZUVPNFAL-SOFGYWHQSA-N 418.833 2.371 10 20 HECD C[C@@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763878067 LOSNMFIOTAPBST-NYCQYLMKSA-N 424.522 2.489 10 20 HECD NS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(F)c1 770556125 YIUSZBBWEDANHO-CQSZACIVSA-N 408.451 2.000 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C[C@@H](O)C(F)(F)F 774771441 IAGFVTIZYDEKHS-MRXNPFEDSA-N 406.360 2.256 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCCCC1 774889574 KZERZJFDTDPTSP-LJQANCHMSA-N 417.550 2.281 10 20 HECD CCN(CC(=O)NCc1cccs1)C(=O)CN[C@@H](C)c1cc(OC)ccc1O 775371076 SOBZUODFWTWCBI-AWEZNQCLSA-N 405.520 2.278 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccc(C)cc3)CC2)cc1 778225111 KJKWIFGZVWLNHP-VAWYXSNFSA-N 423.513 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@H](C(C)C)C3)CC2)cc1 778297061 FXQKWZYCFRCYLP-IBDYFIJFSA-N 417.575 2.500 10 20 HECD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)c1 778919995 SJBASBRYZRFSAF-UHFFFAOYSA-N 414.458 2.284 10 20 HECD CC[C@@H](C)NC(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785412664 KQKLOXKSJXZDDY-LLVKDONJSA-N 412.489 2.326 10 20 HECD CCOc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 787213131 GKWQDEYHFDFTQS-UHFFFAOYSA-N 411.502 2.495 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cccc(N4CCCC4=O)c3)ccc21 788225788 RCHVMJLNKISCEI-UHFFFAOYSA-N 420.513 2.128 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@@H]12 788920966 SUKGUNGCHFEHJG-PKRADWSKSA-N 415.509 2.219 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 788932142 LUPBRZVSBVESOS-GOSISDBHSA-N 417.575 2.464 10 20 HECD CSCC[C@@H](NC(=O)c1cccc(O)c1O)C(=O)Nc1ccc2oc(O)nc2c1 790685922 ARYTVQKADLNMNS-GFCCVEGCSA-N 417.443 2.435 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)NC(=O)OC(C)(C)C 792038064 ITOPSLFXSKWOJP-AWEZNQCLSA-N 410.490 2.375 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3ccc(OC)cc3O)C2)c1 792975803 FQOWSZLIOPDQGG-HNNXBMFYSA-N 401.463 2.496 10 20 HECD COC(=O)CCN(C)S(=O)(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800149041 VNTIUXHMLYRUMS-CQSZACIVSA-N 417.959 2.406 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCOC[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 803298849 FMIBLDMIYCDIAZ-XMSQKQJNSA-N 423.513 2.301 10 20 HECD CN1C(=O)COc2cc(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)ccc21 804247212 ZKAZRDKOXQNIDP-UHFFFAOYSA-N 401.806 2.370 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN(C)[C@@H](C)C1 806040154 DWYGWJJJSWILMN-WFASDCNBSA-N 412.328 2.102 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1OC 807289303 PHBJBJMBCWWTSY-UHFFFAOYSA-N 409.486 2.355 10 20 HECD CN1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809866051 JFKGWDKQXJJPII-QUCCMNQESA-N 417.550 2.136 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H](F)C(F)(F)F 810192523 MVAZSDBPSAHOJB-OAHLLOKOSA-N 415.366 2.459 10 20 HECD CC[C@@H](CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)OC 811868105 WMWJJDKXZYAYIK-KRWDZBQOSA-N 416.501 2.167 10 20 HECD CCC(=O)N[C@H](CCSC)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968817 LIRSBGWENAQNGQ-LJQANCHMSA-N 407.580 2.159 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCN1C(=O)Cc1ccccc1 920291480 PTTBAAUWDULFSQ-JOCHJYFZSA-N 407.514 2.373 10 20 HECD C[C@H]1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778900724 FAYVXCKUBYUCHP-KXXRBXEXSA-N 417.506 2.057 10 20 HECD C/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831343801 JTFYAUBCTPCWQW-TWQVXDNOSA-N 423.604 2.433 10 20 HECD O=S(=O)(Nc1cccc(OCCn2cncn2)c1)c1cccc2nsnc12 47417355 PRORXTRZIJSLKR-UHFFFAOYSA-N 402.461 2.163 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3ccc(OC)c(OC)c3)nc12 51454290 MGJCENMHCQRVPC-UHFFFAOYSA-N 400.435 2.261 10 20 HECD C[C@@H]1NC(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)=NN(c2ccccc2)C1=O 109189897 FPWNULWKXAZSDN-SJORKVTESA-N 421.501 2.039 10 20 HECD Cn1c(=O)c2c(ncn2CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)n(C)c1=O 255329973 JFXNJVJPTBVIQT-UHFFFAOYSA-N 417.429 2.488 10 20 HECD CCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 303274236 GXIAVUGICWGVDV-IBGZPJMESA-N 422.570 2.285 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccco3)cc2F)CC1 730133536 XWWZNJHTPNNHSZ-SFHVURJKSA-N 418.513 2.211 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1O 737284479 NRUOFMVYUFCOEW-UHFFFAOYSA-N 411.458 2.200 10 20 HECD COc1cccc(CNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1O 743183014 FXWMLWSIHSDLTL-UHFFFAOYSA-N 416.459 2.312 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3sc(C)nc3C)CC2)cc1 743568428 WJBALDQDGOJMDU-UHFFFAOYSA-N 403.552 2.390 10 20 HECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 745340394 FWXHLPWWTKEINN-UHFFFAOYSA-N 416.449 2.453 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4n[nH]c(C)n4)cc3)CC2)cc1 746174677 OCKSRSCHYVNHOR-UHFFFAOYSA-N 420.517 2.341 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 748728941 WLZYNVNMWQNNCF-HXUWFJFHSA-N 423.513 2.303 10 20 HECD Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(S(N)(=O)=O)c1C 752808830 MWWUJCFHCPRUFC-UHFFFAOYSA-N 417.531 2.060 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)cc1 755126202 HFRVKRVXALMVTM-LJQANCHMSA-N 415.582 2.371 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC(OCCO)CC1 757641783 HWDAGCVGQHGYJE-UHFFFAOYSA-N 413.465 2.440 10 20 HECD C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 758348282 UACKTDGCHKPZPM-LRDDRELGSA-N 421.544 2.467 10 20 HECD CC(C)OC[C@H](CO)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 763876435 DYFUQURQQAPMEF-HNNXBMFYSA-N 410.470 2.118 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](O)c3cccc(OC)c3)cc2F)CC1 764997870 REPBPBWKRATYBX-NRFANRHFSA-N 401.482 2.326 10 20 HECD COC(=O)c1ncsc1S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 765115535 RYKQKUKNHMSICE-CYBMUJFWSA-N 412.489 2.005 10 20 HECD COC(=O)Cc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765904151 PFYSVGBWCWFROL-UHFFFAOYSA-N 421.247 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cc(OC)cc(C)n3)CC2)cc1 767622828 QCPXRGTVBIVOTL-GDLZYMKVSA-N 417.531 2.005 10 20 HECD COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 769026640 YQIXYMBUCMIODM-UHFFFAOYSA-N 422.529 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@H]4CC[C@H](C)O4)n3)CC2)cc1 771057978 QYJUYCNIEBFOPW-QFBILLFUSA-N 414.506 2.470 10 20 HECD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)O1 775453309 BDYJIZAVVZJTNB-LPHOPBHVSA-N 401.463 2.333 10 20 HECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3cccc(C)c3O)CC2)c1 775647687 YYJGVSCJIZERSK-UHFFFAOYSA-N 406.504 2.224 10 20 HECD COc1ccc(O)c(CN2CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2)c1 775665620 GJAGNVKQTUZWMD-OAHLLOKOSA-N 407.511 2.254 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)n1nnnc1C(C)(C)C 777860150 GDEFWLOAVQBOLC-HNNXBMFYSA-N 400.527 2.057 10 20 HECD CN(CC(=O)NC[C@@H](c1ccccc1)N(C)C)Cc1ccc(N2CCOCC2)cc1 781981484 VTBPJFXRJDBWRH-QHCPKHFHSA-N 410.562 2.374 10 20 HECD C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785433940 QAUVTDNRDVBNHD-IBGZPJMESA-N 408.546 2.492 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(F)cc3F)cc2)CC1 786121619 IRJBYKJRBQYZOZ-UHFFFAOYSA-N 423.485 2.253 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc(OC)c1OC 787323976 RADWMAINOOZLOE-HZPDHXFCSA-N 419.522 2.056 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cccc1N1CCNC1=O 787561047 ZFWNARBNDMPVSS-OAHLLOKOSA-N 409.490 2.407 10 20 HECD CCCCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(C)C 788314181 ZOUYEHSCDYYQGP-UXHICEINSA-N 417.550 2.239 10 20 HECD CCS[C@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319572 LXQBGDWEBIIKNL-IBGZPJMESA-N 405.564 2.274 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccoc3)cc2F)C[C@@H](C)O1 789815790 ACTCHORNGDRIBS-GASCZTMLSA-N 403.454 2.307 10 20 HECD C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864798 RRLUSZNJJMOYQG-INIZCTEOSA-N 413.543 2.309 10 20 HECD CN(C)S(=O)(=O)C[C@@H](NCc1cc(Br)ccc1O)C(F)(F)F 796453549 JTCGKPRXVVMSSN-LLVKDONJSA-N 405.236 2.067 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1 797109883 RDJSQSXJBBLGMC-GFCCVEGCSA-N 412.421 2.323 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C)[C@H](C)C3)cc2F)CC1 805006825 HLZNCDYMODHJCV-IAGOWNOFSA-N 404.530 2.088 10 20 HECD CCCCCNC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807675259 VQJAPZGEMZEQHE-KRWDZBQOSA-N 416.566 2.475 10 20 HECD CCC(=O)N1CC[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1 807840365 AKXWDXYAURDJAD-QGZVFWFLSA-N 401.507 2.181 10 20 HECD Cn1cc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)cn1 917722189 SJTQLTFLBCMGMO-GFCCVEGCSA-N 424.548 2.070 10 20 HECD CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 918444593 VRDZMSIKMHBSRN-UHFFFAOYSA-N 419.503 2.068 10 20 HECD O=C(CC1CCC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007189 DIZIJWHFQRACME-FQEVSTJZSA-N 408.882 2.385 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccco1 1805371038 JAPQGIVHRUPJCE-AUUYWEPGSA-N 408.414 2.114 10 20 HECD C[C@@H](CN)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708879 SBPATEJRWCAQIU-WPRPVWTQSA-N 424.910 2.028 10 20 HECD CN1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500553 OBANGIVSHARVRY-HNNXBMFYSA-N 407.898 2.053 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCCc3nc(C)no3)CC2)cc1 46786998 XEENTGHIVPRFMT-UHFFFAOYSA-N 401.511 2.038 10 20 HECD CCc1ccc(S(=O)(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 56966059 KJCMZTPLYKAMPL-UHFFFAOYSA-N 403.548 2.358 10 20 HECD Cc1noc(C2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)n1 64224187 CUCVWOBBMMAZBZ-UHFFFAOYSA-N 403.458 2.443 10 20 HECD O=C1C[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CN1CC(F)(F)F 97576263 GGTFXZSNELGVNL-LSDHHAIUSA-N 400.397 2.311 10 20 HECD Cc1ccc(C(=O)OCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)c(O)c1O 110005706 ZZMSMCQHLUSRAK-AWEZNQCLSA-N 421.471 2.224 10 20 HECD COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)NCc1c(C)c2ccccc2n1C 472239320 IGBBRVNNFXMXGU-RWQQGDIJSA-N 413.474 2.121 10 20 HECD Cc1c(CNC(=O)N2CCCC[C@@H]2CCNS(C)(=O)=O)n(C)c2ccccc12 472242397 SGHRAVZYUBSUPY-MRXNPFEDSA-N 406.552 2.490 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)n(C)c2ccccc12 472787832 NPVXSEMYDSMJKF-UHFFFAOYSA-N 402.458 2.381 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(CN(C)C)CC3)cc2F)C[C@@H](C)O1 727932155 WIDDSZSHCUFYHZ-HDICACEKSA-N 420.573 2.329 10 20 HECD CS(=O)(=O)NC[C@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1 728196320 OXUUUMYOMHNZLL-OAHLLOKOSA-N 418.515 2.090 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1 728982162 JFZZLJPTYBOGQS-NSHDSACASA-N 416.455 2.199 10 20 HECD COc1ccc(N2CCCN([C@@H]3CC(=O)N([C@H](C)c4cccnc4)C3=O)CC2)cc1 731218800 JSVCBTQLRLWPIL-DYESRHJHSA-N 408.502 2.491 10 20 HECD O=C(CN1C(=O)CCc2ccccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 732274101 KHLGWQQHDANATK-UHFFFAOYSA-N 411.477 2.382 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)CC(F)(F)F 732676770 GKPSYVHEEBTDLS-UHFFFAOYSA-N 402.461 2.189 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 734219956 CLRJYIXXNKCTCW-RTBURBONSA-N 402.539 2.312 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3sc(C)nc3C)CC2)cc1 742440300 ONWGOTSFYFGBSF-MHZLTWQESA-N 407.561 2.366 10 20 HECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)no1 743892500 GTHIRHFUFINKAV-UHFFFAOYSA-N 400.479 2.262 10 20 HECD C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 745779595 PAIIAISZLPPZIC-GHTZIAJQSA-N 404.555 2.336 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCOCC1 746413778 JKNFAMKMYNVJJF-ICSRJNTNSA-N 402.539 2.393 10 20 HECD COc1ccc(N2CCCN(C(=O)COC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 748032164 CFANPMCVFPAFPW-UHFFFAOYSA-N 419.522 2.370 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@H]3C(=O)Nc4ccccc43)CC2)cc1 748728939 YGSFUKLSWACNQJ-HXUWFJFHSA-N 408.502 2.059 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)cc1 751384669 FBKYTGMZYFKXQT-UHFFFAOYSA-N 402.426 2.295 10 20 HECD CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NCc3ccc(N(C)C)cc3)ccc2O1 751968417 OCAWUQSQAQRDFI-LJQANCHMSA-N 404.488 2.098 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)o1 754806137 RFZJYERCGBYMHT-OAHLLOKOSA-N 409.460 2.450 10 20 HECD CCC[C@@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 770299740 LSURPSVWRWNLNC-AVRDEDQJSA-N 402.539 2.225 10 20 HECD CN(CCc1cnccn1)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 771459688 FPJUKZXLPYVHDY-UHFFFAOYSA-N 400.438 2.365 10 20 HECD CCN(C(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1)c1ccccc1 771643015 HPYYZTKIUIYFAJ-UHFFFAOYSA-N 416.459 2.409 10 20 HECD CC(=O)Nc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772906354 LKTLZVYENMITFN-UHFFFAOYSA-N 400.454 2.349 10 20 HECD C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 773995345 UCYGWRIPURIDBZ-CQSZACIVSA-N 420.491 2.207 10 20 HECD COc1ccc(N2CCN(C(=O)CNC3(c4ccc5c(c4)OCO5)CC3)CC2)cc1 775552261 HGXFTHLBHYMXFC-UHFFFAOYSA-N 409.486 2.351 10 20 HECD CS[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@H]1N(C)C 776002088 RTQMVIRVSYDRSV-VQTJNVASSA-N 423.538 2.378 10 20 HECD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1 779473159 IZLVSHGQYBZHHR-VURMDHGXSA-N 416.499 2.261 10 20 HECD CCOC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 784703707 XXLCSVVPIMRSJE-CYBMUJFWSA-N 416.430 2.159 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1 785432326 ANAWOTNQHWBHQA-IRXDYDNUSA-N 418.538 2.321 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccc(F)c(Cl)c1 786958340 IQTTUCUEVHSOIP-UHFFFAOYSA-N 423.847 2.387 10 20 HECD Cc1occc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818702 KEHPYVZIRVILTF-OKILXGFUSA-N 403.454 2.273 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(-c4ncnn4C)c3)CC2)cc1 790133543 CIDQDIKCNJHHIH-HXUWFJFHSA-N 423.517 2.053 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cc1 790249839 SSJYATIXKMIPFU-LJQANCHMSA-N 424.549 2.066 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC(=O)N(C2CC2)C1 790461882 CYIIFQCDXNROTM-CYBMUJFWSA-N 403.438 2.053 10 20 HECD O=C(CCOCC(F)F)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 790487672 DDOPKPNFIUPNAF-UHFFFAOYSA-N 423.439 2.230 10 20 HECD Cc1cc(C(=O)COC(=O)C2(S(C)(=O)=O)CCOCC2)c(C)n1-c1ccccc1 796391658 ADKZSQZRXWDIBA-UHFFFAOYSA-N 419.499 2.414 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@H](C)N(C)C1CC1 804431554 UGWZSKIDKACKLL-LBPRGKRZSA-N 412.328 2.102 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](N3CCCC3)C2)cc1F 804853456 YGKXXLNRINHORU-SFHVURJKSA-N 404.530 2.375 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)C1CCN(C(=O)OC)CC1 807834818 OHDMXFNBFXRSCC-OAHLLOKOSA-N 405.495 2.114 10 20 HECD C[C@@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 808280502 LXMHAWMBDXSERX-LPHOPBHVSA-N 404.507 2.364 10 20 HECD CNC(=O)c1cccc(NC(=O)[C@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)c1 857758754 QSVHEFSKPIVDFO-KRWDZBQOSA-N 410.518 2.342 10 20 HECD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccnc1 1793324013 OIJRKEBRVFSTCD-MHEUCROKSA-N 418.881 2.461 10 20 HECD COc1cc(C)c(C)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250737 JKNVHAIYMHUWGN-UHFFFAOYSA-N 411.458 2.249 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441757 OQJWWTSGLJAGBS-WMZOPIPTSA-N 408.502 2.419 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccoc2)=NN1c1ccccc1 1848119740 RJVSYMQPCUQNSO-ZBWOGFRMSA-N 418.453 2.288 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)O[C@@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1 7176669 AJJKYXPTXNNIRG-LPHOPBHVSA-N 418.515 2.285 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)n(C)c2ccccc12 472813772 UDDNSVFURXEAND-HNNXBMFYSA-N 409.490 2.369 10 20 HECD CS(=O)(=O)Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1F 532346947 CSXHTHLHUXZAJA-UHFFFAOYSA-N 401.466 2.176 10 20 HECD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 728518276 DZOVQDGVTUYOOG-NRFANRHFSA-N 414.550 2.199 10 20 HECD CN(CCN(C)c1ccccc1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 730808671 RJVPEAQBBNWRLO-UHFFFAOYSA-N 414.525 2.347 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 732592299 FTCWEVKBTIJXSA-MRXNPFEDSA-N 414.428 2.126 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cccc(F)c4F)CC3)nc12 734487043 RWBBVAPKGSYOPU-UHFFFAOYSA-N 417.416 2.212 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1O 737286330 VDGZSJDPLBHMHF-UHFFFAOYSA-N 414.458 2.461 10 20 HECD Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc4c(c3)CCCN4C)C2=O)cc1 746879913 JCYINNDQBKCGNZ-DEOSSOPVSA-N 420.513 2.461 10 20 HECD CCCCCC(=O)NC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 748344151 WVOGETNMCPLMTD-UHFFFAOYSA-N 411.524 2.065 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3[C@H]4CC[C@H]3CC(=O)NC4)cc2F)C[C@@H](C)O1 748616336 ASJOAKFHTPPQJJ-FSDCSDTHSA-N 404.486 2.002 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H](CCO)c3ccccc3)CC2)cc1 754052808 ZRGWJQUSCCLQGR-VWNXMTODSA-N 413.562 2.234 10 20 HECD O=c1[nH]c2ccc(S(=O)(=O)Nc3cc(Cl)c(O)c(Cl)c3)cc2[nH]c1=O 758163255 PIHFTQAMTZMFIF-UHFFFAOYSA-N 402.215 2.030 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)[C@@H]4Cc5ccccc5CN4C3=O)cc2)C1 761117164 DMYXLYHUIJKBEE-FPOVZHCZSA-N 418.497 2.277 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)CN(Cc4ccc(F)cc4)C3=O)cc2)C1 761123836 PJPNNDAVZHNFGP-GOSISDBHSA-N 424.476 2.492 10 20 HECD COc1ccccc1SCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 763945995 QEGNEYXBZDMJCF-UHFFFAOYSA-N 420.556 2.339 10 20 HECD CC[C@@]1(c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)CCC(=O)NC1=O 765060595 JFIUWYUSHUJZJE-IBGZPJMESA-N 414.443 2.108 10 20 HECD CN(C)CCOc1ccccc1N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768444896 DBWIBWWTISOGKA-OAQYLSRUSA-N 413.518 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cn5ccccc5n4)n3)CC2)cc1 771064610 DNURLUMFAUCYDG-UHFFFAOYSA-N 418.457 2.284 10 20 HECD O=C1NC(=O)C2(CCC(N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)N1 776222295 FBNXVYRHSAQAND-LQZXRHCMSA-N 408.449 2.367 10 20 HECD CCn1nc(C)c(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 778287663 CKTNXHWVIWEQHP-ZHACJKMWSA-N 411.506 2.372 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1 779515506 TURUBUFEEZLMET-CSKARUKUSA-N 421.497 2.235 10 20 HECD CC[C@@H]1C[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780142214 LRBQCGBOZXCUQU-DLBZAZTESA-N 408.470 2.027 10 20 HECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)C2CN(C(=O)C3CCCC3)C2)cc1 781525286 YAGQSSCHBFVNMN-UHFFFAOYSA-N 405.564 2.448 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3cncs3)cc2F)C[C@H](C)O1 782360642 XDNNCTRRSCGBMJ-KBPBESRZSA-N 421.494 2.298 10 20 HECD CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312730 LMCCCLZIJZIPMP-UYAOXDASSA-N 417.550 2.097 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](Cc2ccccc2)C1 788314111 YGDBANDPPJGJBT-OAQYLSRUSA-N 407.514 2.231 10 20 HECD CCN(CCCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788314324 UVBRYGRYHGEEDZ-FQEVSTJZSA-N 415.582 2.406 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1 788949859 AYXOYDHIKLCVBT-DYESRHJHSA-N 422.529 2.459 10 20 HECD COc1ccc(CNC(=O)C(=O)N2CCc3ccc(Br)cc32)c(O)c1 797390263 BTMCFJSUOXDTFW-UHFFFAOYSA-N 405.248 2.369 10 20 HECD Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 797639554 FWONCWFEBNGLRN-CYBMUJFWSA-N 409.446 2.444 10 20 HECD C[C@H]1CN(c2ccccc2F)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662836 HKXNUDVULUVPSX-HNNXBMFYSA-N 416.472 2.384 10 20 HECD Cc1nc(C)c(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 805261610 HQBZMLULDRGMHW-KRWDZBQOSA-N 417.531 2.332 10 20 HECD COCCn1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)c(=O)cc1C 806506388 RKEBHSDYJYSRBF-UHFFFAOYSA-N 401.532 2.286 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809527183 YZKPXPNYPRIFJV-RDTXWAMCSA-N 415.490 2.425 10 20 HECD CC[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)OCCc2ccccc21 811589139 GSDBZPRQWODNKK-FQEVSTJZSA-N 404.488 2.372 10 20 HECD CC[C@H](C)[C@@H](NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C)C(=O)OC 914905471 IKIPMCGIRCEFJY-ORAYPTAESA-N 401.463 2.350 10 20 HECD CN(C)Cc1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918008998 YYUCHLVTQUSQCP-NRFANRHFSA-N 423.561 2.449 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3C(=O)NC3CC3)cc2F)C[C@@H](C)O1 918220165 HJHKCGJHSWQPIY-SXGZJXTBSA-N 418.513 2.392 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccccc2C)c1C 919154518 LUNGGKLLNFXBGP-UHFFFAOYSA-N 407.488 2.190 10 20 HECD CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc1 1319715557 UBGUKGOZXOZCGS-AWEZNQCLSA-N 402.520 2.395 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccco1)c1cc(O)c(O)c(Cl)c1 1792596702 UPYDNZUZGBRBNK-SJBDTSRBSA-N 420.849 2.330 10 20 HECD COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1F 1803995611 XZJYVZZGIDLGRQ-BTTYYORXSA-N 415.421 2.206 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCc2ccco2)C1 1842069896 RXMZWPFSVYOPGY-UHFFFAOYSA-N 420.469 2.209 10 20 HECD Cc1cc(C(=O)COC(=O)c2cccn2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 4246888 VGJULLYXEJEASQ-UHFFFAOYSA-N 415.471 2.120 10 20 HECD COc1ccc(OC)c(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 559596357 LVXADKHIURQNID-UHFFFAOYSA-N 409.486 2.479 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(Br)cn3)CC2)cc1 727375707 LFAPVZKTCCDALS-UHFFFAOYSA-N 419.323 2.405 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)CNC2=O)c(C)n1-c1ccc(Br)cc1 733271484 ZNXIBBBBYOYKJI-UHFFFAOYSA-N 419.279 2.138 10 20 HECD COc1cc(Br)cc(CN[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1O 742390979 XYHNUULNAMPKOS-IINYFYTJSA-N 409.284 2.180 10 20 HECD Cc1cc(NC(=O)NCc2c(O)ccc3c2CCCC3)n([C@H]2CCS(=O)(=O)C2)n1 743080223 DEGHTOSENWDKES-HNNXBMFYSA-N 418.519 2.457 10 20 HECD COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccc(C)c(O)c1O)CC2 750618604 IPRZSYFLLTUEBD-UHFFFAOYSA-N 401.415 2.165 10 20 HECD COc1ccc(N2CCN(CC(=O)NCCOc3cccc(F)c3)CC2)cc1F 753858673 ZRNQYFNOUQWXAI-UHFFFAOYSA-N 405.445 2.291 10 20 HECD CC[C@H](C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 754678243 ALEDWXDVBXAXQS-CMBDLQSPSA-N 423.529 2.233 10 20 HECD CC[C@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCCO1 756106302 YXZGWDKJKMNJGN-SFTDATJTSA-N 404.555 2.464 10 20 HECD O=S1(=O)CCC(O)(CN(Cc2cccs2)c2ccc3c(c2)OCCO3)CC1 757664109 XQEQFHHRDHQHEQ-UHFFFAOYSA-N 409.529 2.466 10 20 HECD O=C(COC(=O)CSc1ccncc1)NCc1ccc(N2CCOCC2)c(F)c1 759604279 BANBIOKBOXNSOV-UHFFFAOYSA-N 419.478 2.009 10 20 HECD CC(=O)N(C)CCc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 762254477 HSVHOWDPJYVDMQ-UHFFFAOYSA-N 422.488 2.325 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(N2CCOCC2)cn1 772406986 OWOGCDNTOWALRI-UHFFFAOYSA-N 415.469 2.216 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)c1 775371497 YTZVBEZIQVQFBW-GOEBONIOSA-N 410.536 2.010 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC4(CC3)NC(=O)N(C)C4=O)cc2)CC1 775430496 GJIQHTUPHBPREZ-UHFFFAOYSA-N 413.522 2.149 10 20 HECD C[C@H]1C[C@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 776306259 NBRGXQVBIHJANR-FUHWJXTLSA-N 413.497 2.374 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@H](C)[C@@H]3C)CC2)cc1 778285958 RRGDIHNCJSMXGA-IBHATUTGSA-N 403.548 2.252 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(CC(C)C)c3)CC2)cc1 778295710 SBWHRDSRLVSUHJ-HJWRWDBZSA-N 411.506 2.391 10 20 HECD CC(=O)c1cc(F)cc(CN2CCOC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1O 779844705 QOCYOAMVHYIYKS-MRXNPFEDSA-N 401.398 2.091 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785433193 JTYVWOOKIGNIQL-UHFFFAOYSA-N 410.518 2.116 10 20 HECD CN1CCC(n2ccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)n2)CC1 787453174 KGWZIKKMMPTWCV-UHFFFAOYSA-N 410.522 2.005 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C(C)(C)C)s2)ccc1O 790406808 HOTPWCSKDCRSNP-UHFFFAOYSA-N 404.535 2.460 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H]3[C@H]3CCCO3)CC2)cc1 790699598 XMLVTEKPLKQKFF-LEWJYISDSA-N 402.539 2.170 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCN(CC(F)(F)F)C1 792207037 PVTXZVYYIWTSRK-AWEZNQCLSA-N 403.420 2.287 10 20 HECD COC(=O)c1c(NC(=O)C(=O)NCc2ccc(OC)cc2O)sc2c1CCCC2 797390639 LDCJVWOQIWHLRA-UHFFFAOYSA-N 418.471 2.383 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 797710013 PUILLACDUXRJMQ-ZLHSVIROSA-N 423.485 2.118 10 20 HECD COc1cc(N2CCN(CCCN3CCN(C(C)C)CC3)CC2)cc(OC)c1OC 800372331 IGYGJEUWJRGQJM-UHFFFAOYSA-N 420.598 2.251 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(C)[C@@H]3c3ccccc3)ccc21 803686562 DTISPHLEUDPNJA-IFMALSPDSA-N 406.530 2.247 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2CCCC2)cc1F 804853067 SEMPIFLPYKVFGP-GOSISDBHSA-N 404.530 2.375 10 20 HECD C[C@H](OC(=O)[C@@](C)(O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 805581642 ZLYKKLGBZVEGJZ-MYODQAERSA-N 407.422 2.493 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOC[C@H]3[C@H]3CCCO3)cc2F)CC1 806749835 GHHMUOFQBIPXBR-LEWJYISDSA-N 420.529 2.057 10 20 HECD Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290583 ZBPQDMKYEBTJRP-VCSGRIEYSA-N 419.529 2.350 10 20 HECD COc1cc(O)c(CN2CCC(C(=O)NCCCN3CCCC3)CC2)cc1OC 809732078 BRTNIYOITCSVDM-UHFFFAOYSA-N 405.539 2.224 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CO)C3CCCC3)cc2F)C[C@@H](C)O1 810114650 GHNYXWCOCGWOQF-GQIGUUNPSA-N 407.530 2.196 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(CNC(C)=O)s3)CC2)cc1 917927341 USCYXEFCGBKKNB-UHFFFAOYSA-N 423.560 2.294 10 20 HECD Cc1ccc(CCS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1327055571 JWCADOPTDFZZIC-HXUWFJFHSA-N 415.559 2.359 10 20 HECD C/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831338201 FVMKHMOCELUIAC-IJJSQOHJSA-N 409.577 2.043 10 20 HECD Cc1ccc(OCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847393607 NTNNCSBYHYHQIX-ROUUACIJSA-N 411.458 2.086 10 20 HECD Cc1cccc2c(=O)n(CCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cnc12 117528525 HZYPMQSFVXGMMH-UHFFFAOYSA-N 424.476 2.387 10 20 HECD CN(Cc1ccccc1)C(=O)CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 195550359 VPLWYYZGHSSAAZ-UHFFFAOYSA-N 410.518 2.323 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCN3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 726102807 YNHHBXGWPGNXHS-IAGOWNOFSA-N 422.545 2.349 10 20 HECD CCCOc1cccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 727176955 UMLQVAAUABBRJH-SDNWHVSQSA-N 400.547 2.226 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1 729064435 RATUDAKUOFPKIA-SNVBAGLBSA-N 401.394 2.241 10 20 HECD COC(=O)CN(CC(=O)N1CC(=O)Nc2ccccc21)Cc1cc(Cl)ccc1O 731844409 AGZXCXKIRUKKQY-UHFFFAOYSA-N 417.849 2.006 10 20 HECD C=CC(=O)NCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 732102044 PFTXAMDUMDCOHN-ACCUITESSA-N 409.558 2.148 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@H]1C1OCCO1 732449094 LWPCCGUWRLMTDA-IBGZPJMESA-N 407.486 2.224 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1 734072570 HPGUDNGJNJZGTQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1 735824189 ZCFKZITVFJNZPC-HXUWFJFHSA-N 424.545 2.065 10 20 HECD CCc1nncn1CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 743699811 MXJODVAHZODXKI-UHFFFAOYSA-N 408.453 2.410 10 20 HECD CS(=O)(=O)NCCc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)s1 743719326 YDIQJOIMXOFDNF-UHFFFAOYSA-N 408.545 2.354 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC4(CCOCC4)C3)CC2)cc1 745352212 XLPQTWVKWWMEGE-UHFFFAOYSA-N 416.566 2.419 10 20 HECD COc1ccccc1C1(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1 749172638 PBLHRNTWZPCQEO-UHFFFAOYSA-N 414.527 2.278 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1)CNC(=O)OC(C)(C)C 749789283 CNYIMZNTLIBJAR-MRXNPFEDSA-N 406.527 2.483 10 20 HECD CCNc1scnc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 754525887 MXABDDIEKUPSNG-UHFFFAOYSA-N 422.482 2.024 10 20 HECD CCN1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 754749761 UOIQWZYVPKHLTH-SDNWHVSQSA-N 423.585 2.420 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(OCCO)CC1 757653710 HFHYMWRJEPSDGP-HNNXBMFYSA-N 413.465 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@@H](C)CC3)CC2)cc1 757662908 JIXDIOCEOBOVLY-OZSKJFCKSA-N 403.548 2.254 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(C)ccc3[N+](=O)[O-])CC2)cc1 758226736 ZGQANYTVODVFAG-SFHVURJKSA-N 401.463 2.474 10 20 HECD COc1cc(N2CCN(Cc3cc(=O)n4ccsc4n3)CC2)cc(OC)c1OC 759879419 VIAUHGBBZSABNE-UHFFFAOYSA-N 416.503 2.104 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)CC2)cc1 760910229 UHPRCKYIYURCFB-BHDDXSALSA-N 416.566 2.464 10 20 HECD COc1cc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)c([N+](=O)[O-])cc1F 766204388 YXHLXCIRRBHIFA-UHFFFAOYSA-N 414.367 2.177 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cc(C)ccc3O)CC2)cc1 769380404 VVYHTFJIDBXEAV-UHFFFAOYSA-N 403.548 2.105 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccnn2CCc2ccccc2)c1 769743137 YEWXQEYNMOUCAX-UHFFFAOYSA-N 400.460 2.455 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 773749161 PJPDBXXULANVCU-DGCLKSJQSA-N 419.459 2.420 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 779223049 ZQOAECXPKBGTGP-KJXAQDMKSA-N 405.583 2.314 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cn(CCOC)nc3C)cc2F)CC1 782552872 KZYHRULVNICZEV-UHFFFAOYSA-N 403.502 2.049 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CN(C)C(=O)c4ccccc43)cc2F)CC1 783323170 ZLFYVWDLRZJXGB-FQEVSTJZSA-N 424.520 2.453 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1 784108241 GTWYRACTVAZWPC-UHFFFAOYSA-N 405.462 2.406 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2cc(C(=O)OC)ccc2C)cc1 784564628 NFFFJYDIGWHUQO-UHFFFAOYSA-N 400.431 2.408 10 20 HECD CC(C)CO[C@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785433183 JRPWZQWNCPMNQC-OAHLLOKOSA-N 417.510 2.144 10 20 HECD Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786224933 MWQUZTLWTCKCPT-IBGZPJMESA-N 415.509 2.498 10 20 HECD COCn1nc(C)c(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1C 788600614 XZAWEUCZVRRGDE-UHFFFAOYSA-N 408.524 2.013 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1F 789661743 RKPIHLYTKVZFRJ-IBGZPJMESA-N 412.509 2.289 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2ncccn2)C1 790256028 WXYFUTGNDWXTJM-GOSISDBHSA-N 411.506 2.096 10 20 HECD COCCOC1CCC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793133206 RLKMRJOIMCBZKD-OBXNSHGQSA-N 417.550 2.226 10 20 HECD CCOc1cccc(CN[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1O 793245944 FDVMSOCTKWTCJW-IBGZPJMESA-N 401.511 2.101 10 20 HECD Cc1cc(C(=O)Nc2cccc(NC(=O)NCC(N)=O)c2)c(C)n1-c1ccccn1 798056466 YFLWUPDVQZCQDH-UHFFFAOYSA-N 406.446 2.348 10 20 HECD Cc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(Cl)n1 800835271 ULUFQPNJBHNSNR-UHFFFAOYSA-N 415.924 2.079 10 20 HECD COCCOc1cncc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 801163656 XZGYZLXNWUKCNE-UHFFFAOYSA-N 403.454 2.137 10 20 HECD CC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803301814 ZFONRDSATMQZFG-YOEHRIQHSA-N 402.520 2.424 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2nc(C(F)(F)F)cs2)cc1F 803662748 MNUSRWBHAHUHOX-UHFFFAOYSA-N 418.416 2.342 10 20 HECD CC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803677536 QJBASIVOQKLQLW-UHFFFAOYSA-N 414.550 2.153 10 20 HECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2)ncn1 806270063 OSQOPWZCLICICV-VQIMIIECSA-N 424.549 2.067 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1nccn1CC(F)(F)F)c1ccc(N(C)C)cc1 807673651 XGQOWEPDBDTCBB-ZDUSSCGKSA-N 411.428 2.347 10 20 HECD COc1cc(/C=C2/SC(=S)N(CC(N)=O)C2=O)cc(OC)c1OCC(F)F 809144024 AWRYWFPFVDJLDT-VZUCSPMQSA-N 418.443 2.034 10 20 HECD COc1cc(O)c(CNCCNS(=O)(=O)c2ccc(Cl)cc2C)cc1OC 809714141 ZUONBXXYXDQOAY-UHFFFAOYSA-N 414.911 2.439 10 20 HECD NC(=O)COc1cccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)c1 916254621 KARNJNOJUZUMBG-UHFFFAOYSA-N 400.504 2.426 10 20 HECD CC(=O)Nc1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 917833879 USJGCNUCAKYENQ-IBGZPJMESA-N 408.502 2.206 10 20 HECD CCC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918308597 NFLKHMLBLDMHRZ-UHFFFAOYSA-N 424.501 2.469 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)n1cnc2ccccc21 918337012 AZGRPOLCMDDVFS-INIZCTEOSA-N 412.515 2.149 10 20 HECD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920881672 KJTZAXTVZAXOBY-FXAWDEMLSA-N 423.579 2.295 10 20 HECD CN1CCN(c2ccc(CN3CC[C@@H](C(=O)NCC(F)(F)F)C3)cc2F)CC1 1320485337 CBTFGGNVVNADMT-OAHLLOKOSA-N 402.436 2.078 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC[C@@H](CO)CC1CCOCC1 1343835637 MHWUNJSZYHGWSS-IBGZPJMESA-N 407.580 2.464 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)Cn3cncn3)C2)cc1 1843081592 HCFAAJUQPIPXOB-UHFFFAOYSA-N 418.501 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1 3555556 WCOSBGMUKCTBRG-UHFFFAOYSA-N 413.430 2.417 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4nccnc4c3)CC2)cc1 5279715 LLOOFVGMXDFECK-UHFFFAOYSA-N 406.442 2.144 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3ccc4c(c3)CCC4)C2=O)cc1 7095594 FJNNRIFPOYPBCB-DEOSSOPVSA-N 420.513 2.325 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3ccncc3)CC2)c1 732473515 WXEOKPHZLMDNOX-UHFFFAOYSA-N 410.518 2.144 10 20 HECD O=C(Cc1ccccc1OC(F)F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 735651757 RWSCMGHKCHAKOH-UHFFFAOYSA-N 424.469 2.382 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C(C)C)on3)cc2F)CC1 743905581 AHPFTYWLJATCMA-UHFFFAOYSA-N 417.485 2.334 10 20 HECD CCc1cccc2c1N(C(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 746990086 MZQPBAFRSXGLSM-UHFFFAOYSA-N 411.477 2.430 10 20 HECD CCc1ncsc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 747477087 PXHHWTQGEIHISR-UHFFFAOYSA-N 406.483 2.061 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)CC2)cc1 749634165 VRFSBOOYCCZZGD-UHFFFAOYSA-N 422.485 2.257 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H]([C@@H]4CCOC4)C3)cc2F)C[C@@H](C)O1 750262605 RFQIZQHXMURZIZ-IZBJGVDFSA-N 419.541 2.414 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 751212353 AZAUTCUPKORQFV-UHFFFAOYSA-N 410.517 2.039 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)c1 751318029 KHQXLPAUDYJDBG-AWEZNQCLSA-N 420.487 2.402 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCc4occc4C3)CC2)cc1 752920864 VFCRPDXYBWNSMW-CMDGGOBGSA-N 409.486 2.468 10 20 HECD C[C@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(Br)c(F)cc1O 756562751 JRAXCGPXZJLGBB-NSHDSACASA-N 402.308 2.497 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc(C(=O)O)c1C 761259136 HAPQWEBIJHKNBH-UHFFFAOYSA-N 404.488 2.317 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(Br)cc1-n1cncn1 762275026 LMDCWMPBOZGGES-UHFFFAOYSA-N 403.236 2.414 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)cc2F)CC1 777240406 BRZKSMJHARGJNK-MRXNPFEDSA-N 421.561 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3nc(C)c(C)s3)CC2)cc1 778294394 LSBWZNPXVJSXKA-HJWRWDBZSA-N 414.531 2.290 10 20 HECD O=C(Cn1cnc(NCc2ccc(N3CCOCC3)cc2)n1)NCc1ccccc1 783636944 ZNYRAPQVSIWMEV-UHFFFAOYSA-N 406.490 2.043 10 20 HECD COCCn1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 784067891 WZIXSEHIPAANST-UHFFFAOYSA-N 412.412 2.315 10 20 HECD CCc1nn(C)c(Cl)c1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786659815 QOINBGFNOFLCJK-UHFFFAOYSA-N 403.914 2.234 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCCN3C3CCCC3)nc12 786880356 INNTZBIGGXYTNS-MRXNPFEDSA-N 402.451 2.062 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCCc3nc(C4CC4)no3)cc2)CC1 787320463 VQDYBMXBHFBYDI-UHFFFAOYSA-N 411.506 2.255 10 20 HECD Cc1cc(C(=O)N2CCN(c3cnc(O)nc3N)CC2)c(C)n1-c1ccc(F)cc1 787914342 XORGHLYLDZLQEC-UHFFFAOYSA-N 410.453 2.273 10 20 HECD CSCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819137 LYHVZEHZOOMYLB-GASCZTMLSA-N 411.543 2.315 10 20 HECD COc1ccc(CNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c(O)c1 794373805 MGJYUJAGDPSPIP-CQSZACIVSA-N 407.492 2.010 10 20 HECD COc1cc(Br)cc(CNC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1O 796480349 CZNZWAVINUWCNG-FZMZJTMJSA-N 421.357 2.361 10 20 HECD COc1cc(N2CCN(C(=O)c3cc(F)cc4nn[nH]c34)CC2)cc(OC)c1OC 800535382 AOOYGSYSALOPEM-UHFFFAOYSA-N 415.425 2.085 10 20 HECD CCCCN1CCC(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803308931 MZPIBJDRLFPQKQ-GOSISDBHSA-N 416.566 2.081 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 803317068 QPOXRPFBFWPHEF-HNNXBMFYSA-N 417.456 2.338 10 20 HECD CN1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)[C@H]1c1ccccc1 806276334 NBBIYRSXKDJTST-HZPDHXFCSA-N 404.561 2.303 10 20 HECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807677204 MRDCRDLMANLWAY-JKSUJKDBSA-N 418.538 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@H]4CCC(=O)[C@@H]4C)n3)CC2)cc1 809464991 OGYVOGMFZQYRHW-HZPDHXFCSA-N 412.490 2.127 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc4c3CCCC4)cc2F)C[C@@H](C)O1 816890959 DBJXSYSKXIVJBY-HUUCEWRRSA-N 401.486 2.226 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3cn4ccccc4n3)cc2)C1 918006247 TWPXIAIRISVGCB-SFHVURJKSA-N 420.517 2.078 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 918219908 QRKCBOPDNYBAQF-INIZCTEOSA-N 407.486 2.272 10 20 HECD COc1cc([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(OC)c1OC 919815607 PKTPJAXILODSJX-LLVKDONJSA-N 424.475 2.281 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccn(-c2ccncc2)n1 1320807706 ILWNJURDSUDBGC-UHFFFAOYSA-N 400.822 2.442 10 20 HECD O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=S=c2cc(Br)ccc2=C1 1442721149 LNXNOKFABXCOLL-UHFFFAOYSA-N 400.261 2.218 10 20 HECD CCc1ncsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601460 KTTONMVOCKMNGO-CLLJXQQHSA-N 402.476 2.077 10 20 HECD CC[C@H](O)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1805375962 MLZNDHGLMPLPPS-HNNXBMFYSA-N 410.898 2.367 10 20 HECD Cc1cc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc2s1 1843250713 GZWNOBUMIWEFFW-UHFFFAOYSA-N 412.471 2.475 10 20 HECD O=C(C1CC(F)(F)C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035052 RIWWUWCFLCNQKF-HWKANZROSA-N 408.401 2.065 10 20 HECD COc1ccc(-c2noc(CN3CCN(C(=O)Cc4ccc(N)cc4)CC3)n2)cc1 237442800 KAXQVKHZUZJJDS-UHFFFAOYSA-N 407.474 2.214 10 20 HECD C[C@H](NC(=O)N1CCC(N2CCCC2=O)CC1)c1ccc(N2CCOCC2)cc1 729602558 NIMHNRCLLCPLDJ-KRWDZBQOSA-N 400.523 2.381 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3[nH]cc4c(=O)ncnc3-4)c2C)c1 730658305 SUTPILPPFWRVRZ-UHFFFAOYSA-N 419.441 2.213 10 20 HECD COC(=O)CN(CCN1CCOCC1)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 731882051 OOCNAGYTKXKOQY-UHFFFAOYSA-N 417.481 2.181 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCN(Cc2ccco2)CC1 732202412 PIKANWDLXVLJIG-NRFANRHFSA-N 413.518 2.311 10 20 HECD C[C@H]1CC(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 742096295 VUJZEHMYHVGPHG-SEVUAYLXSA-N 423.585 2.467 10 20 HECD COCCN(CC(=O)NC(=O)NCc1cccs1)c1ccc(OC)c(OC)c1 746475500 VEZOSBYIECKLRY-UHFFFAOYSA-N 407.492 2.244 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)c3c(C)nn(C)c3C)CC2)cc1 746819461 WTAAREOMNARCSM-KRWDZBQOSA-N 413.566 2.478 10 20 HECD CNS(=O)(=O)[C@H]1CCN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 749805458 DDHMIRILRPZTIS-IBGZPJMESA-N 408.568 2.289 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)o1 751306277 RHRFFIFTIDTBRY-UHFFFAOYSA-N 411.443 2.492 10 20 HECD Cn1nnc2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cnc21 754247924 XBVLOWXIHOLOOI-UHFFFAOYSA-N 402.405 2.364 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)C1 756326927 LSADWMYEIUOXNU-RTBURBONSA-N 404.507 2.175 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc([N+](=O)[O-])ccc1O 756573495 KEWPEKMROZOJNW-AWEZNQCLSA-N 405.476 2.386 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1 759034383 YPBPIBKAHVMACD-AWEZNQCLSA-N 409.446 2.051 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCCc3ccc(O)c(O)c3)cc(C3CC3)nc21 762263252 DAHOMJOIKMKMHC-UHFFFAOYSA-N 424.457 2.168 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1 763223201 LAYZPNZUFSQHCC-OAHLLOKOSA-N 402.831 2.020 10 20 HECD CCOC1CC(CNC(=O)NCc2ccc(N(C)C)cc2C)(N2CCOCC2)C1 767888462 UIXVMFJEGNZOMY-UHFFFAOYSA-N 404.555 2.130 10 20 HECD COc1ccc(CN2CC[C@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)cc1 775020512 GWGVWWXUAZCQER-INIZCTEOSA-N 401.419 2.208 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1Br 776839315 NGPOWYZCOPPNTK-MRVPVSSYSA-N 413.188 2.317 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)n([C@H](C)C4CC4)n3)nc12 777188217 SZICUIYHHZESIX-GFCCVEGCSA-N 413.434 2.445 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](OCC(C)C)C3)CC2)cc1 778323878 LGELYGFWJXOZFY-HEDKFQSOSA-N 415.534 2.174 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1C(=O)NC(C)C 785296259 MXZKFDCZLIVFOE-CQSZACIVSA-N 413.474 2.230 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3nc(-c4ccoc4)no3)cc2)CC1 786261314 AQABVJVQLAILQE-UHFFFAOYSA-N 423.473 2.247 10 20 HECD COc1ccc(F)cc1[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788311215 RWVMRJFXMVPLNM-HNNXBMFYSA-N 415.465 2.165 10 20 HECD CC1(C)CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793734969 WERFJPZWAYCPAG-ROUUACIJSA-N 414.550 2.090 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 804269035 SVGKDQPGMBDUAY-MAUKXSAKSA-N 418.538 2.446 10 20 HECD CSCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 807053186 KUSMKAQXNDGCDG-QGZVFWFLSA-N 418.607 2.093 10 20 HECD CC[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769419 UHEXUBVEIDLGJN-HOCLYGCPSA-N 411.449 2.010 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)cc3)cc2)C1 813419940 GXXHFMRVHBYMII-LPHOPBHVSA-N 401.894 2.392 10 20 HECD Cn1cnnc1C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918221593 YXVWNOXAMLNPOS-UHFFFAOYSA-N 416.501 2.005 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1-n1cccn1 918337006 ASGVMQRTXDCAMO-UHFFFAOYSA-N 410.499 2.037 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)C2CCCCC2)CC1 921193565 ZSZZRGURWXBXGU-UHFFFAOYSA-N 400.567 2.436 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(O)(Cc3ccccc3F)CC2)c1 1256146931 FBXHCKUADRVDRH-UHFFFAOYSA-N 422.478 2.113 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)C1 1317954362 LLYXFESNURJFPE-RCDGMEKDSA-N 411.546 2.336 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSCc1csc(C)n1 1320691535 ASJMASVRGPKEAU-AWEZNQCLSA-N 410.517 2.387 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1nccs1 1804285784 SRCIOUFCUFNPAR-LJWNITHASA-N 415.471 2.225 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cc(F)c[nH]1 1804291702 VFAGZBCVJIVATQ-BPQKRJORSA-N 415.421 2.236 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807764072 SPGKSGDBRSMFEN-UUIGLSAGSA-N 410.474 2.254 10 20 HECD Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cn1C 1810551869 MTSKFIAUZAZVTI-UHFFFAOYSA-N 412.490 2.298 10 20 HECD Cn1cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426855 KVDXSZIDTXIBIL-KRWDZBQOSA-N 412.490 2.378 10 20 HECD COc1cc2c(cc1NCCn1cnc3c1c(=O)n(C)c(=O)n3C)oc1ccccc12 24869948 AEMMLHQAMWQZKZ-UHFFFAOYSA-N 419.441 2.454 10 20 HECD CC(C)CC(=O)N1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 140950702 JMOUTZLDISHBBT-GOSISDBHSA-N 402.539 2.484 10 20 HECD COc1cccc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1O 727760941 FEPJNZDVWRTANL-ULQDDVLXSA-N 400.475 2.383 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3c(C)nc4c(c(O)nn4C)c3C)CC2)cc1 729283490 SNNNKSIHCPAJQH-UHFFFAOYSA-N 409.490 2.191 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C(C)C)N3CCCCC3)CC2)cc1 729348387 WBJSGCYHTQGQMB-JOCHJYFZSA-N 402.583 2.444 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3cccc(F)c3)CC2)cc1 742948049 LPUJEUFWQFVRGU-UHFFFAOYSA-N 400.498 2.498 10 20 HECD CCN(CC(=O)NN1C(=O)N[C@](C)(CCc2ccccc2)C1=O)c1ccc(OC)cc1 746109518 RVPCEAWWFWVOIR-HSZRJFAPSA-N 424.501 2.496 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccnc3Br)cc2)C1 758176734 TVUBLNOWJVGPGI-AWEZNQCLSA-N 417.307 2.476 10 20 HECD COc1cccc(OC)c1OCc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762333046 VRTOSSRYMBIRCZ-UHFFFAOYSA-N 421.431 2.410 10 20 HECD C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)c1ccc(N2CCOCC2)cc1 765136301 LGANQWTVZIXXSU-LPHOPBHVSA-N 419.522 2.336 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1 768146825 UUYSXESXDZAEGN-LBPRGKRZSA-N 422.445 2.070 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1nccn2c(Br)cnc12 769722345 MXMKXCMTXBAMIF-UHFFFAOYSA-N 416.279 2.258 10 20 HECD CN1CCN(c2ccc([C@H]3NC(=O)c4cc(N5CCOCC5)ccc4N3)cc2)CC1 771522006 YHWRJMKRSIZEEG-JOCHJYFZSA-N 407.518 2.129 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(Cc2ccccc2)n1 772274764 FGUQPIHRASHRPK-UHFFFAOYSA-N 424.526 2.096 10 20 HECD C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(c2ccccn2)CC1 775259698 XHRBQNLEPTUKQI-WOJBJXKFSA-N 423.561 2.306 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 775376397 VYGZQFAPMNIJSY-HNNXBMFYSA-N 414.462 2.308 10 20 HECD Cn1ncc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C(F)(F)F 782099989 LFKQAJJGSYUHIN-ZDUSSCGKSA-N 424.427 2.462 10 20 HECD COCCCN(CCO)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 782928623 ODFAQBYSWJMCBG-UHFFFAOYSA-N 419.444 2.082 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)CC3CCCCC3)cc2)CC1 786262772 PSVWERPMTMDECX-UHFFFAOYSA-N 414.550 2.058 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H]1CCCO1 788882358 CDNJLIHMZYLBDV-BPQOCRPUSA-N 409.502 2.433 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(O[C@H]2CCOC2)cc1 789912486 UCZCXKNQOLOCCX-FQEVSTJZSA-N 416.499 2.341 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@](C)(OC)C3)CC2)cc1 792003581 AKQPQBFYXGLQON-QFIPXVFZSA-N 404.555 2.418 10 20 HECD CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCOCC3)cc1)CC2 792176790 MKSSUGFIJQRYJU-UHFFFAOYSA-N 401.532 2.384 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(C(=O)NCCOC)c1 795775562 XTNCZEIBGLJNDM-UHFFFAOYSA-N 419.547 2.340 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC1CCN(CC(F)F)CC1 803651743 TXKWNOIYQJFELZ-UHFFFAOYSA-N 422.520 2.481 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@]3(CCc4ccccc43)C2)cc1F 803661767 MGXGRHYPLCIMFJ-QHCPKHFHSA-N 411.477 2.208 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1 804426486 AKJVYQIYQKOQIP-QRVBRYPASA-N 416.499 2.408 10 20 HECD CCOC(=O)N[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804851591 HZOCXLQWZABZQE-INIZCTEOSA-N 422.501 2.025 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 806519030 IJEZUCNFRFBMIN-GJZGRUSLSA-N 406.527 2.349 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1OCC(F)F 809634021 ZOQUTWAQVAGVQD-UHFFFAOYSA-N 406.433 2.066 10 20 HECD COCCn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 812085307 UCAGPYCIGPIGNH-UHFFFAOYSA-N 401.492 2.258 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)c3ccc(Cl)cc3)nc12 815498829 OIDIMRDYVFFACA-IBGZPJMESA-N 419.821 2.216 10 20 HECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3O)CC2)C[C@H](C)O1 816491313 HXVLBNSRZIOWJL-IRXDYDNUSA-N 419.547 2.017 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(S(=O)(=O)NC)s1 916232384 JJWYYLHNSAETFJ-UHFFFAOYSA-N 410.565 2.454 10 20 HECD CC(C)[C@@H](CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 920921030 QAVZJHOUCOLTDC-DENIHFKCSA-N 417.598 2.155 10 20 HECD Cc1c([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1C 1254665877 VBICSDDUABGBSU-OAGGEKHMSA-N 417.529 2.448 10 20 HECD CN1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712894 YOOXJLFESYZHCS-FQLMCAECSA-N 407.898 2.097 10 20 HECD Cc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426718 BNTXFQSOVZVIRG-QGZVFWFLSA-N 414.462 2.336 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCc1nc2ccccc2c(=O)[nH]1 17814255 LKECACXDUYGCLC-UHFFFAOYSA-N 406.486 2.351 10 20 HECD CCN(CC)C(=O)CCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 726382451 UTMXYDCSAJZBBL-GOSISDBHSA-N 402.539 2.043 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc4c3OCCO4)n2)c[nH]1 727247139 UUWARHMUJGVDLU-UHFFFAOYSA-N 421.456 2.497 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)c3cn(C)nc3C)CC2)cc1 727845818 AFBYKFNZGILXHI-QGZVFWFLSA-N 414.554 2.310 10 20 HECD Cc1nn(C)cc1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733606826 WLZMVQMDMJQTAW-UHFFFAOYSA-N 403.394 2.299 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3c(C)noc3C)CC2)cc1 742940630 VYWWAIMDJRNIRY-UHFFFAOYSA-N 401.511 2.264 10 20 HECD COc1cc(CNC(=O)NCc2c(O)ccc3c2CCCC3)ccc1OCC(N)=O 745618511 XXVSFXJKRSWGJD-UHFFFAOYSA-N 413.474 2.143 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ncn(Cc2ccccc2)n1 749731534 RGNZUQSJSXOCJU-UHFFFAOYSA-N 402.505 2.020 10 20 HECD CC[C@H](C)[C@@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)C(=O)OC 749821043 OEZUWVCTTUHCBE-BJOHPYRUSA-N 407.492 2.356 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4cnn(C)c4)C(=O)C3)c2C)cc1 750075509 GUUHQAYTUTVHPD-UHFFFAOYSA-N 407.474 2.325 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1F 753033541 QWFYWPWTWRNLND-QGZVFWFLSA-N 415.513 2.497 10 20 HECD CNC(=O)c1ccc(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753834083 PKFHLBNZYCUEII-UHFFFAOYSA-N 400.454 2.226 10 20 HECD COc1ccc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1F 753857630 NVKXTJZOLIMWSP-UHFFFAOYSA-N 400.498 2.339 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 755257453 NMLXWCSPYGTBRC-QIJZPMMNSA-N 424.545 2.481 10 20 HECD COC(=O)[C@]1(C)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760638501 BKMMQRNNNQEDRC-SFHVURJKSA-N 424.500 2.422 10 20 HECD CCCc1c(NC(=O)C(=O)NCc2cccc(OC)c2O)cnn1-c1cc(C)ccn1 761065254 JUDQMLZZWMEOOF-UHFFFAOYSA-N 423.473 2.497 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)CC2)cc1 761652448 WHVVZPPIQBYAGE-HBMCJLEFSA-N 402.539 2.074 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccn(CCC(C)C)n3)CC2)cc1F 766515783 GRTHSFZVXJFJHF-UHFFFAOYSA-N 417.485 2.364 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCC[C@H]3OC)CC2)cc1 774789538 TWRBJXLNYYKUDY-GHTZIAJQSA-N 404.555 2.322 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H]1CC1(Cl)Cl)c1ccc(N2CCOCC2)cc1 775156755 AFFHTDOMBVHFOP-JSGCOSHPSA-N 400.306 2.010 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCc3ccc(O)c(O)c3)C2)cc1 778925888 PRVSBEXJODOHMJ-INIZCTEOSA-N 404.488 2.123 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C)C3=CCN(C)CC3)cc2F)CC1 781373115 CSMRYUBKHCJEMZ-QGZVFWFLSA-N 403.546 2.417 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 787636595 VCQUGTJXKSUWSV-UHFFFAOYSA-N 408.458 2.291 10 20 HECD CC(C)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CN1CCCC1 790235920 CITDUQWPRHNFJZ-LJQANCHMSA-N 415.582 2.310 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4nccnc4cc3F)cc2)CC1 791724033 JGLFSAKBDYSMBT-UHFFFAOYSA-N 407.449 2.367 10 20 HECD COc1ccc(Cn2cc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cn2)cc1 793050857 HDHDUBJZMKIZFL-CQSZACIVSA-N 424.457 2.037 10 20 HECD COc1ccc(CNC(=O)CS(=O)(=O)Nc2ccc(OC(C)C)cc2)c(O)c1 794390010 WJYNYARYUKTWIF-UHFFFAOYSA-N 408.476 2.246 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCCC3CCOCC3)CC2)cc1 798737418 LTTIHTLEGLRFAC-UHFFFAOYSA-N 404.507 2.484 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCN(Cc4ccccc4)C3)ccc21 803685765 KCUXCSXXAKUPLQ-OAQYLSRUSA-N 420.557 2.324 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 807292783 YJCOWNASIZBXFS-UHFFFAOYSA-N 420.513 2.036 10 20 HECD CC(C)(C)c1cc(CN2CCN(C(=O)Cn3cnnn3)CC2)c(O)c(C(C)(C)C)c1 809733731 GESHEMKKVUPXMU-UHFFFAOYSA-N 414.554 2.318 10 20 HECD Cn1cccc1[C@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917052335 MAYSBZCJJKWBPP-OAQYLSRUSA-N 400.498 2.454 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)CCC(=O)N4)cc2)C1 918372661 OTRZUCOMLCNMOR-SFHVURJKSA-N 406.486 2.203 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@@H]2CCCN2c2ccccc21 920195595 WEUOYYZQDBKAPD-FQEVSTJZSA-N 420.513 2.155 10 20 HECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCC[C@@H](C)C1 920636290 QKNFJVQOBOZELO-DYVFJYSZSA-N 412.508 2.204 10 20 HECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCC2(O)CCS(=O)(=O)CC2)c1 1257512560 MNMGMIFWNPZOBK-UHFFFAOYSA-N 410.923 2.417 10 20 HECD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1807993711 MNXNBHFXXGEBOM-FOIQADDNSA-N 422.441 2.423 10 20 HECD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(Cl)c1 1846848692 VJPWGVLEWAQXTK-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC12CCCCC2 564004175 SLUIBAYBMIVRDW-UHFFFAOYSA-N 424.545 2.497 10 20 HECD O=C(COC(=O)c1cccc(F)c1F)NCc1ccc(N2CCOCC2)c(F)c1 726677329 MBULJSWPOGJQIQ-UHFFFAOYSA-N 408.376 2.414 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)c1 729064659 UMISFJBHZJDJMV-CQSZACIVSA-N 411.458 2.453 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC3CCN(S(C)(=O)=O)CC3)cc2)CC1 731051545 XJWFWPSJANZLEW-UHFFFAOYSA-N 408.568 2.146 10 20 HECD O=C(NCCCN1C(=O)CNC1=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 731130398 PFCRWIJEOHTQQA-UHFFFAOYSA-N 408.418 2.099 10 20 HECD O=C(Nc1cccc(N2CCCCC2)c1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12 731811634 WNDQSWRUCIQMKQ-UHFFFAOYSA-N 424.486 2.340 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2O1 732478654 IATYKVOURMTYTM-OAHLLOKOSA-N 413.449 2.093 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c[nH]nc3-c3cccnc3)CC2)cc1 732924573 YSLGWGYFXXOQOI-UHFFFAOYSA-N 406.490 2.032 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 734215146 DDRUZIURWQQYER-DLBZAZTESA-N 420.529 2.233 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C3CC3)[C@@H](C)O)c2C)c1 745739614 JGOSFAGVIXFOGU-IIBYNOLFSA-N 412.486 2.404 10 20 HECD CNS(=O)(=O)c1cccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 747458189 HZRDOUFJLSXNET-UHFFFAOYSA-N 423.560 2.014 10 20 HECD Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 749635062 JIIHJEYPEUUUKN-UHFFFAOYSA-N 419.485 2.179 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H]1[C@H](O)C(F)(F)F 750638732 PREQFLHYONUZIJ-SJORKVTESA-N 419.419 2.384 10 20 HECD Cc1nn(C)cc1[C@@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759419909 IPPZKUZRFQJEMD-FQEVSTJZSA-N 415.513 2.158 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3O)CC2)cc(OC)c1OC 760083783 HWUOEOXNNUTSEN-UHFFFAOYSA-N 417.418 2.289 10 20 HECD CCOc1cccc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1O 768155682 HOZYQFDHZVITEO-UHFFFAOYSA-N 421.475 2.206 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(-n2cnnn2)c1 768912603 PGZBDCGQNROOKF-QGZVFWFLSA-N 412.881 2.416 10 20 HECD CCc1[nH]nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1Br 769938318 PUGPTCAJZUEESB-UHFFFAOYSA-N 403.258 2.064 10 20 HECD COCCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 773245616 YWHWABGXWLIGIP-HZPDHXFCSA-N 422.497 2.415 10 20 HECD CCC[C@]1(COC)CCCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 773956871 BNQUNGHLQHIBJB-JTHBVZDNSA-N 405.583 2.459 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(OCc2ccccc2)nc1 774356796 NDFVDSOLKPGCCM-UHFFFAOYSA-N 407.426 2.369 10 20 HECD NS(=O)(=O)c1ccc(CN2C(=O)/C(=C/c3ccc(F)nc3)SC2=S)cc1 777403796 NZXZOXHXWWMHIS-QPEQYQDCSA-N 409.489 2.270 10 20 HECD Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 786223140 AYRIAVZGXWBFRI-NHCUHLMSSA-N 424.545 2.100 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCN(c2ccccc2)CC1 788010042 GRBBYYHCHGWRTP-UHFFFAOYSA-N 424.545 2.069 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)C1 788979471 WFWBECVMAWPUNN-LJQANCHMSA-N 416.566 2.304 10 20 HECD CN(CCc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801500 UJSSFRJWTUZAEK-UHFFFAOYSA-N 417.456 2.119 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC(C)(C)[C@H]3C)cc2F)C[C@@H](C)O1 789815887 BFZHPSLORVVYTP-OWCLPIDISA-N 421.513 2.081 10 20 HECD CO[C@@]1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1(C)C 789847796 VHUGIKKIDWTXHL-UTKZUKDTSA-N 405.564 2.176 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@H](c2ccco2)C1 789867523 HRHVJBUIYSDPNW-IBGZPJMESA-N 415.515 2.049 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)OC)sc1C(=O)OC 790409936 XJRMTFFATJMRPW-UHFFFAOYSA-N 415.445 2.226 10 20 HECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2c(O)ccc3ccc(OC)cc23)C1 792712805 SJCGYLWRZJSNLB-GOSISDBHSA-N 422.547 2.426 10 20 HECD Cc1ccc2c(c1)CC[C@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)O2 793124356 NHEMKPIVOZEPKK-OAQYLSRUSA-N 414.527 2.240 10 20 HECD COc1cc(N2CCN(C(=O)Cc3ccc4c[nH]nc4c3)CC2)cc(OC)c1OC 793814964 KAAUIUKGIQPFKH-UHFFFAOYSA-N 410.474 2.480 10 20 HECD CC[S@@](=O)CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803471489 CPCXZWVKWBISSX-XETJZTBLSA-N 413.451 2.101 10 20 HECD CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676711 CEKCEZMLRUIKOF-UHFFFAOYSA-N 412.538 2.249 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)OC[C@@H]1CCCO1 804964601 NCAGWARNVAKOQU-KRWDZBQOSA-N 415.469 2.348 10 20 HECD C[C@@H]1C[C@@H](N2CCOCC2)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 804968635 HLQSBRGCNRJNFD-YLJYHZDGSA-N 404.580 2.244 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@@H]4CN(C(C)=O)C[C@H]43)CC2)cc1F 808354535 HFYIAYNIRUSYRM-YVWKXTFCSA-N 418.513 2.313 10 20 HECD Cn1nnc2c1C[C@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 810630194 GVWVGNMYJNUSAN-CZUORRHYSA-N 403.914 2.060 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ncccc3CSC)CC2)cc1 811438084 PCGBQSUFTUWQTN-UHFFFAOYSA-N 415.515 2.459 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C4(CCC4)[C@H]3[C@@H]3CCCO3)CC2)cc1F 811754892 LUMKXDRATBBDNW-VQTJNVASSA-N 403.498 2.474 10 20 HECD CSC1(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCN(C)CC1 811940678 PXVCHNWOYFNJFY-UHFFFAOYSA-N 406.596 2.492 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@]4(CCN(C)C4)C3)cc2F)CC1 813632651 LFFUQNOKRCVSHN-JOCHJYFZSA-N 403.546 2.205 10 20 HECD Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)nnn1-c1ccn(C)n1 814679880 QLDPRDPSJCEMJP-IBGZPJMESA-N 423.521 2.197 10 20 HECD C[C@@H]1CN(CCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 916249797 KYASQACWLRTOLV-RTBURBONSA-N 404.555 2.164 10 20 HECD CCc1ccc(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918335552 QAZQMQGNVDGFEQ-UHFFFAOYSA-N 402.516 2.179 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cn3c(=O)oc4ccccc43)cc2F)CC1 1318574025 FYCRGPKCGLMNRM-UHFFFAOYSA-N 412.465 2.192 10 20 HECD C/C=C/C=C\C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1790822667 PDFZJYDWFNGAFV-OMJYXIODSA-N 420.893 2.477 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1cc(O)nc(O)c1 1817845003 TUIMADHGNZWBPO-MRXNPFEDSA-N 422.445 2.160 10 20 HECD COc1ccc([C@H](C)C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841256643 ZTHFTXWJCJQJMP-AWEZNQCLSA-N 411.458 2.122 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(F)c(F)c3)CC2)cc1 49512237 YJRDLLMYJQUWJI-UHFFFAOYSA-N 411.474 2.074 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c(F)cc1F 729065353 DIXPVXJTTIAZQG-SECBINFHSA-N 408.357 2.282 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1cccc(S(N)(=O)=O)c1 729231670 WZSXIFCYMCQIGB-KRWDZBQOSA-N 408.499 2.490 10 20 HECD CS(=O)(=O)CCSCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 730465321 HILLCVPDWVEWBL-UHFFFAOYSA-N 403.481 2.178 10 20 HECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 730680457 SKRVRFRHCRWKMJ-UHFFFAOYSA-N 401.438 2.480 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1 734067376 NDSRGOTUTXFYEA-UHFFFAOYSA-N 421.519 2.429 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](OCC(F)(F)F)C3)CC2)cc1 738318296 CXUHBIUMTQSQKJ-SFHVURJKSA-N 415.456 2.387 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@](C)(C(N)=O)c1cccc(Cl)c1 749360382 KNUJKEHTYFZWQI-NRFANRHFSA-N 402.926 2.355 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)cc1F 749984915 BCWRBAROMULYKS-SFHVURJKSA-N 406.483 2.018 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CSCN3C(=O)C(C)(C)C)CC2)cc1F 753741547 KLDCXTIJUOLOQY-MRXNPFEDSA-N 409.527 2.431 10 20 HECD COC(=O)Nc1ccccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758234227 ZXFYNQRBLYZENF-GOSISDBHSA-N 415.490 2.435 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(OCC(F)F)c3)cc2)C1 758575587 HXKMHXUDWLSSNL-MRXNPFEDSA-N 418.444 2.357 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N(C)C)cc1)NS(=O)(=O)c1cccnc1Cl 760300970 SKTZYHHUARUDKA-ZDUSSCGKSA-N 410.927 2.174 10 20 HECD COc1cc(Cl)cc(CNCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1O 761198172 NQJLJHYXKYTLNO-UHFFFAOYSA-N 415.855 2.031 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 768012133 PSITWMZRAYIDFJ-UHFFFAOYSA-N 400.454 2.191 10 20 HECD Cc1nc(O)nc(O)c1CCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771063990 GJQIDOZZOCKCRE-OAHLLOKOSA-N 420.897 2.269 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 772829058 GKOXWZVXKMYTFF-CRAIPNDOSA-N 414.499 2.018 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773860025 YAACRGKNTAJWCR-AWEZNQCLSA-N 403.504 2.280 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 774730903 ZTDGAWWGGFSFDF-UHFFFAOYSA-N 411.502 2.061 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC3(N(C)C)CCCCC3)CC2)cc1 774815515 LZGWKNHOZAVINM-UHFFFAOYSA-N 416.566 2.161 10 20 HECD COc1ccc([C@H](CNCc2ccc([N+](=O)[O-])c(OC)c2O)N2CCOCC2)cc1 774941769 DGOHQFZAXVWNII-IBGZPJMESA-N 417.462 2.481 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(CCO)cc3)CC2)cc1 778317677 DQONRRIXEQNYDR-ZHACJKMWSA-N 409.486 2.074 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1 778557276 PKRVMAGZGCKFLF-UHFFFAOYSA-N 406.552 2.394 10 20 HECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2 778925935 RBBJPCJHKNKDHG-HNNXBMFYSA-N 413.430 2.182 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccc(C)cc4)CC3)CC2)cc1 784388425 JSQCJSNMXKIORV-UHFFFAOYSA-N 408.546 2.474 10 20 HECD CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)OCC(=O)c3ccc(O)c(O)c3)c2C1 784860221 DLCAVZRQEUSQDD-UHFFFAOYSA-N 417.418 2.154 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 785296664 OMZKSRVJWWSNPS-KSSFIOAISA-N 414.458 2.342 10 20 HECD CCOc1ccccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 786685820 ANSLZVQQRXAWLM-UHFFFAOYSA-N 411.502 2.197 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C 787638486 MXCVALJMIIZVPG-HXUWFJFHSA-N 400.498 2.269 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@@H]2CCc3n[nH]cc3C2)cc1)C1CCCCC1 788482471 BGEWIHRCXHONMU-GOSISDBHSA-N 409.534 2.469 10 20 HECD CCOC1CC(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789164537 TVNWAEVEQUVKLH-UHFFFAOYSA-N 408.470 2.027 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc[nH]1 789956921 ZTITUPJXHWAUFO-ZDUSSCGKSA-N 424.423 2.364 10 20 HECD CNC(=O)[C@@]1(C)CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C1 797438378 PIRGSGOKUQOHAH-AWEZNQCLSA-N 417.216 2.237 10 20 HECD CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 798166438 ZMCFBGUVCMFZRU-HXUWFJFHSA-N 416.566 2.478 10 20 HECD CC[C@@H](CO)N(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663673 WOOVTVMYXYUAJL-SFHVURJKSA-N 401.482 2.308 10 20 HECD CCN(CCCN1CCCC1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804319918 VFVUQTVHQJJBSQ-UHFFFAOYSA-N 416.566 2.115 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OC)c(OC)c3C)nc12 805592323 QPDZKQLMYYBAFW-UHFFFAOYSA-N 415.402 2.294 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3noc4c3CCCC4)cc2)C1 806495515 HTTBOPBXSRSETH-MRXNPFEDSA-N 411.506 2.255 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3nc(C)c(C)s3)CC2)cc1 807340192 GYWZPBHUXWQEFH-UHFFFAOYSA-N 402.520 2.124 10 20 HECD CCCN(CC)CCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 807777879 VFCARDSXVMRUKN-UHFFFAOYSA-N 414.344 2.351 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3cc(OC)cc(OC)c3)CC2)cc1 920088674 HLWXPYOTWPVHHH-UHFFFAOYSA-N 413.518 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 920251541 BTDLJJOFVKNSSQ-OUKQBFOZSA-N 422.529 2.282 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(NC(C)=O)c(F)c1 1116777868 IGOOWMJUECUKNM-INIZCTEOSA-N 404.394 2.100 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)[C@@H](C)c1ccccc1 1320397047 CEDVLNHDHIKYQI-JKXTWKSPSA-N 401.459 2.243 10 20 HECD COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1347439187 YVHWRJGGAPSPGJ-KRWDZBQOSA-N 424.906 2.160 10 20 HECD O=C(CCc1ccsc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600378 DBVARHNYMSUJIH-MUJYYYPQSA-N 401.488 2.439 10 20 HECD CC1=CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC1 1797701313 YKYWTWLAKBCTLF-LVQVYYBASA-N 421.588 2.231 10 20 HECD Cc1nccn1[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846658874 ZXFIBXRFBPEOMS-GFCCVEGCSA-N 418.881 2.334 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@H](CC(N)=O)C3CCOCC3)ccc21 466626777 GVWXWRZYYFOWGY-LJQANCHMSA-N 401.507 2.305 10 20 HECD Cc1c(CNC(=O)NC[C@@H](O)CS(=O)(=O)c2cccs2)n(C)c2ccccc12 472219240 CBIVEODDNNOIDP-CQSZACIVSA-N 421.544 2.182 10 20 HECD CCN(CC)c1ccc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1 727177508 LLYCAGYZLZYQGV-NTCAYCPXSA-N 413.590 2.283 10 20 HECD CCN(CC(=O)NC)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 733161922 QJKUIGGFWVMIKW-JLHYYAGUSA-N 411.574 2.324 10 20 HECD Cc1nc(CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 733579593 FDNIRTPJXFULLD-UHFFFAOYSA-N 421.494 2.219 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)ccc1Cl 737286098 QMTMMVDEKZXSJU-UHFFFAOYSA-N 406.822 2.486 10 20 HECD C[C@H]1Oc2c(cccc2C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)NC1=O 739768072 KJDGTJVPXOZURW-CYBMUJFWSA-N 408.458 2.360 10 20 HECD CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NCc2cccc(OC)c2O)cc1 743222354 YWLWMJFLEALQIQ-CYBMUJFWSA-N 415.446 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(=O)N(C)c4ccccc43)CC2)cc1 745985634 PQJTXWMDPUPKJP-UHFFFAOYSA-N 408.502 2.217 10 20 HECD CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 749634662 DJFWARYYBXFBJF-UHFFFAOYSA-N 416.909 2.498 10 20 HECD CCOCCO[C@H]1CCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 750315639 LVTBUDMGHVRURN-IBGZPJMESA-N 422.545 2.305 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCCc3csc(C)n3)nc12 750563228 FAAZMVFXSOUTBT-UHFFFAOYSA-N 404.448 2.443 10 20 HECD CN(CC(C)(C)CN1CCOCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 752651082 UVCNESUBNJVTBB-UHFFFAOYSA-N 422.545 2.162 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccc(C)cc4)CC3)CC2)cc1 754270480 LXWRVRLXAKDULY-DEOSSOPVSA-N 424.589 2.309 10 20 HECD CS(=O)(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2cccc3nonc23)c1 765047787 PLPQLGRRZCQUTJ-UHFFFAOYSA-N 402.841 2.049 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(-c4ccccc4F)n3)CC2)cc1 765529176 JOWMDEYFYLUVOU-UHFFFAOYSA-N 408.433 2.343 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCC(=O)OCc1ccccc1 767289771 OKSNNYNSKUYJDK-UHFFFAOYSA-N 404.488 2.415 10 20 HECD C[C@H](NC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773020123 OAAUDCWXIPJRMY-HNNXBMFYSA-N 417.531 2.106 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 784509659 HKGHSSWQAVBAMX-ZIFCJYIRSA-N 402.539 2.393 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 785427231 BAUDYICUZYTFAI-QFIPXVFZSA-N 408.546 2.492 10 20 HECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cn2)n1 787490519 RGHWCZOFBQFRTF-KRWDZBQOSA-N 420.517 2.444 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc4c[nH]nc4c3)CC2)cc1 789947364 UUDNIVPFADBDFD-UHFFFAOYSA-N 407.518 2.443 10 20 HECD C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793826583 RSAGXPGSTDPTHM-IAGOWNOFSA-N 411.502 2.153 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)CN3CCC[C@H](C)C3)CC2)cc1 793901179 LJVAHAOFXJFIHV-ROUUACIJSA-N 416.566 2.017 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1 803686143 XDWPEURHQUKEEM-UHFFFAOYSA-N 411.502 2.361 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCc4ccc(OC)cc4C3)CC2)cc1 804317807 QPVWKAUIQUGSIP-UHFFFAOYSA-N 423.513 2.374 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(C3(C)OCCO3)CC2)cc1F 804852649 LKHMZFBFLWRXLI-UHFFFAOYSA-N 421.513 2.290 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC[C@@H]1COC2(CCCC2)O1 806691554 KHMXYKCHTLGBSZ-HXUWFJFHSA-N 415.534 2.437 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(C(C)(C)O)c1 806847675 UMFIYPIHJATSJX-UHFFFAOYSA-N 411.502 2.348 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCOC2(CCCC2)C1 808109760 DNLZTVOHGDSRQA-IBGZPJMESA-N 415.534 2.090 10 20 HECD COc1ccc(-c2cnc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2C)cc1 819418089 YTAOSJJWLBIPJT-UHFFFAOYSA-N 416.459 2.425 10 20 HECD CC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 914788202 BUKBPSVFDFTFNT-QGZVFWFLSA-N 405.520 2.035 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1 914929204 CATKIAPJGDMMGL-GOSISDBHSA-N 415.534 2.435 10 20 HECD CCc1ncncc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919855492 UADAFAQRCWRYSA-UHFFFAOYSA-N 421.480 2.225 10 20 HECD C[C@H](NC(=O)N1CCC[C@H](CS(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 920872141 OUSZVPKWMAYBSE-IRXDYDNUSA-N 409.552 2.050 10 20 HECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920887054 YRNUUWJMDWKZIS-GJZGRUSLSA-N 423.560 2.129 10 20 HECD CN1CCN(c2ccc(CNCCCN3C(=O)COc4ccccc43)cc2F)CC1 1329667511 YWYRSPDNICPUEA-UHFFFAOYSA-N 412.509 2.483 10 20 HECD O=C(CCN1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719883 SOOMXQFKSRMNBC-MUJYYYPQSA-N 421.925 2.489 10 20 HECD Cn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)c1 1825724653 ANZUEPQDOQIRCB-SFHVURJKSA-N 412.490 2.378 10 20 HECD O=[N+]([O-])c1ccccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 19108247 FHFDBKCLXDRZCU-UHFFFAOYSA-N 405.461 2.110 10 20 HECD C[C@@H](NC(=O)CNC(=O)NCc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 109190688 WINBZDHDTKTDEW-MRXNPFEDSA-N 414.481 2.339 10 20 HECD COc1ccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 727665877 WHSSLZVXPRXAQB-UHFFFAOYSA-N 403.410 2.438 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CCO)C3)cc2F)C[C@@H](C)O1 729544655 KNUKCCNCBBMITL-FGTMMUONSA-N 407.530 2.150 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)N2C(=O)c3ccccc3C2=O)c1O 729861132 DTWPEGPCMVTJNU-INIZCTEOSA-N 414.483 2.435 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCC(=O)N(CC)CC)cc2F)CC1 730118576 YRRHUTRNTKOKAH-UHFFFAOYSA-N 421.561 2.415 10 20 HECD CC1CCN(c2ccc(CNC(=O)CSCC(=O)N3CCOCC3)cc2)CC1 731016495 UOIRKHDCAFEJEY-UHFFFAOYSA-N 405.564 2.131 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@@H]1CCOC1 734151252 HCHFFFAVDYKSIG-KRWDZBQOSA-N 419.547 2.283 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(CC(F)(F)F)c3)cc2)C1 741071569 FHSFWICQMCJNET-CQSZACIVSA-N 424.427 2.469 10 20 HECD CCN(CC(=O)NN1C(=O)N[C@@](CC)(c2ccccc2)C1=O)c1ccc(OC)cc1 746109060 IOGDBUQGMRCDQK-QFIPXVFZSA-N 410.474 2.410 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 748853376 NZEWOZOELDCPRC-KGLIPLIRSA-N 419.432 2.149 10 20 HECD O=C1CCc2cc(F)c(NC(=O)C(=O)NCCCSc3nccs3)cc2N1 749730704 BQJGSBLUUJZQCE-UHFFFAOYSA-N 408.480 2.404 10 20 HECD CN(CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)S(=O)(=O)c1cccnc1 751308272 UUJWQVZSYQHMOF-UHFFFAOYSA-N 422.470 2.051 10 20 HECD Cc1cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(F)cc1F 753362967 HJMAYILUPNVOSW-UHFFFAOYSA-N 416.471 2.309 10 20 HECD COCCCn1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)n1 754920221 GVLWGDBCYQVMNE-UHFFFAOYSA-N 412.446 2.386 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O 755246295 AMOGNGSWXGAJJM-UHFFFAOYSA-N 411.418 2.136 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)N[C@H](c4ccccc4F)C3=O)cc2)C1 761116621 BKZBHOYEVSREBC-HNAYVOBHSA-N 410.449 2.321 10 20 HECD CN(C)CCOc1cc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)ccn1 761744460 MEAOPNSTGOZPBP-UHFFFAOYSA-N 418.881 2.345 10 20 HECD COC(=O)N[C@@H](C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 761775207 DOPDNRZDEBXUDN-BBRMVZONSA-N 408.499 2.179 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)NCc1cccc(Br)c1O 766201953 YAZNJBDAYRVRBG-AAEUAGOBSA-N 406.298 2.306 10 20 HECD CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 767992938 GGEAJDQFVSSKRX-UHFFFAOYSA-N 412.465 2.383 10 20 HECD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(C)c(C)c1 769628649 MQENTSJSUKLFNE-KRWDZBQOSA-N 406.460 2.025 10 20 HECD COc1cc(N2CCN(C(=O)CCC(=O)c3ccccn3)CC2)cc(OC)c1OC 770253898 YZGDZFNPVUZUJO-UHFFFAOYSA-N 413.474 2.419 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccnn2-c2ccc(C)nn2)cc1 773223031 XPTXKEOJGPQFIT-UHFFFAOYSA-N 421.505 2.414 10 20 HECD COCc1cc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)ncn1 774077206 FFAHKNJQDWGWPG-UHFFFAOYSA-N 407.474 2.328 10 20 HECD COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 775258010 OISSSGDDGNRNOZ-UTKZUKDTSA-N 414.502 2.400 10 20 HECD COc1cc(C(=O)CCC(=O)NCCc2ccc(O)c(O)c2)cc(OC)c1OC 777417588 AYORARKFDLIXAE-UHFFFAOYSA-N 403.431 2.445 10 20 HECD CN(CC(=O)Nc1ccc(Br)cn1)C(=O)/C=C\c1ccc(O)c(O)c1 779485220 ZLASSRJKWNEZOB-CLTKARDFSA-N 406.236 2.366 10 20 HECD O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 779877315 GQOFKCLMQRBBGZ-UHFFFAOYSA-N 423.466 2.233 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)cc1 781069200 AMYSBYUMVQSISS-UHFFFAOYSA-N 414.462 2.251 10 20 HECD COc1ccc([C@@H]2[C@H](C(=O)OCC(=O)c3ccc(O)c(O)c3)CCC(=O)N2C)cc1 783683477 FDLILPWODMNTCN-IIBYNOLFSA-N 413.426 2.442 10 20 HECD CCCC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)C1 787320977 BMVKEFMNBHUUJC-FQEVSTJZSA-N 414.550 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ncnn3-c3ccccc3)CC2)cc1F 787345809 PTUZPQNDHWGAMD-UHFFFAOYSA-N 410.453 2.447 10 20 HECD CCC[C@]1(COC)CCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814143 ZCYQTOMNWWWOKQ-JOCHJYFZSA-N 421.513 2.086 10 20 HECD COc1c(NC(=O)C(=O)NCc2ccccc2O)cc(Cl)cc1C(=O)N(C)C 792973653 LHCVXOWTIWKOHA-UHFFFAOYSA-N 405.838 2.011 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(C)cc3F)cc2)CC1 795180656 CPTDDBSSHJXTQQ-UHFFFAOYSA-N 419.522 2.422 10 20 HECD NC(=O)Cc1occc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 795316524 BAUUVOSSJIYIQT-UHFFFAOYSA-N 411.380 2.093 10 20 HECD CNC(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1Br 795626764 UQIIYRUAULDWLH-UHFFFAOYSA-N 411.237 2.146 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3COC(=O)NC(C)C)nc12 796709797 NBFGHBDOTURJLW-OAHLLOKOSA-N 419.482 2.101 10 20 HECD COc1cc2c(cc1S(=O)(=O)Nc1cccc(N3CCCC3)c1)OCC(=O)N2 797429812 ALBJHCMKBQBTKO-UHFFFAOYSA-N 403.460 2.427 10 20 HECD CC(C)COC1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803297492 XTJRAEYYMLFGHG-SFHVURJKSA-N 417.550 2.364 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc2c(c1)OCCCO2 803624714 YPRIEBSXYVZFKA-UHFFFAOYSA-N 407.517 2.219 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCC3(C)C)cc2F)CC1 805008711 AGFDPVPEEOPIGF-IBGZPJMESA-N 404.530 2.279 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(Cl)cn3)CC2)cc1 806720864 ADPTUBUNROJELH-UHFFFAOYSA-N 402.882 2.099 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1CCN(c2ccncc2)CC1)c1ccc(N(C)C)cc1 807663401 LZHXCRANJSFCSE-QGZVFWFLSA-N 409.534 2.358 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4O[C@H](C)C[C@H]4C)n3)CC2)cc1 809464659 JTRTXWHGLIVSCQ-STXHMFSFSA-N 400.479 2.456 10 20 HECD COc1ccc(N2CCC(NC(=O)CNS(=O)(=O)c3ccc(C)cc3)CC2)cc1 810318151 QXPVBEAWSHUMPI-UHFFFAOYSA-N 417.531 2.067 10 20 HECD CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](CNCc2ccc3c(c2)CCO3)C1 816545414 QDGDCJBCLMTCLG-QGZVFWFLSA-N 403.523 2.474 10 20 HECD CN(C)CCn1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 857457084 JTNJAIZYUGHEIF-HNNXBMFYSA-N 407.465 2.445 10 20 HECD O=Cc1cc([N+](=O)[O-])ccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917180211 PHGYPPFBDJUAKT-UHFFFAOYSA-N 417.393 2.078 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1 917752314 VBLNEIMVFKGDHK-UHFFFAOYSA-N 415.449 2.166 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(F)c(NC(C)=O)c1 1254760393 CLEVMQBVMYHEFI-INIZCTEOSA-N 404.394 2.100 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3ccc4c(c3)CCO4)CC2)cc1 1319138501 SSPVTCHUUBGFIA-UHFFFAOYSA-N 424.497 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3c(C)cnn3CC3CC3)CC2)cc1 1325006080 GGYJHPUARGWLBU-KTKRTIGZSA-N 423.517 2.454 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCNC(=O)c1ccc(F)cc1 64015660 DZWFMFRDSLENSV-UHFFFAOYSA-N 415.465 2.213 10 20 HECD CO[C@@H](C)CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 726624072 CKFVESLOISMYTG-LBPRGKRZSA-N 423.447 2.256 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 727366863 RPJLRBXDEMJJLH-UHFFFAOYSA-N 413.430 2.475 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](NC(C)C)C3)CC2)cc1 732444155 QAIUTSNIKVTKIC-FQEVSTJZSA-N 417.598 2.379 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1F 732704355 POBLXONAKLCPIN-UHFFFAOYSA-N 416.428 2.413 10 20 HECD Cc1cc(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)no1 733925577 YBQLPXHFZIXHFQ-UHFFFAOYSA-N 410.453 2.098 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 737181810 DVKKXYUOHXKGHR-GFCCVEGCSA-N 400.435 2.358 10 20 HECD C[C@H](NC(=O)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 740910447 QFEZZHMCTCEZDZ-VDZJLULYSA-N 409.552 2.239 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccs4)nn3)cc2)C1 742566971 UEUZCFOEZTYAKY-INIZCTEOSA-N 424.530 2.020 10 20 HECD O=C(NCc1nnnn1C1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743698729 YATOGWUNSGMQQJ-GFCCVEGCSA-N 407.425 2.078 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1 743905766 HPHUIWRXJSKNJY-ZDUSSCGKSA-N 412.446 2.136 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2)c1ccc(N2CCOCC2)cc1 746795119 WJSWBNMCTNGJMX-INIZCTEOSA-N 424.501 2.168 10 20 HECD CCOC(=O)CC[C@@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 752050592 MJBZKUXIHWRRGA-IBGZPJMESA-N 417.550 2.399 10 20 HECD C[C@H](NC(=O)NC1CCN(c2cccnn2)CC1)c1ccc(N2CCOCC2)cc1 758495698 QVAKQWWOXQRIQD-KRWDZBQOSA-N 410.522 2.342 10 20 HECD COCCc1noc(CN(C)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1 758743368 YOOWFDUIGWXHRW-UHFFFAOYSA-N 403.483 2.078 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(C)nc3OC)CC2)cc(OC)c1OC 759221912 RSJDGLXQUGWXJG-UHFFFAOYSA-N 401.463 2.387 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Nc3cccc(C(N)=O)n3)cc2F)C[C@@H](C)O1 761875258 RBXPZBXVGBCXPH-CHWSQXEVSA-N 401.442 2.255 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3cc(N4CCCC[C@@H]4CO)ncn3)cc2)C1 764782724 HZJHAROFGGEXFU-UYAOXDASSA-N 424.549 2.142 10 20 HECD CS(=O)(=O)N1CCC(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 765995638 WDJPYVGZWHZQQS-QGZVFWFLSA-N 401.960 2.024 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(Br)nc3)ccc21 766403825 RHZSAFPLGIONOM-UHFFFAOYSA-N 403.280 2.481 10 20 HECD O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769470304 KZMYCJDBADGKDE-UHFFFAOYSA-N 410.474 2.389 10 20 HECD COc1cccc(CNC(=O)c2cc(S(=O)(=O)N(C)C(C)C)ccc2F)c1O 769497939 FODREQUVXQAGIC-UHFFFAOYSA-N 410.467 2.499 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(N)(=O)=O)ccc1Cl 771211204 DUGYOJULBDQCFV-UHFFFAOYSA-N 423.922 2.096 10 20 HECD C[C@@H](NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(N(C)C)cc1 773087249 HXLFTIXTYDBNMV-GFCCVEGCSA-N 407.448 2.472 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 775046517 XHSBCMSCMBBQNI-OAQYLSRUSA-N 408.546 2.492 10 20 HECD C[C@H](NCC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C)c1ccc(N(C)C)cc1 775835557 UYAWOXJXCINDJI-CABCVRRESA-N 416.547 2.028 10 20 HECD O=S(=O)(Nc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cccc2nonc12 776308560 PGSDPRIKMUCASO-UHFFFAOYSA-N 407.351 2.317 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)cc1OC 780864194 WUVQHNQKSMBHSA-UHFFFAOYSA-N 400.431 2.022 10 20 HECD COC[C@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)OC 781362497 JEFWGSCMKJUEGN-HNNXBMFYSA-N 405.417 2.003 10 20 HECD CNC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCO1 782041281 JTPFMRXYEKMYTD-KRWDZBQOSA-N 420.307 2.444 10 20 HECD C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801772 UBBUQERWTWVZMI-SUMDDJOVSA-N 403.498 2.458 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H](C)c1cn(C)nc1C 793754974 FQZNMYAXBVKGNZ-NSHDSACASA-N 423.311 2.423 10 20 HECD C[C@H](O)CCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 795630663 SZRDBGVDPHMZKR-LBPRGKRZSA-N 424.431 2.419 10 20 HECD CN(CCOCCO)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 800687380 QTHYBICNUQRSRX-WYMLVPIESA-N 414.574 2.197 10 20 HECD COc1ccc(CS(C)(=O)=O)cc1NC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 806639914 XJHNYROYLSMBDR-LBPRGKRZSA-N 408.476 2.404 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(CCc1ccccc1)CCN(C)C 807100368 KDZFIYCOURJYNJ-UHFFFAOYSA-N 410.562 2.310 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCN(c2ncccc2F)CC1)c1ccc(N(C)C)cc1 807671833 TVUIHXPXDCUIAB-INIZCTEOSA-N 413.497 2.203 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1F 810358830 NLYJFWLLIXKMSL-UHFFFAOYSA-N 417.412 2.389 10 20 HECD COC(=O)COc1ccc(N(C)S(=O)(=O)c2ccc(Cl)c3nonc23)cc1 814389895 QCOVZDSDHGGPCT-UHFFFAOYSA-N 411.823 2.253 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCO[C@@H](C(C)C)C3)CC2)cc1 819406824 WQGOXWASIWAQHN-VFCOFNOGSA-N 415.534 2.174 10 20 HECD CCn1c(=O)n(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc21 919968783 KFKFRHOQHBWOPP-UHFFFAOYSA-N 422.529 2.348 10 20 HECD Cc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 1328763788 ZUVPEZRKKCWOPZ-UHFFFAOYSA-N 401.532 2.311 10 20 HECD C[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1nnnn1C 1518425702 UIMVMXQYALWFET-JMZICWNOSA-N 422.561 2.130 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc(O)c1)c1cc(O)nc(O)c1 1802551052 LWDRUGZGGKDVET-BJWYYQGGSA-N 411.458 2.083 10 20 HECD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1826245362 RWNIRVVUPGQSJK-OAHLLOKOSA-N 423.604 2.267 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H](NS(C)(=O)=O)C2)c(C)n1-c1cccc(F)c1 725796805 XWFRFXRKSVLNAV-QGZVFWFLSA-N 407.511 2.430 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCC[C@@H]1C 726611303 OCCNSBPSTXONGF-HOTGVXAUSA-N 406.502 2.251 10 20 HECD O=[N+]([O-])c1cc(CN[C@@H]2CCN(CCN3CCOCC3)C2)ccc1N1CCCCC1 734509709 PEERPWXSEDWCSY-HXUWFJFHSA-N 417.554 2.081 10 20 HECD CS(=O)(=O)CCn1ccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)n1 743206639 CZHZASHYIVXENZ-UHFFFAOYSA-N 418.475 2.461 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(-c4ccccn4)no3)CC2)cc1 746174068 JQFHXZLCRBWVCD-UHFFFAOYSA-N 407.474 2.297 10 20 HECD CC(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 746783055 HRONHIIWSOBWNP-GASCZTMLSA-N 417.485 2.472 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2nnc3ccccc3c2=O)cc1 748775426 SXZPHWRRDBKOIN-LJQANCHMSA-N 421.501 2.065 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C)c1 749917628 BKTLBOBSMPPMNB-INIZCTEOSA-N 423.496 2.096 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(C)nc3N(C)C)CC2)cc1 750404313 RJHKVOLMCZMVBZ-UHFFFAOYSA-N 412.538 2.408 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOC[C@H]3c3ccccc3)CC2)cc1 754052705 YBGBWXMCNNJJSD-UPVQGACJSA-N 411.546 2.252 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3c(OC)ncnc3N(C)C)CC2)cc1 754450406 HUTAAXNVYBNKOX-UHFFFAOYSA-N 400.483 2.304 10 20 HECD CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 756903023 YRUSCYWXEFFWIG-IAGOWNOFSA-N 410.540 2.393 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCC3(N(C)C)CCCCCC3)CC2)cc1 758186128 PCQYZHPMYNYAHZ-QFIPXVFZSA-N 418.626 2.422 10 20 HECD C[C@@H](NCCN1C(=O)CNC1=O)c1cc(Br)cc(Br)c1O 761500581 WVJZKDTYUXJZHT-SSDOTTSWSA-N 421.089 2.120 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(C)nn2-c2ncccn2)cc1 768014750 FLJHVQRZVQGKNQ-UHFFFAOYSA-N 421.505 2.414 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 768813904 AATFKNZXZBGMGS-UHFFFAOYSA-N 401.441 2.111 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cc(Cl)ccc3O)CC2)cc1 769379859 QJNNHROMZUUJBO-UHFFFAOYSA-N 423.966 2.450 10 20 HECD Cc1[nH]ccc(=NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1Cl 771767946 YNYOHPDFAGCBQA-OAHLLOKOSA-N 401.898 2.489 10 20 HECD CCCCn1c(=O)nc(O)c2c1nc(CN[C@H](C)c1cc(OC)ccc1O)n2C 775369134 KOUFKWVOCKOKSR-GFCCVEGCSA-N 401.467 2.201 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3cnccc3C)CC2)cc1 778420263 UDIDEHSIXQOBKP-GFOMBABLSA-N 408.502 2.481 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3cc(S(=O)(=O)N(C)C)cn3C)cc2)CC1 778675289 GEMZLUTVGSEWBY-UHFFFAOYSA-N 418.563 2.442 10 20 HECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)CCC3)c1C 783182869 CNZJBDRLCHUINR-UHFFFAOYSA-N 418.515 2.248 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1 785294989 GCSVXOPKZJVHRR-CQSZACIVSA-N 415.515 2.337 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccnc(OCC(F)(F)F)c1 787277649 JDJBULHOBMMJGT-UHFFFAOYSA-N 424.423 2.330 10 20 HECD CCCCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(C)C 788314180 ZOUYEHSCDYYQGP-PMACEKPBSA-N 417.550 2.239 10 20 HECD CCOC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 788736461 IILYQULTHGBLBU-UHFFFAOYSA-N 412.489 2.344 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 793685292 HGROMURLHLHHAB-ROUUACIJSA-N 411.502 2.284 10 20 HECD COc1ccc(C)cc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 799818340 ZIYJEEGNAAFLSS-UHFFFAOYSA-N 417.531 2.151 10 20 HECD C[C@H](NC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(N(C)C)cc1 799976110 UXUCKYNZIIJWQW-INIZCTEOSA-N 408.568 2.413 10 20 HECD COc1c(C)cnc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1C 803688668 YMCGOBUUXBOHBH-UHFFFAOYSA-N 410.518 2.364 10 20 HECD C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806493910 IBUUDWMRCPESBR-SLYNCCJLSA-N 413.566 2.157 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100755 PTGOXMVHWCAEAF-GOSISDBHSA-N 410.518 2.081 10 20 HECD CNS(=O)(=O)c1ccc(-c2ccc(/C=C3\N=C(C4=S=CC=C4)OC3=O)o2)cc1 812446462 DCCUPZBJUDBYKC-PTNGSMBKSA-N 414.464 2.429 10 20 HECD NS(=O)(=O)c1c(NCc2ccc(N3CCSCC3)cc2)cccc1[N+](=O)[O-] 917390744 DIMSOHADGSFZAU-UHFFFAOYSA-N 408.505 2.408 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccccc3)cc2)C1 918116890 BUUIPYKGFJRVHG-SFTDATJTSA-N 424.545 2.039 10 20 HECD Cc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1[N+](=O)[O-] 918338210 LDBCYZSSYNTBGB-UHFFFAOYSA-N 403.460 2.068 10 20 HECD Cc1c[nH]cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005710 XBDFMRZVYOQCFY-FQEVSTJZSA-N 419.865 2.145 10 20 HECD COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1C 18535744 WLADSWWUHCHPSI-UHFFFAOYSA-N 401.463 2.300 10 20 HECD C[C@H](NC(=O)Cn1nc(-c2ccccc2)oc1=O)c1ccc(N2CCOCC2)cc1 115952563 WQBUVCKTMCMUQV-INIZCTEOSA-N 408.458 2.217 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2nccnc2c1)c1ccc(N2CCOCC2)cc1 141699602 GKVVAPZHPUQFQN-HNNXBMFYSA-N 405.458 2.282 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)N(C)C[C@H]2COc3ccccc3O2)c(O)c1O 727003699 CVCAYGPEDHOJMO-KBPBESRZSA-N 401.415 2.250 10 20 HECD C[S@@](=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 737110499 BPTPWMHWIUKORM-SFNQZPIRSA-N 416.499 2.276 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3cccc(C(=O)NC4CC4)c3)n2)cn1 743047114 QDBNMPKOXKQKPE-UHFFFAOYSA-N 403.489 2.237 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3ccc(N4CCOC4=O)cc3)n2)cn1 743050421 RQGUCRAPIFNXNT-UHFFFAOYSA-N 405.461 2.301 10 20 HECD COc1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1-n1cnnn1 743193041 IKMMCBDARMWKNE-OAHLLOKOSA-N 423.477 2.390 10 20 HECD CCc1nncn1CCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743699280 FEDUYTMRTYSRFM-AWEZNQCLSA-N 408.453 2.410 10 20 HECD CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743954986 FMKIOSCSEFTBFK-UHFFFAOYSA-N 416.499 2.071 10 20 HECD CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 749555631 RNLAJHUCAPRTHF-NLWGTHIKSA-N 401.555 2.060 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)[C@H](C)Oc4ccccc43)CC2)cc1F 753739287 DOGAVZKYMWVAJI-HNNXBMFYSA-N 413.449 2.297 10 20 HECD NC(=O)c1ccc(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 753933423 WEMRPGUAMRUFOK-UHFFFAOYSA-N 419.432 2.250 10 20 HECD CCOc1ccc(C(=O)NCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754027885 HTXFQPJSOGPMAD-UHFFFAOYSA-N 415.465 2.312 10 20 HECD CC(=O)N1CC[C@H](CN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 755044258 CAHZTOMZHJAGNX-MRXNPFEDSA-N 419.481 2.201 10 20 HECD O=C(O)[C@@H](Cc1ccc2c(c1)OCO2)NCc1ccc(N2CCOCC2)c(F)c1 756358733 CMTWDHNYSONRSF-QGZVFWFLSA-N 402.422 2.177 10 20 HECD O=C(O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Br)s1 757658166 XTIJAVGEGNNLQV-UHFFFAOYSA-N 422.234 2.413 10 20 HECD COc1ccccc1OCC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759224269 DUSVJLZKWLYMKE-UHFFFAOYSA-N 416.474 2.449 10 20 HECD CCC[C@@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 770215598 ZJZOLTMEBXRZPI-LRAJWGHMSA-N 410.486 2.150 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(NS(C)(=O)=O)c(F)c2)cc1 771164982 ZSLCISXMRGCWQE-UHFFFAOYSA-N 415.512 2.084 10 20 HECD C[C@H](NC(=O)N1CCC(C)(C)S(=O)(=O)CC1)c1ccc(N2CCOCC2)cc1 774797772 UQWNQYDIVNPDGU-INIZCTEOSA-N 409.552 2.193 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(S(N)(=O)=O)c(C)c1 775227276 ZCTHVZQIRKFREF-UHFFFAOYSA-N 404.536 2.440 10 20 HECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1cc(OC)c(OC)cc1O 775756407 BMTSSRVOGHCBEB-UHFFFAOYSA-N 415.490 2.418 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](OCC(C)C)C3)CC2)cc1 778323876 LGELYGFWJXOZFY-GEPASTNRSA-N 415.534 2.174 10 20 HECD CN(CC1(O)CCOCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 780507208 NSKKUXVEQZNYMO-OAHLLOKOSA-N 413.465 2.440 10 20 HECD COc1c(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cccc1C(N)=O 782781846 RWGQGQDNGWHDAL-UHFFFAOYSA-N 424.501 2.382 10 20 HECD O=C(COC(=O)c1ccccc1S(=O)(=O)CC(F)F)c1ccc(O)c(O)c1 783587346 GMIUQSZJQNGQHP-UHFFFAOYSA-N 400.355 2.176 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1 786117562 NNWMMXSKUNEODJ-UHFFFAOYSA-N 405.502 2.222 10 20 HECD COC(C)(C)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 787128371 GKHPPVKZCYULBU-GASCZTMLSA-N 410.486 2.414 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(c3ccccn3)CC2)C2CC2)cc1 788640992 HTSKMUPQXHVCAZ-UHFFFAOYSA-N 421.545 2.424 10 20 HECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819164 MHGTXIVQWQLVHA-JZXOWHBKSA-N 421.513 2.083 10 20 HECD CSCC[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789840154 FTLDYLOWCRKQJQ-AWEZNQCLSA-N 411.543 2.003 10 20 HECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCCCSc1nccs1 790941441 WOEWLXXSXJZQCS-GFCCVEGCSA-N 409.537 2.008 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C)[C@H](Cc4ccccc4)C3)CC2)cc1 792944859 YPGAGVKZDPTHAA-HSZRJFAPSA-N 422.573 2.203 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(C(=O)NCCOC)c2)cc1 795805145 CUODZAYEGCQXCU-UHFFFAOYSA-N 419.547 2.388 10 20 HECD COC1CCC(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803298414 APEPTQYAXVCPSM-XPQZIERPSA-N 417.550 2.412 10 20 HECD CN(Cc1ccccn1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450899 TYCJXAGJJFVZOJ-UHFFFAOYSA-N 418.444 2.427 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN2C2CCCCC2)cc1F 803661783 MYMSIXXFGMYPFJ-SFHVURJKSA-N 404.530 2.421 10 20 HECD O=C(Nc1cccc2c1CNC2=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 806844884 XQXRGWRNOXQAJG-UHFFFAOYSA-N 405.410 2.396 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)ccc1O 807385464 PTTMCDVCAZXGRP-UHFFFAOYSA-N 400.460 2.355 10 20 HECD COC[C@@H](C)[C@@H](C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 812479465 CJJUHEVHZDQCFZ-IAGOWNOFSA-N 415.513 2.477 10 20 HECD Oc1c(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)ccc2ccccc12 816514030 KDGBLMZTPUPXMJ-UHFFFAOYSA-N 405.502 2.494 10 20 HECD COc1ccc(N2CCN(CCNC(=N)N[C@H]3CCOc4ccccc43)CC2)cc1 849091224 LZCNPGAZHXVJPB-NRFANRHFSA-N 409.534 2.455 10 20 HECD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 919859607 BKMRYOBYDHONOH-KGENOOAVSA-N 422.464 2.272 10 20 HECD O=C(c1cc(F)c(F)cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250622 SMSNTCHNVCQWPR-UHFFFAOYSA-N 407.348 2.041 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3c(F)cccc3F)CC2)cc1 38598321 XGIKXIMWESKRPT-UHFFFAOYSA-N 411.474 2.074 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@@]4(CCc5ccccc5C4)C3=O)CC2)cc1 69005047 XTRVWZZSPHYETQ-XMMPIXPASA-N 420.513 2.254 10 20 HECD CN(c1ccc(CNC(=O)NCCN2CCCS2(=O)=O)cc1)C1CCCCC1 726247536 MIYGSLORYZKCKD-UHFFFAOYSA-N 408.568 2.290 10 20 HECD COC(=O)CSCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 729855701 IANIDCGPQLKVJL-OKILXGFUSA-N 413.515 2.145 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccccc1S(=O)(=O)N(C)C 734519607 ZKAJLKJYJBDWHD-UHFFFAOYSA-N 404.536 2.311 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1F 743598525 LMVXUSCDWQQLIT-KBXCAEBGSA-N 416.501 2.399 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@]1(O)CCN(Cc2ccccc2)C1 746280270 OMNDAZKWUQUVGP-RUZDIDTESA-N 423.557 2.149 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)o1 748639662 ITVHWEIQVPKCAY-UHFFFAOYSA-N 416.477 2.327 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1OC 751240614 TZQKARIHYRVKOR-UHFFFAOYSA-N 420.531 2.391 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCC(=O)N2C)NC(=O)OC(C)(C)C)cc1 752481188 OVPRYUQLINZSGA-SJORKVTESA-N 404.511 2.055 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(Cc4ccco4)C3)CC2)cc1F 753737878 GEVYGISXKDNCEK-OAHLLOKOSA-N 401.438 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1F 753739687 YAKPFMBZRXSEMT-CALCHBBNSA-N 417.481 2.048 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(NC(C)=O)cc3)CC2)cc1F 753861039 LERRZOQMPWADPK-LJQANCHMSA-N 417.481 2.355 10 20 HECD COc1ccc(N2CCN(Cn3cc(I)cn3)CC2)cc1F 754014908 UGEMFWLYICVAMI-UHFFFAOYSA-N 416.238 2.415 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754040382 PGNQYYBPBYOZCF-UHFFFAOYSA-N 422.478 2.273 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@H]3CCN(C)C[C@H]3C)cc2F)CC1 754370869 WDVABUGAKGNQER-XLIONFOSSA-N 405.562 2.449 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnc(Br)c1 758176404 CXNGJEYTNVOVPG-UHFFFAOYSA-N 424.320 2.009 10 20 HECD O=C(NCCCSc1nccs1)N1CCN(C(=O)c2ccc(O)cc2)CC1 759601539 NLCWIMMFJCKQQC-UHFFFAOYSA-N 406.533 2.499 10 20 HECD O=C(N[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1)c1cccnc1 762275236 PEJXMFXPGODTII-IBGZPJMESA-N 405.454 2.193 10 20 HECD CCN(CC)c1ccc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)cc1 769465325 FWLHUACMGXACDQ-UHFFFAOYSA-N 410.566 2.482 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C[C@H](O)C(F)(F)F 774771440 IAGFVTIZYDEKHS-INIZCTEOSA-N 406.360 2.256 10 20 HECD COC(=O)c1cc(NC(=O)CN[C@@H](C)c2cc(OC)ccc2O)cc(C(=O)OC)c1 775374775 FRTVWOJUDBZEDH-LBPRGKRZSA-N 416.430 2.263 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1cc([N+](=O)[O-])nc1C 777828690 OPJRDOGXGLYSFO-UHFFFAOYSA-N 410.814 2.051 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C(C)=O)ccc3O)CC2)cc1 778422735 GICZMOJGZQHWIG-KTKRTIGZSA-N 423.469 2.447 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 781952003 QKHQMYZQXCEGED-FQEVSTJZSA-N 410.430 2.241 10 20 HECD CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785423883 IFLAMYPFSATCHI-NRFANRHFSA-N 408.546 2.349 10 20 HECD C[C@H]1c2c(F)cccc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324896 ZJISGSMRWVYHLU-INIZCTEOSA-N 411.477 2.424 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc2c(c1)CC(=O)N2C 788934755 YXJYKDKRYQHBBY-MRXNPFEDSA-N 420.513 2.299 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCc2ccccc2C1 789801894 VVOGCJONUJQBNR-UHFFFAOYSA-N 411.477 2.254 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cccc1NC(=O)N(C)C 792369616 FYXNXCVXSWATLT-LBPRGKRZSA-N 414.462 2.186 10 20 HECD COc1ccc(CNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c(O)c1 797629573 JFFBMFFROZEYDA-UHFFFAOYSA-N 416.459 2.312 10 20 HECD C[C@@H](NC(=O)C(=O)NCC(C)(C)c1ccncc1)c1ccc(N2CCOCC2)cc1 803298674 WEQZBKDROKPSSV-QGZVFWFLSA-N 410.518 2.189 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3nccn3C)C2)cc1F 804851669 KRDRCHXGDXBGJS-QGZVFWFLSA-N 415.513 2.428 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1nncn1C 805824024 SRUGGYFKZZAZLB-ZDUSSCGKSA-N 403.442 2.050 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NCc2cc(OC)ccc2O)s1 806809947 FAOYEPKFZRPHGG-QWRGUYRKSA-N 407.496 2.277 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(CCN(C)C)Cc1ccccc1F 807098581 YUDFXEDPVIMJJR-UHFFFAOYSA-N 414.525 2.407 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)cc1 807544878 HDAZPMUGYNOGAO-UHFFFAOYSA-N 401.511 2.195 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1ccc(N(C)C)cc1 807670953 JWGGTNOSMRCCDH-IRXDYDNUSA-N 416.566 2.331 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc2c(c1)OCO2 814330434 QKRKNCZRBMNNRQ-OAHLLOKOSA-N 416.499 2.070 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1Cl 912984152 JUNHOXWBZPUEAB-UHFFFAOYSA-N 402.881 2.447 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([C@H](C)NC(C)=O)s3)CC2)cc1 918740462 SMECCOWMDACWIG-AWEZNQCLSA-N 423.560 2.465 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 1116577614 UMZYGBUUQREPAO-SFHVURJKSA-N 418.515 2.051 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](c3ccccc3)c3cnn(C)c3)CC2)cc1 1320886244 UVHSJMGMVHZKHU-XMMPIXPASA-N 419.529 2.457 10 20 HECD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1337655552 ZUGNWJUWVDSVAQ-QGZVFWFLSA-N 424.906 2.160 10 20 HECD C/C=C(\C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790246042 HDMLAWHAUKMLTD-KOCKHJGFSA-N 408.882 2.311 10 20 HECD CSc1cccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1O 1844716697 KIQSMEWTEGVJDV-UHFFFAOYSA-N 415.471 2.051 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 740910448 QFEZZHMCTCEZDZ-WDYCEAGBSA-N 409.552 2.239 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccccc1CN1CCOCC1 743954540 BRDLQNPSSJXLPL-UHFFFAOYSA-N 423.513 2.358 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cc(F)ccc3F)CC2)cc1 745549272 PFFSEFAFZNJACI-UHFFFAOYSA-N 404.413 2.408 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC(C(=O)Nc3nncs3)CC2)cc1F 746978103 JPQFEHMZNJSAIE-UHFFFAOYSA-N 406.487 2.304 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](c4ccco4)C3)cc2)C1 753928307 FZZUROMJFYRNLE-YLJYHZDGSA-N 412.490 2.264 10 20 HECD COc1ccc(N2CCN(c3ccc(S(N)(=O)=O)c4cccnc34)CC2)cc1F 754026168 MSJQHNROYZWRNS-UHFFFAOYSA-N 416.478 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N(C)C)cc3)CC2)cc1F 754213792 VCQGJBUEVPEWHP-UHFFFAOYSA-N 400.454 2.188 10 20 HECD COc1cc(N2CCN(Cc3csc(NC(C)=O)n3)CC2)cc(OC)c1OC 759871438 BDWMBZLGABMINC-UHFFFAOYSA-N 406.508 2.450 10 20 HECD C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762090555 ADOQWQOOBYGAQQ-KBPBESRZSA-N 419.494 2.379 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1scnc1C1CC1 763119659 SYTDSHPHXDNFIF-UHFFFAOYSA-N 400.504 2.454 10 20 HECD Cc1cc(NC(=O)CSCC(=O)NCc2cccc(Br)c2O)no1 765753029 MKFIPYOPDPDFQY-UHFFFAOYSA-N 414.281 2.439 10 20 HECD O=C(NCCc1ccc(CO)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 776040888 FTAKZVGZSRUFNL-UHFFFAOYSA-N 401.482 2.321 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CCO)c3ccccc3)CC2)cc1 778377923 JIPVOXNAVXOYOC-LEQVUBRHSA-N 423.513 2.140 10 20 HECD CCCN(Cc1ccccc1O)C(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O 779484206 ATDAHZUVLFEYIR-UZLBHIALSA-N 420.531 2.167 10 20 HECD O=C(NCc1ccc(Cn2cccn2)cc1)C(=O)NCc1ccc(N2CCCC2)cc1 788460468 FMFVYRZJCOTQHW-UHFFFAOYSA-N 417.513 2.464 10 20 HECD CN(C)S(=O)(=O)c1cccc(NC(=S)NNc2ccc3c(=O)[nH]ccc3c2)c1 789319614 LRBOZBKIFGMBIV-UHFFFAOYSA-N 417.516 2.092 10 20 HECD CSCCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789819139 LYHVZEHZOOMYLB-HUUCEWRRSA-N 411.543 2.315 10 20 HECD Cc1cncc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 789820992 RKTSWXKAUUEPDS-HZPDHXFCSA-N 414.481 2.075 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1cccc(F)n1 793011212 GVARNOKDSBENQF-UHFFFAOYSA-N 411.481 2.008 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@H]3COCCN3C(=O)OC(C)(C)C)CC2)cc1 794763938 NMOPVGHPIOVFGN-SFHVURJKSA-N 419.522 2.370 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(S(C)(=O)=O)nc1 795074218 WWELMIMQHZQGEP-UHFFFAOYSA-N 411.549 2.150 10 20 HECD C[C@H](Oc1ccc(C=O)cc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795396979 NOBIBWNUAWGYRT-LPHOPBHVSA-N 409.486 2.285 10 20 HECD CC(=O)N1CCN(C(=O)CCNCc2ccc3c(c2)CCN3Cc2ccccc2)CC1 796290495 ZZGRGFAVMXCEMJ-UHFFFAOYSA-N 420.557 2.420 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nccn3C)cc2Cl)C1 804624861 CBZJGICJFMQZOE-AWEZNQCLSA-N 403.914 2.242 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(c4ccccn4)CC3)cc2)CC1 805025249 MEQHTWBSNQDWJN-UHFFFAOYSA-N 421.545 2.283 10 20 HECD COc1cc(O)c(CNc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1OC 809683615 GCJHEFAQVKSWDM-UHFFFAOYSA-N 408.476 2.471 10 20 HECD COCC[C@H]1COCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 813321578 YJKHGFDEYZADQX-ZDUSSCGKSA-N 424.409 2.248 10 20 HECD CCN(CC)c1ccc(CN(C)S(=O)(=O)c2cccc(S(N)(=O)=O)c2)cc1 875930531 WIYSFBITSGEYDC-UHFFFAOYSA-N 411.549 2.001 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(C3CCCC3)CC2)c1 914568554 WNPDRSBRGNGWMQ-UHFFFAOYSA-N 401.551 2.487 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917709090 DEHQSQSPEWWDIC-CHWSQXEVSA-N 402.470 2.289 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918439513 MIIKKURCSVQUMJ-UHFFFAOYSA-N 401.438 2.050 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C/C=C\c3ccccc3)CC2)c1 919806100 MRLAQRLWVBJIBX-YVMONPNESA-N 415.515 2.235 10 20 HECD COCCCN(C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 921205109 QKCVAZRWYLARAQ-UHFFFAOYSA-N 423.447 2.210 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc2c(cnn2C(C)C)c1 1324121030 MYKOQQBUSUEQRR-INIZCTEOSA-N 412.446 2.328 10 20 HECD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1514747694 JFRPFISOPGAYMR-LJQANCHMSA-N 418.515 2.123 10 20 HECD CCOCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1787741240 PNVWDLYWDCGAAK-UHFFFAOYSA-N 421.544 2.017 10 20 HECD CC(C)=CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804335970 OCYZJJJOGYFZOV-QDMKHBRRSA-N 409.577 2.231 10 20 HECD O=C(C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1 1842608056 DJYBDGQESIBVIK-UHFFFAOYSA-N 414.845 2.451 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)n(C)c2ccccc12 472813774 UDDNSVFURXEAND-OAHLLOKOSA-N 409.490 2.369 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H](N2CCCCC2=O)C1 732823774 AWHOXWNKBQGOEL-FQEVSTJZSA-N 400.523 2.210 10 20 HECD CCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc21 737144419 FEDXRBLLPUESHT-UHFFFAOYSA-N 407.474 2.148 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1 737182210 FSWIBAOKVPBQRS-CABCVRRESA-N 413.474 2.442 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1C 742266880 QFJAPZVRWGTWFZ-UHFFFAOYSA-N 404.488 2.301 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cccnc3[N+](=O)[O-])cc2F)C[C@H](C)O1 742277837 GDEVCHNONXBNPK-STQMWFEESA-N 424.454 2.221 10 20 HECD COc1ncnc(OC)c1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742806645 SYYNZCURULDHLL-GFCCVEGCSA-N 408.405 2.494 10 20 HECD CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 743699083 IZGAKULEBWRNPH-NEPJUHHUSA-N 423.425 2.403 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1C 751213712 VUYGUIPLZUGOGZ-UHFFFAOYSA-N 424.544 2.348 10 20 HECD O=C(NCCn1cccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752905276 HZKWOKSPFMAPQP-UHFFFAOYSA-N 423.496 2.243 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(CC(F)F)CC3)CC2)cc1F 753894926 YVLZURANNWUWGG-UHFFFAOYSA-N 400.445 2.395 10 20 HECD CN(CC(=O)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 756653297 FGUDQAZSPOLFDM-HNNXBMFYSA-N 422.528 2.129 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@]12CCCO2 759221411 PXNVUUAGRFVVDL-SFHLNBCPSA-N 407.486 2.188 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNc3cc(N4CCSCC4)ncn3)cc2)C1 764782662 HCKVNIQXAKNJIC-KRWDZBQOSA-N 412.563 2.344 10 20 HECD CC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765926661 ORVWJZMERLHVCS-UHFFFAOYSA-N 420.263 2.392 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2cncn2)cc1 765979166 JAIFMXQZRNNWRN-QGZVFWFLSA-N 411.531 2.353 10 20 HECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CCCC1 768913901 HONPRCOTHXZYDM-UHFFFAOYSA-N 420.487 2.257 10 20 HECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 772993944 JMQWYPVFRJPJMI-NPMXOYFQSA-N 424.501 2.406 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@]3(C)CCCOC3)cc2F)C[C@@H](C)O1 781291002 RTWBDVCOUUMLDP-MCFFVMPBSA-N 422.497 2.415 10 20 HECD CCc1cccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786120195 KFTDOVRTYOXYOS-UHFFFAOYSA-N 401.532 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)N3CCc4ccccc43)nc12 788137595 CRUTYZXTDGXWCB-CYBMUJFWSA-N 410.430 2.106 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(C)cs1 789800997 YFECKKNTVXEISG-MRXNPFEDSA-N 420.510 2.311 10 20 HECD COCCN(C)c1ccc(/C=C2/SC(=S)N(CCCC(=O)OC)C2=O)cn1 790106690 UZMHCOGACFFUHK-SDNWHVSQSA-N 409.533 2.319 10 20 HECD CCN(CC)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249181 PQJTVJBVUSJPRZ-KRWDZBQOSA-N 414.572 2.495 10 20 HECD C[C@@H](O)CCCOC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 795630661 SZRDBGVDPHMZKR-GFCCVEGCSA-N 424.431 2.419 10 20 HECD CN1CCN(Cc2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)CC1 799184930 PRCLLCPTZRNCLW-UHFFFAOYSA-N 403.533 2.240 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H](CN2CCOCC2)C1 799886933 GMPHKXDCYXZTFW-FQEVSTJZSA-N 418.607 2.494 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc(C=O)cc3)cc2)CC1 803161888 JBUYGOSMLYPRCA-KRWDZBQOSA-N 409.486 2.251 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 803380560 AJOPJAMKUJHYDJ-MRXNPFEDSA-N 414.472 2.242 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[S@](=O)Cc1ccccc1 805410921 JZPKFIZQDKAOTE-NDEPHWFRSA-N 402.516 2.196 10 20 HECD COC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCO1 807952041 CTBABFNYMSZALV-NVXWUHKLSA-N 423.941 2.066 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c1O 808925243 HFBXHVAPHDTYKJ-UHFFFAOYSA-N 416.384 2.428 10 20 HECD COCC[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 813042161 HGIAGBSBWVHYKL-JFIYKMOQSA-N 409.502 2.386 10 20 HECD CCOc1ccc(-c2nnn(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)n2)cc1 913238998 LCVMUNBKFPJGOQ-UHFFFAOYSA-N 422.489 2.096 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3cn4ccccc4n3)cc2)C1 918006244 TWPXIAIRISVGCB-GOSISDBHSA-N 420.517 2.078 10 20 HECD C[C@@H](NC(=O)Cc1ccccc1NS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 1251761587 ILMGBIXLZGECBB-MRXNPFEDSA-N 417.531 2.315 10 20 HECD Cc1cnn(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)c1 1788426767 QZWPULVTEIWUNU-UHFFFAOYSA-N 421.457 2.446 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccnc1Cl)c1cc(O)nc(O)c1 1794528114 LAOMGVDINOWRQV-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD O=C(/C=C/c1cccnc1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1807163342 SZTMOGZSKHEFLN-SNAWJCMRSA-N 422.485 2.446 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)C1 1810554625 QFYXVXMBLMBIAH-ZTFGCOKTSA-N 415.515 2.213 10 20 HECD COCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824060870 WHFIFTWUXKQCKW-KRWDZBQOSA-N 405.495 2.153 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cncc(F)c2)C1 1842500829 JSWDMDGCHIKSNZ-UHFFFAOYSA-N 405.813 2.416 10 20 HECD C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 109190404 RKRLMRDNAWIGGO-OAHLLOKOSA-N 412.446 2.039 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3ccc(S(C)(=O)=O)nc3)CC2)cc1 726608880 RFQOWHHVUORTHM-UHFFFAOYSA-N 404.492 2.284 10 20 HECD O=C(NCCCOCC1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 740908035 VSYLVHNNUCTFAI-UHFFFAOYSA-N 409.502 2.295 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741096703 BZUGPUFJCKOSKO-UHFFFAOYSA-N 413.449 2.482 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(C1)OCCO2 741779610 YPUJXRGEPMEOEG-AWEZNQCLSA-N 406.438 2.238 10 20 HECD COC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 743554592 IOJCYZZPQAXQSD-MRXNPFEDSA-N 417.428 2.099 10 20 HECD COCCCN(C)CCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 743555268 UOPPIZLHSAAABK-IAGOWNOFSA-N 410.534 2.207 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(N(C)C)cc3F)CC2)cc1 751892724 BXPOECFBRUVXNK-UHFFFAOYSA-N 415.465 2.406 10 20 HECD Cc1cc(C(=O)O)c(F)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 753771059 MJJHQSIHGOTVHD-UHFFFAOYSA-N 402.425 2.005 10 20 HECD NC(=O)c1ccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 754274833 QHZRPEQGNBDRSC-GOSISDBHSA-N 401.894 2.468 10 20 HECD Cc1cc(C(=O)CN2C(=O)N[C@]3(CCOC3)C2=O)c(C)n1-c1ccc2c(c1)CCC2 755853243 YDKHBIHGRFDEQK-QHCPKHFHSA-N 407.470 2.476 10 20 HECD C[C@@H](NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1O 756711446 KOTBXYGUTLVRMG-SNVBAGLBSA-N 401.391 2.208 10 20 HECD Cc1cc(C(=O)N(CCCN(C)C)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 758278069 CDPGYXOEVZNSQF-SFHVURJKSA-N 418.563 2.070 10 20 HECD COc1cc(CCNC(=O)COC(=O)c2cccc(O)c2O)ccc1OC(F)F 758560717 VZKXZTWOEVIMHC-UHFFFAOYSA-N 411.357 2.224 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnc([C@@H]4CCCO4)s3)nc12 760667983 FSMHWWSWXVAAID-LBPRGKRZSA-N 418.431 2.277 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(OC)c1O 763937927 LZANSQSPELGGSN-UHFFFAOYSA-N 404.438 2.440 10 20 HECD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCc1ccc(O)c(O)c1 768913983 KFCROTLIYOLSCO-UHFFFAOYSA-N 404.488 2.131 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc4c(c3)NC(=O)CO4)cc2F)C[C@@H](C)O1 770676228 NJDNLEBAAZNBCN-BETUJISGSA-N 414.437 2.095 10 20 HECD C[C@H](NC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(N(C)C)cc1 776127999 HLNVWXPNPANNRA-RCDICMHDSA-N 409.490 2.368 10 20 HECD COc1ccc(OC)c(S(=O)(=O)N2CCN(Cc3cc(F)ccc3O)CC2)c1 778994054 GTKIBRQOBOYMPX-UHFFFAOYSA-N 410.467 2.055 10 20 HECD COC(=O)c1cnc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 779662009 ODXDVTNPSKZLAH-UHFFFAOYSA-N 406.389 2.263 10 20 HECD CC(=O)N1CCN(C(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)CC1 782721373 IWUAGLOPGZOKPP-UHFFFAOYSA-N 415.515 2.217 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cc1 785429271 YQADJKZSXUARRF-UHFFFAOYSA-N 414.550 2.010 10 20 HECD COC(=O)[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[C@@H]1C 787328789 UKJBEAWJYMXBQS-UKRRQHHQSA-N 406.438 2.284 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)nc3-c3ccoc3)cc2)CC1 790045209 CCUJMIOBPXDSMQ-UHFFFAOYSA-N 407.474 2.279 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CNCc2ccc(S(=O)(=O)CCO)cc2)c1O 791007497 XMWDRKMJHWGMLB-UHFFFAOYSA-N 400.840 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc(C(C)C)nc3)CC2)cc1F 796925891 QUJXCWWMEPAURY-UHFFFAOYSA-N 401.442 2.035 10 20 HECD CNC(=O)COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(C)c1 797023383 ZMACFQFJLJSQBY-OAHLLOKOSA-N 412.490 2.002 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2COC3(CCCCCC3)O2)cc1F 803663916 APOYFHGZHQLQRB-INIZCTEOSA-N 407.486 2.090 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(c4ccccc4)CC3)CC2)cc1 804317289 YURXFENFTVKYIM-UHFFFAOYSA-N 422.529 2.129 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc2)CC1 805025637 RWBIZGZGYYRYQD-WIYYLYMNSA-N 400.567 2.480 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCCN4C)C3)cc2)CC1 805026227 GWVUTFXXMJFTOV-UNMCSNQZSA-N 412.578 2.482 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2COC(=O)N[C@H]2CCOC2)cc1F 806634287 JMCYPEFYIXVBRL-DLBZAZTESA-N 422.501 2.471 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)C1 813837392 KTUSUWKHONGWHD-QQOXCAACSA-N 417.506 2.265 10 20 HECD CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1 918371471 HQPXHJKUEAYNMZ-UHFFFAOYSA-N 403.504 2.462 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918461764 KTLFCDKRWZESDG-UHFFFAOYSA-N 424.501 2.041 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CC(=O)N(Cc2ccco2)C1 919968291 AJADJNBRAZJWNV-LJQANCHMSA-N 411.502 2.153 10 20 HECD Cn1nnnc1-c1ccc(NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 1131017513 ZGOYPZADYNVTDL-UHFFFAOYSA-N 404.455 2.346 10 20 HECD COC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423889 AHMBZAPOEQDALZ-INIZCTEOSA-N 405.495 2.151 10 20 HECD CC(C)Cn1c(N)c(C(=O)CSc2ncc(-c3ccccc3)n2C)c(=O)[nH]c1=O 10350288 MGELSVOUGDGKEY-UHFFFAOYSA-N 413.503 2.150 10 20 HECD Cc1c(CNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)n(C)c2ccccc12 473258909 CBZXYZXCRRVCJD-GOSISDBHSA-N 407.474 2.293 10 20 HECD CC1(C)Cc2cc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)ccc2O1 729687890 FRWINDISEDNTEP-NTEUORMPSA-N 412.558 2.151 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1c(C)nc2c(C(N)=O)cnn2c1C 734407261 KKUDXAHVMMGCEY-UHFFFAOYSA-N 408.506 2.068 10 20 HECD CN(C)C(=O)c1cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccn1 735884475 CPWUZEDWHJYIHA-UHFFFAOYSA-N 411.506 2.314 10 20 HECD COc1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 737130628 FKLOXFYIUMCBEC-UHFFFAOYSA-N 415.465 2.359 10 20 HECD CC(C)CCn1nccc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 746365713 QBWPXOLFMBYFTB-UHFFFAOYSA-N 413.522 2.363 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 750637052 JHYJGPPHGLYMCZ-IIAWOOMASA-N 404.486 2.002 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751238942 GIRDXIVDVHHMQM-UHFFFAOYSA-N 418.515 2.160 10 20 HECD O=S(=O)(C[C@H]1CCCCO1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751358707 GCYFPQMZUUMXCT-IAGOWNOFSA-N 402.944 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)NCCc3nnc4n3CCCCC4)CC2)cc1F 753835063 ZBPKSLKVSZHJBZ-UHFFFAOYSA-N 416.501 2.227 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)CC2)cc(OC)c1OC 759293943 OYWUYHFHPLVECL-JKSUJKDBSA-N 418.538 2.169 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCc1nnc2n1CCCCC2 760979249 HEODESCANYBJQK-UHFFFAOYSA-N 403.870 2.370 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCSC3)cc2F)C[C@@H](C)O1 762036449 OAYKFTKQSYAEGL-FMKPAKJESA-N 410.511 2.352 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC([C@@H](O)C(F)(F)F)CC1 765690648 QZFPVDWSMMGHOJ-QGZVFWFLSA-N 401.429 2.368 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1Cl 766435030 WBDOCEYQCCAHDH-CQSZACIVSA-N 402.882 2.375 10 20 HECD COc1ccc(O)c(CNC(=O)CC(C)CC(=O)NCc2cc(OC)ccc2O)c1 768080141 NCXREPONYPQAOL-UHFFFAOYSA-N 416.474 2.464 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1C 774117893 NXIPJYVUODNGKK-UHFFFAOYSA-N 411.414 2.278 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2nc(N(C)C)no2)cc1 776640702 JPSHGGBBGJEYIR-GOSISDBHSA-N 401.511 2.342 10 20 HECD C[C@@]1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCOC1 781146843 CMNJCJCXUUZMER-JOCHJYFZSA-N 413.497 2.375 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCc2cn3ccccc3n2)cc1 786142706 ACLPBDBQNWIHJF-UHFFFAOYSA-N 407.518 2.498 10 20 HECD CN1C(=O)Cc2cc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 788707717 XOHOYONTXRABOP-INIZCTEOSA-N 421.501 2.229 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)cc1 788977739 MHPULZCIHBZJIS-BSRJHKFKSA-N 417.550 2.334 10 20 HECD CC(C)Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855466 ROPNWBTWDMWLBR-UHFFFAOYSA-N 415.563 2.025 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ncccc3Br)CC2)cc1 793246852 KQUYCBUPSCJKMM-UHFFFAOYSA-N 419.323 2.405 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c(O)c1 797389776 XRDCXKRGUGLECV-MRXNPFEDSA-N 418.421 2.353 10 20 HECD Cc1cnc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803299741 NEYRGVZXNPUUMH-HUUCEWRRSA-N 402.520 2.343 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 803688953 GNAZXEXMRQMPFH-UHFFFAOYSA-N 422.529 2.043 10 20 HECD CC(C)O[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1(C)C 809438194 KXZNXCSBWWPMDF-WOJBJXKFSA-N 417.550 2.190 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CC(=O)N(C)C2)c(C)n1-c1ccc2c(c1)OCCO2 914918561 BNELMAOHEDJADJ-OAHLLOKOSA-N 412.442 2.070 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCN(c2ccncc2)CC1 918220076 SOZXWHJSDRTIMB-UHFFFAOYSA-N 413.497 2.214 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccccc3F)CC2)cc1 920254792 QDVYJCVTTLKHGW-KHPPLWFESA-N 411.477 2.398 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1323237430 AKUVIEBANXNZLV-QGZVFWFLSA-N 408.502 2.494 10 20 HECD CCOC(=O)/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1795473034 WFESKKUNASENDC-FBKAWLDUSA-N 422.865 2.122 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)[C@H](O)c1ccco1 1800713154 GUUKJNAOTLNIJB-SJBDTSRBSA-N 420.849 2.330 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(-c2ccccc2)on1 1847199551 OQEFXRPVYUJBME-IRXDYDNUSA-N 420.425 2.277 10 20 HECD COc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1SC 727177098 WKQRPQJTVOXSDE-LCYFTJDESA-N 418.587 2.168 10 20 HECD CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)Cc2ccccc21 727832875 NGNXPYCFGDILQR-UHFFFAOYSA-N 412.509 2.231 10 20 HECD C[C@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2NC1=O 741097490 SOZCCAIBMYJJSD-CQSZACIVSA-N 406.442 2.037 10 20 HECD C[C@H]1COCCN1CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745802375 LKOQZBHFBIFLGG-JKSUJKDBSA-N 412.481 2.277 10 20 HECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1 747841317 GSBMLWVERMCMII-UHFFFAOYSA-N 414.531 2.296 10 20 HECD COc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 748468426 XBCKKXWBSWTVJT-ZIAGYGMSSA-N 416.453 2.098 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1NC(=O)CN1CCCCC1 748476377 LOBLYWGATKOSSN-UHFFFAOYSA-N 424.501 2.380 10 20 HECD CC(C)(C)OC(=O)[C@@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 748832060 DEULEUXQLBASAQ-IBGZPJMESA-N 421.513 2.085 10 20 HECD COC(=O)Nc1cccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758234182 ZGSIYTPVIXPHJS-LJQANCHMSA-N 415.490 2.435 10 20 HECD O=C(CN1CC(=O)N[C@H]2CCCC[C@@H]21)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 758780902 UWNVQMSRHRCNEM-PMACEKPBSA-N 417.465 2.144 10 20 HECD CCN(CC)C[C@@H](C)NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759278576 OUVRMWDBMHSZBS-MRXNPFEDSA-N 408.543 2.274 10 20 HECD CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1 761635008 BPNQEHIYERSMJS-UHFFFAOYSA-N 405.476 2.245 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1O 768087217 SZRMXJRIWHPBAC-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CC(=O)Nc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(F)c1 772899727 VRVZYURXKWAQRT-UHFFFAOYSA-N 419.428 2.455 10 20 HECD C[C@H](NC(=O)C(=O)NCC1(N(C)C)CCCCC1)c1ccc(N2CCOCC2)cc1 774815487 LDPSKTKMYVCTTL-SFHVURJKSA-N 416.566 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(OC)nc3C)CC2)cc1 778326458 PPVRKLJMKCMVJJ-LUAWRHEFSA-N 410.474 2.251 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCNC4=O)cc3)c2)CC1 781045580 LAGRRJHMJLTDRD-UHFFFAOYSA-N 407.474 2.137 10 20 HECD O=C(OCCCN1CCCC1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407383 JNVJWRJBQAKNNJ-UHFFFAOYSA-N 424.500 2.424 10 20 HECD C[C@H](NC(=O)N(C)CCN1CCOC(C)(C)C1)c1ccc(N2CCOCC2)cc1 788909788 RYCZPCPHGWROLH-SFHVURJKSA-N 404.555 2.336 10 20 HECD O=C1N[C@H]2CCN(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C[C@@H]2CO1 798426703 HNYGXJHTXWIPND-KEYYUXOJSA-N 424.448 2.397 10 20 HECD CO[C@H](C)CS(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 800831001 OUMUXTMTUKGZDV-OLZOCXBDSA-N 416.565 2.312 10 20 HECD Cc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)co1 801390829 PPSRBQCRYMAIEB-CHWSQXEVSA-N 405.426 2.209 10 20 HECD COC1CCC(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803309247 SLZWMDPMFKOFNX-VXESANQCSA-N 403.523 2.022 10 20 HECD C[C@H](CO[C@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676433 IGZPPICEKOYLEQ-UTKZUKDTSA-N 417.550 2.382 10 20 HECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)NCCCSc1nccs1 806280552 QSFIYJRPZGAZHG-CYBMUJFWSA-N 407.517 2.390 10 20 HECD CCc1cnccc1[C@@H](C)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809518972 LGOXKPLNCYZJIT-QGZVFWFLSA-N 410.518 2.316 10 20 HECD CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1c(C)noc1C 809617340 NZRSBGFMSZLJQS-IBGZPJMESA-N 414.506 2.354 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H](O)c1ccccc1 812010217 NFBVERROQIHTOK-SCWSEQNSSA-N 410.518 2.310 10 20 HECD CNS(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CC1 816528504 GAEGHLAGPGTDAG-UHFFFAOYSA-N 418.563 2.440 10 20 HECD CCCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C\c2cnn(C)c2)c(O)nc1=O 917112663 VQKOQPBQOMQZER-KHPPLWFESA-N 422.489 2.311 10 20 HECD O=Cc1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 917177758 HZRNQJPUZQLXGK-UHFFFAOYSA-N 417.393 2.078 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C(F)(F)F)nc1O 1255148537 LZKJTEFXTUQIND-NSHDSACASA-N 414.336 2.121 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)nc(C(F)(F)F)n1 1324228225 PKMNVJIIORWMGF-LBPRGKRZSA-N 413.352 2.119 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)cc1 1338347285 KLKJKYIQUOGDGU-MRXNPFEDSA-N 400.523 2.364 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796933133 RLGJMJJZSQBKRN-MCADOKRXSA-N 408.502 2.464 10 20 HECD CC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CCCCC1 1804336339 QAQHOQGKLURWCA-QDMKHBRRSA-N 423.604 2.455 10 20 HECD O=C(C1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426103 LESSVWYPSPVKLW-SFHVURJKSA-N 417.506 2.153 10 20 HECD O=C(COC(=O)c1cncc(O)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 732393791 TWBOQDNRTINFTK-UHFFFAOYSA-N 402.362 2.358 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cnc(C(C)(C)C)nc1)c1ccc(N2CCOCC2)cc1 737157622 KXTZPYYSQSJMFP-OAHLLOKOSA-N 411.506 2.427 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C(C)=O)c4ccccc43)nc12 746478752 LLQURXLOUGLNQS-UHFFFAOYSA-N 409.446 2.375 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CC(=O)N(c2cn[nH]c2)C1 748853377 NZEWOZOELDCPRC-UONOGXRCSA-N 419.432 2.149 10 20 HECD CC(C)CC(=O)N1CCC(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 749197308 AKCXEQXVXVKLIJ-UHFFFAOYSA-N 420.529 2.499 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)NCCCSc1nccs1 751086191 RSTPFPNCDDECHM-UHFFFAOYSA-N 407.926 2.439 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1F 752290925 FBRRPMWJJPNHDM-UHFFFAOYSA-N 403.838 2.262 10 20 HECD CN(CC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc2c(c1)OCO2 756655354 OVVSUOCRHOVCEW-UHFFFAOYSA-N 417.487 2.275 10 20 HECD CCn1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 757259924 PGYXBLVOIURZDV-UHFFFAOYSA-N 407.421 2.228 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(CSC)o3)CC2)cc1 758192395 KWXLKBXDHRJWNN-OAHLLOKOSA-N 410.565 2.216 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccccc3F)CC2)cc(OC)c1OC 759411171 CGJRLWBMLWWJBQ-UHFFFAOYSA-N 417.437 2.139 10 20 HECD O=C(COC(=O)c1cc(O)cs1)Nc1cc(-n2nnnc2C2CC2)ccc1F 761150191 QINKOUNRTPLYQN-UHFFFAOYSA-N 403.395 2.241 10 20 HECD COc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1OC 762167256 GQTBJPXQTGAFGA-UHFFFAOYSA-N 410.467 2.055 10 20 HECD Cn1nccc1CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 762569207 SSYPBSXNXOPBBM-UHFFFAOYSA-N 411.428 2.317 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1F 765504549 VFDZBJVNPBZTNC-GOSISDBHSA-N 423.485 2.119 10 20 HECD CCC[C@](C)(O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770884848 ZJQFVJYGWWIEBY-NRFANRHFSA-N 401.486 2.110 10 20 HECD COc1cc(C[C@H](CO)CNCc2ccc(N3CCN(C)CC3)cc2)cc(OC)c1 771844417 UUUJHHPIACUDDY-NRFANRHFSA-N 413.562 2.396 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773845391 IJKJGGBYTQNGJJ-INIZCTEOSA-N 424.501 2.041 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(=O)n(-c2ccccc2)n1C 773847723 SMYQILYSGHSAJY-HNNXBMFYSA-N 421.501 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C(=O)OC(C)(C)C)C(C)C)CC2)cc1 776028619 QISXDBYSRVYUSI-HXUWFJFHSA-N 405.539 2.300 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccccc3C)CC2)cc1 778246190 RBTJFWUBSJCSSP-VAWYXSNFSA-N 423.513 2.404 10 20 HECD COc1ccc(CCC(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 779503660 SCYNEMLQZAVYFH-IZZDOVSWSA-N 410.470 2.423 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c1 779626834 GIKPOQIUYNWSFU-SFHVURJKSA-N 404.488 2.125 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@]2(N(C)C)CCSC2)cc1 788249669 ZOKPLVPDPLKNHH-OAQYLSRUSA-N 406.596 2.045 10 20 HECD COc1cc(Br)cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)c1O 789768767 ICEHXDKLQSGQCW-AWEZNQCLSA-N 419.341 2.163 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(Cn2cccn2)c1 793809666 FVILHSLCQOCNDY-UHFFFAOYSA-N 405.502 2.272 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1 796646939 MATWMZUXYTXEQI-UHFFFAOYSA-N 400.410 2.103 10 20 HECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCCCSc1nccs1 803975306 AAMOTDSNNQUXDQ-CQSZACIVSA-N 404.561 2.309 10 20 HECD CN(C)CCN(CCc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291146 SVYBPHZWSBRXCJ-UHFFFAOYSA-N 420.557 2.312 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807653543 DVCFXKNUJDLEPJ-GUXCAODWSA-N 408.502 2.240 10 20 HECD Cc1sc2ncnc(NN/C=C3\C(=O)NC(=S)N(CC(C)C)C3=O)c2c1C 814318290 IQBMNFGVMUENHI-VZUCSPMQSA-N 404.521 2.008 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)C1 914905232 GTHFUQIBHDLTCV-KRWDZBQOSA-N 413.474 2.448 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F 917862634 HTXHXBMZMVCZGH-UHFFFAOYSA-N 409.439 2.391 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1 919654212 GFTOKYZASOCGAB-KRWDZBQOSA-N 405.520 2.492 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 1329957711 PGUJIGXAADDFIG-UHFFFAOYSA-N 405.520 2.088 10 20 HECD CCC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361967 CVIWTOVEOKQDLD-GFCCVEGCSA-N 411.487 2.258 10 20 HECD O=C(c1cccc(-c2cnco2)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250658 ZCQSWPPDVICDPX-UHFFFAOYSA-N 420.425 2.279 10 20 HECD Cc1cncc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847039112 MQHJZJZAOHGEIJ-GQCTYLIASA-N 409.442 2.037 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(Cc4ccccc4C)CC3)CC2)cc1 22770801 DYGLOSORLDGMCC-UHFFFAOYSA-N 422.573 2.470 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 60749408 XKUKOVZLABYDGA-UHFFFAOYSA-N 415.515 2.118 10 20 HECD Cc1ccc(CN(CC(=O)N[C@@H](C)C(=O)N(C)C)c2ccc3c(c2)OCCO3)s1 727146717 AJJRHUOBUJLXPL-HNNXBMFYSA-N 417.531 2.427 10 20 HECD COC(=O)CSCc1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 728609905 BHELSCGYKBAYKB-UHFFFAOYSA-N 424.500 2.422 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCSCC3)cc2F)C[C@H](C)O1 732887500 JLVVHCMHBCVOBB-HOTGVXAUSA-N 410.559 2.287 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 733892002 WPLITWYAKPQVQR-DEOSSOPVSA-N 409.530 2.371 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1cccc(OC)c1O)O[C@H](C)C2 737279217 WCLZOVXLHCYIHW-GFCCVEGCSA-N 400.431 2.378 10 20 HECD C[C@@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1 741251719 MDLVQGLKBYEVMM-GOSISDBHSA-N 415.509 2.162 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](NC(=O)C3CC3)[C@@H](C)O)c2C)c1 745739613 JGOSFAGVIXFOGU-IERDGZPVSA-N 412.486 2.404 10 20 HECD NC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(F)c1 747090529 FNNVZOTUTQPGCG-UHFFFAOYSA-N 400.454 2.455 10 20 HECD COC(=O)c1cc(C)c(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 747252456 GOYQMCMDYBJLHL-UHFFFAOYSA-N 418.515 2.405 10 20 HECD Cc1nc(-c2cccc(NC(=O)C(=O)NCCCSc3nccs3)c2)n[nH]1 749731505 QXEBCKLYGLYKGW-UHFFFAOYSA-N 402.505 2.474 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H]1[C@@H](O)C(F)(F)F 750636921 IQIAKGWRPYVOLH-HZPDHXFCSA-N 405.392 2.260 10 20 HECD CN1CC[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 750728900 KXJOMGWFPPTMAH-HXUWFJFHSA-N 413.543 2.161 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)C1 756326926 LSADWMYEIUOXNU-RBUKOAKNSA-N 404.507 2.175 10 20 HECD C[C@H](NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1O 756481231 WBYLHYVFZLTVEV-JTQLQIEISA-N 401.391 2.208 10 20 HECD C[C@H](NCC(=O)N1CCOCC1)c1cc(Br)cc(Br)c1O 756792225 ZZUNLTZBTXDGJB-VIFPVBQESA-N 422.117 2.427 10 20 HECD CCN(CC)C(=O)CN1CCCN(C(=O)NCCCSc2nccs2)CC1 759589652 DXMWXKAHLYIOPO-UHFFFAOYSA-N 413.613 2.211 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cn(CC3(C)COC3)nn2)cc1 759683864 VWDNSQGDMKXHSF-IBGZPJMESA-N 413.522 2.202 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2nc3ccc(F)cc3s2)SC1=S 760987762 FSEDJYPEJOEITL-YRNVUSSQSA-N 417.534 2.186 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3ccc(S(N)(=O)=O)cc3)c2)CC1 767384062 YHUMXUIGUNIRCZ-UHFFFAOYSA-N 402.520 2.117 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](Cn2cccn2)c2ccccc2)c1 769908210 MJAZBFAGRWRYDU-QGZVFWFLSA-N 400.460 2.132 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(SC(F)F)nc1 771206437 YQJPAUUVHWJJPJ-UHFFFAOYSA-N 422.457 2.488 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NS(C)(=O)=O)C(C)(C)C 771577791 ICROCYLMCHKRKE-AWEZNQCLSA-N 421.357 2.467 10 20 HECD Cc1nnnn1-c1cc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)ccc1F 771980093 VBORLKFAXDUSHS-UHFFFAOYSA-N 416.800 2.438 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C 773760254 FTHBGCQVYXYWCU-FATZIPQQSA-N 423.469 2.144 10 20 HECD COC(=O)CCN1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H](C)C1 774683566 PGUFCMRNRPQCMJ-KRWDZBQOSA-N 420.579 2.019 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc(C(F)(F)F)n1 777576971 PYIGXSJAHCWIKH-AWEZNQCLSA-N 421.423 2.436 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CO)c3ccccc3)cc2F)C[C@H](C)O1 782056391 TZHQNEWOOKRSPA-FIKGOQFSSA-N 415.509 2.379 10 20 HECD CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 783150990 HLWBATVVQLXPBX-AWEZNQCLSA-N 420.487 2.358 10 20 HECD CSc1cc2c(cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)OCCO2 785297368 NPRFUYSEMVMBEM-LLVKDONJSA-N 418.471 2.277 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C(C)C)N3CCCCC3)cc2)CC1 787321104 DRQLVZDVIPMIHQ-JOCHJYFZSA-N 400.567 2.482 10 20 HECD C[C@H]1CCCC[C@@H]1OCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 787987619 LLVDLDHDYKFSFM-RXVVDRJESA-N 417.550 2.193 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)N3CCc4ccccc43)CC2)cc1 788141684 VUIROQLLIOFNCY-GOSISDBHSA-N 423.513 2.338 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1 788974854 JGDFLPLUKKRKGD-UHFFFAOYSA-N 424.549 2.093 10 20 HECD COC(C)(C)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789816280 CPKPMXANEWQYFA-OAGGEKHMSA-N 423.529 2.375 10 20 HECD CSC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789823052 YDRIOKVPXOLNCJ-ZOBUZTSGSA-N 423.554 2.410 10 20 HECD CC[C@@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789840640 LUCWVBIOQSBUON-QFIPXVFZSA-N 405.514 2.442 10 20 HECD CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 789969610 WOAGZCZRNGSOBC-RXVVDRJESA-N 416.566 2.018 10 20 HECD O=C(NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1cccc(O)c1O 790796661 ZDLKBUVLHYYVKH-UHFFFAOYSA-N 410.517 2.306 10 20 HECD CC[C@@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 792205044 IBFZDBDISPVJKF-CQSZACIVSA-N 417.485 2.393 10 20 HECD COc1ccc(CNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c(O)c1 800559490 BPHVJFSGNFPOBY-UHFFFAOYSA-N 400.410 2.449 10 20 HECD C[C@H](CCc1cccn1C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803303571 PTZSSPGLEYNARF-QZTJIDSGSA-N 412.534 2.176 10 20 HECD O=C(NCCOC[C@@H]1CCCO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 803560319 GCSTUSCHJQQALK-IBGZPJMESA-N 404.507 2.365 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3cc(F)cc(F)c3)CC2)cc1 804030481 URVTVAFVAVRMTD-UHFFFAOYSA-N 417.456 2.417 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 804269037 SVGKDQPGMBDUAY-QAPCUYQASA-N 418.538 2.446 10 20 HECD CN(C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCSC1 807771866 YHQKRYCSNBHUIM-HIFRSBDPSA-N 413.490 2.337 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@H]4CCC(=O)[C@@H]4C)n3)CC2)cc1 809464988 OGYVOGMFZQYRHW-CVEARBPZSA-N 412.490 2.127 10 20 HECD CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 809785892 GVHOEUVYDPMIIJ-SFHVURJKSA-N 409.596 2.405 10 20 HECD O=C(Nc1ccc2nccnc2c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918297924 VBYZLGRYPYMWIV-KRWDZBQOSA-N 406.442 2.482 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1781071892 LOWZRYBLYKAKFT-BYYRLHKVSA-N 408.882 2.241 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc(F)c[nH]1 1822236901 VEGVXZZQNGWWSP-CQSZACIVSA-N 414.397 2.303 10 20 HECD O=C(c1cnccc1F)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501228 OXNUVPWUMZTKBQ-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 23199813 RQAQMJVZRVMXMC-MRXNPFEDSA-N 415.465 2.469 10 20 HECD Cc1c(CNC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)n(C)c2ccccc12 472221758 KPFHRMLRWGCHNM-INIZCTEOSA-N 407.522 2.275 10 20 HECD COc1cccc(CNC(=O)CCCN(C)S(=O)(=O)c2ccc(F)cc2)c1O 727761361 WUJKNJUZOBAUIM-UHFFFAOYSA-N 410.467 2.257 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1Cl 737278321 IMPXENZDILQFLB-UHFFFAOYSA-N 419.865 2.449 10 20 HECD CCCNC(=O)c1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 741182746 XXANWFPERCBIMR-UHFFFAOYSA-N 415.515 2.314 10 20 HECD C[C@H](C(=O)N1CC(=O)Nc2ccccc21)N(C)Cc1ccc(N2CCOCC2)cc1 741734407 FCYHROJHUJBJSX-QGZVFWFLSA-N 408.502 2.329 10 20 HECD CCn1cc(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 742334033 DBBOPISTPSHNSG-ZDUSSCGKSA-N 400.451 2.452 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@]3(C)Cc4ccccc4C(=O)O3)CC2)cc1 742921749 YVKWXKBZSIDAGS-XMMPIXPASA-N 423.513 2.105 10 20 HECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958147 NNMVGUBIKBIENY-UHFFFAOYSA-N 411.502 2.466 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)c1O 745776745 WLPWYFAWJPCPIT-UHFFFAOYSA-N 421.519 2.228 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cnn(Cc2ccccc2)c1 746703153 YZQKSQCUFGRWJU-UHFFFAOYSA-N 412.515 2.247 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(OCC(N)=O)c2)cc1 750874888 PBZDKOSOKDMGNP-NRFANRHFSA-N 411.502 2.438 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(C)(C)C(N)=O)CC3)cc2)CC1 751095051 LSOKDTXLSZXCOG-UHFFFAOYSA-N 401.555 2.014 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CCc3ccccc3F)CC2)cc1 754043340 NXOCHCWESCIZKW-NRFANRHFSA-N 401.526 2.492 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3nc4ccccc4o3)CC2)cc1 754071102 KMVKEWKKXQNIHQ-IBGZPJMESA-N 410.518 2.451 10 20 HECD O=C(CN1CCO[C@@H]([C@@H]2CCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756898422 LVDBQBBUJAWOLU-LEWJYISDSA-N 420.465 2.280 10 20 HECD O=C(N[C@@H](CO)CC(F)F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 760676232 GXSZMRCCQHYNMF-SNVBAGLBSA-N 406.432 2.000 10 20 HECD C[C@@](O)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(F)(F)F 761062198 ZXBFOBPAOCBKNL-CQSZACIVSA-N 424.422 2.298 10 20 HECD C[C@H](Nc1cnn(CCO)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 762538776 NXJOYECEDDZWJA-ZDUSSCGKSA-N 404.426 2.090 10 20 HECD CCc1nc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 765403467 ZGLVUABAVVRHPC-JTQLQIEISA-N 421.504 2.426 10 20 HECD NC(=O)CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CCCC1 769708213 BIWPHAGVCXSCJR-UHFFFAOYSA-N 423.516 2.125 10 20 HECD Cc1cn2c(=O)c(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cnc2s1 772731338 BQHVMYCSIRLDSL-UHFFFAOYSA-N 416.478 2.095 10 20 HECD Cn1c(C2CC2)nc2cc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc21 774322700 NQUJTMNKKSMMDS-UHFFFAOYSA-N 414.487 2.458 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1 775271377 KWDTWCATKXEXQM-UHFFFAOYSA-N 412.415 2.008 10 20 HECD COCCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)c1ccc(O)c(O)c1 783504843 VIUOWKLEQVPPSX-UHFFFAOYSA-N 412.398 2.348 10 20 HECD COc1ccccc1[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nccn1C 785439942 XTRUTAPKKLQHSQ-HXUWFJFHSA-N 421.501 2.017 10 20 HECD CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312729 LMCCCLZIJZIPMP-QUCCMNQESA-N 417.550 2.097 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(Cn2cccn2)cc1 788458988 IKUVEOIOZUHTPA-UHFFFAOYSA-N 405.502 2.272 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccoc3)cc2F)C[C@H](C)O1 789815791 ACTCHORNGDRIBS-GJZGRUSLSA-N 403.454 2.307 10 20 HECD CSCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789833724 JGBCDRORDSJDAA-UHFFFAOYSA-N 411.543 2.053 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCn3cccn3)cc2Cl)C1 793758270 WGRQNDYJQXDEOL-OAHLLOKOSA-N 403.914 2.205 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccnc1-n1ccnc1C 793805628 PARIBYFOTINPMC-UHFFFAOYSA-N 420.517 2.307 10 20 HECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797389618 QCTGMYFANGFULT-UHFFFAOYSA-N 401.419 2.248 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc4c3OCO4)cc2F)CC1 800911479 YCUPASNLJVRDOD-UHFFFAOYSA-N 421.494 2.175 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803298816 XAKAMGHWSKQTEI-KURKYZTESA-N 403.523 2.022 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(Cc2cccs2)CC1)c1ccc(N(C)C)cc1 807672893 KBROAQQNUMQXBB-INIZCTEOSA-N 400.548 2.336 10 20 HECD CCc1nn(C)c(CC)c1CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 809444561 GZWCHDBEXGUANE-UHFFFAOYSA-N 411.550 2.418 10 20 HECD COc1ccc(O)c([C@@H](C)NC2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1 813331804 VGKCIJKPKRVKJA-GFCCVEGCSA-N 408.524 2.245 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(N2CCOC2=O)cc1 918266642 RBPGJVVPSNATHL-UHFFFAOYSA-N 408.458 2.498 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(-n2cccn2)c1 918284648 MICSXILTKWTJPP-UHFFFAOYSA-N 423.448 2.103 10 20 HECD Cc1cnn(-c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)c1 918337064 DBBNBZDGKKMABN-UHFFFAOYSA-N 424.526 2.346 10 20 HECD COC(=O)C1CCN(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 919723026 XXWBMKSILRROCZ-UHFFFAOYSA-N 409.552 2.239 10 20 HECD CNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1 1317916120 XRENIPSLCPGDTE-SFHVURJKSA-N 423.517 2.378 10 20 HECD C[C@H](CO)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1 1323293401 WZUVSRYQRCXQCP-GOSISDBHSA-N 415.509 2.162 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(F)ccc1F 1796601404 DKZBXWMQXUWUBU-BTTYYORXSA-N 403.385 2.337 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cccnc1 1796932705 UDZRELJWDKECKE-GGPHIMKMSA-N 417.469 2.126 10 20 HECD CC(=O)C[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291205 GNWMQQZJYFPHQN-CILYOPLKSA-N 416.474 2.070 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CC2CCOCC2)C1 1842834661 ZKBDIOQGPYDPPA-UHFFFAOYSA-N 408.882 2.385 10 20 HECD COc1ccc(C)cc1-n1nnnc1SCC(=O)NCc1ccc(N(C)C)cc1 15405268 IQMZAZYOWJGMLU-UHFFFAOYSA-N 412.519 2.454 10 20 HECD Cc1cc(C(=O)N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)c(C)o1 52241652 MNDJLONBMNQPQB-UHFFFAOYSA-N 412.534 2.379 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 141682323 GHCVXXFUVWCMBU-AWEZNQCLSA-N 401.438 2.487 10 20 HECD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N(C)C)c(F)c1 302993313 MUTLVNGQSMZVMC-IBGZPJMESA-N 400.433 2.426 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cn3ccc(C(F)(F)F)n3)cc2F)CC1 730193144 WYMLTARGTMNWQI-UHFFFAOYSA-N 413.419 2.499 10 20 HECD CCN(CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(=O)OC(C)(C)C 734320799 XQERATVWUBYSIK-QGZVFWFLSA-N 418.538 2.262 10 20 HECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCCN(c2ccccc2)C1=O 734558403 SSXWYEDTVKEKJB-QGZVFWFLSA-N 417.487 2.031 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](CCO)c3ccccc3)CC2)cc1 741083528 SHBCMVMQACIRQP-JOCHJYFZSA-N 412.534 2.240 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3CC(c4ccccc4)=NO3)CC2)cc1 742919845 KVRPIOQRZAHSTG-JOCHJYFZSA-N 408.502 2.127 10 20 HECD CC(C)[C@@H](NC1CCOCC1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 743315704 ZJILRZXKJOYBRR-OAQYLSRUSA-N 407.530 2.196 10 20 HECD CCCNC(=O)CN1CCC(NC(=O)NCc2c(O)ccc3c2CCCC3)CC1 743535003 NBUOHOSAGLLWLJ-UHFFFAOYSA-N 402.539 2.061 10 20 HECD Cc1cc(F)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1 747611632 NHVBPUSNWJVRQC-UHFFFAOYSA-N 402.425 2.005 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1 748480766 BWEIOKKYDFSYFN-UHFFFAOYSA-N 412.471 2.093 10 20 HECD Cc1cscc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 748743562 HAMDTYSCRNJELN-OAHLLOKOSA-N 400.504 2.013 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1 751112658 ZLKBCQCZQCYVEY-HNNXBMFYSA-N 420.554 2.388 10 20 HECD Cc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc12 751227074 CHRXEVQWNKHIFF-UHFFFAOYSA-N 420.466 2.110 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3c3cc(C)on3)CC2)cc1 754001179 YZVUWKZLIYTXCE-KNQAVFIVSA-N 400.523 2.312 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ccc(C)nc3)CC2)cc(OC)c1OC 759216408 QAPXHUIGGQFCKO-UHFFFAOYSA-N 400.479 2.448 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@@H]3CO)cc2)C1 762274284 YQYMSWRWUWHCEV-UGKGYDQZSA-N 422.529 2.190 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)c3cccc(OC)c3OC)CC2)cc1OC 768445206 GAQRMYVRBSIXSI-UHFFFAOYSA-N 416.474 2.385 10 20 HECD COc1ccc(-n2c(C)nnc2SCC(=O)NCc2ccc(O)c(O)c2)cc1 768914402 PJKDOUWAVRRCDF-UHFFFAOYSA-N 400.460 2.404 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3cscn3)CC2)cc1 769017706 STVZGAIZJLVMOW-UHFFFAOYSA-N 403.552 2.206 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O 779540634 BGVUIWRYAGLENB-YWEYNIOJSA-N 404.444 2.240 10 20 HECD Cc1ccc(C(=O)NCC(=O)N2CCN(c3cccc(Cl)c3)CC2)c(O)c1O 780919582 VLBJZMRHUJQPJA-UHFFFAOYSA-N 403.866 2.138 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(F)c(C)c3N)CC2)cc1 781797073 YBMRMAYQBBURHN-UHFFFAOYSA-N 401.438 2.231 10 20 HECD O=C(CSc1nnc2ccccn12)NCc1ccc(N2CCC(CO)CC2)cc1 782709641 RYSGIXJNALDMJU-UHFFFAOYSA-N 411.531 2.347 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1C(=O)NC(C)C 785296266 CBXICYBUQRPFDK-CQSZACIVSA-N 413.474 2.230 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 788334596 XQBNZANONFHIKP-UNMCSNQZSA-N 423.513 2.033 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1nc2c(s1)CCCC2 789371358 VHIWHVVLSGFUHA-UHFFFAOYSA-N 418.494 2.253 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC(=O)N(C2CC2)C1 790464044 ICKRRZXGLVXYAY-CYBMUJFWSA-N 403.438 2.053 10 20 HECD C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793932011 QVFGTCROFDSBKF-LPHOPBHVSA-N 412.509 2.460 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)CCc2cccc(Cl)c2)cc1 795363063 SFHLUSMSWAPUKT-UHFFFAOYSA-N 403.913 2.201 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)C[C@H]3CCCOC3)ccc21 803003350 YJXSKWWRNXNRNW-INIZCTEOSA-N 408.520 2.391 10 20 HECD Cc1ccccc1CN1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806277178 RWVQKPCIONGDOZ-UHFFFAOYSA-N 418.588 2.394 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 807073292 GEWJEEFSNQYTSY-BLLLJJGKSA-N 423.318 2.235 10 20 HECD O=C(CCNS(=O)(=O)c1cccnc1)NCc1cc(Cl)cc(Cl)c1O 807838975 DNRAGYVFUMFNQK-UHFFFAOYSA-N 404.275 2.079 10 20 HECD CCC1(O)CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 809321127 QWZGUZXCDCNLIV-DKTYTTGXSA-N 404.507 2.100 10 20 HECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 809785891 GVHOEUVYDPMIIJ-GOSISDBHSA-N 409.596 2.405 10 20 HECD Cc1noc(C)c1S(=O)(=O)NCC(=O)N(Cc1ccco1)Cc1ccccc1O 810418797 ZWOUNPOTUITQFR-UHFFFAOYSA-N 419.459 2.097 10 20 HECD CNS(=O)(=O)c1ccc(C)c(NCc2ccc(N3CCN(C)CC3)c(F)c2)c1 1340982278 VNJWQAOIZRBVTI-UHFFFAOYSA-N 406.527 2.406 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1F)c1cc(O)nc(O)c1 1799739824 XPQNZAKQUDLRNB-CLLJXQQHSA-N 403.385 2.337 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccco2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 5710264 SSLXQDFTQHRFIG-UHFFFAOYSA-N 402.428 2.374 10 20 HECD CC[S@](=O)c1ccccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 195632127 IPZFJVYKLKMVNY-SANMLTNESA-N 406.529 2.301 10 20 HECD O=C(NCC(=O)N1CCc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 303162542 PRAWSWNGHJPTRP-UHFFFAOYSA-N 412.465 2.051 10 20 HECD CN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1cccc(OC(F)(F)F)c1 728492859 RESBGOQKJALJPB-UHFFFAOYSA-N 401.366 2.046 10 20 HECD CS(=O)(=O)CCSCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 730465771 SPZWBBRAPAXMPT-UHFFFAOYSA-N 403.481 2.178 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1O 737283935 HCYHHXNTMUQRAQ-UHFFFAOYSA-N 413.474 2.413 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1O 737285097 ZGMNWOYRTFQFEB-UHFFFAOYSA-N 407.430 2.318 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C(C)C)N3CCCC3)CC2)cc1 741014141 QSXFRIXHGLJWSP-OAQYLSRUSA-N 403.523 2.007 10 20 HECD Cc1nccn1C[C@H](C)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749196319 MVLCUNIVYJAMQY-OAHLLOKOSA-N 403.502 2.427 10 20 HECD CCOC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 749254007 NUGMDSSRFKUGAL-UHFFFAOYSA-N 404.488 2.383 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(Cl)ccc(F)c3N)nc12 754115457 PNVFSKJIUUOXRZ-UHFFFAOYSA-N 408.773 2.343 10 20 HECD COc1cc(N2CCN(C(=O)Nc3nnc4ccccn34)CC2)cc(OC)c1OC 759978847 QIDXXJFOVTWZJI-UHFFFAOYSA-N 412.450 2.109 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c1 761972004 DZXRVJUSLJDYMC-JTQLQIEISA-N 410.430 2.117 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3scnc3C3CC3)CC2)cc1F 763137122 IAJVJMJMTHWLSX-UHFFFAOYSA-N 404.467 2.456 10 20 HECD O=C(NCC(F)(F)F)c1ccccc1NS(=O)(=O)c1cccc2nonc12 765032862 CZXNAHTWISATLV-UHFFFAOYSA-N 400.338 2.316 10 20 HECD COc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 766433938 SCBFTNLTDGUIAH-OAHLLOKOSA-N 412.446 2.235 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)COc3ccc(F)cc3)CC2)cc1OC 768440642 SFJYHDLEVCEKHX-UHFFFAOYSA-N 404.438 2.272 10 20 HECD CCOc1cccc(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1O 768805342 WAJYNCOPDHFMKC-UHFFFAOYSA-N 401.488 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C(C)C)n(C)n4)n3)CC2)cc1 771069592 XNXPLXIQOWHHJW-UHFFFAOYSA-N 424.505 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)C(F)(F)F)cc2F)C[C@H](C)O1 773180327 ORMKNPDDKDCDDO-QWRGUYRKSA-N 406.380 2.116 10 20 HECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1F 774273223 BOCUCONCEYXCPN-MUUNZHRXSA-N 404.463 2.402 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCCn3cc(C(=O)OC)nn3)ccc21 774597794 UYCCDEOQWVJSDB-UHFFFAOYSA-N 400.435 2.140 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H](c1ccco1)N1CCCC1 774861264 YIFCLHIUXLJIHS-HXUWFJFHSA-N 408.502 2.225 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCC2 775287357 ZVBPUQXTIHYEMD-UHFFFAOYSA-N 404.444 2.279 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c1 775372445 AYNVVCPAYPQCKX-GFCCVEGCSA-N 401.419 2.171 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1nnc2n1CCC2 786445716 XMZALCHFDZGDBL-MRXNPFEDSA-N 410.522 2.050 10 20 HECD CO[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccccc1 786652801 AZKKRCAODZIHRM-UWJYYQICSA-N 411.502 2.204 10 20 HECD C[C@@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 787708954 VMHSLZJYLVLINS-QZTJIDSGSA-N 400.567 2.169 10 20 HECD CC(C)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCS1 789840865 OYGXYOXJVZVKIK-LJQANCHMSA-N 423.554 2.003 10 20 HECD CSC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949390 HVVKYYIPYBHZPO-LBPRGKRZSA-N 419.469 2.026 10 20 HECD CC1(C)CCC(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793733629 NGSUMTHVGLEAHR-QGZVFWFLSA-N 414.550 2.090 10 20 HECD C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 793910208 ITJAOIILXIWDER-KZNAEPCWSA-N 400.567 2.168 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 797710012 PUILLACDUXRJMQ-UMHPPVOVSA-N 423.485 2.118 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](OC)C[C@@H]3C)CC2)cc1 799528899 LCUNPUNJOALHSK-RXVVDRJESA-N 404.555 2.416 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@@]2(CCOC2)C1 803447951 CJGFWRLYWIYQQV-OAQYLSRUSA-N 423.460 2.012 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCCc2c[nH]nc21 806430232 JLIZGLOAEGULEZ-CQSZACIVSA-N 421.295 2.420 10 20 HECD CN1Cc2ccccc2[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 807677538 WCGCMXBXMOFBGA-PZJWPPBQSA-N 423.513 2.203 10 20 HECD C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 809401524 UCGZJYWYMNELJU-VGSWGCGISA-N 424.545 2.473 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([C@@H](C)NC(C)=O)s3)CC2)cc1 918740463 SMECCOWMDACWIG-CQSZACIVSA-N 423.560 2.465 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1C(=O)CC(C)(C)C 1320143151 SZKJCUFPSIUYKT-HOTGVXAUSA-N 420.506 2.115 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C1CC1)c1cc(O)nc(O)c1 1794844302 JQKAWLQMINXNML-BTTYYORXSA-N 414.487 2.392 10 20 HECD CC(C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546532 CWJSNEYOKGVOOL-UHFFFAOYSA-N 405.495 2.153 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1 726186271 CAHLDWCFFRPZOX-LJQANCHMSA-N 413.497 2.404 10 20 HECD COCCCN1CCC(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 727031401 REUVUGKSVSAVMB-UHFFFAOYSA-N 404.555 2.166 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1F 728585270 RRXVQRROJINWKC-UHFFFAOYSA-N 422.478 2.318 10 20 HECD Cc1cc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 728937737 JJFVVTWOXWZGKG-HOCLYGCPSA-N 422.478 2.082 10 20 HECD C[C@@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 730218307 JWGRCPQUWGSKTJ-BVRAVYJCSA-N 409.558 2.076 10 20 HECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCCN1C(=O)CNC1=O 731036775 QIHIHDYVBBKTIA-UHFFFAOYSA-N 402.495 2.406 10 20 HECD COc1ncnc(OC)c1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 731991795 VWMMUEVQDQIAQU-UHFFFAOYSA-N 408.405 2.494 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1 734072475 BMXHHOGUFCEDAG-OAHLLOKOSA-N 413.474 2.049 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cccc(-n2cncn2)c1 735516409 NLULZZXTXAHAIS-UHFFFAOYSA-N 420.517 2.475 10 20 HECD CCN1C(=O)c2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)cc2S1(=O)=O 743716794 XWTREUQXDMMYRO-UHFFFAOYSA-N 414.483 2.365 10 20 HECD CN1CCC(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 751060275 JBTFVJKJJPAICO-UHFFFAOYSA-N 409.533 2.326 10 20 HECD CCOC(=O)CCCS(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751371880 LSRHEKONNSEXRW-INIZCTEOSA-N 418.943 2.273 10 20 HECD CN(CC(=O)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 756653298 FGUDQAZSPOLFDM-OAHLLOKOSA-N 422.528 2.129 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CN(C4CC4)C[C@H]3C)cc2F)CC1 757681465 CEKUPPVDZUPBRM-UZLBHIALSA-N 403.546 2.250 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@@]34CCOC4)cc2F)C[C@@H](C)O1 764642598 LZDCGJSPOWBUFT-FWVWUXMJSA-N 420.481 2.025 10 20 HECD Cc1nc(CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)s1 767554276 DLDKMSYXLTUCGY-UHFFFAOYSA-N 421.494 2.138 10 20 HECD O=C(CSc1nnnn1C1CC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768911597 FVMJCAHVCYBTTB-CQSZACIVSA-N 422.942 2.240 10 20 HECD CNC(=O)C1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCC1 769748680 IZDIXGDNZYFPLS-UHFFFAOYSA-N 423.516 2.043 10 20 HECD CCNS(=O)(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 770772141 WEYFMCGPYCRSFQ-IBGZPJMESA-N 408.568 2.146 10 20 HECD COCCC[C@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771066105 ITKIWCRJBDBTQL-INIZCTEOSA-N 402.495 2.500 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCCn4ccnc4C)n3)CC2)cc1 771067906 PNFGUVNJHROLCL-UHFFFAOYSA-N 424.505 2.107 10 20 HECD Cc1cc(N2CC[C@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)n(C)n1 773030903 XUJAJSPNOFMSTO-QAPCUYQASA-N 401.486 2.160 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1OC 773764025 ZRUBEWULLFANLA-GFCCVEGCSA-N 420.418 2.401 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(OCc2cccnc2)c1 774363724 LCQPGQKUQXCRTO-UHFFFAOYSA-N 407.426 2.369 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)C(C)(C)C)CC3(C)C)nc12 776036736 SKCXMXDQBSHKTI-UHFFFAOYSA-N 417.510 2.081 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)OCO4)n2)c[nH]1 778078588 NEKWEDFIUWEFLI-UHFFFAOYSA-N 407.429 2.454 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 784031202 XKFJSNOOFJXVPV-UHFFFAOYSA-N 419.503 2.020 10 20 HECD CCOC(=O)c1c(C)csc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785297456 OOYDQMGLADFFEW-LLVKDONJSA-N 406.460 2.330 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)cc1 785425206 YIRNWJYYXUANJN-QGZVFWFLSA-N 418.538 2.132 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)CC2)c1 788940735 YMHBQXLXHMVJMI-UHFFFAOYSA-N 422.529 2.260 10 20 HECD CN(CCC1CCOCC1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789844187 DXOHIISAKXDSKQ-UHFFFAOYSA-N 405.564 2.131 10 20 HECD C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789845042 JCDYPBFQSPEWGP-QZTJIDSGSA-N 418.607 2.235 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)/C=C/c2cccc(Cl)c2)ccc1O 790408081 TVJFVPOWBIZCMF-BQYQJAHWSA-N 402.881 2.366 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 792336423 UXPLCEGVCUWOKT-UHFFFAOYSA-N 411.506 2.109 10 20 HECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2c(O)ccc3ccc(OC)cc23)C1 792712807 SJCGYLWRZJSNLB-SFHVURJKSA-N 422.547 2.426 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nc1Br 793050682 FMNAHXKPDYCPGJ-SNVBAGLBSA-N 408.252 2.250 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCC(=O)NC1CCCCC1 793760692 KEDWHIVENXTUNB-UHFFFAOYSA-N 403.523 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3CCO4)CC2)cc1 794144283 YZIIJNUHMWWSQR-MDZDMXLPSA-N 407.470 2.474 10 20 HECD COCc1ccc(OC)c(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 795775362 PUFDDKIHUIHQHQ-UHFFFAOYSA-N 420.531 2.499 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)CCC(F)(F)F 803688923 FWPQIJXQAHHRCB-UHFFFAOYSA-N 414.472 2.076 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H](C)CCC(C)(C)C)CC2)cc1 803750540 NHZQDWBADABWMG-GOSISDBHSA-N 418.582 2.264 10 20 HECD COCCCOc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 804143646 GKQPTANHVIYKKC-UHFFFAOYSA-N 408.476 2.109 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3ccc(Cl)nc3)CC2)cc1 804317909 SFHBPYFYXSUQQK-UHFFFAOYSA-N 416.909 2.188 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(c1cc(OC)c(OC)cc1[N+](=O)[O-])C2 804706391 OYYLJUXUSSLRFJ-UHFFFAOYSA-N 407.448 2.083 10 20 HECD CCNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806511010 CKZLFFFHAYLHHW-LJQANCHMSA-N 404.511 2.333 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 807291724 MKCHHOKFVQNOSL-NRFANRHFSA-N 409.461 2.418 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(CCc2cccs2)CC1)c1ccc(N(C)C)cc1 807672230 ADZOKZJKFNKEPE-QGZVFWFLSA-N 414.575 2.378 10 20 HECD C[C@H]1CO[C@H](C)CN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769843 IYFYEKNHTLILLK-RRFJBIMHSA-N 411.449 2.009 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 808084610 BNOOMIVNKZEPOE-FXAWDEMLSA-N 403.523 2.054 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(COCc4ccccn4)n3)CC2)cc1 809465115 RRIZZTXNEWFSJZ-UHFFFAOYSA-N 423.473 2.081 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1O 810328466 RMGSDIBNXLCTAE-UHFFFAOYSA-N 418.393 2.014 10 20 HECD O=C(COC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(O)c(O)c1 916590176 FYNAPEROEIQVAY-UHFFFAOYSA-N 419.455 2.312 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 918286660 JQPXCBYGJGYGMO-KBPBESRZSA-N 416.453 2.098 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[nH]c2c1C(=O)CCC2 918373344 WONVYXHFFWRCPS-INIZCTEOSA-N 408.502 2.474 10 20 HECD O=C(COC(=O)c1cc(F)ccc1F)NCc1ccc(N2CCOCC2)c(F)c1 918904468 DOZCYCOXZFOQKO-UHFFFAOYSA-N 408.376 2.414 10 20 HECD O=C(COC(=O)[C@@H]1CC1(Cl)Cl)NCc1ccc(N2CCOCC2)c(F)c1 918953698 RLWKAAKEAKOJPJ-LBPRGKRZSA-N 405.253 2.016 10 20 HECD C[C@H]1CCN(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1254033653 SJALIAWWKDMZSX-ZDUSSCGKSA-N 409.533 2.326 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(-c2ccccc2F)n1 1325382196 HXBZZUZHTCMTJG-INIZCTEOSA-N 413.405 2.327 10 20 HECD CN1CCN(c2ccc(CNC3CCN(C(=O)c4ccncc4)CC3)cc2F)CC1 1326797757 PZIOOEZIAQVABS-UHFFFAOYSA-N 411.525 2.367 10 20 HECD CN(C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290890 MFXUWASAHCTUIE-CQSZACIVSA-N 421.885 2.342 10 20 HECD CN1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500554 OBANGIVSHARVRY-OAHLLOKOSA-N 407.898 2.053 10 20 HECD COc1ccc(CCNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 38588941 LSNQEBRADBXNGQ-UHFFFAOYSA-N 412.534 2.368 10 20 HECD CCN1CCN(c2ccc(CNC3=NS(=O)(=O)c4ccccc43)cc2F)CC1 301215284 ZPRUJJYPTPFVRC-UHFFFAOYSA-N 402.495 2.206 10 20 HECD Cc1oc(C(=O)O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 327525590 UAAHPKLIZPZGJS-UHFFFAOYSA-N 408.841 2.112 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1 733041968 ISVHGAQIDRCYHL-NSHDSACASA-N 421.466 2.025 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 734702015 PWFFTMMVRCJJRD-UHFFFAOYSA-N 403.454 2.480 10 20 HECD O=C(CCc1nc(-c2ncccn2)no1)N(Cc1ccccc1O)C[C@@H]1CCCO1 735517800 CXQZBFCCIOFLHH-INIZCTEOSA-N 409.446 2.373 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CCN(C)C)CCN(C)C)cc2F)C[C@H](C)O1 741080340 ZWTDABGSYKCMME-ROUUACIJSA-N 423.577 2.074 10 20 HECD O=C(C[C@H]1CCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799617 LUMHVISYKLQIQZ-ZIAGYGMSSA-N 402.463 2.198 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C/c2cnc(C)s2)cc1 753056264 RMJUMQYIBLBMCE-JXMROGBWSA-N 409.533 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(Cc4ccccc4)n3)CC2)cc1F 753740600 TUYOGVVDHNVVMM-UHFFFAOYSA-N 422.460 2.402 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)C3CCOCC3)CC2)cc(OC)c1OC 759289857 ZSPLJCQJTHJFNC-HNNXBMFYSA-N 407.511 2.359 10 20 HECD C[C@@H]1CN(CCCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCCO1 764279395 QHFGGVJZFCMERZ-RTBURBONSA-N 404.555 2.384 10 20 HECD Cc1ccc(S(N)(=O)=O)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 767933529 MNAGRPDRMGQIPD-UHFFFAOYSA-N 416.547 2.425 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@@H]2CNS(C)(=O)=O)c1O 768342119 PIOANIPPAHBGHI-CYBMUJFWSA-N 407.330 2.067 10 20 HECD Cc1cccc([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 769037357 LZFRMDJXKCTHBJ-TZIWHRDSSA-N 410.518 2.230 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1 769766336 QHPLTEKKHJASSG-UHFFFAOYSA-N 404.423 2.400 10 20 HECD C[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)cc1 773003274 CPDKSWLASFRZPI-PZJWPPBQSA-N 400.567 2.261 10 20 HECD C[C@@H](NC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1)c1ccc(N(C)C)cc1 773314092 ZHJTVGHTGTUPAE-CYBMUJFWSA-N 418.510 2.377 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](C)S[C@H](C)C3)CC2)cc1 778287700 CRUZFUWHOUTNDC-KCUINEJTSA-N 403.548 2.252 10 20 HECD Cc1cc(C(=O)NCCN2CCNC(=O)C2)c(C)n1-c1cccc(Br)c1 781412550 PGSITYQFQWFCNO-UHFFFAOYSA-N 419.323 2.018 10 20 HECD COC(=O)CCCN1C(=O)/C(=C/c2ccc(OCC(=O)OC)cc2)SC1=S 782192635 AAZKOZTXWFQKGE-UVTDQMKNSA-N 409.485 2.393 10 20 HECD Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 786223141 AYRIAVZGXWBFRI-RTWAWAEBSA-N 424.545 2.100 10 20 HECD CC(=O)Nc1ccc(F)c(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786258428 FKRPWZRPSATNSJ-UHFFFAOYSA-N 412.465 2.383 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 787741994 YRLFTAZHUSSLMD-LAUBAEHRSA-N 422.529 2.410 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccnc1OCC(F)F 788928674 BOBDDOFAMKKHSD-UHFFFAOYSA-N 418.444 2.258 10 20 HECD C[C@@H]1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789841243 VOHGDCKAYFGBSF-HZPDHXFCSA-N 405.514 2.346 10 20 HECD COC(=O)[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)c(O)c1 792181897 VWXRRXFXHBZRKT-FQEVSTJZSA-N 404.438 2.380 10 20 HECD COc1ccc(CNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c(O)c1 792859829 SXUZFVZIFMNZJQ-IBGZPJMESA-N 403.454 2.413 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 793578572 TVPZFMQXKFXOMI-CYBMUJFWSA-N 402.463 2.340 10 20 HECD C[C@@H](Cc1ccsc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793790261 KCAWKEZIEGPNIF-INIZCTEOSA-N 401.532 2.291 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cncc(F)c3)cc2F)C[C@@H](C)O1 799251951 YUVQUXTUXAYGAO-CHWSQXEVSA-N 404.417 2.228 10 20 HECD C[C@@H](NC(=O)N1CC[C@H](C(=O)N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 804988380 BOGKHQMJYGKAPP-MJGOQNOKSA-N 400.523 2.238 10 20 HECD COc1cccc([C@H]2CN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CCO2)c1 807291488 WQGHMWIJRQCMAI-JOCHJYFZSA-N 421.497 2.288 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 915556180 AROGHRHZSXXXGF-UHFFFAOYSA-N 407.488 2.190 10 20 HECD CCC(=O)N[C@@H](CCSC)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969378 KJUWQXIXXSHREV-KRWDZBQOSA-N 411.543 2.051 10 20 HECD CCN(CC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc(OC)c(OC)c1 921061105 OEOLUPLONJBLEO-UHFFFAOYSA-N 401.463 2.108 10 20 HECD COC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 1325497598 HJNHFFHKLMWJPP-HZPDHXFCSA-N 422.501 2.423 10 20 HECD Cc1occc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1794734627 KQCFARXICUWPQX-FVCICTRLSA-N 420.849 2.170 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2c(c1)CCCO2 1796603508 QGHZOXLQAWEDRO-BCDXTJNWSA-N 423.469 2.383 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)s1)c1cc(O)nc(O)c1 1798926114 LHVYGZDIYWAPSX-JGPRNRPPSA-N 408.867 2.168 10 20 HECD O=C([C@@H]1CC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427042 CJFYZUPGXYSVLW-GJZGRUSLSA-N 409.433 2.381 10 20 HECD C/C=C(/C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900806 YETMFEBVRNBUBQ-AUBBPRACSA-N 423.604 2.433 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc3c(c2)CCC3)C1 1841900387 AEHYAMHUGHNQDW-UHFFFAOYSA-N 407.470 2.041 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccs2)C1 1842372902 RJUYEQSEANVCMX-FNORWQNLSA-N 400.456 2.395 10 20 HECD O=C(C1=CCCS1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441133 OVPUBXNQXIRDIH-UHFFFAOYSA-N 410.499 2.004 10 20 HECD O=C(Cc1ccc(Cl)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847418542 ZIXKPUQEMMZPIL-HOTGVXAUSA-N 419.840 2.343 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)C3CC(=O)NC(=O)C3)c2C)cc1F 726820248 PFGSNZNZGQHFHE-UHFFFAOYSA-N 400.406 2.320 10 20 HECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1ccc(N2CCCC2)cc1 729286983 IWQMJDHKJGDVOP-UHFFFAOYSA-N 404.474 2.407 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)cc1 729507370 SGSTWHAEAKVEEH-IBGZPJMESA-N 403.571 2.262 10 20 HECD CNC(=O)CN1c2ccccc2C(=O)N(C)C12CCN(c1ccc(OC)cc1)CC2 731301174 KRUXLWGJECSZNB-UHFFFAOYSA-N 408.502 2.330 10 20 HECD COC(=O)C1(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)CCCCC1 732202204 IXTGHYMSLXFVNC-GOSISDBHSA-N 404.507 2.365 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C4CCC4)CC3)cc2F)C[C@H](C)O1 733614289 JYYNJKGMURKESL-ROUUACIJSA-N 418.557 2.226 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 740907588 QKFGGIBKAJBXRL-SJLPKXTDSA-N 411.593 2.395 10 20 HECD C[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)n1cncn1 742750823 QFGWDQFGOLNDEL-PBHICJAKSA-N 402.499 2.287 10 20 HECD COc1ccc(C[C@H](CO)CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1O 745785806 CCBMNSNBTVRPHN-INIZCTEOSA-N 405.470 2.256 10 20 HECD O=S(=O)(NCc1ccccc1O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 751148950 DQLDKAYHMLPELV-UHFFFAOYSA-N 410.517 2.045 10 20 HECD COC[C@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 754347552 MSEOLWBDCPMXQK-CTNGQTDRSA-N 403.523 2.057 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3nccs3)CC2)cc(OC)c1OC 759243234 CDLQKTNSNAGPQZ-UHFFFAOYSA-N 406.508 2.243 10 20 HECD Cc1nnc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)o1 759630587 ASNWFNAJFUGXPH-VIFPVBQESA-N 408.461 2.437 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 764952819 AQUAONLCHRXQCU-LJQANCHMSA-N 419.522 2.370 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccnc1OCC(F)F 765863891 KNYTXMHSVYGVFV-UHFFFAOYSA-N 402.448 2.419 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(-n3ccnn3)c2)C2CC2)cc1 768717452 RNQIPCRFVLGPSG-UHFFFAOYSA-N 404.474 2.463 10 20 HECD Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(OCCN(C)C)c1 769899656 KJSYTSRYPMXRRU-UHFFFAOYSA-N 407.492 2.265 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCC(Oc4ccnc(C(N)=O)c4)CC3)ccc21 772454692 JJXPJIQJNWDPJY-UHFFFAOYSA-N 423.517 2.316 10 20 HECD C[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Cl)c(Cl)cc1O 774250056 BAYIZCOWPYHAQM-QWHCGFSZSA-N 402.322 2.283 10 20 HECD CC[C@H]1C[C@@H](CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 781762626 DOSIUZVRJOSZOF-HKUYNNGSSA-N 404.507 2.482 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3c(C)nn(C)c3C)n2)o1 784100047 UEXSWCGRULXGGM-UHFFFAOYSA-N 409.493 2.190 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785295296 SQJHBGLFIJFNEM-UONOGXRCSA-N 414.458 2.135 10 20 HECD O=C(OCc1ccno1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785399546 SKFYKQIOVMBKML-UHFFFAOYSA-N 419.371 2.446 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)C(=O)NCc1ccc(N3CCC(C)CC3)cc1)C2 786673872 NEQYOJZCAJMHPO-FQEVSTJZSA-N 421.545 2.311 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@]3(N(C)C)CCSC3)cc2)CC1 788248934 XIMVHRZOKNEBMS-JOCHJYFZSA-N 418.607 2.093 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@H](OC(F)F)C1 789859366 CFCIJBKUJPCQLC-INIZCTEOSA-N 413.490 2.086 10 20 HECD O=C(c1c(F)ccc(O)c1O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 789940375 WRLDQCVTHVYENP-UHFFFAOYSA-N 414.842 2.037 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(SC)c(Cl)c2)ccc1O 790407823 SEVODELDMXKGIC-UHFFFAOYSA-N 422.937 2.476 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@@](F)(CO)C1 801996143 GGUOSMJSFCJNOB-KRWDZBQOSA-N 405.392 2.158 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCc4ccccc4CC3)CC2)cc1 804318972 GFERODPQBUELMT-UHFFFAOYSA-N 407.514 2.408 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2cccc(-n3cncn3)c2)C2CC2)cc1 805745653 CVKIKGKLNULLKG-UHFFFAOYSA-N 418.501 2.141 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1 806885896 JMIYMKLLWPXHTK-SECBINFHSA-N 400.357 2.277 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)cc1 917759347 OJFURVLCPZRCDN-UHFFFAOYSA-N 407.448 2.210 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918438575 HRFMLSZVGXIYOS-UHFFFAOYSA-N 415.465 2.440 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OCC(F)F)nc1 1320395105 XHNNSZALVQLOGP-ZDUSSCGKSA-N 410.373 2.041 10 20 HECD C[C@@H](OC(=O)[C@@]1(F)CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1328754433 YKBMHIJSLXXECG-VERVWZFWSA-N 411.385 2.461 10 20 HECD Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807991344 OYABEVYQUHNBSV-QRWLVFNGSA-N 422.441 2.423 10 20 HECD CC(C)(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cn1 1843248756 KSLBNGRMWDCAAX-UHFFFAOYSA-N 410.474 2.316 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@]2(F)CCCCC2(F)F)C1 1843891959 MCBMUKJAKBYNOH-SFHVURJKSA-N 413.396 2.227 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(S(=O)(=O)N2CCCC2)cn1 301085813 WXDIDUZPWVPRLQ-UHFFFAOYSA-N 416.547 2.339 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(S(C)(=O)=O)cc3)cc2F)CC1 303312336 PJQYJRFJVMJKOR-UHFFFAOYSA-N 419.522 2.301 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnc4c(c3)c(C)nn4C)CC2)cc1 725825706 QIUHHXZPMIHMAM-UHFFFAOYSA-N 415.519 2.186 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(C)c(C(N)=O)c3)CC2)cc1 726602266 VQBBVXVUDDOPGQ-UHFFFAOYSA-N 403.504 2.050 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(O)CCCCC3)CC2)cc1 729043815 ZBENKKBWSGGNCQ-UHFFFAOYSA-N 404.555 2.202 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3nnc(C(F)F)s3)CC2)cc1 743315562 XGQSZDOJGFDUOA-UHFFFAOYSA-N 412.466 2.428 10 20 HECD CNC(=O)[C@H]1CCCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386902 GRYZJRSLHQQWDQ-LJQANCHMSA-N 405.454 2.001 10 20 HECD CN(C)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 748039288 XMSIMRDWILKWKO-CQSZACIVSA-N 409.533 2.421 10 20 HECD CCOC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 749257614 ZOXFVTPHMFLVNC-UHFFFAOYSA-N 404.488 2.178 10 20 HECD O=C1C[C@@H](N2CCN3C(=O)NC[C@@H]3C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 751925747 SXMGBTKNCXGQIZ-RTBURBONSA-N 418.457 2.443 10 20 HECD NS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1F 752149975 QBKBUCJEGJDXIV-OAHLLOKOSA-N 408.451 2.000 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)N[C@@H](C)c3cc(OC)ccc3O)C2)nc1 753281660 ZBXVKUKXCCVYIY-ZDUSSCGKSA-N 414.462 2.222 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21 753857562 NDSJSPXEQHASNZ-RBUKOAKNSA-N 423.604 2.491 10 20 HECD COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 754488797 JVSCJFGVLGTJBJ-UHFFFAOYSA-N 422.441 2.270 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 755125320 BWNKNSUQSPWBOK-QGZVKYPTSA-N 410.518 2.139 10 20 HECD CCOC(=O)c1cnn2c(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)ccnc12 758018797 JAGFRZIOAPKTJJ-UHFFFAOYSA-N 423.473 2.313 10 20 HECD CCCOc1cccnc1C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 758935126 DBWNTXGAPIQCHC-UHFFFAOYSA-N 400.391 2.152 10 20 HECD CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 761060651 FYXMQZOUYSZHIN-UHFFFAOYSA-N 421.494 2.282 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCC[C@H]1N1CCOCC1 763586079 FXCUYPJXLVNOEJ-PZJWPPBQSA-N 420.529 2.105 10 20 HECD CC(C)Oc1cncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 764939126 LMHCSSCPASCUED-UHFFFAOYSA-N 403.504 2.034 10 20 HECD CC(C)C(=O)NCCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767768763 NNTUPWHUOANNCI-OAHLLOKOSA-N 421.497 2.493 10 20 HECD COc1cc(Br)cc(CN2CCC(C(=O)N3CCOCC3)CC2)c1O 768193692 JLVYJXLACNQTLC-UHFFFAOYSA-N 413.312 2.234 10 20 HECD CN(C)CCNC(=O)c1ccc(CNCc2ccc(N3CCN(C)CC3)cc2)cc1 771844217 XLZQALAKOAUCOY-UHFFFAOYSA-N 409.578 2.020 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773849166 XGXZTTOMQBXWLW-MRXNPFEDSA-N 424.501 2.041 10 20 HECD CCCCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774652761 LFXCZHCFCCSOPZ-FUHWJXTLSA-N 402.539 2.090 10 20 HECD CCOC(=O)c1ccc(N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)nc1 774835174 DCDRUMNKTOPHSG-UHFFFAOYSA-N 416.434 2.203 10 20 HECD O=S1(=O)CCCN1c1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1F 775359114 XGFFKADNCIHVRB-UHFFFAOYSA-N 419.522 2.492 10 20 HECD COc1ccc(Cn2ccc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)n2)cc1 778606557 YPRWYCUQZZVMAH-CQSZACIVSA-N 424.457 2.470 10 20 HECD CO[C@@H](C)CCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 782248622 DHKOUMOZSPWPSJ-INIZCTEOSA-N 401.486 2.374 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1 782539714 WHEBGLPBEHXXPG-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)C(=O)N(CC1CCCC1)c1ccc(N)cc1 784106314 KUXQRISYTBARFN-UHFFFAOYSA-N 412.494 2.295 10 20 HECD C[C@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785428070 JQORLHUGPCISFT-MRXNPFEDSA-N 400.548 2.336 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CC1 786256647 IMXWWRDKJNMWDN-UHFFFAOYSA-N 400.410 2.332 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc3c(c1)CCCN3C)O[C@@H](C)C2 786625504 IXAQKCGZRWLOCQ-HNNXBMFYSA-N 423.513 2.334 10 20 HECD CO[C@@H](C)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 787412608 GKVDYZSDKSCFQL-RYUDHWBXSA-N 423.447 2.254 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(CN2CCCC2=O)cc1)c1ccc(N(C)C)cc1 787435458 YFKYSKDQRRORIT-QGZVFWFLSA-N 422.529 2.369 10 20 HECD CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCCCN1C(=O)c1cccc(O)c1O 790945147 HJNDTFRPYLPAKW-CQSZACIVSA-N 421.494 2.124 10 20 HECD COc1c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cccc1[N+](=O)[O-] 793174258 BYVOLTIDTUAQNA-UHFFFAOYSA-N 405.432 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@](C)(OC)CC3)CC2)cc1 794186282 ZBNBBDVQELZZEK-ZUTVHTERSA-N 415.534 2.318 10 20 HECD COc1ccc(CNC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)c(O)c1 794378852 WYWSRBBKTYKSBH-HSZRJFAPSA-N 421.453 2.159 10 20 HECD COc1ccc(CNS(=O)(=O)c2cccc(I)c2)c(O)c1 795356392 BZJQOQSOZFJZSN-UHFFFAOYSA-N 419.240 2.484 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(S(N)(=O)=O)cc2)cc1 798322230 POQJIMWJLWKFQO-LJQANCHMSA-N 417.531 2.221 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2COC3(CCCCCC3)O2)cc1F 803663917 APOYFHGZHQLQRB-MRXNPFEDSA-N 407.486 2.090 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 804008209 KFAGNQBIGSBJJD-HXUWFJFHSA-N 423.513 2.438 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(Cc3ccccn3)C3CC3)CC2)cc1 804315632 OEENVOSAXWHDDE-UHFFFAOYSA-N 408.502 2.366 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCN1C 806037515 YONOFKVEXAEREZ-IEBWSBKVSA-N 412.534 2.473 10 20 HECD CN1Cc2ccccc2[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 807677540 WCGCMXBXMOFBGA-TZIWHRDSSA-N 423.513 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(C(C)(C)C)nc3)CC2)cc1 808558141 AVRYIDONLDGWSK-UHFFFAOYSA-N 412.490 2.288 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 918304473 SEURKOCWHJQCNR-UHFFFAOYSA-N 402.882 2.492 10 20 HECD COC(=O)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1Cl 1321909792 XFSMSINSMZESMK-HNNXBMFYSA-N 413.835 2.488 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)cc1 18215529 OZQBXRLQINAEPE-UHFFFAOYSA-N 416.528 2.294 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1N1CCCS1(=O)=O 610124629 XNBDXDVNEGYCSE-UHFFFAOYSA-N 424.529 2.340 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1Cl 734703256 KLEAINDZCPMRSW-UHFFFAOYSA-N 402.882 2.329 10 20 HECD CC(=O)N1CCc2cc(NC(=O)C(=O)NCCCSc3nccs3)ccc21 749730033 GVBQRHMZVWYXNO-UHFFFAOYSA-N 404.517 2.289 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C)ccc3OC)CC2)cc1F 754212584 LZCZTLVOTPGVKV-UHFFFAOYSA-N 401.438 2.439 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(O)n1 755259686 WYMLJTLOQBCBSP-CYBMUJFWSA-N 420.416 2.421 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(C)n1-c1ccccn1 755491547 XUVWTBKPEVDWMX-XAMWDVODSA-N 404.470 2.026 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1Br 756094471 AJBUPMOUFHOOHV-UHFFFAOYSA-N 407.220 2.196 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(F)cc3[N+](=O)[O-])CC2)cc1 758222071 FEJPILIXXGWFQA-KRWDZBQOSA-N 405.426 2.304 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCCc1cnn(-c2ccccc2)c1 759596150 NNWVGMGWZUQOPN-CLFYSBASSA-N 407.426 2.199 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(Cc4ccccn4)CC3)cc2)CC1 765979866 WFBROMXYQXBOKS-UHFFFAOYSA-N 414.575 2.071 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3c(F)cccc3F)cc2)C1 766774597 FIRDCANAOZYUHB-HNNXBMFYSA-N 423.485 2.286 10 20 HECD COC(=O)Cn1cc(CCOC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)nn1 772678203 CONMDVFNFTYKOH-UHFFFAOYSA-N 412.446 2.267 10 20 HECD C[C@H](NC(=O)NCCN(C)S(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773394881 ARHMIHLHEHMSAT-AWEZNQCLSA-N 410.565 2.495 10 20 HECD COC(=O)C1(NC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)CCCCC1 775254972 MEAOLVNOWDUXCU-QGZVFWFLSA-N 403.523 2.166 10 20 HECD C[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O)c1ccc(N2CCOCC2)cc1 775255845 ROXXSBJOXCNLBH-HNNXBMFYSA-N 422.485 2.038 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCS[C@@H](C(C)C)C3)CC2)cc1 778297062 FXQKWZYCFRCYLP-NDDJGDGRSA-N 417.575 2.500 10 20 HECD COCCO[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 781963260 IOXAYXQYNLIJGM-MRXNPFEDSA-N 408.454 2.138 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] 784126300 WMYSOEBGYCFZEI-IBGZPJMESA-N 401.463 2.303 10 20 HECD COc1ccc(CN2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785438974 JBLRIDVYPSBZIM-UHFFFAOYSA-N 424.545 2.112 10 20 HECD Cn1ccnc1[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccccc1 785596808 BDPJQCADUCZRKI-OAHLLOKOSA-N 415.544 2.381 10 20 HECD Cc1c(NC(=O)C(=O)NCCCSc2nccs2)cccc1N1CCNC1=O 787519154 TZPKNYBZLUKFKY-UHFFFAOYSA-N 419.532 2.218 10 20 HECD C[C@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 787905646 YWOWIIRKGAJFIN-SFHVURJKSA-N 400.567 2.456 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(Cc2cccs2)CC1 788931148 GJVYKNYQTBNYPB-UHFFFAOYSA-N 412.559 2.309 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c(O)c1 794384302 YXYGFJJVZNGIID-GOSISDBHSA-N 418.515 2.259 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc4ccccc4c(=O)o3)CC2)cc1 797479821 KGAAALMRLACHJY-UHFFFAOYSA-N 422.437 2.307 10 20 HECD COc1ccc(N2CCN(CN3C(=O)N[C@@](C)(C4CCCC4)C3=O)CC2)cc1F 802734551 RYGQEICKHDWCIY-NRFANRHFSA-N 404.486 2.415 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccccc3-c3cnn(C)c3)ccc21 803685210 COQNUHAFIJDKDI-UHFFFAOYSA-N 417.513 2.402 10 20 HECD O=C(COC(=O)[C@H](O)c1cccnc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 803954880 ZZEYKFGBLLJFST-HXUWFJFHSA-N 416.389 2.072 10 20 HECD O=C(NCc1ccc(Cl)cn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806722008 UKZDYQAWLWOFEL-KRWDZBQOSA-N 403.866 2.265 10 20 HECD CCc1cnc(N2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)s1 807101694 AQNSWUARXOKHKL-UHFFFAOYSA-N 415.563 2.045 10 20 HECD CC(C)[C@H](NCc1cc(Cl)c(F)cc1O)C(=O)N(C)Cc1nnc2n1CCC2 816594402 BXSSCRJBOWFUAB-SFHVURJKSA-N 409.893 2.495 10 20 HECD Cc1cc(CCNC(=O)c2cc(S(N)(=O)=O)cn2C)c(C)n1-c1ccccc1 822093780 KXVTVJNLTZCGOB-UHFFFAOYSA-N 400.504 2.053 10 20 HECD CCC(CC)N1C[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 915580659 AHSHHYCTNSCLOW-KRWDZBQOSA-N 403.523 2.291 10 20 HECD O=C(CNc1ccc(Cl)cc1C(=O)c1ccccc1F)N[C@@H]1CCS(=O)(=O)C1 1321221225 MYZHSTPYZJGNMC-CYBMUJFWSA-N 424.881 2.425 10 20 HECD COc1cc(/C=C2/N=C(C3=S=C(C)C=C3)OC2=O)c([N+](=O)[O-])cc1OCC(=O)O 1338685747 LRSOHSDYIHOUKX-VZUCSPMQSA-N 418.383 2.031 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cc(-c2ccco2)no1 1796600656 XLSVMILHDIWYLP-BTTYYORXSA-N 424.413 2.306 10 20 HECD COc1ccc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1803610942 XFMRHXCAONNLMD-QDMKHBRRSA-N 415.421 2.206 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)sc2nc3n(c(=O)c12)CCC3 108873563 REABMGDSGNIXIN-UHFFFAOYSA-N 424.526 2.479 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3c(C)c4ccccc4n3C)ccc21 471233989 GYMKYZGHJVOWBM-UHFFFAOYSA-N 418.497 2.442 10 20 HECD COc1ccc(Cl)c2c1N(C(=O)C1=CC=CN3CCS(=O)(=O)N=C13)CCC2 728006933 XPZKRSWQQRIJMT-UHFFFAOYSA-N 407.879 2.125 10 20 HECD CCN1CCCC[C@@H]1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732250927 MGPZCJISMFDMFA-UYAOXDASSA-N 401.555 2.062 10 20 HECD CC[C@@H](C)[C@@](C)(O)CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 732883326 RBFXZDXLMNRIIP-GCJKJVERSA-N 406.571 2.304 10 20 HECD C[C@H]1[C@@H](C)[S@@](=O)CCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 736653543 PRZNNLORADBYFK-XIQHSNRVSA-N 411.543 2.490 10 20 HECD CCc1nsc(N2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 743875343 NJWDHLKIUMPFRJ-UHFFFAOYSA-N 416.595 2.337 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1 745994141 ZYGURQAOCRZJMC-ZDUSSCGKSA-N 420.487 2.382 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1 747473977 BUXCOKMMLXJJPY-CQSZACIVSA-N 423.560 2.467 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cccc(-c3ccccn3)c2)SC1=S 747698107 HYPWFBQWPHTIEM-VBKFSLOCSA-N 419.553 2.499 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)ccc1OC 753522474 SDXSKGGRZDVYCP-UHFFFAOYSA-N 409.420 2.136 10 20 HECD O=C(O)COc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1Cl 757657118 ROLPUDQZLJMKIP-UHFFFAOYSA-N 401.780 2.008 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc4c(c3)OCCCO4)CC2)cc1 758233373 WIMHFRPJSVPLCN-LJQANCHMSA-N 414.502 2.418 10 20 HECD COc1cc(N2CCN(C(=O)NC3CCN(C4CC4)CC3)CC2)cc(OC)c1OC 759215459 FFMNILJOUNKTQJ-UHFFFAOYSA-N 418.538 2.171 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@H](Cc4ccccc4)N(C)C3=O)CC2)cc1 761186773 UJHUZOJDTSZVOE-QFIPXVFZSA-N 422.529 2.323 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(S(=O)(=O)Nc2nccs2)cc1 762268919 VJJOYKXXPFEVBU-UHFFFAOYSA-N 419.484 2.328 10 20 HECD CCCn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C1CC1 765646947 AGKBLWUMNSPLDX-UHFFFAOYSA-N 416.547 2.335 10 20 HECD CCOc1ccc(O)c(CN2CCCN(S(=O)(=O)c3c(C)noc3C)CC2)c1 768216496 YHHDDJRVVMQABQ-UHFFFAOYSA-N 409.508 2.292 10 20 HECD COc1ccc(CNC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 772777715 XUNIBFYAGVOTBC-YSKGHYERSA-N 401.415 2.376 10 20 HECD COc1ccc(CN2CC[C@@H](NCc3ccc([N+](=O)[O-])c(OC)c3O)C2=O)cc1 775020514 GWGVWWXUAZCQER-MRXNPFEDSA-N 401.419 2.208 10 20 HECD C[C@H](CCc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 775217989 FKTMNUWONVJLHM-OAHLLOKOSA-N 417.481 2.134 10 20 HECD COc1ncc(/C=C\C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)cn1 776307304 VZXDWTDSHZDODX-ZBTAVZRMSA-N 408.458 2.305 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3OC(=O)c4ccccc43)cc2)CC1 786258533 ZJRMCWQNPRRQRT-NRFANRHFSA-N 407.470 2.273 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1F 789661744 RKPIHLYTKVZFRJ-LJQANCHMSA-N 412.509 2.289 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCO[C@@H](c2ccco2)C1 789867524 HRHVJBUIYSDPNW-LJQANCHMSA-N 415.515 2.049 10 20 HECD C[C@@H](COc1ccccc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793688539 UVQAWXQXFHBFCJ-SFHVURJKSA-N 411.502 2.065 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 793899652 BKFDTZVENUYQEM-MSOLQXFVSA-N 400.567 2.480 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1c1ccc(Br)cc1 794701718 CMFSGQXITRUPGL-SJLPKXTDSA-N 419.275 2.254 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c(O)c1 797389612 PZLUQKCKNFMHJA-UHFFFAOYSA-N 411.458 2.282 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 806519033 IJEZUCNFRFBMIN-LSDHHAIUSA-N 406.527 2.349 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 807768460 KFBKGYPGDZYCIC-QLFBSQMISA-N 411.449 2.009 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 808224284 RJHQMZNZTMTLGA-FQEVSTJZSA-N 423.513 2.438 10 20 HECD CNS(=O)(=O)c1ccc(-c2ccc(/C=C3/N=C(C4=S=CC=C4)OC3=O)o2)cc1 812446463 DCCUPZBJUDBYKC-RVDMUPIBSA-N 414.464 2.429 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3cnn(-c4ccccc4)n3)CC2)cc1 915363280 CZKONYUCIFGTQT-UHFFFAOYSA-N 420.517 2.057 10 20 HECD C[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831647310 PTZDDOYYNOBZJS-WBMJQRKESA-N 410.898 2.365 10 20 HECD O=C([C@@H]1C[C@]1(F)Cl)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502417 VCJXURMFRTWJBP-DYZYQPBXSA-N 403.237 2.493 10 20 HECD COc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c1 1846775849 LEPRJNJWSLGRSU-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(N4CCOC4=O)c3)ccc21 60750277 RBWXDSWOWSDACP-UHFFFAOYSA-N 408.458 2.281 10 20 HECD COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 727468452 KPNQXNPQNISGQI-KRWDZBQOSA-N 420.481 2.209 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1 729065349 DGXVIVNHVQABGF-AWEZNQCLSA-N 411.458 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4cccnc4c3N)CC2)cc1 729287324 HIPPWKZNWAAPJW-UHFFFAOYSA-N 420.469 2.331 10 20 HECD COc1ccc(N2CCC(NC(=O)N(C)CCN(C)C3CCN(C)CC3)CC2)cc1 729609724 AUPZOOIDDINTBL-UHFFFAOYSA-N 417.598 2.331 10 20 HECD COC1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 730823935 QQJOJGCHAOJJOX-UHFFFAOYSA-N 422.545 2.351 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1 734015489 NYGBIWBFHNYXDC-QGZVFWFLSA-N 418.515 2.259 10 20 HECD CNS(=O)(=O)c1csc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 748849189 KBIXLLGNSWTQRM-CQSZACIVSA-N 410.517 2.183 10 20 HECD CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCOCC3)cc2)=NN1c1ccccc1 750866477 GFGRBDPQODJRCX-QFIPXVFZSA-N 406.486 2.363 10 20 HECD COC(=O)CCc1nc(COC(=O)c2csc(Cc3ccc(N)cc3)n2)no1 751937762 WHERCWOGERYSCH-UHFFFAOYSA-N 402.432 2.162 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753738706 SEXOQCCLQYGYAO-UHFFFAOYSA-N 421.494 2.095 10 20 HECD CCCN(CCC)S(=O)(=O)N1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 753817771 PPWSUENJSNVLNY-UHFFFAOYSA-N 415.531 2.218 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC[C@H]1COc2ccccc2O1 756336811 QTJLKBPUOOSTEA-OALUTQOASA-N 412.486 2.329 10 20 HECD Cn1ccnc1[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 756690742 XFSRYRRLQMHRNB-MRXNPFEDSA-N 401.486 2.219 10 20 HECD COc1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759200789 RWVSMKORCMJQDF-UHFFFAOYSA-N 402.451 2.470 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)[C@@H](C)c3ccccc3)nc12 759553576 DVGYNXDTUUQSIQ-YEJXKQKISA-N 413.430 2.210 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21 760491004 DYYZMAIRZMFIDB-LFVRLGFBSA-N 412.486 2.220 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCNC(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2 761217472 XDGBBROEJJIHAX-HNNXBMFYSA-N 412.442 2.117 10 20 HECD C[C@H](NC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 763021922 YMARWZAESOOQGC-HNAYVOBHSA-N 415.515 2.412 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 763282550 YSILYPMXNALALI-LBPRGKRZSA-N 414.487 2.401 10 20 HECD COc1ccc(C(=O)NCC(=O)NCc2cccc(Br)c2O)cc1OC 765728572 WCQITKLERBZWKB-UHFFFAOYSA-N 423.263 2.218 10 20 HECD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(N2CCCCC2)c(F)c1 765758148 JOLJEHDLZSNTMT-KRWDZBQOSA-N 412.575 2.044 10 20 HECD CCOC(=O)N1CCC(S(=O)(=O)NCc2cccc(Br)c2O)CC1 766205947 BHVYMJVCBOCRBX-UHFFFAOYSA-N 421.313 2.195 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ncn(-c4ccccc4)n3)CC2)cc1 767153866 BXOZLLDAAROQGA-UHFFFAOYSA-N 420.517 2.218 10 20 HECD O=C(NCCc1cccs1)C1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768438891 ADVGFMHIPKGNOP-IBGZPJMESA-N 402.516 2.450 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC 774765197 XNEXTVCHZRECKM-RDJZCZTQSA-N 419.522 2.056 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(Cc3ccc4c(c3)OCCO4)CC2)c1O 774824152 YVRGILLZMGNZIT-UHFFFAOYSA-N 415.446 2.398 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1O 774930587 RMPQCVYJWKQBQQ-QGZVFWFLSA-N 400.435 2.371 10 20 HECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1cnc(OC)nc1 775825185 AHYAPDHOVGMSHN-RMKNXTFCSA-N 416.503 2.118 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(S(C)(=O)=O)[C@@H](C)C3)c2C)cc1 776575472 RIQQGOWOHUQOEL-HNNXBMFYSA-N 405.520 2.209 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCN(c2ccccc2)C1=O 785423243 UHLGFCXLCPVVMA-HXUWFJFHSA-N 408.502 2.023 10 20 HECD CC[S@](=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 787951120 WNDKCRNVCOTGHU-NDEPHWFRSA-N 405.472 2.375 10 20 HECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 793902231 QPCVKKRPJILPNT-GGPKGHCWSA-N 417.550 2.136 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793902399 QPCVKKRPJILPNT-WSTZPKSXSA-N 417.550 2.136 10 20 HECD COCc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 795805147 CVAGKVVFPGGAMX-UHFFFAOYSA-N 424.494 2.296 10 20 HECD O=C(CN1CCOC[C@@H]1[C@@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796344017 FQYWJOMUENIZEK-RTWAWAEBSA-N 420.465 2.280 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cc1ccc([S@@](C)=O)cc1 797920858 VBHOMHFJOARYQF-MUUNZHRXSA-N 402.516 2.234 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CCCC34CCOCC4)CC2)cc1 800437515 NOCBMTMUITUOEA-RBBKRZOGSA-N 403.567 2.117 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803307522 HIXZVAPIYMOIFH-CABCVRRESA-N 414.506 2.053 10 20 HECD NS(=O)(=O)c1ccccc1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 807604285 ANILKCXPDOQCMB-UHFFFAOYSA-N 404.275 2.346 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cn(C4CCOCC4)nn3)cc2F)C[C@@H](C)O1 810167842 QOVVVSVGPWFERM-GASCZTMLSA-N 417.485 2.312 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)C3CCCC3)CC2)cc1 811994895 IHUIVFYRWBOXDN-OAQYLSRUSA-N 404.555 2.058 10 20 HECD CO[C@](C)(C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 812656129 GNVURERTNLQZBH-KIMHZCHSSA-N 422.497 2.414 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccoc1C1(O)CCOCC1 815449585 UZKDKYGIMFHRJQ-UHFFFAOYSA-N 416.474 2.159 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 920926940 SPKWIGWGDBVJFM-MRXNPFEDSA-N 424.501 2.041 10 20 HECD C[C@H]1CCc2ccccc2N1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1115886074 CJMZBZZUPHEJLX-AWEZNQCLSA-N 403.504 2.335 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(Cl)n1)c1cc(O)nc(O)c1 1794482547 XYRSNBJSFRAUKY-QDMKHBRRSA-N 416.865 2.036 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CCC1 1803432580 NVDZJMBMYFNQKW-PLCSWTFUSA-N 404.438 2.347 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)C1CCCCC1 1804332220 RXYFKBGWTWCMIT-QDMKHBRRSA-N 409.577 2.065 10 20 HECD Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991340 OYABEVYQUHNBSV-MGPUTAFESA-N 422.441 2.423 10 20 HECD O=C(CC1CCOCC1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543365 AEBDSEYBZRHJOC-UHFFFAOYSA-N 417.506 2.154 10 20 HECD O=C(Cc1ccccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817638655 HDRCDPZFFZXNRS-MRXNPFEDSA-N 422.445 2.160 10 20 HECD O=C(Cc1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426199 OGVWQTCJQFTOLM-LJQANCHMSA-N 424.501 2.364 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)C1 1841243850 RLCFBLCCRKRUKV-IRXDYDNUSA-N 411.433 2.253 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H]2CCC(=O)N2)C3)cc1 1845398429 MDWFLQXSMLLZGI-HXUWFJFHSA-N 420.513 2.190 10 20 HECD CN1CCC(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)CC1 1845500228 FVTXKGIHSSBXDK-UHFFFAOYSA-N 421.925 2.300 10 20 HECD CCOC(=O)c1sc(NC=C2C(=O)N(C)C(=O)N(C)C2=O)nc1-c1ccccc1 29004253 IGNZWDAKDRUUCA-UHFFFAOYSA-N 414.443 2.333 10 20 HECD Cc1ccc(C(=O)NCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(O)c1 116774364 XIAAMDFENDKQFK-UHFFFAOYSA-N 415.465 2.113 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)cc2nccnc12 195632139 GAYOMYABAPRWJM-UHFFFAOYSA-N 400.435 2.256 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1C[C@H]2CC[C@H]1O2 733758604 KQCXSKHVDKSFMR-MBOZVWFJSA-N 411.481 2.126 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)cc2F)C[C@@H](C)O1 733840429 DRWKQAHICOAJPK-QUYZETPZSA-N 420.481 2.166 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@]1(O)CCN(Cc2ccccc2)C1 733887829 UVVYLMAMZASEFQ-DEOSSOPVSA-N 409.530 2.119 10 20 HECD CC(C)Oc1cccc([C@H](O)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 735122116 PUVQAGNGCDBDJT-GOSISDBHSA-N 408.476 2.014 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(Cl)nc1 737131069 KXICTZZSAOZCSG-UHFFFAOYSA-N 402.882 2.199 10 20 HECD CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)Cc1ccc(N2CCOCC2)cc1 741730876 WUOAMDSCEPAEBN-UHFFFAOYSA-N 424.545 2.430 10 20 HECD Cn1nnnc1SCCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742797463 CKXDBOLCWCQYLD-LBPRGKRZSA-N 412.466 2.079 10 20 HECD O=C(NCCC(=O)N1CCCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 748343628 KZZTZOWMKHLRPD-UHFFFAOYSA-N 406.502 2.254 10 20 HECD CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 751357059 DOAGFAHQVNSNJM-KRWDZBQOSA-N 407.536 2.449 10 20 HECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)c(O)c1O 751532639 BIHOATSLYHUKPR-UHFFFAOYSA-N 410.879 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(F)(F)[C@@H](C)C3)CC2)cc1 753027074 YYFYYRGRFUGITF-WAVCKPEOSA-N 407.461 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)NCC(=O)N(C)C3CCCCC3)CC2)cc1F 753911277 HZPHJNOTEAZEMY-UHFFFAOYSA-N 406.502 2.457 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)c4ccccc4C3)CC2)cc1 754029361 GBGCOEDFTXFFPG-JOCHJYFZSA-N 410.562 2.130 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(Br)ccc2O)c1 754441706 XRNNYAMUKYBBRV-UHFFFAOYSA-N 401.238 2.484 10 20 HECD C[C@@H](NCC1(O)CCS(=O)(=O)CC1)c1cc(Br)cc(Cl)c1O 756606070 KWWPDNLBNGICGG-SECBINFHSA-N 412.733 2.398 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c2C)c1 758492768 MHARFRIHQDYPHJ-CYBMUJFWSA-N 424.544 2.480 10 20 HECD CN(C)S(=O)(=O)c1ccc(CNC(=O)NCCCSc2nccs2)cc1 759562278 MGZVOOFKBXHMTI-UHFFFAOYSA-N 414.578 2.375 10 20 HECD COCCCN1CCC(NC(=O)NCc2cccc(Br)c2O)CC1 764781729 BOPFDBKGHZHMCY-UHFFFAOYSA-N 400.317 2.455 10 20 HECD O=C(c1ccc2c(c1)OCO2)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768238154 QLXSBNLLVKNFOQ-UHFFFAOYSA-N 409.486 2.210 10 20 HECD CC1(C)C(=O)Nc2ccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc21 768967898 IJVVNJFXWZPEFO-UHFFFAOYSA-N 413.499 2.403 10 20 HECD CC(C)[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 778241331 JTCGEEZJVMUPKA-CBGDNZLLSA-N 407.530 2.412 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(OC[C@@H]2CCOC2)CC1 784242759 ZRUBKFGXCDJRKS-LJQANCHMSA-N 403.523 2.250 10 20 HECD O=C(CN1CCC([C@H]2CCOC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 784344285 UYBSRCRGRGFEFU-IBGZPJMESA-N 405.514 2.027 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCc3c(cnn3-c3ccccc3)C2)cc1 785422916 POZZRHJIFRHTJT-UHFFFAOYSA-N 403.486 2.139 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)cc1F 785538747 FXCWYEVIFMERNO-UHFFFAOYSA-N 412.509 2.420 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(O)cc3)cc2F)C[C@@H](C)O1 786626766 MVPQQYDZIAHVDH-HUUCEWRRSA-N 415.465 2.078 10 20 HECD CCN1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 787324859 KVNJUYGKFFOLMW-OAHLLOKOSA-N 419.481 2.343 10 20 HECD CC(C)(C)SCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 788377173 RZPBZZYDVDQPCR-UHFFFAOYSA-N 411.543 2.051 10 20 HECD Cc1nc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)sc1C 789864545 PPKKYVIYTXBNON-UHFFFAOYSA-N 418.588 2.288 10 20 HECD CCCCOCCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 793750590 PTIGLGUEFQAFHS-UHFFFAOYSA-N 401.301 2.436 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCCN(C)c2ccccc2F)cc1F 793828883 UEIQVCWGNRLRCJ-UHFFFAOYSA-N 404.461 2.290 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCN(c4ccc(F)cc4)C3)ccc21 793865464 UNZMYKBACZMXPE-GOSISDBHSA-N 424.520 2.467 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4ccccc4c(=O)o3)cc2)C1 797711899 DBLJFFPDRFWJHS-QGZVFWFLSA-N 405.454 2.425 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(c4ccc(F)cc4)CC3)ccc21 803688101 VCLQAWIQTMAXMF-UHFFFAOYSA-N 410.493 2.173 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCOc1cccnc1 804078386 IOXLCRRVMNWLGB-UHFFFAOYSA-N 422.279 2.093 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCC[C@@H]1N1CCOCC1 806088469 WIHVFNIXZQSRDG-PMACEKPBSA-N 417.550 2.281 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807545110 BZTYCAAIFPTRJE-AVRDEDQJSA-N 408.546 2.348 10 20 HECD C[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@H](C)CO1 807769841 IYFYEKNHTLILLK-KFWWJZLASA-N 411.449 2.009 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(-n4cccn4)cc3)CC2)cc1 917242640 WVSWAYQNQOPQKB-UHFFFAOYSA-N 420.469 2.387 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C(=O)O 917918622 QYAGBQIWYUJPST-UHFFFAOYSA-N 408.451 2.147 10 20 HECD CCOc1ncccc1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918006337 PHIUNNKCSYIGQH-SFHVURJKSA-N 411.506 2.181 10 20 HECD COC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 920055052 BEXCWMHAHAXHBC-GJZGRUSLSA-N 422.501 2.469 10 20 HECD CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 920195229 NGSPIXGXWDAKNM-UHFFFAOYSA-N 424.501 2.373 10 20 HECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCNS(=O)(=O)NC(C)C)c1 1255825271 XHSRWCZBFGLKIN-UHFFFAOYSA-N 412.943 2.310 10 20 HECD COc1cc(/C=C2/N=C(C3=S=C(C)C=C3)OC2=O)c([N+](=O)[O-])cc1OC(C)=O 1317745728 VQONMEJZWWGUBO-WUXMJOGZSA-N 402.384 2.493 10 20 HECD C[C@H](OC(=O)CO[C@H]1CCOC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1318911088 RGAFPVMXGNYSHL-ZFWWWQNUSA-N 423.421 2.138 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CC1)c1cc(O)nc(O)c1 1792601537 QDBGWLZUOVMMQK-BCDXTJNWSA-N 407.470 2.476 10 20 HECD O=C(CC1(O)CCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429443 VJYDXQKLFOUNTG-KRWDZBQOSA-N 417.506 2.031 10 20 HECD CCCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C)Cc1ccccc1O 110076257 OBFPJUIDXMFDHE-HNNXBMFYSA-N 417.531 2.229 10 20 HECD COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)NCc1c(C)c2ccccc2n1C 472239316 IGBBRVNNFXMXGU-PSBWJHGTSA-N 413.474 2.121 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC[C@H](NC(=O)C(C)(C)C)C2)n(C)c2ccccc12 567266396 AMFMSAVUMYYOTI-INIZCTEOSA-N 412.534 2.256 10 20 HECD CC(=O)NCCc1ccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc1 608259147 UMQPTUVFUDGFGP-UHFFFAOYSA-N 403.504 2.019 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(CCN(C)C)cc3)CC2)cc1 728141287 AKZULVJTEMZWCY-UHFFFAOYSA-N 424.545 2.477 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCOC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 731682816 XRFUKJMCWNUQBQ-NUJGCVRESA-N 409.502 2.292 10 20 HECD COC(=O)[C@@H](c1ccccc1)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 736312495 UGAIWOFWWNISKL-JOCHJYFZSA-N 411.502 2.190 10 20 HECD C[S@](=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 737110498 BPTPWMHWIUKORM-JWRCQZCYSA-N 416.499 2.276 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 741212021 LUODJTMCLSBEIR-UHFFFAOYSA-N 418.538 2.180 10 20 HECD COc1cc(N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc(OC)c1OC 741795395 LDKCGPRHCKMENR-UHFFFAOYSA-N 419.390 2.424 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(-c2cccnc2)n1 743869026 JZOGWEKGRICXEG-GOSISDBHSA-N 418.501 2.114 10 20 HECD Cc1ccc(N2CCC[C@H](OC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2=O)cc1 744854622 LTHIZQLZLXZLIN-SFHVURJKSA-N 418.471 2.425 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnn(C4CCOCC4)c3)CC2)cc1 749916318 LXFLIOZVEVVJGS-UHFFFAOYSA-N 420.535 2.191 10 20 HECD CNS(=O)(=O)[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)C1 750200323 BNXGYJHXQKCCFI-KRWDZBQOSA-N 407.511 2.348 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)C2CC2)cc1 756094408 KUXVIWPXSUAJLU-ZCLUNYJNSA-N 422.529 2.234 10 20 HECD COc1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCOCC4)c(F)c3)C2=O)cc1O 761090022 HWGPKTLNGIZQAJ-IBGZPJMESA-N 415.421 2.170 10 20 HECD CCOc1cccc(CN2CCCN(S(=O)(=O)c3c(C)noc3C)CC2)c1O 768216217 RPTLWCUCSUCTIZ-UHFFFAOYSA-N 409.508 2.292 10 20 HECD COc1cccc(NC(=O)Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)c1 770959088 SOKJLDMCRBDJHW-UHFFFAOYSA-N 418.431 2.004 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N(C2CCCCC2)C1 772443101 IDYIVDAOGKTOFY-GOSISDBHSA-N 400.523 2.256 10 20 HECD CN(C)C(=O)c1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772908417 YTYOOOSHPUZONT-UHFFFAOYSA-N 414.481 2.092 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773844534 CXJBVYHYKNWBTP-AWEZNQCLSA-N 403.504 2.362 10 20 HECD O=C(NCCc1c[nH]c2ccccc12)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774613748 CXEUVJDNNFEWLV-UHFFFAOYSA-N 424.476 2.119 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCc2cc(OC)c(OC)c(OC)c2)c1 775374770 DXSKUXMPORZIQG-ZDUSSCGKSA-N 404.463 2.394 10 20 HECD CCN(CC)CCCNC(=O)C1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779520472 HUPNXJVWOLCALO-CLFYSBASSA-N 403.523 2.198 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC3(N(C)C)CCC3)cc2F)C[C@H](C)O1 782643008 BBJQVZZGTGMKPP-ROUUACIJSA-N 420.573 2.472 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2nc(C(F)(F)F)cs2)cc1 785423004 SMLQQODWLQAHLX-UHFFFAOYSA-N 400.426 2.203 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 785428816 SJTFELTYZHSRIM-RXVVDRJESA-N 408.546 2.396 10 20 HECD O=C(NCCc1cccc(F)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 785541436 ZNVKKUYDISUHIP-LJQANCHMSA-N 400.450 2.398 10 20 HECD C[C@@H]1c2c(F)cccc2CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324897 ZJISGSMRWVYHLU-MRXNPFEDSA-N 411.477 2.424 10 20 HECD O=C(Nc1cnc(CC2CC2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 792959860 RJSAUQHJDKRLOW-GOSISDBHSA-N 410.474 2.281 10 20 HECD O=C(Cn1cc(NCc2ccc3c(c2)CCN3Cc2ccccc2)cn1)NCCO 796345957 PABOAKTYYIVPMD-UHFFFAOYSA-N 405.502 2.166 10 20 HECD C[S@@](=O)c1ccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 797877804 DHYDQPHZTUXCOB-MUUNZHRXSA-N 400.544 2.492 10 20 HECD COc1cncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 798429972 UZBRUPTVWYSYOE-KBPBESRZSA-N 409.483 2.321 10 20 HECD CS(=O)(=O)c1ccc(C(=O)NCCCSc2nccs2)cc1[N+](=O)[O-] 801155496 WHVMUZBTOJEGLJ-UHFFFAOYSA-N 401.491 2.367 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803297233 OAEIMFDXZQPBPO-NSISKUIASA-N 417.550 2.362 10 20 HECD C[C@H](NC(=O)C(=O)NCCC[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803303793 AFVIUQJWYXMMKO-PXNSSMCTSA-N 403.523 2.166 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)cc1F 803664207 GOWIJQCTABNHCW-QAPCUYQASA-N 403.454 2.216 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)NC1CCN(S(=O)(=O)C2CC2)CC1 806940459 ZSQJUJPRCSMSLO-UHFFFAOYSA-N 422.334 2.455 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccccc1 807289374 RSHUFJJFPYRHRH-FCHUYYIVSA-N 404.514 2.241 10 20 HECD Cc1cc(=O)cc(C)n1CCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 810182859 JUTLUKLMKOLWDW-HXUWFJFHSA-N 424.545 2.263 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOCC(F)(F)F)cc1Cl 811680320 XYYPBPICBSGOQH-UHFFFAOYSA-N 410.823 2.032 10 20 HECD Cc1cc(C(=O)N2CCN(c3ncnc4c3cnn4C)CC2)c(C)n1-c1ccccn1 914849133 FOKDJNXXYUXAEG-UHFFFAOYSA-N 416.489 2.128 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 917355455 DKWDAWCSOGXKSE-IIBYNOLFSA-N 416.474 2.486 10 20 HECD CCNC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918031405 WJEPFSNWBZFIPI-GOSISDBHSA-N 423.517 2.460 10 20 HECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccco1 918177026 DZSJJMCVEWJYKQ-IBGZPJMESA-N 404.486 2.482 10 20 HECD COCCOc1ncccc1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918208243 NJQQVTXVKVHZPZ-UHFFFAOYSA-N 418.469 2.082 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920870185 MPXRGMLYBVGMCJ-CQSZACIVSA-N 420.487 2.270 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)C1CCCC1 727105266 YFRRIOQFXDWGTD-QFBILLFUSA-N 414.550 2.090 10 20 HECD CN(C1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1)S(C)(=O)=O 728198600 MYTIPYBAHDGVSR-UHFFFAOYSA-N 418.515 2.185 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1 728836841 FPEHACHXMCFBKX-UHFFFAOYSA-N 412.368 2.414 10 20 HECD C[C@H](NC(=O)N(C)CCN(C)C1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 729603521 WGVSSTCUIHVDJY-IBGZPJMESA-N 417.598 2.252 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)CC3CCCC3)CC2)cc1 730808382 KVRUEZLZYORXQW-UHFFFAOYSA-N 400.567 2.483 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731844186 BKDGWQXHALTUEW-SFHVURJKSA-N 418.515 2.415 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1F 740494776 ICWBZGDIRUKKOP-QGZVFWFLSA-N 401.438 2.314 10 20 HECD CN(Cc1ccccc1O)C(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2 741145797 MIDLMZGJBLDWPE-UHFFFAOYSA-N 405.472 2.376 10 20 HECD CC(C)Nc1ncccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743313459 JMMLAIWHBSOULS-UHFFFAOYSA-N 402.520 2.067 10 20 HECD CNS(=O)(=O)c1ccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)s1 745408968 YBMRDELDZFGJEH-UHFFFAOYSA-N 409.533 2.240 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@]3(CCCc4sccc43)C2=O)cc1 749071759 SKBTYHQERGGIMT-OAQYLSRUSA-N 412.515 2.214 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC(=O)c3cccs3)cs2)cc1 751931867 UQIJYSFIULDGBA-UHFFFAOYSA-N 401.469 2.491 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cccc4nonc34)n2)c[nH]1 753917813 BBSUPEXHYBTMMJ-UHFFFAOYSA-N 405.417 2.262 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCC[C@H]1CCOC1=O)c2[N+](=O)[O-] 754055678 VXDXLVDHOYAMOZ-LLVKDONJSA-N 409.350 2.480 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1cccc(CN2CCSCC2)c1 758548283 QXHZLODSTRTHAR-UHFFFAOYSA-N 402.472 2.442 10 20 HECD NC(=O)c1c(NC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)sc2c1CCCC2 759593120 IXAYYUFUOIYKSR-VURMDHGXSA-N 416.455 2.332 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)NCCCSc3nccs3)CC2)nn1 760130576 XVVKJXLLHUWRRW-UHFFFAOYSA-N 410.525 2.050 10 20 HECD Cc1cc(C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 763453396 RWLOHIKELZOTMY-UHFFFAOYSA-N 405.520 2.413 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1 766893148 ZUFDCJGBIGDDFY-UHFFFAOYSA-N 411.288 2.408 10 20 HECD C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NCCc1ccc(O)c(O)c1 768900322 FLLHCBJFOYYDHZ-SECBINFHSA-N 413.293 2.399 10 20 HECD Cc1cc(S(=O)(=O)NCCNCc2ccc(N3CCN(C)CC3)cc2)c(C)s1 771855730 JZZJDEZZRQABDP-UHFFFAOYSA-N 422.620 2.185 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccn(Cc4ccccc4)n3)CC2)cc1 771968158 WSWDDOMKHLXJAL-UHFFFAOYSA-N 419.529 2.492 10 20 HECD COc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OCC(N)=O 773022682 ITZJONUCTZAYGL-CYBMUJFWSA-N 401.463 2.125 10 20 HECD CN(CC(=O)N1CCOCC1)Cc1cc(Br)cc(Br)c1O 775647269 UASKQKXZLAYLDP-UHFFFAOYSA-N 422.117 2.208 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)cc1 776059631 PYDLFUMSFACIPU-QGZVFWFLSA-N 405.524 2.411 10 20 HECD COc1ccc(O)c(CNCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1 776083074 NRROTIHDAXAXLU-SFHVURJKSA-N 406.504 2.148 10 20 HECD COC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc(O)c2O)CC1 776331514 XUDRPZCZIHWBDX-QGZVFWFLSA-N 404.850 2.423 10 20 HECD Cc1cc(C(=O)CN(C[C@H](C)O)[C@@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 785533400 DVADZXRFHXENTM-HOTGVXAUSA-N 402.491 2.112 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCc3nc(C)ncc3C2)cc1F 786676626 XUTQMWGDKGGUEL-QGZVFWFLSA-N 413.497 2.060 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(CC2CC2)CC1 788485712 RWRCXQLSINNSFD-UHFFFAOYSA-N 400.567 2.480 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C(=O)N1c1ccccc1 788911554 PHKXUXANRAJAGP-UWJYYQICSA-N 420.513 2.213 10 20 HECD CC1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCS1 789840645 LUSGTCCQAHEFGQ-UHFFFAOYSA-N 423.554 2.147 10 20 HECD COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)c1 791528687 XBJRMJAYTWHFSS-OAQYLSRUSA-N 413.449 2.480 10 20 HECD COc1ccc(OCCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 793866519 ZLULBNAGBSZKRM-UHFFFAOYSA-N 411.502 2.279 10 20 HECD O=C(COC(=O)CCCC1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 798736461 AOKOFSFRQUULMH-UHFFFAOYSA-N 422.497 2.419 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)cc1 804940552 AWFJULUGQDEMLA-UHFFFAOYSA-N 404.460 2.227 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1c[nH]nc1-c1ccccn1 807386741 HEEAXXZARMVLHY-UHFFFAOYSA-N 416.235 2.195 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671669 RXBVOSINVRVUII-CVEARBPZSA-N 418.538 2.303 10 20 HECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807679275 PLBZZSLREIGORR-NUJGCVRESA-N 418.538 2.303 10 20 HECD C[C@H]1COCCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768347 HKZCSHYKOQBGEX-LSDHHAIUSA-N 411.449 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@@H]4CN(C(C)=O)C[C@@H]43)CC2)cc1F 808354529 HFYIAYNIRUSYRM-IMFGXOCKSA-N 418.513 2.313 10 20 HECD O=C(CN1CCC(F)(F)[C@@H](CO)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 812859823 QUHRJYCIIBAKST-CYBMUJFWSA-N 414.408 2.350 10 20 HECD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ncnc3[nH]cnc23)c(C)n1-c1ccccn1 914903075 DFEIXZVHBVKZDJ-ZDUSSCGKSA-N 405.418 2.339 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3N3CCN(C)CC3)c2)CC1 1116717674 NXDBUFGSEAFTQN-UHFFFAOYSA-N 421.545 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c[nH]c(Br)c3)CC2)cc1 1256091477 OZSVNROTCGXAFC-UHFFFAOYSA-N 422.279 2.291 10 20 HECD CN1CCN(c2ccc(CN(C)[C@H]3CCN(CC(F)(F)F)C3=O)cc2F)CC1 1319948141 IOMYQOOQXWLYFJ-KRWDZBQOSA-N 402.436 2.173 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccnn1C[C@@H]1CCOC1 1320717501 KNUYCTSMFNTLMN-INIZCTEOSA-N 417.485 2.342 10 20 HECD C[C@H](Cc1ccncc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1801248564 JADJAVDIDCUQAV-NKGKWGDASA-N 410.474 2.018 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807998745 NXXFYOSNNCCREL-YONMQOAISA-N 410.474 2.420 10 20 HECD Cc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843861 DWSGYUOPDFOWIB-AWEZNQCLSA-N 412.406 2.132 10 20 HECD CC(C)(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cn1 1840986988 SHIBBOZOIBKGHA-UHFFFAOYSA-N 410.474 2.316 10 20 HECD CS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 13794067 FXHJHTCYCBDWJC-GOSISDBHSA-N 412.467 2.215 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(SC)nc3)CC2)cc1 727228781 ZYQKXTXEVYIOAF-UHFFFAOYSA-N 400.504 2.490 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H]3CN4CCC[C@H]4CO3)cc2F)C[C@@H](C)O1 729497578 VERGULQEHGXEEW-ZAWLATJESA-N 420.529 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3cccc(OC)c3)CC2)cc1 729876207 UEPSNCNRFAKRHX-NDEPHWFRSA-N 402.516 2.301 10 20 HECD C[C@H](NC(=O)NC1CCN(C[C@@H]2CCOC2)CC1)c1ccc(N2CCOCC2)cc1 736379646 IOMKTORXHQILML-OALUTQOASA-N 416.566 2.384 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCN(C)C[C@H]3C(C)C)cc2F)CC1 739006797 ZZCQKSKKVVIAIM-NRFANRHFSA-N 405.562 2.449 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(F)cc3C)CC2)cc1 743432854 UQVSEZMFPATBDJ-UHFFFAOYSA-N 414.481 2.020 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2nn[nH]c2n1 753800079 SHOYCRZDOZFIOG-UHFFFAOYSA-N 406.368 2.138 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1F 754040585 RTEWPLZWUKTCQA-UHFFFAOYSA-N 413.402 2.393 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCOC(C)(C)C3)CC2)cc1 754130071 DLQCTTMQGFBMKB-GOSISDBHSA-N 404.555 2.464 10 20 HECD COCC(C)(C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 757182192 LFHORKCKKBHTFI-UHFFFAOYSA-N 416.501 2.167 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 761999623 GDJIDPFBWAOHTC-UHFFFAOYSA-N 418.468 2.491 10 20 HECD COc1cc(N2CCN(C(=O)CCC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 764881683 WJDNTGJIGIYVID-UHFFFAOYSA-N 408.495 2.483 10 20 HECD CCCCN(C)C(=O)CSCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 764975162 MPUPNKJFTSOZNR-UHFFFAOYSA-N 411.543 2.270 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 767768182 ALCQCCGZPYIIES-UHFFFAOYSA-N 415.515 2.167 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)NC(=O)CC2 768171047 MZKCMKOAJLITTR-UHFFFAOYSA-N 420.469 2.211 10 20 HECD CCO[C@@H](C)c1noc(CN2CCN(Cc3cc(OC)c(OC)cc3O)CC2)n1 768464850 BQGBJLMVVTWWSN-AWEZNQCLSA-N 406.483 2.208 10 20 HECD CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(S(N)(=O)=O)CC2)cc1 772695393 WFGZTQJBTWMOLF-UHFFFAOYSA-N 416.507 2.129 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1 774542275 KEHOYPLVVMYGBM-UHFFFAOYSA-N 418.541 2.460 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(COC)cc2)cc1OC 774615192 QSJFJCIAQHOODC-UHFFFAOYSA-N 414.505 2.404 10 20 HECD C[C@@H](NCC(=O)NC(=O)NCc1cccs1)c1ccc(N2CCOCC2)cc1 775259279 QSMDBUUQMRQKJM-OAHLLOKOSA-N 402.520 2.261 10 20 HECD COCC1=CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 775827395 QYUZVIHGSHXKNE-CALCHBBNSA-N 405.514 2.334 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C[C@@H](C)O)[C@H](C)CO)c2C)cc1 785537518 QHZCUVMHLYHKKW-HZPDHXFCSA-N 402.491 2.127 10 20 HECD CC(=O)c1cccc(OCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786657145 UADLCKLYUNBNQC-UHFFFAOYSA-N 409.486 2.253 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3Oc4ccccc4O[C@@H]3C)cc2)CC1 786660528 ZDXPHVHEVMUVQK-ZHRRBRCNSA-N 409.486 2.200 10 20 HECD COC(C)(C)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 787128373 GKHPPVKZCYULBU-GJZGRUSLSA-N 410.486 2.414 10 20 HECD C[C@@H](CN1CCOCC1)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 788882355 BZHPYRXFRVNCPL-RCCFBDPRSA-N 422.545 2.301 10 20 HECD CC(C)c1[nH]nc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1[N+](=O)[O-] 796252391 OTDNCKCQZGMKRV-UHFFFAOYSA-N 403.439 2.323 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)N=c1cc[nH]cc1I 797642691 KMWLYXBFEQZCDU-SECBINFHSA-N 413.215 2.272 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCN(C3CC3)C2)cc1 803175277 BOBMANDFAPDYRI-SFHVURJKSA-N 410.518 2.227 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803297234 OAEIMFDXZQPBPO-PWIZWCRZSA-N 417.550 2.362 10 20 HECD O=C(OCc1cn[nH]c1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 803483184 JUABVGWGZMIROW-UHFFFAOYSA-N 418.387 2.181 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCN(c4ccccc4)C3)ccc21 803686097 VXIVZVKUHDCKLA-FQEVSTJZSA-N 406.530 2.470 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(CCO)Cc2ccc(C)o2)cc1F 804852833 OPWIUVIJGATMNS-UHFFFAOYSA-N 405.470 2.211 10 20 HECD CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCc4ccc(N5CCC(O)CC5)c(F)c4)[C@@H]1[C@H]3C2 806457861 SMDKQICCJHNSNM-HWIQRTGZSA-N 403.498 2.352 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(N2CCOCC2)c1 807098153 WCCRZDHKEHNCIG-UHFFFAOYSA-N 424.545 2.139 10 20 HECD COc1cc(N2CCN(CN3C(=O)C(C)(C)[C@H]3C3CC3)CC2)cc(OC)c1OC 811764047 NLZOOKPFMLECQZ-HXUWFJFHSA-N 403.523 2.439 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cl)cc1[N+](=O)[O-] 916676649 NHIVSXXVRFGPAZ-UHFFFAOYSA-N 423.878 2.413 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(CC(N)=O)CC1 917131878 GYZIYQGMYSWBJP-AWEZNQCLSA-N 419.481 2.376 10 20 HECD Cc1nn(C)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1[N+](=O)[O-] 919986174 YRQMFPGPPZLEKZ-VXGBXAGGSA-N 405.430 2.319 10 20 HECD Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807991336 OYABEVYQUHNBSV-FOIQADDNSA-N 422.441 2.423 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC(F)(F)C1)CC2)c1cc(O)nc(O)c1 1816720321 KTJUKHIDHSVLPZ-SNVBAGLBSA-N 424.429 2.220 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)s2)C1 1841939185 AVPMVAWDUVOHJM-UHFFFAOYSA-N 407.879 2.267 10 20 HECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1Cl 1843251232 KQUUXCSVOIJZKH-UHFFFAOYSA-N 417.849 2.286 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccccc1 303429952 DFNVDQOFGPFYAO-HNNXBMFYSA-N 400.454 2.489 10 20 HECD CS(=O)(=O)Nc1cc(F)ccc1NS(=O)(=O)c1cccc2nsnc12 536902643 ZHWGXYKHACUCGU-UHFFFAOYSA-N 402.454 2.003 10 20 HECD CCc1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(N)(=O)=O 577771988 RKZFOHVMFSFNRP-UHFFFAOYSA-N 404.492 2.393 10 20 HECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)N(C)Cc1ccc(N2CCCCC2)cc1 725818912 FQSNWIAAXLKYCS-IBGZPJMESA-N 409.552 2.381 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 728300710 UUCZFNHMQYEJOR-BGYRXZFFSA-N 413.518 2.047 10 20 HECD Nc1ccc(Cl)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 728335751 SIFZZZWQADXHII-UHFFFAOYSA-N 421.856 2.371 10 20 HECD C[C@H]1COCCN1CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729612303 VHZZXMIWMCJMNI-HNNXBMFYSA-N 412.481 2.277 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cccc(F)c3F)CC2)cc1 732923146 QBBYEKMXGZFRJI-UHFFFAOYSA-N 411.474 2.074 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3c(O)ccc4c3CCCC4)ccc21 743716940 BRICMOUWSSDOFC-UHFFFAOYSA-N 421.497 2.226 10 20 HECD COc1ccc(C[C@@H](CO)CNC(=O)NCc2ccc3c(c2)CCCN3C)cc1O 745788958 WSBQQRROEQMRAL-GOSISDBHSA-N 413.518 2.434 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCNS(=O)(=O)c2cccs2)C2CC2)cc1 747437616 LZSNDPOWFICSRC-UHFFFAOYSA-N 422.576 2.467 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3cccc(NS(C)(=O)=O)c3)CC2)cc1F 753740048 LWFUVJVZMPQIGE-UHFFFAOYSA-N 421.494 2.097 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058686 APXKIKWOXCLBRV-SJLPKXTDSA-N 417.554 2.209 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 756535951 SSZHTMYAQSPODT-OAHLLOKOSA-N 407.511 2.382 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)c1 761973412 PQPXFYHMBXWBNO-AWEZNQCLSA-N 415.490 2.195 10 20 HECD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(Cc2cc(C)ccc2O)CC1 768870868 FJXIIJVYHREEBV-UHFFFAOYSA-N 422.503 2.204 10 20 HECD COC(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(F)c1 772375332 NQHUOMIGLAMCJK-UHFFFAOYSA-N 406.435 2.099 10 20 HECD COC(=O)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778221921 XUZANILJBZLCPH-VAWYXSNFSA-N 423.469 2.325 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOC3CCCCC3)CC2)cc1 778248054 ZZVIOYIZRYWXQJ-VAWYXSNFSA-N 415.534 2.366 10 20 HECD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779498883 GJXCGVDGQBGVOU-DDJMYBDESA-N 413.449 2.422 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)O[C@@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1 783264705 PTHGGFJIEMDMDT-IRXDYDNUSA-N 418.515 2.251 10 20 HECD O=C(COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)NCC1CCC1 785407184 FEYXRWYMCWPLMK-UHFFFAOYSA-N 424.500 2.328 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)cc1 785435443 ZCRZEABCGHSIFC-UHFFFAOYSA-N 418.538 2.132 10 20 HECD CCC(CC)[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)N1CCOCC1 786601184 YPHTZLZZNKZGSV-LAUBAEHRSA-N 418.582 2.183 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1 788312229 DYCNXTGIMKXZPF-UHFFFAOYSA-N 413.493 2.373 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCOC2(CCCCC2)C1 789855517 SQCZQULBQSKMPC-UHFFFAOYSA-N 417.575 2.418 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c(O)c1 797390882 YAYSPQRQGIBYIX-NDEPHWFRSA-N 416.377 2.283 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(S(=O)(=O)N2CCCC2)CC1 799933536 RSJJSPSILYLVPF-UHFFFAOYSA-N 418.563 2.162 10 20 HECD Cc1cn(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1[N+](=O)[O-] 800870746 SNQGXPBOQZDKPX-KBPBESRZSA-N 405.430 2.169 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)Cn1cc(Br)c(O)nc1=O 801548281 DQNPSPAZPUWDIV-UHFFFAOYSA-N 410.268 2.246 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 802609452 AXUPVQWYYZJFEX-UHFFFAOYSA-N 409.442 2.385 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCOC[C@@H]3C)CC2)cc1 805820944 AOMZPZSUGTVIIT-OALUTQOASA-N 404.555 2.179 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 807099375 UDEMVZKNUCTTMQ-NRFANRHFSA-N 417.550 2.254 10 20 HECD CCn1c(SCC(=O)C(C)=O)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 808011424 NZIIUTPCSCCMGQ-UHFFFAOYSA-N 409.533 2.481 10 20 HECD Cc1nnsc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816721902 XKULRMOKVWRARH-UHFFFAOYSA-N 410.502 2.344 10 20 HECD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 912558465 NJTMSVUFXOVLEC-UHFFFAOYSA-N 409.405 2.029 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCOc3ccccc3F)cc2)C1 918001243 HNLHTPCKUVJIHW-QGZVFWFLSA-N 414.481 2.406 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](CO)Cc1ccco1 918065318 XLHTYUJNSURUEL-INIZCTEOSA-N 405.470 2.030 10 20 HECD CN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1ccc(Br)cc1F 919867258 JFOMHZHWIIKJSV-UHFFFAOYSA-N 414.256 2.049 10 20 HECD Cc1cc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc(CO)n1 1117284611 NTTZEJQPTHHTNP-UHFFFAOYSA-N 409.469 2.145 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnn1-c1ccncc1 1319788373 YTGHTRYGVBCMFT-SFHVURJKSA-N 418.501 2.207 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 1320416978 JZKWSHNDQIUBEW-QGZVFWFLSA-N 403.508 2.165 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1[S@](=O)CC 1320436706 MTVYEZSQEMVNFP-OHZJNBGDSA-N 405.472 2.130 10 20 HECD COC(=O)CNC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1321297307 ZKUODRSKRSMTCT-UHFFFAOYSA-N 414.481 2.092 10 20 HECD C[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)O1 1804285622 CODAXNWIKMLOBN-CESFCVHUSA-N 416.474 2.022 10 20 HECD CCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832358952 NLNCJJDYTQXNBC-QGZVFWFLSA-N 405.495 2.153 10 20 HECD C/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899336 FAYKKCLYYKMWFN-FIMWJMCYSA-N 409.577 2.043 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 16134505 ZGCFJFLSCNSTFO-UHFFFAOYSA-N 423.922 2.096 10 20 HECD CNc1snc(C)c1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 31627939 ATXNMDXRIALZBE-UHFFFAOYSA-N 404.492 2.007 10 20 HECD COC[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 303519793 CNGWMFAPKPEJRN-IBGZPJMESA-N 404.555 2.275 10 20 HECD Cc1c(CNC(=O)N[C@@H]2CCCN(Cc3nccn3C)C2=O)n(C)c2ccccc12 472148740 AHKIEVOQMSJTAG-QGZVFWFLSA-N 408.506 2.211 10 20 HECD Cc1nc(C)n(C[C@@H]2CCCN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)C2)n1 579753081 XULXYEBWNDINIV-GOSISDBHSA-N 422.533 2.250 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726726240 QFSGRZJHGJJJQL-UHFFFAOYSA-N 424.501 2.087 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](N4CCCC4)C3)CC2)cc1 727224862 SCKSQEIVWWNFDR-NRFANRHFSA-N 415.582 2.087 10 20 HECD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(O)cs2)c(=O)n(-c2ccccc2)n1C 732355751 SZCNDISIAAILIY-GFCCVEGCSA-N 401.444 2.436 10 20 HECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 732999990 LQLNALKPMPIVTD-KRWDZBQOSA-N 419.459 2.112 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 734402005 BKXRWSCDOVNEAO-UHFFFAOYSA-N 415.559 2.221 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1O 737284707 QJTWDNNLKWGQHP-UHFFFAOYSA-N 417.425 2.390 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cnc(O)c(Br)c1 742051024 OMUHMNFLZVJRLK-UHFFFAOYSA-N 410.243 2.455 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H](c1cccc(F)c1)N1CCOCC1 742054667 CXCUIQJYGJTQCZ-QFIPXVFZSA-N 413.493 2.352 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)cc1 747200221 QFIUEQWXNYUUSR-UHFFFAOYSA-N 410.518 2.323 10 20 HECD COCCS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1 749573377 UNFCCVLDGWYEIF-UHFFFAOYSA-N 404.488 2.196 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccnc3N3CCOCC3)CC2)cc1F 753881795 PUZJKVUXYSIXNS-UHFFFAOYSA-N 415.469 2.420 10 20 HECD CCc1nnc(O)c(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1CC 754570342 PFEBTEJMZGQASZ-UHFFFAOYSA-N 417.485 2.282 10 20 HECD COCC1(O)CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 758256402 ICVWXVAHOBEFIG-UHFFFAOYSA-N 420.216 2.252 10 20 HECD CC(C)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n(-c2ncccn2)n1 768013123 WCGPVYBLTXORLP-UHFFFAOYSA-N 421.505 2.449 10 20 HECD Cc1cccc(F)c1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 772452999 XGEJLZIMXPXLIX-MRXNPFEDSA-N 405.495 2.314 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1 772641504 RICVNPMCTYBRAK-CYBMUJFWSA-N 411.466 2.456 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCOc1ccc(S(C)(=O)=O)cc1 773739331 FFFAWULBQKPAAR-CQSZACIVSA-N 407.488 2.408 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccccc3)cc2F)CC1 774316421 BEPZPNMGAQNOFT-QGZVFWFLSA-N 412.509 2.461 10 20 HECD COc1cc(OC)c(NC(=O)C(=O)NCc2ccccc2O)cc1Br 778596003 PZUSXCBBQHYVKP-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc(OC)c(F)c3)CC2)cc1 779219515 UCBWQKJOVKKLEQ-FQEVSTJZSA-N 417.525 2.458 10 20 HECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(NCc2ccc3c(c2)CCCN3C)CC1 779343736 BGEYNJRVHZDKGL-UHFFFAOYSA-N 417.579 2.352 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 784029134 YHRUOMFGGJATGQ-UHFFFAOYSA-N 411.380 2.494 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cnn(Cc2ccccc2)c1 788827248 KUAOCPHKNWCVSD-UHFFFAOYSA-N 405.502 2.272 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC(C)(C)C1 789833205 FLSSQZOFOGLALR-OAHLLOKOSA-N 405.514 2.298 10 20 HECD Cc1nn(C)c(Br)c1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 801502818 ZDCVTWPIEDSMCU-UHFFFAOYSA-N 423.311 2.372 10 20 HECD CC(C)[C@@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCS1 803299796 NWBXOYFURGJKHA-LPHOPBHVSA-N 405.564 2.300 10 20 HECD Cc1cnc([C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803302933 FZKYWIYDFBZNGI-HOCLYGCPSA-N 416.547 2.385 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc([N+](=O)[O-])cc(C)c3F)nc12 803458019 YTQUOYIAQPVRLW-UHFFFAOYSA-N 418.337 2.324 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1F 803664091 DHRKPPPPDZGSHB-BGYRXZFFSA-N 424.520 2.098 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(CC(C)C)CC(C)C)CC2)cc1 803747607 SPORUQFSGXQUBH-UHFFFAOYSA-N 418.582 2.074 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)N2CCCCCC2)cc1F 804080249 JVEIEWURMDBXPJ-UHFFFAOYSA-N 420.529 2.197 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC(Oc2ncccc2F)CC1 807288907 CLAWPEIVIPJBIY-UHFFFAOYSA-N 424.476 2.283 10 20 HECD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)nn1-c1ccc(F)cc1F 808934287 YEERRNCLUXEAQF-UHFFFAOYSA-N 416.384 2.168 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@@H](C4CCC4)C3)CC2)cc1 813610475 LGHPTUVXXFIOKD-FQEVSTJZSA-N 416.566 2.275 10 20 HECD COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 919792074 NRNKLEIYICAYAL-UHFFFAOYSA-N 400.435 2.439 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)cc2nc(S)[nH]c12 919878768 XIPCDEOQGADRDZ-UHFFFAOYSA-N 420.491 2.478 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(C(F)(F)F)[nH]1 1796600925 QVPPKIGHUMPDSB-ZSBIGDGJSA-N 424.379 2.405 10 20 HECD Cc1ccn(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847651 QHNJXQXBCWMZNH-HNNXBMFYSA-N 424.461 2.483 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CCN2CCCCC2)C1 1842740192 UBXBUYDXTCWGPJ-UHFFFAOYSA-N 421.925 2.444 10 20 HECD CC[C@@H](C)NC(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 6428486 UUCHDZLIIHASCW-LLVKDONJSA-N 410.382 2.442 10 20 HECD O=C(O)COc1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1Br 108047790 OYTNJJZIPJDUHG-MDWZMJQESA-N 417.215 2.374 10 20 HECD Cc1c(CNC(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)n(C)c2ccccc12 559902661 RBRUDYFORNQFHE-CQSZACIVSA-N 410.440 2.103 10 20 HECD C[C@H]1CN(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 726713949 WWCLFQVKYQBEHM-HNNXBMFYSA-N 412.481 2.277 10 20 HECD O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCOCC2)cc1 731684339 XCSNUWZIQBUWMG-UHFFFAOYSA-N 400.435 2.310 10 20 HECD CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1 731897648 UBBRVDYLCPVGSF-XLIONFOSSA-N 402.539 2.360 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCO[C@@H](C(F)(F)F)C1 740470152 VEOMWDWGDGLDAM-MRXNPFEDSA-N 405.392 2.260 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 741093751 VADPVYXDICGTHJ-RCCFBDPRSA-N 410.536 2.439 10 20 HECD COC(=O)[C@H](C)CN(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748028177 XKMAZIMMOULBAC-LLVKDONJSA-N 412.489 2.136 10 20 HECD CN1CC(=O)N(CC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 749358174 DFHKNFLIXJHISI-UHFFFAOYSA-N 409.402 2.478 10 20 HECD Cc1cccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)nn2)c1 751098371 QLPLCYIJHPXZMH-SFHVURJKSA-N 418.501 2.207 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1F 754212589 MGRRXFSKPXMQSP-UHFFFAOYSA-N 416.409 2.338 10 20 HECD COc1ccc2c(c1)C=C(C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)CO2 755215044 ZBPXYZRMMOPSNG-QGZVFWFLSA-N 421.497 2.489 10 20 HECD O=C1[C@@H]2[C@@H](C(=O)N1CCNCc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)[C@H]1C=C[C@H]2C1 756142499 SRMXEKOHKIKXLJ-USNOLKROSA-N 424.501 2.482 10 20 HECD CN1C(=O)c2ccc(NC(=O)CN(Cc3ccccc3O)C[C@H]3CCCO3)cc2C1=O 756336603 OMWUFABQYNUYQV-QGZVFWFLSA-N 423.469 2.238 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3CCN(CC(C)C)C3)CC2)cc1 756930406 YITZJNSQHXXPIE-FQEVSTJZSA-N 417.598 2.094 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763877539 JYWWLNVNAFKINN-MMEWPQADSA-N 410.495 2.101 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765032752 HTYHMQUNSJTACR-UHFFFAOYSA-N 410.477 2.053 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1 765823021 QYOBFQHQVMYIGU-UZLBHIALSA-N 412.486 2.300 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC(=O)N[C@@H]4CCCC[C@H]43)cc2F)C[C@@H](C)O1 769033298 LQZALUJZEHEFKN-YZDADXEPSA-N 418.513 2.392 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3ccc(N4CCCCC4)cc3)CC2)cn1C 769531932 ZICWHLBMLBOUBF-UHFFFAOYSA-N 417.579 2.225 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769957264 KQUOZXBBOKUYKR-BEFAXECRSA-N 417.531 2.404 10 20 HECD Cn1c(C(C)(C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc2ccccc21 771492972 BUUKLLGSGVNZQX-UHFFFAOYSA-N 402.476 2.316 10 20 HECD COc1ccc(C=O)cc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772881222 WCHJKZJRWLQTDT-UHFFFAOYSA-N 402.422 2.179 10 20 HECD C[C@H](NC(=O)C(=O)NCCCN(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 774988896 RTEOPWGHFULFEJ-IBGZPJMESA-N 424.545 2.343 10 20 HECD Cc1cc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n([C@H]2CCS(=O)(=O)C2)n1 775467754 RBZACRKYWYIJBI-YOEHRIQHSA-N 405.524 2.500 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(S(C)(=O)=O)cc1 777828187 JEOBAKXHXBFXOJ-UHFFFAOYSA-N 411.863 2.265 10 20 HECD CC(=O)Nc1ccc(C)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 780460034 RHTWCWWQWQKUGI-UHFFFAOYSA-N 401.488 2.441 10 20 HECD O=C(CCCc1ccc(O)c(F)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 786796192 BMEAZKIXRWBHCJ-UHFFFAOYSA-N 420.506 2.405 10 20 HECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 788403549 VRXWSYWXVFCUMM-QGZVFWFLSA-N 409.486 2.271 10 20 HECD COc1ccc(CCS(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 788632674 ZGWKIEZNYNMYIC-UHFFFAOYSA-N 422.522 2.458 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H](C)C1 789861725 RMBLBRWSBFWZBO-FXAWDEMLSA-N 418.607 2.045 10 20 HECD C[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 792469828 MXOXLBKHWZKFJX-LBPRGKRZSA-N 416.441 2.073 10 20 HECD CCOC(=O)Cc1cccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 795557408 XBXASIVEODHMKO-UHFFFAOYSA-N 406.489 2.450 10 20 HECD C[S@@](=O)C1(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 799404108 SIYYDGNCCMPMKH-JGTBNHKDSA-N 401.479 2.467 10 20 HECD CSc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccn1 803303132 XXJJYSSLYJVYIB-HNNXBMFYSA-N 414.531 2.134 10 20 HECD CC(C)c1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)on1 803304796 HOHHNXSFJPMLSQ-OAHLLOKOSA-N 400.479 2.128 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)C2CC2)cc1 806700237 SQSSIDFTFNCVIY-FQEVSTJZSA-N 415.534 2.436 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)CC1(C)OCCO1 807420985 QKANEWVTWWJYIB-MRXNPFEDSA-N 403.523 2.149 10 20 HECD COC(=O)[C@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CCO2 809561641 DTILNWDAWCVLPN-JOCHJYFZSA-N 411.502 2.150 10 20 HECD CN(C)CCn1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 857473074 SSCDAZHQPXROPT-QGZVFWFLSA-N 405.930 2.198 10 20 HECD Cc1cc(C(=O)NCCNS(C)(=O)=O)c(C)n1-c1ccc(Br)cc1 900998801 QUUOJYNTORFLSG-UHFFFAOYSA-N 414.325 2.136 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)NC(=O)c3ccoc3)cc2F)C[C@@H](C)O1 918139404 BTFLMIKZGZOPBP-ZNMIVQPWSA-N 403.454 2.467 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCC2(CC1)OCCO2 918207045 QHFWCXYIKNXAFZ-UHFFFAOYSA-N 407.486 2.272 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)OCCO4)cc2F)C[C@H](C)O1 918220552 KZFGGVUCFWCPDS-HOTGVXAUSA-N 407.486 2.488 10 20 HECD CN1CCN(c2ccccc2NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 918306099 RKWGEMMIMFIPJS-UHFFFAOYSA-N 409.534 2.102 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(N2C(=O)CCC2=O)c1 919968550 FPILTDWJVDBZAZ-UHFFFAOYSA-N 421.497 2.479 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc4c(c3)[nH]c(=O)c(=O)n4CC)CC2)cc1 1319615542 UJFUORPDCRZRTI-UHFFFAOYSA-N 422.485 2.071 10 20 HECD CC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753580 KGSASVBGSLZQCD-QHCPKHFHSA-N 409.486 2.127 10 20 HECD CC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790242020 GSKVLNNXNIVSKI-RBOXIYTFSA-N 410.898 2.391 10 20 HECD CC[C@@H](C)[C@H](N)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1796001506 GPAXRPIYRJXUDB-HFVZKWEFSA-N 409.914 2.376 10 20 HECD CC1=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)CCO1 1804285757 RFSYLJPDGPUNIC-NCSLWMNCSA-N 414.458 2.149 10 20 HECD CC(C)(C)c1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249973 WVJOVMIUYNGKGV-UHFFFAOYSA-N 410.474 2.316 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H]3CNC(=O)C3)C2)cc1 1845999413 CAAJKGCRMIGRFW-LJQANCHMSA-N 420.513 2.047 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc(-n2cnnn2)ccc1F 728119380 YSSVBKLLBCKPLL-UHFFFAOYSA-N 411.441 2.302 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1 729064510 SLYPYCFUMIUVNJ-LLVKDONJSA-N 401.419 2.184 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731857475 CVCVYRMOXYIDCI-KRWDZBQOSA-N 404.488 2.122 10 20 HECD Cc1ncc(/C=C/C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 732867256 KPZVARZYCBSBBE-HWKANZROSA-N 419.478 2.300 10 20 HECD COC(=O)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1 734702298 VLPLTIRWWNPROB-UHFFFAOYSA-N 413.474 2.258 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](OCC(F)(F)F)C3)CC2)cc1 738318295 CXUHBIUMTQSQKJ-GOSISDBHSA-N 415.456 2.387 10 20 HECD C[C@@H]1COCCN1c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 738550684 GZFWMEWDFJZMFR-CYBMUJFWSA-N 405.476 2.241 10 20 HECD C=CC(=O)NCc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739767514 CRPJSLCILOKGDQ-UHFFFAOYSA-N 406.486 2.443 10 20 HECD CCN(CC)c1ccc(CNCCS(=O)(=O)NC[C@@H]2CCCCO2)cc1F 740005443 CJQLIQFKGHFAMQ-KRWDZBQOSA-N 401.548 2.250 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@H](C(F)(F)F)C3)cc2F)CC1 740477914 GMLCTZAEEPAASG-KRWDZBQOSA-N 418.435 2.440 10 20 HECD COc1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc2n1 743716642 JFCPMDPCOVZDTJ-UHFFFAOYSA-N 401.444 2.251 10 20 HECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cc21 743914540 UZYGZCSAEZPHCZ-UHFFFAOYSA-N 421.501 2.017 10 20 HECD Cc1cc(C(=O)N(CCN(C)C)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 750188537 YVZSWUSLYHQKHR-IBGZPJMESA-N 421.538 2.424 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)c3ccc(OC)cc3OC)CC2)cc1 754071568 SDHPAHVAOMRXRK-LJQANCHMSA-N 415.534 2.332 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1F 758338259 LEAYVYCADGTPFQ-UHFFFAOYSA-N 422.438 2.290 10 20 HECD CN1CCC(N2CC[C@@H](NC(=O)NCc3cccc(Br)c3O)C2)CC1 764785180 STODZXVJRUJGAU-CQSZACIVSA-N 411.344 2.122 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccnc3OCC(F)F)ccc21 765859088 KZBMTVPFNYIWLQ-UHFFFAOYSA-N 404.417 2.363 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CC[C@H](SC)C3)CC2)cc1 778287876 FLVFPOCXXSUWED-HRSJTUSDSA-N 403.548 2.300 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnc4c(c3)COCC4)CC2)cc1 778423934 YZJWJZQTPIMIOT-SREVYHEPSA-N 422.485 2.006 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](OCCO)C3)cc2F)C[C@@H](C)O1 780311110 FCWAWCAHLCAQBX-JZXOWHBKSA-N 409.502 2.122 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC3(N(C)C)CCC3)cc2F)C[C@@H](C)O1 782642999 BBJQVZZGTGMKPP-HDICACEKSA-N 420.573 2.472 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2cncc(Br)c2)c1 785233516 RLPVZDGXAUEWME-UHFFFAOYSA-N 401.238 2.278 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)cc1 785423823 CGEFCMYYFJLQFV-INIZCTEOSA-N 402.445 2.042 10 20 HECD CC1CCN(C[C@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)CC1 785429014 VKKMZVOQSGXGGI-HXUWFJFHSA-N 400.567 2.339 10 20 HECD Cc1ccc(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1 788320883 QSUIHZWRADGVSQ-HNNXBMFYSA-N 401.532 2.257 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H](C)O1 789825384 LOKWNEOGKLLYRB-NBOOPKSLSA-N 421.513 2.081 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCn3c(=O)ccn(C)c3=O)c2C)c1 791261728 HDKWHLIPZYJIHH-UHFFFAOYSA-N 408.502 2.391 10 20 HECD COc1ccc(CNC(=O)NCCNC(=O)c2cccc(Br)c2)c(O)c1 792957426 VGTMOZBJFOXCDH-UHFFFAOYSA-N 422.279 2.393 10 20 HECD C[C@]1(C(N)=O)CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 794363898 QQSPMYWSKJDANC-GFBZKKKVSA-N 423.585 2.453 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1C 795802670 CNHLIZUCFSDYSO-UHFFFAOYSA-N 418.515 2.487 10 20 HECD Cn1nccc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 800998886 NLOWRUHGYXYJKJ-KRWDZBQOSA-N 401.486 2.485 10 20 HECD COCCC1(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCCC1 803308236 UYBFLXMNBUHGEE-SFHVURJKSA-N 417.550 2.414 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cc1F 803663628 VGCKHJPOGZKQLG-IBGZPJMESA-N 421.419 2.386 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1 807098445 WIHSFSBECWVCAU-QGZVFWFLSA-N 416.566 2.078 10 20 HECD Cc1noc(C)c1CO[C@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807672879 JVMHKQJOBDIUCZ-KUHUBIRLSA-N 414.506 2.352 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](C)C1=CCN(C)CC1 809710818 ZHDLIGNJUXJLEI-CYBMUJFWSA-N 424.339 2.270 10 20 HECD CO[C@H](C)[C@@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 811865419 BOAWDVNOOVEWGY-HZPDHXFCSA-N 416.501 2.165 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)CN4CCOCC4)CC3)c2C)c1 900693117 ZHSVUPNBSDTIIQ-UHFFFAOYSA-N 424.545 2.019 10 20 HECD CNC(=O)c1cc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)cn1C 914790118 CFVUUAYLKVVGQG-UHFFFAOYSA-N 404.473 2.201 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)COc3ccc(F)cc3)CC2)cc1 915926768 CHXPAFINOCTNBE-UHFFFAOYSA-N 414.481 2.325 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3nc4ccccc4n3C)CC2)cc1 916235191 ZHAGYKIATJJDFF-UHFFFAOYSA-N 422.533 2.203 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)O)cc1)c1ccc(N2CCOCC2)cc1 920865839 OQTHTNGJOMPIMC-OAHLLOKOSA-N 420.487 2.026 10 20 HECD O=C(Nc1c(Cl)ccc2nonc12)c1ccc(S(=O)(=O)N2CCOCC2)cc1 1261140172 KMBVVRGPBFZVSN-UHFFFAOYSA-N 422.850 2.149 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)C2CC2)[C@H]1c1cccnc1 1814165962 MQNFTRNPCGYBCA-OEFDOCSMSA-N 423.469 2.328 10 20 HECD Cc1cc(C(=O)CN2CCN(CC(=O)N(C)C)CC2)c(C)n1-c1ccc2c(c1)CCC2 28729798 JULLDHWCWVOUIQ-UHFFFAOYSA-N 422.573 2.471 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(C(=O)NC4CC4)c3)ccc21 60763624 WOCSMJDRXRWLJE-UHFFFAOYSA-N 406.486 2.216 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C3(NC(C)=O)CCCCC3)cc2F)CC1 730194591 MRAXVCODIPQTAI-UHFFFAOYSA-N 404.530 2.423 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccnc2-n2cncn2)cc1 737116370 CVWDUKOSGCFQLL-UHFFFAOYSA-N 407.478 2.106 10 20 HECD Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 741915035 RDRZVQDGFLHJRS-HNAYVOBHSA-N 411.550 2.234 10 20 HECD O=C(CCC(=O)N1CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800902 MNOMPQLNJSBCMD-HNNXBMFYSA-N 411.449 2.012 10 20 HECD COc1ccc(N2CCN(CCNC(=O)/C(=C\c3ccccc3)NC(C)=O)CC2)cc1 742927419 QUAIXXLHXYPENV-PTGBLXJZSA-N 422.529 2.111 10 20 HECD CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NCc1cccc(OC)c1O 743915558 LHLWRJLOMGUBED-UHFFFAOYSA-N 406.460 2.456 10 20 HECD CC(C)CNC(=O)NC(=O)[C@H](C)OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 744474348 RULVGYIZHJJXBH-ZDUSSCGKSA-N 422.437 2.489 10 20 HECD CN1CCCc2cc(CNC(=O)c3cc(C4CC4)nc4c3c(O)nc(=O)n4C)ccc21 746878702 CDXQUJJRMLDHOU-UHFFFAOYSA-N 419.485 2.224 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(N2CCOC2=O)c1 749730050 HMHALBFUNDUZMH-UHFFFAOYSA-N 406.489 2.337 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OCCO3)cc1C 751270543 BFXNFXUHHRUPFL-UHFFFAOYSA-N 412.489 2.329 10 20 HECD Nc1ccc(Cc2nc(C(=O)O[C@@H]3CCN(C4CCOCC4)C3=O)cs2)cc1 751946286 YNPLAGKTWIEQAR-QGZVFWFLSA-N 401.488 2.253 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1 756931233 NYEPNWHMHUUBAL-UHFFFAOYSA-N 420.415 2.225 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)CN3CCCCC3)CC2)cc(OC)c1OC 759280280 MIDQLXORCXOKIS-KRWDZBQOSA-N 420.554 2.418 10 20 HECD COCCCN(Cc1cc(Br)cc(OC)c1O)[C@@H]1CCS(=O)(=O)C1 768203478 HRGALCQCUWTEIT-CQSZACIVSA-N 422.341 2.189 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1 772017709 XCLTWWGKSRHIGX-GFCCVEGCSA-N 413.521 2.143 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 773618199 IOESSWMDVSBLQD-WMZOPIPTSA-N 418.538 2.257 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1)c1ccc(N(C)C)cc1 773848164 UUJBASIDJLDHIX-HNNXBMFYSA-N 411.506 2.069 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)cc1 776059630 PYDLFUMSFACIPU-KRWDZBQOSA-N 405.524 2.411 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1 779481902 RPJYUAMWXLFTNA-KRXBUXKQSA-N 415.877 2.229 10 20 HECD CCOC(=O)C1CCN(C(=O)C[C@@H](C)NCc2ccc(N3CCOCC3)cc2)CC1 783504495 NGFJWHMCMHNSIQ-GOSISDBHSA-N 417.550 2.193 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCCC3(C)C)CC2)cc1 785529135 VOBVTGMMTFBDIH-HXUWFJFHSA-N 416.566 2.018 10 20 HECD Cc1ccc(OC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788310250 KFWSRSXCRGOREJ-SFHVURJKSA-N 411.502 2.032 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(Cn2cccn2)cc1 788466095 YPKHGRYYGAZZNP-UHFFFAOYSA-N 405.502 2.238 10 20 HECD CN(C)c1ccc(CN[C@@H]2CCN(CCN3CCOCC3)C2)c(C(F)(F)F)c1 792978479 VALLVIQBVJJWFQ-QGZVFWFLSA-N 400.489 2.268 10 20 HECD O=C(COc1c(Cl)cncc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 795246588 CFYTUOVLOYPCLH-UHFFFAOYSA-N 424.816 2.314 10 20 HECD CO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@H](C(=O)O)C1 797709670 GIUCZZBNFQEYHP-DZASIIFFSA-N 423.485 2.213 10 20 HECD COc1ccccc1CCNC(=O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 798067920 UTXWPROYGJBCQT-UHFFFAOYSA-N 408.502 2.230 10 20 HECD Cc1noc(C)c1CCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304305 XORYLXOTJNDURT-OAHLLOKOSA-N 414.506 2.054 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CC(C)(C)OC1(C)C)c1ccc(N2CCOCC2)cc1 803307897 PATHHGIYPZFVIT-QAPCUYQASA-N 403.523 2.163 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCC[S@](=O)C(C)(C)C)cc2)CC1 805022765 CUWLDONDQDGJKH-NDEPHWFRSA-N 407.580 2.203 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 807481159 IICIUKQRLMIHFT-KSSFIOAISA-N 418.538 2.349 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807676054 CGTKDAHBXVALNZ-UTKZUKDTSA-N 422.529 2.189 10 20 HECD CCOC1CC(Cc2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)C1 809465030 PCRZJSRBJBSMNF-UHFFFAOYSA-N 414.506 2.327 10 20 HECD COC(=O)CC[C@@]1(C)NC(=O)N(CN(Cc2ccc(N(C)C)cc2)C(C)C)C1=O 811734402 DSSNWIHDBZFHLA-OAQYLSRUSA-N 404.511 2.184 10 20 HECD CCn1cnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917198474 BLOKUNIBEGSGSI-OKILXGFUSA-N 407.515 2.459 10 20 HECD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(N2CCSCC2)cc1 917383787 MTCYKPWJUYOFET-QZTJIDSGSA-N 401.532 2.031 10 20 HECD CCNC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918037433 PPKOUIAGTMJCRB-GOSISDBHSA-N 423.517 2.460 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)cc1 918429963 QXXXTKOBCYUPJO-UHFFFAOYSA-N 409.490 2.317 10 20 HECD Cc1nnnn1-c1cccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 918457029 RFMIASCWSJMJTN-UHFFFAOYSA-N 419.489 2.166 10 20 HECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n[nH]1 919087375 KLKXIIAKFQWUGJ-ZIAGYGMSSA-N 418.469 2.198 10 20 HECD CC(C)C(=O)N1CCC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 928991807 BKJDXRSLVCUCIG-UHFFFAOYSA-N 403.523 2.149 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)CCc1ccccc1 1116927306 XQICJPJVDMBTJV-HTAPYJJXSA-N 401.459 2.072 10 20 HECD COCCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792313767 CWMFUFHAADOGFS-UHFFFAOYSA-N 421.544 2.017 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cscn1 1795165527 RPUIIYHPGZINSB-LJWNITHASA-N 415.471 2.225 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807999169 RQJJDBIUAGUYCR-IOVOPAHISA-N 408.458 2.340 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)nn2)C1 1844427479 BNRYBQSORNGIEE-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 110362119 AOVYMSCWGMIPJJ-UHFFFAOYSA-N 417.531 2.344 10 20 HECD COc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc(Cl)c1OCC(N)=O 437021680 SGCOGJYBHSJBIB-UHFFFAOYSA-N 419.865 2.318 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1F 740494774 ICWBZGDIRUKKOP-KRWDZBQOSA-N 401.438 2.314 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3[C@@H](C)CC[C@@H]3C)CC2)cc1 741018381 RIXRJUNDYGSFGL-BZSNNMDCSA-N 403.523 2.148 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cccc([N+](=O)[O-])c3)cc2)C1 742758942 QWWSZPBTOAVFQC-QGZVFWFLSA-N 411.462 2.296 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3cccc(OC)c3)CC2)cc1 742939967 NNZUSUGFSXMKPL-UHFFFAOYSA-N 412.534 2.368 10 20 HECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cn1 743954938 DKWUZRCMEPWECE-UHFFFAOYSA-N 405.458 2.415 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(CC(F)F)c3)cc2)C1 746031849 JAEVYBWUPCLRLI-AWEZNQCLSA-N 406.437 2.172 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(CC(=O)Nc3cc(C)on3)CC2)c1O 748050475 DHGHZZQKSBXHDA-UHFFFAOYSA-N 406.870 2.301 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(-n2cncn2)c(F)c1 749731262 MASNGWVIBQXOBO-UHFFFAOYSA-N 406.468 2.100 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)cc(OC)c1OC 760129827 PJTDXVBFDXSLBT-UHFFFAOYSA-N 404.442 2.278 10 20 HECD CC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1F 764891181 BEHVWGBWKPMTLV-UHFFFAOYSA-N 412.465 2.383 10 20 HECD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCCc1ccc(O)c(O)c1 768900647 LKRXWTJNVPIQRY-UHFFFAOYSA-N 401.375 2.053 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 772452065 PPQVRQKYFMFFQQ-MOPGFXCFSA-N 410.536 2.269 10 20 HECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1NS(C)(=O)=O 774125917 GJUGBEUEOPGVLY-UHFFFAOYSA-N 418.519 2.030 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccccc1C(=O)N1CCCCC1 774355710 BPRLOZOFHLUHAC-UHFFFAOYSA-N 411.458 2.021 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(CC(=O)O)CC(F)(F)F)cc2F)CC1 780568982 LKIUOQZBCRJHOB-UHFFFAOYSA-N 420.407 2.126 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cccn(C)c2=O)cc1 782423972 SHLIZZRRPYLPGB-UHFFFAOYSA-N 408.458 2.212 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)CCc1ccc2c(c1)CCO2 784741498 ORFYTEYTQWFLMM-UHFFFAOYSA-N 416.543 2.462 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 785296037 AZESZZIHBWHXQL-CYBMUJFWSA-N 413.474 2.312 10 20 HECD O=C(COC(=O)c1cccc2[nH]ncc12)NCc1ccc(N2CCOCC2)c(F)c1 785593734 YVACJDPZFFZIGN-UHFFFAOYSA-N 412.421 2.012 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4ccccc4oc3=O)cc2)CC1 786259170 LTJBFYAHTBDOPK-UHFFFAOYSA-N 405.454 2.392 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3Cc3ccccn3)cc2)CC1 787318430 FAXBAZDHPURBCS-QHCPKHFHSA-N 421.545 2.031 10 20 HECD CC(C)CCOCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789822566 BOCUKOOVHVHCLS-IAGOWNOFSA-N 423.529 2.234 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC[C@H](C2CCOCC2)C1 789861091 POIDTGNOOJHYOR-IBGZPJMESA-N 417.575 2.131 10 20 HECD COc1ccc(CNC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c(O)c1 792795181 BYBQYSKAFXDAGY-UHFFFAOYSA-N 405.407 2.368 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnc(CC4CC4)nc3)CC2)cc1 792964644 MMRAAPBYONLQFA-UHFFFAOYSA-N 409.490 2.115 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 795078852 UOUXAZKEOGMGPO-KRWDZBQOSA-N 419.522 2.455 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c(O)c1 797389360 CYJGWGVKNDJDGY-HNNXBMFYSA-N 413.474 2.049 10 20 HECD CS[C@H](C)CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449163 QDZHAJVXQKSWSP-GFCCVEGCSA-N 401.479 2.241 10 20 HECD Cn1ccnc1[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cccc(O)c1O 803548826 CCMFKESNKUHTOV-AWEZNQCLSA-N 402.451 2.266 10 20 HECD Cc1nc2n(n1)CCN(C(=O)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)C2 803677533 QHMDADTZROBCGO-UHFFFAOYSA-N 410.522 2.014 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O 807098530 XMTFQAHGKMUCRU-FQEVSTJZSA-N 414.550 2.117 10 20 HECD O=C(CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)c(F)c1 810092956 JPMJQYJBOKMSHB-UNMCSNQZSA-N 417.525 2.312 10 20 HECD CCC[C@H](C(=O)OCC)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccn2)c1C 821585714 UVNGNAQMKHCFQJ-MRXNPFEDSA-N 407.492 2.281 10 20 HECD CSCc1nnc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 917201287 MFOCYXFZXQQPEH-UHFFFAOYSA-N 412.512 2.317 10 20 HECD COC(=O)C1(NC(=O)CN2CCCN(c3ccc(OC)cc3)CC2)CCCCC1 917209992 AEHNQTCOIYZGHP-UHFFFAOYSA-N 403.523 2.199 10 20 HECD C[C@H](CN1CCCC1=O)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918099006 HSPBHYPUAPCIEQ-BZUAXINKSA-N 406.502 2.249 10 20 HECD C[S@@](=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918373357 WTDUBECZSQMEKH-SONOPUAISA-N 413.543 2.197 10 20 HECD CS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919970700 WAZULXQEZTVWAE-UHFFFAOYSA-N 421.494 2.088 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 1320838224 CKAYWHBAIVKUQP-UHFFFAOYSA-N 408.462 2.032 10 20 HECD Cc1ccoc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005532 LZZMXLUSYJCIRL-FQEVSTJZSA-N 420.849 2.410 10 20 HECD Cn1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n1 1788216199 XYJCFWOLOBJFAO-UHFFFAOYSA-N 421.457 2.217 10 20 HECD COC(=O)C1CCN(S(=O)(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731039613 YWFUWWQKHWTYSC-UHFFFAOYSA-N 409.552 2.142 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c1 734073263 ITCPGNQQLBZZIP-HUUCEWRRSA-N 413.474 2.269 10 20 HECD O=C(Cc1c[nH]c2ccc(F)cc12)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 734423531 PVPSAQXTHWJWQP-UHFFFAOYSA-N 415.490 2.401 10 20 HECD O=C(CN1CCN(c2ccccn2)CC1)NCc1ccc(N2CCSCC2)cc1 740750491 SRWGFJMVFNRRPT-UHFFFAOYSA-N 411.575 2.073 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3ncccc3c2)cc1C(=O)O 741657635 VOYICOARBVZTAQ-UHFFFAOYSA-N 421.456 2.105 10 20 HECD O=[N+]([O-])c1ccc(NCCc2ccc(O)c(O)c2)c(S(=O)(=O)N2CCCC2)c1 749287799 YYSDRVONOBSCEL-UHFFFAOYSA-N 407.448 2.445 10 20 HECD COc1cc(C)cc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)c1O 754725844 BUJLGLKUBODFEP-UHFFFAOYSA-N 410.458 2.498 10 20 HECD Cn1cc([C@@H](CO)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 757644465 WSYJXUAZXDUZNZ-QGZVFWFLSA-N 409.437 2.023 10 20 HECD CC[C@@H](CN1CCCC1)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 758680107 MFFIULYFYHYRIQ-FQEVSTJZSA-N 417.598 2.381 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H]3CCO[C@H](C)C3)CC2)cc(OC)c1OC 759296827 GATPXSOECYGHFG-CVEARBPZSA-N 407.511 2.359 10 20 HECD COc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)NC(C)(C)C 762275740 YYXWNKZLRNQFFJ-UHFFFAOYSA-N 422.503 2.156 10 20 HECD CS(=O)(=O)N1CCC(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 766236426 DGQBEJUSCFEXGA-HNNXBMFYSA-N 403.495 2.270 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN4C(=O)CC[C@@H]4C3)c2C)cc1 766267987 CFZXMFXIGGBCLT-LJQANCHMSA-N 409.486 2.370 10 20 HECD CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 767173970 PQXLTWZIYZCBJM-UHFFFAOYSA-N 401.438 2.472 10 20 HECD O=C1C[C@@H](c2cccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)c2)CN1 772473418 FOUPDPWYLMLYSE-GOSISDBHSA-N 406.486 2.145 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)cc2)C[C@@H](C)O1 774357687 XTCKQKNZGZIZPX-GASCZTMLSA-N 413.474 2.009 10 20 HECD CCCCOC(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774361452 DZZIQEUYVXYVNJ-UHFFFAOYSA-N 400.431 2.352 10 20 HECD O=C(NCc1ccccn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774473872 TVDRCGQDAZYWBH-HNNXBMFYSA-N 404.417 2.084 10 20 HECD C[C@@H](NCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 775836097 ZAOCAYKFTSNJAR-GOSISDBHSA-N 424.545 2.192 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765938 DISYKSLDBZJTJO-OAHLLOKOSA-N 419.913 2.061 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 786263349 QXZRDRLMBUYQRY-UHFFFAOYSA-N 424.469 2.259 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccccc1N1CCOCC1)c1ccc(N(C)C)cc1 788331697 JUOPFLUIOGSANS-QGZVFWFLSA-N 410.518 2.083 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccccc1N1CCOCC1 788331822 MMUDKBBDLGXUMH-UHFFFAOYSA-N 422.529 2.056 10 20 HECD COc1cc(N2CCN(C(=O)c3ccn(CC(F)F)n3)CC2)cc(OC)c1OC 790023525 HKPYKNXAFYUKIT-UHFFFAOYSA-N 410.421 2.136 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCNS(=O)(=O)c2ccc(F)cc2F)c1 799725429 GWVQNUVEQWLJLT-NSHDSACASA-N 414.430 2.086 10 20 HECD O=C(N[C@H]1CCc2ccccc2OC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807695348 NKGHNAVWWDIXAW-PMACEKPBSA-N 424.497 2.410 10 20 HECD O=C(COc1ccc2c(c1)CCC2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338213 LSUCUIFYKXZBQB-UHFFFAOYSA-N 414.527 2.105 10 20 HECD NS(=O)(=O)c1ccc(N2CCN(Cc3ccc(N4CCCC4)cc3)CC2)cc1 1324716454 KMHQCSGLGNVXLP-UHFFFAOYSA-N 400.548 2.256 10 20 HECD CCCOc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1844975594 VFCAKXNYDYKBOP-UHFFFAOYSA-N 411.458 2.412 10 20 HECD CCNC(=O)CN1CCCN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 484818035 GUIUTXAWULTVMZ-UHFFFAOYSA-N 414.550 2.189 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1 742830152 FHKRKAZMSWSBJA-QGZVFWFLSA-N 417.531 2.406 10 20 HECD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NCc1c(O)ccc2c1CCCC2 743715699 BXAWQBWFVQBBGI-XMMPIXPASA-N 419.481 2.281 10 20 HECD COc1ccc(C[C@H](CO)CNC(=O)NCc2ccc3c(c2)CCCN3C)cc1O 745788959 WSBQQRROEQMRAL-SFHVURJKSA-N 413.518 2.434 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(-n3cnnn3)ccc2Cl)cc1OC 760820690 AZMWIYNBTBEHQI-UHFFFAOYSA-N 402.842 2.408 10 20 HECD COc1ccc2oc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)cc2c1 763281223 DNCVMZILPLBFSI-ZROIWOOFSA-N 412.514 2.192 10 20 HECD Cc1nn(C)c(=O)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 765177683 PORRRJLJLAORCE-INIZCTEOSA-N 404.898 2.151 10 20 HECD O=S(=O)(NCc1cccc(Br)c1O)c1ccccc1Cn1cncn1 766201227 PWZIXQLMKJTZTG-UHFFFAOYSA-N 423.292 2.273 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC4(CCN(C)C4=O)CC3)CC2)cc1 770493799 SXRKPWZCCYGGCB-UHFFFAOYSA-N 400.523 2.318 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1 772955199 RDINPCWVCDIQMT-UHFFFAOYSA-N 408.380 2.192 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 774361440 DIDXVRGZUYRTLD-UHFFFAOYSA-N 411.458 2.021 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 776055196 HPELUEJVZDTMSF-LLVKDONJSA-N 401.539 2.003 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSC(C)(C)C3)CC2)cc1 778314991 XREZMMFIDBZFOW-CMDGGOBGSA-N 403.548 2.254 10 20 HECD Nc1nc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cs1 779115986 MGWOQOQZSFEMDR-UHFFFAOYSA-N 407.407 2.296 10 20 HECD CC[C@@H]1C[C@@H](CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 781762629 DOSIUZVRJOSZOF-PKOBYXMFSA-N 404.507 2.482 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2 783315980 GLKDQMUSMAIYSD-UHFFFAOYSA-N 408.502 2.414 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2cnn(-c3ccccc3)c2)cc1F 786119208 CJGPWJSXXDKHBV-UHFFFAOYSA-N 409.465 2.053 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)C2 786674746 QNSMKOHQYSOGOT-LJQANCHMSA-N 409.534 2.262 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@H](Cc2ccccc2)C1 788910597 MLPIXYDFYVMCIT-JOCHJYFZSA-N 407.514 2.373 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCCO1 789825645 NIRJXRCJNADYLM-JFIYKMOQSA-N 421.513 2.083 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)c(F)cc1C 792982195 MKZKRNUATNVHBY-UHFFFAOYSA-N 404.394 2.280 10 20 HECD C[C@H](Cc1ccsc1)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 793790263 KCAWKEZIEGPNIF-MRXNPFEDSA-N 401.532 2.291 10 20 HECD O=C(CN[C@@H]1CCCC12CCOCC2)NCc1ccc(N2CCOCC2)c(F)c1 800436764 HOOIVUYZBLIZJN-HXUWFJFHSA-N 405.514 2.217 10 20 HECD COC(=O)c1cn(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1 800571083 FBTRDIAGHRNRTF-ZDUSSCGKSA-N 405.886 2.271 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccco3)C2)cc1F 804851636 JOZDSXUUFINTKO-IBGZPJMESA-N 403.454 2.481 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 806421658 WXKKCVFYUGTCTG-OXJNMPFZSA-N 408.502 2.242 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 807095219 BJCKTCDADORFLP-QGZVFWFLSA-N 410.522 2.079 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1 807100967 PAWJQMUZKHWLEN-QGZVFWFLSA-N 420.517 2.478 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](CC(=O)NC)c1ccccc1 807731513 CWHPZDCMJPBUPV-HXUWFJFHSA-N 410.518 2.095 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(c2cccnn2)CC1 807745037 KBYDOCMRMITWHB-UHFFFAOYSA-N 411.506 2.096 10 20 HECD O=C(NCCC[C@H]1CCCCO1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807994837 VBWHGDRPMXDONO-RTBURBONSA-N 404.507 2.365 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccnc1-n1cccn1 918436826 FWYBJHIPNZDADO-UHFFFAOYSA-N 422.514 2.075 10 20 HECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCC[C@H](C)C1 920636291 QKNFJVQOBOZELO-GUYCJALGSA-N 412.508 2.204 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(c3nc(C)no3)CC2)c1 921054412 WSRGJGQEPASYFY-UHFFFAOYSA-N 414.506 2.498 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ncoc3C(C)C)CC2)cc1 1116453269 XCWJMKGFFBTVFI-NDEPHWFRSA-N 405.520 2.404 10 20 HECD O=C(CSC1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600778 CUBDVBUJSLNRBA-QDMKHBRRSA-N 405.520 2.420 10 20 HECD CCO/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1802673756 XBMMJXHEQGFXID-JNZMVSHCSA-N 402.447 2.005 10 20 HECD Cc1n[nH]cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428130 PIHNSCMYTOGWQD-KRWDZBQOSA-N 413.478 2.071 10 20 HECD Cc1cnc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1842332159 ZJRKGQWEBQODJP-GQCTYLIASA-N 415.471 2.099 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441753 OQJWWTSGLJAGBS-FUHWJXTLSA-N 408.502 2.419 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)n(C)c2ccccc12 472780391 ADMYUDQLVPWRQG-UHFFFAOYSA-N 405.458 2.271 10 20 HECD C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 726611309 OCCNSBPSTXONGF-JKSUJKDBSA-N 406.502 2.251 10 20 HECD O=C(NCCCc1nnc2n1CCCCC2)NCc1ccc(N2CCOCC2)cc1 727601649 AMBQTRNXSNVYBT-UHFFFAOYSA-N 412.538 2.273 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1 734073487 PLLSMHVIROCQEN-UHFFFAOYSA-N 405.838 2.011 10 20 HECD CC(C)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 734167660 YWQVLAXTAJRNLH-DAYGRLMNSA-N 406.502 2.248 10 20 HECD CN1CC[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 737727349 DIWSAHKRYCWAMX-IXJPEXDMSA-N 409.558 2.076 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 742271992 UDICWBFSYMGWAZ-UHFFFAOYSA-N 418.515 2.272 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1ccc(Br)cn1 742283200 PMAKVWCAMSEUES-UHFFFAOYSA-N 412.309 2.159 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cccc(-n2cnnn2)c1 742632871 YDMBFCCXFGWQTD-UHFFFAOYSA-N 400.508 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-n4cccn4)cc3)CC2)cc1 742927389 QBOUZDUYKGDEOX-UHFFFAOYSA-N 405.502 2.433 10 20 HECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N(C)C)cc1 743813414 YRYCPNYRAMFHAE-QGZVFWFLSA-N 405.524 2.247 10 20 HECD C[C@H](NC(=O)Cn1c(S)nc2ccccc2c1=O)c1ccc(N2CCOCC2)cc1 746687915 NBHJPSRBULSUIU-HNNXBMFYSA-N 424.526 2.399 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(OCCC(N)=O)cc3)CC2)cc1F 753883841 GKVIMUZGGBMLCW-UHFFFAOYSA-N 416.453 2.443 10 20 HECD COc1ccc(N2CCN(C(=O)c3cncc(N4CCOCC4)c3)CC2)cc1F 757052951 MORFTAGQYRKCOU-UHFFFAOYSA-N 400.454 2.028 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(C(C)=O)c(=O)n(C)c3=O)c2C)cc1 758175545 HEXISZXRYBQTOJ-UHFFFAOYSA-N 423.469 2.439 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)c3nnc(C)s3)CC2)cc1 759316121 YRERQUUTRWZMQU-HNNXBMFYSA-N 418.567 2.428 10 20 HECD CCOC(=O)N[C@@H](C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)C(C)C 760088616 JOWDPRMQZUYQNZ-GOSISDBHSA-N 423.510 2.132 10 20 HECD O=C(O)COc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1F 761297893 UXWVCUZYSPKZPA-UHFFFAOYSA-N 406.482 2.206 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)C2CC2)cc1 762423847 MUNCKVOWQONYED-FQEVSTJZSA-N 411.506 2.258 10 20 HECD C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763877542 JYWWLNVNAFKINN-ONSXPEOJSA-N 410.495 2.101 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1(O)CCSCC1 764846937 MMUZEOUXQSQUMC-UHFFFAOYSA-N 404.454 2.416 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)NCc2cccc(Br)c2O)s1 765320328 YOQDJXCNEVJXRM-UHFFFAOYSA-N 415.269 2.434 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC 766924505 FYUCRHDFZSOENH-UHFFFAOYSA-N 414.462 2.050 10 20 HECD COc1ccc(O)c(CNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c1 769530722 NRTSEMYPYUZAAZ-CQSZACIVSA-N 407.492 2.010 10 20 HECD CC[C@H](C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 770118014 VMXSPAAMEFKWAR-NHYWBVRUSA-N 400.497 2.250 10 20 HECD CC(C)CCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774538937 CZTQAZKECZTFKL-PKOBYXMFSA-N 416.566 2.336 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c1O 775054175 LEVDMPRAILJYJD-HNNXBMFYSA-N 413.496 2.135 10 20 HECD C[C@H](NC[C@H]1CCC[C@@]12NC(=O)N(C)C2=O)c1ccc(N2CCOCC2)c(F)c1 777126319 VEOGIVSDOXQAQZ-CMPZQBNXSA-N 404.486 2.033 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)c1 779287784 RNVWMNHSWVPHDA-KRWDZBQOSA-N 412.414 2.256 10 20 HECD CC[C@@]1(CO)CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 779537420 SYSMFHQLTLOAQK-XMSQKQJNSA-N 402.539 2.082 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCCC(=O)NC)cc1 784030215 LIJCAUBBKDHZRI-UHFFFAOYSA-N 413.474 2.284 10 20 HECD CC[C@H]1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cccc(Cl)c2O1 784223132 NCZPPKABQZXWSG-LBPRGKRZSA-N 407.879 2.342 10 20 HECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(c1ccc(N)cc1)C1CCCCC1 786425161 ADYJAADANPRXMF-UHFFFAOYSA-N 413.478 2.483 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCOCC(F)(F)C(F)(F)F)c1 787669765 BQTHAPWCIQOISW-UHFFFAOYSA-N 407.313 2.135 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1 788974956 LQTGTJMWJCTWTO-LJQANCHMSA-N 403.523 2.341 10 20 HECD C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801771 UBBUQERWTWVZMI-HHXXYDBFSA-N 403.498 2.458 10 20 HECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864156 MMTMCUNBTCMRHR-OTWHNJEPSA-N 417.575 2.176 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1 793634674 VZDLDBHKESTPDK-GOSISDBHSA-N 418.538 2.097 10 20 HECD C[C@H](COc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 793685291 HGROMURLHLHHAB-QZTJIDSGSA-N 411.502 2.284 10 20 HECD CC[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793733235 LUPZDGXPROAWTF-FDDCHVKYSA-N 414.550 2.043 10 20 HECD COCc1nnc(N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1CC(C)C 802675421 YJELPVNWLYIXPO-UHFFFAOYSA-N 419.526 2.433 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1nnc2ccccn12 804101077 KXBZAZFLQPEKPK-DNVCBOLYSA-N 408.506 2.486 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@H]3c3ccccc3)CC2)cc1 804317646 KUTZLJXVPFKBSH-QFIPXVFZSA-N 423.513 2.380 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671074 LDEFTINFDVKJAR-GDBMZVCRSA-N 404.511 2.055 10 20 HECD Cc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(N2CCOCC2)c1 807858206 QBBIYDIWKHNTIY-UHFFFAOYSA-N 424.545 2.172 10 20 HECD CN(C)c1ccc(S(=O)(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cn1 811824697 OIOAIVURSZSPSC-UHFFFAOYSA-N 415.563 2.480 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nccnc3N)cc2F)C[C@H](C)O1 812251541 WOCVRRFCAHEMES-STQMWFEESA-N 405.499 2.220 10 20 HECD CN(C)c1noc(CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 857473033 RSGGOXDMVNBXFF-OAHLLOKOSA-N 407.902 2.208 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@@H]3C[C@@H](O)c3cnn(C)c3)cc2F)CC1 1324777553 ZLTXUYTZHCHXCW-DENIHFKCSA-N 401.530 2.399 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 1327062882 YZXXQEMMHMQRQO-UHFFFAOYSA-N 403.287 2.466 10 20 HECD Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808580265 LRWMFFORMSIQMF-QRWLVFNGSA-N 421.457 2.158 10 20 HECD CC(C)N1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 727832212 PJJPPNZOXXZDOO-RTBURBONSA-N 420.573 2.472 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3NC(=O)OC)nc12 729750064 QVUJLDOBTQUBGY-UHFFFAOYSA-N 414.374 2.147 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 733351470 FXIXQBUYCSXTLA-WOJBJXKFSA-N 415.582 2.452 10 20 HECD Cc1ccc(S(=O)(=O)NCCN(C)C(=O)NCc2ccc(N(C)C)cc2)cc1 743814152 WAYYMNXPQYPEND-UHFFFAOYSA-N 404.536 2.181 10 20 HECD COc1cccc(CNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)c1O 745407890 OHLZEURTSLPUSP-UHFFFAOYSA-N 421.519 2.228 10 20 HECD COc1cccc(CNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c1O 751308755 BTEKHOWXDRAHBM-UHFFFAOYSA-N 418.393 2.171 10 20 HECD COCCOc1ccccc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 751501893 TXQBJNWGOWKCAA-UHFFFAOYSA-N 404.532 2.236 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3c(C)nc4cc(O)nn4c3C)CC2)cc1F 753731465 OCPZUGAQBYPWJL-UHFFFAOYSA-N 413.453 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)c3cn(CC(=O)C(C)(C)C)nn3)CC2)cc1F 753737872 GEAXWDFLKXMCEP-UHFFFAOYSA-N 403.458 2.003 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc1F 754036681 FWAGWLZWOLICBQ-UHFFFAOYSA-N 407.392 2.191 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 754450163 IGQSTZVMQYCSMA-HNNXBMFYSA-N 401.467 2.470 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3cc(OC)ccc3O)cc(C(C)C)nc21 754636899 RYTMADCFKZKXCC-UHFFFAOYSA-N 412.446 2.285 10 20 HECD CCCn1nc(C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 759718925 RAEZJUXAYKVLPJ-UHFFFAOYSA-N 404.536 2.075 10 20 HECD Cc1cc(C(=O)CN2CCOC3(CCC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 766265963 GQEPNZGGAIXZKN-UHFFFAOYSA-N 417.531 2.179 10 20 HECD CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 767296815 BORARCRVZLFTOI-QGZVFWFLSA-N 424.501 2.198 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCOC4(CCOCC4)C3)cc2F)CC1 769104268 YODQIVXXQAQYFV-UHFFFAOYSA-N 420.529 2.059 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1 769153430 IFRBNRBFBVXDAZ-FCHUYYIVSA-N 416.566 2.042 10 20 HECD COc1ccc(Cl)cc1N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)CC1=O 770625652 RJIOEJAWBMPADN-ZDUSSCGKSA-N 404.850 2.472 10 20 HECD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)cc1 773003272 CPDKSWLASFRZPI-FPOVZHCZSA-N 400.567 2.261 10 20 HECD CN(C)C(=O)COC1CN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 774484408 PVGDAMQPFPJCBI-UHFFFAOYSA-N 409.446 2.356 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1 775285809 CXFRGGKETAXWEU-UHFFFAOYSA-N 424.500 2.180 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)n([C@H](C)CC)n3)nc12 778159763 JUXLXIPLRCFOCU-LLVKDONJSA-N 401.423 2.445 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCN(Cc2ccccc2)C1 779009872 GETROWPKALPWTJ-NVXWUHKLSA-N 417.531 2.404 10 20 HECD Cc1cccc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788312008 AHUPYNSRLYZFLG-NRFANRHFSA-N 408.502 2.207 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CN3CCc4ccccc4C3=O)cc2F)CC1 788750313 DSTHWKMGGUVSQW-UHFFFAOYSA-N 424.520 2.282 10 20 HECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)cc1C 789955147 QRHGOAFCWCENQA-UHFFFAOYSA-N 408.451 2.000 10 20 HECD Cn1ccc(CCC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 795794894 DDJBWUCDMFQPQP-UHFFFAOYSA-N 417.421 2.310 10 20 HECD CC(C)(NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(=O)N1CCCC1 796593471 RXDQEJYMXVABFB-UHFFFAOYSA-N 419.481 2.391 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)[C@@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 801546241 KXRQDJKZJDDCGU-OAHLLOKOSA-N 422.551 2.238 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(OC(F)F)nc1 802550192 PYZVHGLWPKCYIS-UHFFFAOYSA-N 420.416 2.117 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C)nn1-c1ncccn1 802610589 HDJWQGDIWHQUMP-UHFFFAOYSA-N 408.462 2.444 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccoc3CC(=O)OC)cc2F)CC1 810361867 OVKRRHMGZGIUCY-UHFFFAOYSA-N 403.454 2.206 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CO)(c4ccccc4)CC3)nc12 814646776 RDWNISNWHFLDNB-UHFFFAOYSA-N 410.474 2.138 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1O 819427437 NFPZTPZSWZTWQD-CQSZACIVSA-N 408.432 2.376 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1C 917758316 OWXRJNGCIXHRTI-UHFFFAOYSA-N 410.473 2.228 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918169047 BWGNDMOSXVFPMY-UYAOXDASSA-N 414.550 2.186 10 20 HECD O=C(Nc1ccc(-n2cnnn2)cc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 918294779 WUWVNOBFQFIXKH-UHFFFAOYSA-N 418.413 2.128 10 20 HECD O=C(NC[C@H]1CCCO1)c1c(NS(=O)(=O)c2cn[nH]c2)sc2c1CCCC2 919956341 VHMOOEXLPISWKX-LLVKDONJSA-N 410.521 2.060 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(C)ccc(F)c3N)CC2)cc1 920572319 ISIFKPFJAADBLV-UHFFFAOYSA-N 401.438 2.231 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc(C(F)F)c1 1796598969 RNZQWJSMKKYKKR-BTTYYORXSA-N 418.400 2.391 10 20 HECD CC(C)(F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931826 NPTQILNESIBQNG-RBVVOMGSSA-N 400.454 2.166 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)[nH]n1)c1cc(O)nc(O)c1 1817846467 ZFUJJYAOWFSSSH-LSDHHAIUSA-N 413.434 2.215 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2)C1 1846862324 XVWJQYNXBVYVFH-UHFFFAOYSA-N 423.469 2.412 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC(=O)OC(C)(C)C)cc2F)C[C@H](C)O1 725800734 QDIFFHZKHFERQP-HOTGVXAUSA-N 423.529 2.329 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)CN4CCCC4)CC3)c2C)cc1 728551926 RSSHOIBTIYHJMZ-UHFFFAOYSA-N 424.545 2.483 10 20 HECD Cc1nc2cc(O)nn2c(C)c1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 729259597 PZODQQGQHKOEIS-UHFFFAOYSA-N 409.490 2.089 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1F 729528607 FSQOHMIISMOLEE-XLIONFOSSA-N 415.465 2.280 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H](CNC(C)=O)C3)cc2F)CC1 730133594 ZMWNDCUMXMVHAT-LJQANCHMSA-N 419.545 2.025 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CCN2CCCC2=O)c([N+](=O)[O-])c1Br 732984018 XFJQXOHICWDSHE-UHFFFAOYSA-N 417.216 2.333 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c(C)n1-c1cccc(Cl)c1 739697267 YNBVFFFNUUZGOD-HNNXBMFYSA-N 424.954 2.393 10 20 HECD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NCc1c(O)ccc2c1CCCC2 743716206 KWVOHXYNZZNYNA-UHFFFAOYSA-N 411.414 2.221 10 20 HECD COc1ccc(N2CCC(NC(=O)N(CCN(C)C)C[C@H]3CCCO3)CC2)cc1 745799506 IPMYJQVZHQLCFH-OAQYLSRUSA-N 404.555 2.416 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1nc(C)n(-c2n[nH]c(C(F)(F)F)n2)n1 747397599 UAAUHUWRAXMZDL-UHFFFAOYSA-N 408.388 2.017 10 20 HECD CN(C)[C@]1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCSC1 748620462 XUTSUOQZQFCMDO-NRFANRHFSA-N 406.596 2.132 10 20 HECD CC(C)CC(=O)N1CCC(NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 749415827 LZQZAIYHEYEBNG-UHFFFAOYSA-N 402.539 2.360 10 20 HECD C[C@H]1C[C@H](NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c2c(O)ccc(F)c21 756740666 SJJUVCMXZKCQCO-LRDDRELGSA-N 408.499 2.256 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3ccnc3[C@H](O)c3ccccc3)CC2)cc1 758231684 PVHOUDDDUYNTPH-JTHBVZDNSA-N 422.529 2.157 10 20 HECD Cc1nnc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 759313495 ILGZTLNQYNZVBA-WFASDCNBSA-N 402.524 2.109 10 20 HECD O=C(NCCCSc1nccs1)N1CCN(C(=O)c2ccccc2O)CC1 759603607 ZJBKWACRHINBOC-UHFFFAOYSA-N 406.533 2.499 10 20 HECD Cc1c(NS(=O)(=O)c2cccc3nonc23)cccc1S(=O)(=O)NC(C)(C)C 765089757 MCSSCAKRMPTCEX-UHFFFAOYSA-N 424.504 2.409 10 20 HECD COc1ccc(NC(=O)NCc2cccc(Br)c2O)cc1-n1cnnn1 765303960 PDELPRFMZRYPFW-UHFFFAOYSA-N 419.239 2.461 10 20 HECD C[C@@H](NCCCN1CCC[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765798535 UZLOWROBIASUFE-IAGOWNOFSA-N 408.974 2.415 10 20 HECD O=C(NC[C@H]1CCCS1(=O)=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765899610 WUIWJKAYMSRPFR-MRXNPFEDSA-N 417.478 2.133 10 20 HECD Oc1nc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)nc2ccccc12 768231449 UVTVSNJCYRDGPU-UHFFFAOYSA-N 419.529 2.490 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 769540208 GSOKWAUJLNUFDA-ULQDDVLXSA-N 420.531 2.314 10 20 HECD Cc1cc(=O)nc(-c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)[nH]1 769730890 WQRVEHJWMVMVSE-UHFFFAOYSA-N 414.443 2.075 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)c4c(C)n[nH]c4C)n3)CC2)cc1 771068655 SBQCVRIRKZTTJX-CQSZACIVSA-N 424.505 2.461 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(N2CCOCC2)cc1 774778798 FIPPOVMGAZTBBI-GCJKJVERSA-N 424.545 2.120 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOCCC(C)C)CC2)cc1 778250270 YITXJVBUTKZPOP-CMDGGOBGSA-N 403.523 2.079 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc(C(F)(F)F)nc3)CC2)cc1 778443580 MJPLGWOSVJUCGX-UHFFFAOYSA-N 424.379 2.010 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1 784560799 NRPATYLYAGBKCL-GOSISDBHSA-N 411.502 2.317 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n(-c2ccc(F)cc2)n1 785303940 MWEIBYROGFUXFI-LBPRGKRZSA-N 412.421 2.417 10 20 HECD COc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC(F)F 785429265 XZADTIMETQCVSF-UHFFFAOYSA-N 407.417 2.295 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C(=O)OC(C)(C)C 785432408 BRKYUZPYTJMCJK-RDJZCZTQSA-N 418.538 2.273 10 20 HECD CCOc1ccccc1OCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786256194 AYOBFDBCNXRMQU-UHFFFAOYSA-N 411.502 2.449 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1[N+](=O)[O-] 786256291 CVKIKOACSQETRA-UHFFFAOYSA-N 412.446 2.202 10 20 HECD CCS[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324614 WLUGDAASRMFTGQ-RTBURBONSA-N 405.564 2.320 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788940628 YAFRJPBNSDKNOS-IBGZPJMESA-N 414.550 2.058 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1 793634675 VZDLDBHKESTPDK-SFHVURJKSA-N 418.538 2.097 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2c(C)nn(CCN(C)C)c2C)cc1 795072199 DZESHTIKJGLZCQ-UHFFFAOYSA-N 407.584 2.386 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccc(Cl)c(-c3nn[nH]n3)c2)c1 799774154 NZYRHSDWQVBOFM-VIFPVBQESA-N 409.855 2.274 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CC[C@@H](S(C)(=O)=O)C3)c2C)cc1 800466488 NSLVQPCOTZEPTI-GOSISDBHSA-N 418.515 2.182 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](C)CC2(C)OCCO2)cc1F 804852883 PUNOCRKKVZXIFO-HNNXBMFYSA-N 409.502 2.194 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N=c3ccnc4n(C)[nH]cc3-4)cc2F)C[C@@H](C)O1 806480484 NJBOECDTODECQQ-ZIAGYGMSSA-N 412.469 2.416 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@H](CC(C)C)C3)CC2)cc1 808074176 PRXJBGVPGAONOT-WIYYLYMNSA-N 417.550 2.444 10 20 HECD CSc1nnc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)s1 809608209 OOMFXDCQKGQBOD-UHFFFAOYSA-N 405.549 2.133 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCCC(F)(F)C1 809763019 HQERWOKHBYSTQW-QGZVFWFLSA-N 409.477 2.423 10 20 HECD COc1ccc(C(=O)O)cc1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 919973128 MBHANTRUHXQQKX-INIZCTEOSA-N 421.471 2.469 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCCNCc2ccc(N3CCCC3)cc2)c1 1318348934 UPGHXNVPTLDXLX-UHFFFAOYSA-N 404.492 2.263 10 20 HECD O=C(C1=CCCS1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004008 RIROMOUXSHYYCP-LJQANCHMSA-N 424.906 2.216 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@H]1C[C@H]1C1CC1 1792851525 CSYZLMBKVHMVMP-DTFBLWLJSA-N 420.893 2.001 10 20 HECD CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1802424370 WLNCHTDKBDWZML-HNAYVOBHSA-N 410.474 2.398 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423647 BEFWOGMGOZGUBT-VHFSOBRXSA-N 419.522 2.133 10 20 HECD Cn1c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc2ccccc21 1843249510 RKSWWNUIUCGSAN-UHFFFAOYSA-N 406.442 2.115 10 20 HECD Cc1nnsc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501166 HZDRTLZJYXARIG-UHFFFAOYSA-N 408.867 2.042 10 20 HECD Cc1c(CNC(=O)C(=O)NCCc2cccc(C(=O)N(C)C)c2)n(C)c2ccccc12 513004201 JDXCRTWBEPBLTR-UHFFFAOYSA-N 420.513 2.164 10 20 HECD O=C(c1ccccc1)c1ccc(O)c(CN(C2CC2)[C@H]2CCS(=O)(=O)C2)c1O 728194087 FUUGJCOKFZFOQE-INIZCTEOSA-N 401.484 2.480 10 20 HECD COc1ccc(N2CCC(NC(=O)Cc3cccc(NS(C)(=O)=O)c3)CC2)cc1 730218203 FZPVPHMOIQSTFP-UHFFFAOYSA-N 417.531 2.394 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCc2ccccc2C1 732274058 BTDZJZNQGGFDHD-GCJKJVERSA-N 420.557 2.451 10 20 HECD CCc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1N 751681687 CUYVZWGXVHYDLF-UHFFFAOYSA-N 415.465 2.280 10 20 HECD O=C(CN1CC[C@H](C2CCOCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 755056140 DAODPWVHCZGXPM-IBGZPJMESA-N 405.514 2.027 10 20 HECD O=C(CN1CC=C(C(F)(F)F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 757122140 VEEPWPGSXIEWOF-UHFFFAOYSA-N 401.404 2.473 10 20 HECD COc1cc(N2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)CC2)cc(OC)c1OC 759223625 RNDQCQJJGKNETD-UHFFFAOYSA-N 423.510 2.228 10 20 HECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCCCSc2nccs2)C1 759589491 JHLWXJJVILRIHE-KBPBESRZSA-N 400.570 2.198 10 20 HECD CCOC(=O)Cn1cccc(NC(=O)NCc2cccc(Br)c2O)c1=O 765319270 RPSYGZDSLQYVNF-UHFFFAOYSA-N 424.251 2.201 10 20 HECD Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1cccc(Br)c1O)C2=O 765729165 YSNYURVFTGCKJR-UHFFFAOYSA-N 403.232 2.376 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3ccccc3Cl)CC2)c1 768285452 IOCLWTGDGNWGHB-UHFFFAOYSA-N 423.922 2.375 10 20 HECD COc1ccc(C(=O)N2CCN(Cc3cc(OC)c(OC)cc3O)CC2)c(OC)c1 768442114 IYRDEXRQUAMUME-UHFFFAOYSA-N 416.474 2.385 10 20 HECD COc1ccc(-n2c(C)nnc2SCC(=O)NCCc2ccc(O)c(O)c2)cc1 768900660 LULLVLLKYLEYPO-UHFFFAOYSA-N 414.487 2.447 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4cccnc4)n3)CC2)cc1 771059207 YXSLJPQEDVVDSY-UHFFFAOYSA-N 407.474 2.150 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)NC1CCN(c2ccc(OC)cc2)CC1 772109363 ZXXOFFMTGYUAPT-UHFFFAOYSA-N 401.511 2.468 10 20 HECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773991393 XOKXZMANICCORG-OAHLLOKOSA-N 413.522 2.203 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNS(=O)(=O)c1ccccc1N 774327982 TULABLHBLNNQPQ-UHFFFAOYSA-N 416.547 2.196 10 20 HECD CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cn1 774364234 VTJMAONKSLMNTE-UHFFFAOYSA-N 416.434 2.137 10 20 HECD CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCc1ccc(O)c(O)c1)c1cnn(C)c1 776358014 XCMGRNWUAHBKDQ-KRWDZBQOSA-N 404.467 2.098 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2nnc(C(F)(F)F)s2)CC1 777398416 DSTMKIBHUQVWKH-RQOWECAXSA-N 400.382 2.330 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccn2c(O)nnc12 780956394 UYAJVLJPPLOYER-GFCCVEGCSA-N 403.389 2.435 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)Cc2ccn(C)n2)NC(=O)OC(C)(C)C)cc1 782711292 IYBYEGNVBJONQX-GOSISDBHSA-N 401.511 2.411 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 785294032 JZDNCINPXGRUMU-CTUXIKGSSA-N 424.906 2.316 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 785294033 JZDNCINPXGRUMU-DNMZCBJRSA-N 424.906 2.316 10 20 HECD CN1CCC[C@@H](OC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1=O 785413980 RWSFIVZTXZSDOO-CQSZACIVSA-N 410.473 2.032 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 788269253 JLCDVXIOPSNARI-OAHLLOKOSA-N 422.501 2.024 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1 788979659 ZNRMREODPZKVFG-FUHWJXTLSA-N 418.538 2.132 10 20 HECD CCC1(CC)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCS1 789797556 AKSOBVLYWGEQIY-UHFFFAOYSA-N 423.554 2.413 10 20 HECD COc1ccc(CNC(=O)[C@@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c(O)c1 794382632 DXRGUAXUFWSYJE-IXDOHACOSA-N 420.531 2.314 10 20 HECD CN1C(=O)COc2cc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 799244492 CNTVQIGYFADAIT-UHFFFAOYSA-N 414.437 2.339 10 20 HECD C[C@@H](NC(=O)C(=O)NCC(C)(C)[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803305353 LLGJTGOOCRJPSE-YLJYHZDGSA-N 417.550 2.412 10 20 HECD COC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)C 803451305 JBONFKRUTOOUCZ-QGZVFWFLSA-N 413.465 2.160 10 20 HECD COCC1(O)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803677041 DLDXZDNVVNOMJM-UHFFFAOYSA-N 417.550 2.072 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(Cc4cccs4)CC3)ccc21 803687354 LAZZIHADTYERAR-UHFFFAOYSA-N 412.559 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc4n(n3)CCCC4)CC2)cc1 804751615 BYRIKEBEYIOHJW-KTKRTIGZSA-N 409.490 2.072 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671077 LDEFTINFDVKJAR-HOCLYGCPSA-N 404.511 2.055 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1F 810351759 SGQKSWHUGFEGRX-UHFFFAOYSA-N 405.401 2.415 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(OC(F)F)cc1 916676593 LZIJMOWIUTZWHH-UHFFFAOYSA-N 410.442 2.453 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)N3CCOCC3)cc2F)C[C@H](C)O1 918179796 GOAQNDJCFFLWIO-IRXDYDNUSA-N 422.545 2.349 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1 1116419688 PSFAMMFRSRJQRP-UHFFFAOYSA-N 403.504 2.419 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(C)=O)c1C 1116718634 IQCRQOBZWWKGTL-KRWDZBQOSA-N 400.431 2.269 10 20 HECD O=C(COC(=O)c1ccccc1N=Nc1ccc(O)cc1)N[C@@H]1CCS(=O)(=O)C1 1317690899 ZQBAYMZWUFOTIB-CQSZACIVSA-N 417.443 2.268 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(C(=O)N(C)CC)c1 1323860374 UZVIAJPVDIBLMB-KRWDZBQOSA-N 414.458 2.094 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001919 RLPKBYHRRQHRMV-HRAATJIYSA-N 410.474 2.398 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)/C=C/c2ccoc2)C1 1841950233 IDOJWENLVYZLQI-BQYQJAHWSA-N 418.453 2.289 10 20 HECD COc1ccc([C@@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843249105 WPJQNFZBSKOHMW-ZWKOTPCHSA-N 423.469 2.122 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2ncn(C)n2)C3)cc1 1845398273 UPXWVPPAPLLGFE-UHFFFAOYSA-N 418.501 2.353 10 20 HECD CN(C)c1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 17370701 VMTFRLDYVZDMEY-UHFFFAOYSA-N 401.532 2.470 10 20 HECD CCN(CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 55247923 JQQLDPVOVIUMKJ-UHFFFAOYSA-N 415.512 2.141 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)c1ccc(-n2cnnn2)cc1 145167020 NXOYQBDEWOWALR-UHFFFAOYSA-N 412.519 2.473 10 20 HECD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NCc3ccccc3O)nn2)CC1 725895888 UFQINQPFDJJZKZ-UHFFFAOYSA-N 401.467 2.486 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC(CCO)CC3)CC2)cc1 730112757 HIMSRUMWPYCPAO-UHFFFAOYSA-N 404.555 2.011 10 20 HECD CC[C@@H](C)CS(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 733314277 NILMRJXIPDZUBU-MRXNPFEDSA-N 421.542 2.408 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1 734061459 YNCJNWSZRVYLQT-UHFFFAOYSA-N 409.439 2.402 10 20 HECD NC(=O)C1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCC1 749052739 RADPYSBYIQJHPI-BENRWUELSA-N 409.558 2.254 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2)c1ccc(N2CCOCC2)cc1 749635261 BDGFDHSBRZDGHH-OAHLLOKOSA-N 422.485 2.224 10 20 HECD Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(N(C)C)n1 750216538 UPWJADRLMCZEKH-KRWDZBQOSA-N 412.490 2.308 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(N(C)C)cc3F)nc12 751893640 OGPQKJZJYALXHY-UHFFFAOYSA-N 402.382 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(-n4cnnn4)c(C)c3)CC2)cc1F 753879473 PHRUVJIOXQLRNP-UHFFFAOYSA-N 411.441 2.473 10 20 HECD O=C(OCC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1)c1cccc(O)c1O 758556685 FVPZLYDTDVZOTE-UHFFFAOYSA-N 422.840 2.392 10 20 HECD CC(C)NS(=O)(=O)NCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 759549236 IWRUXTGIXDYAIG-UHFFFAOYSA-N 412.556 2.069 10 20 HECD O=C(NCCCSc1nccs1)NC[C@H](O)COc1ccc2c(c1)OCO2 759602860 NDETZSZZUSKGRO-LBPRGKRZSA-N 411.505 2.093 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2COC(=O)C2)NC(=O)OC(C)(C)C)cc1 765684570 PGBKDEGRKDZLSZ-PBHICJAKSA-N 405.495 2.388 10 20 HECD CCC[C@@]1(CO)CCCN1C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 768975228 LJTCOWKAKZUTEP-AXKWSIDASA-N 415.534 2.054 10 20 HECD C[C@@H](NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O)c1ccc(N(C)C)cc1 773083905 LFHNBVURGGCATM-GFCCVEGCSA-N 411.911 2.310 10 20 HECD O=C(CN1CCC[C@@H](C[C@H]2CCOC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 773703732 VIVYXRFOWMRNTO-VQTJNVASSA-N 419.541 2.417 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC[C@H]3C)cc2F)CC1 774748465 BHPBBYXENWAPOZ-VQIMIIECSA-N 404.530 2.279 10 20 HECD C[C@@H](CNCc1cc(Br)cc(Br)c1O)S(C)(=O)=O 776253250 UGBAVKICQOQBMO-ZETCQYMHSA-N 401.120 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H](c4ncc[nH]4)C3)CC2)cc1 778258036 XGFDQWCBBIQUQW-BLGFXRMMSA-N 423.517 2.029 10 20 HECD CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 779335483 DLTQYNASALQTBE-QKNQBKEWSA-N 413.566 2.014 10 20 HECD NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 779475191 GPOUOFKPQLLGOE-SOFGYWHQSA-N 409.442 2.087 10 20 HECD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785294040 KASGTHDXXDNWGJ-AWEZNQCLSA-N 413.474 2.230 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@H]1c1ccncc1 789801535 UQXVSLXXBJCDCZ-IBGZPJMESA-N 412.465 2.037 10 20 HECD O=C(CN1CCC2(CCOCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 792932730 CMEPQXQWWNMVDN-UHFFFAOYSA-N 405.514 2.171 10 20 HECD COCCN1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 798213965 YMGWELJDLWZMJF-INIZCTEOSA-N 421.497 2.053 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 799643724 CZSBOSWYGNVYHX-SJORKVTESA-N 404.511 2.103 10 20 HECD CCN(CC)S(=O)(=O)c1ccc2nnc(Sc3ncc([N+](=O)[O-])s3)n2c1 799928339 QQFPRFOZMUTIMO-UHFFFAOYSA-N 414.494 2.276 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803298046 NWBQBHQIQHTFQL-QGZVFWFLSA-N 408.502 2.287 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1C)c1nnc2n1CCCCC2 804101470 OGZCARAHAIEGBI-SFHVURJKSA-N 412.538 2.263 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807672314 XNOYBCPIDQBZQD-ZHRRBRCNSA-N 403.523 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](n4cc(Cl)cn4)C3)CC2)cc1 810132076 VBDXMQZFQFDTKB-SFHVURJKSA-N 403.914 2.141 10 20 HECD C[C@](O)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cl)cc1 815065868 QSHGAJKJDOLPHW-HXUWFJFHSA-N 422.934 2.099 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1cnn([C@H]2CCOC2)c1 816461659 ULINXHMBZGDWBI-AWEZNQCLSA-N 420.516 2.432 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc4c(nc3O)CCC4)CC2)cc1 915830736 ULHASAXDYKCHRC-UHFFFAOYSA-N 410.518 2.227 10 20 HECD COc1ccc(N2CCCN(CC(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)CC2)cc1 917211134 WRNNWNTVSYFCSF-UHFFFAOYSA-N 422.485 2.072 10 20 HECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 1319920447 GGSPJOXGIOQJNA-VIHMKRCTSA-N 420.462 2.122 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nc(C)sc3C)CC2)cc1 1335397259 YWJGPRHCDACKMU-MHZLTWQESA-N 407.561 2.366 10 20 HECD CC(=O)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822338714 CYWGMYWZNIKNRZ-XHDPSFHLSA-N 415.450 2.137 10 20 HECD Cc1cc(C(=O)Cn2cnc3c(cnn3C)c2=O)c(C)n1-c1ccc2c(c1)OCCO2 17180422 HMQULWZXOYNRKP-UHFFFAOYSA-N 419.441 2.192 10 20 HECD O=S(=O)(C[C@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 725823801 FRRKTKYEGAUWRZ-OAHLLOKOSA-N 408.442 2.140 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCNC(=O)c3cccs3)CC2)cc1 726610036 AXBWNRVIHDVDIO-UHFFFAOYSA-N 402.520 2.455 10 20 HECD O=C(CN1CCc2ccc(O)cc2CC1)NCc1ccc(N2CCOCC2)c(F)c1 728570107 WUXPMQUDWZQYNB-UHFFFAOYSA-N 413.493 2.085 10 20 HECD CN(C)CCN(Cc1ccccn1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 730672392 HCJOIAPGCVVBHF-UHFFFAOYSA-N 415.513 2.331 10 20 HECD CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 732892590 DTMRSVCTKFDOPU-UHFFFAOYSA-N 404.488 2.313 10 20 HECD NS(=O)(=O)c1cc(F)cc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 735750932 ZGULJBDRHYWHAU-MRXNPFEDSA-N 423.466 2.392 10 20 HECD Cc1sc(=O)n(CCC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 736195454 GURATLGSPCZCLE-UHFFFAOYSA-N 403.548 2.442 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 737108420 WLQPRDDGKUZSKL-TXEJJXNPSA-N 404.442 2.299 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(CC(C)C)nn3C)CC2)cc1 737139371 OGNPGKOAWYIOEN-UHFFFAOYSA-N 413.522 2.305 10 20 HECD C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 741015519 BZBGFQKWRSYXPT-IXDOHACOSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COCc3cccc(OC)c3)CC2)cc1 742920733 RQEYCAORPNYBEM-UHFFFAOYSA-N 413.518 2.159 10 20 HECD CCN(CC(=O)N(CC)CC(=O)NC(C)C)Cc1cc(Br)ccc1O 743874168 UZYFPHSJSFFXDX-UHFFFAOYSA-N 414.344 2.350 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(C(C)C)[nH]2)cc1OC 747607399 PAFIZYYVLZNYAH-UHFFFAOYSA-N 402.498 2.104 10 20 HECD CCN(C)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 749198479 MHEWVKMYRLWMGY-IBGZPJMESA-N 405.562 2.451 10 20 HECD O=C(NCC1(CO)CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 749210248 XAFYRJYZZPWYRO-HNNXBMFYSA-N 413.465 2.345 10 20 HECD NC(=O)c1csc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 751067000 PZIVARMQOVJWPK-UHFFFAOYSA-N 424.485 2.062 10 20 HECD Cn1cc(Br)cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c1=O 751556423 CWDPLZXRCJDOKL-UHFFFAOYSA-N 421.295 2.306 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3c3cc(C)no3)CC2)cc1 754009178 ZJUIDIWENUEMCR-PZJWPPBQSA-N 400.523 2.312 10 20 HECD COC[C@H](C)CC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 756664159 CBVJNFUZXJIKJQ-BZUAXINKSA-N 410.486 2.271 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@]3(N(C)C)CCC[C@@H](C)C3)CC2)cc1 758202243 HGMHLSAGSKPSRH-BKULYWANSA-N 418.626 2.278 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])cc3C)CC2)cc1 758222987 KDNQFYBDOJTYBW-IBGZPJMESA-N 401.463 2.474 10 20 HECD CC[C@]1(C)NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 761116399 CDIRFHKDUSJXAL-NRFANRHFSA-N 412.469 2.163 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc1OC 768441905 LMCFWTBMQLHFRN-IAGOWNOFSA-N 405.539 2.032 10 20 HECD CCN(C)c1ccc([C@H](C)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1 773014000 HNVFFSWCSKWRSA-INIZCTEOSA-N 405.568 2.380 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)c1 773780051 PUZJZPCDNKNUJZ-ZDUSSCGKSA-N 423.491 2.212 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773844536 CXJBVYHYKNWBTP-CQSZACIVSA-N 403.504 2.362 10 20 HECD CCc1ccnc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 775093304 MTRCKOYDCYXQOE-UHFFFAOYSA-N 401.438 2.093 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 776078096 ZNHOEOZZCOMEQB-FXAWDEMLSA-N 409.552 2.020 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1C(=O)NC(C)C 785296265 CBXICYBUQRPFDK-AWEZNQCLSA-N 413.474 2.230 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N(C)C)cc1 785401221 WYOOXWHDDLNXPF-HZPDHXFCSA-N 406.490 2.388 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc1 785439442 PEXVPDAZLZMOIG-UHFFFAOYSA-N 414.937 2.367 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C3(NC(=O)OC(C)(C)C)CC3)cc2)CC1 786659432 KRGFKCJOVFLQJC-UHFFFAOYSA-N 416.522 2.029 10 20 HECD Cn1cc(-c2ccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)nn2)cn1 788786891 NSZPPWFPTOMWHZ-UHFFFAOYSA-N 411.441 2.175 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](Oc4ccncc4)C3)cc2)C1 788894646 RVACBQWRBRXWGF-WIYYLYMNSA-N 423.517 2.146 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](C)[C@@H](C)C(=O)NCc2cc(OC)ccc2O)c1 790788374 VHDPFUMTPFZACT-ZIAGYGMSSA-N 416.474 2.320 10 20 HECD COc1ccc(CNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c(O)c1 794384203 XAXCCGQKRUJZIR-IBGZPJMESA-N 406.504 2.329 10 20 HECD COCc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 795803162 GUIAVCZKUBXSME-UHFFFAOYSA-N 406.504 2.157 10 20 HECD CCOc1cccc(CNc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1O 796392413 FDRLYVIYXDMLIH-UHFFFAOYSA-N 422.503 2.433 10 20 HECD CS[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 803306589 WJCGBEBOWNZKLS-VDZJLULYSA-N 405.564 2.491 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)[C@H](C)C1 804852381 ABYJMZYRLXKEND-APWZRJJASA-N 406.546 2.477 10 20 HECD CCOC(=O)[C@@H]1CCCN(S(=O)(=O)NCc2cc(Cl)cc(Cl)c2O)C1 805134485 APRGDNADSXDEBW-SNVBAGLBSA-N 411.307 2.309 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOC4=O)cc3)cc2)C1 917835016 XAAOJLBGFCLEEY-GOSISDBHSA-N 422.485 2.275 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3cn4ccsc4n3)cc2)C1 918117544 NQTPWYAUHHJUDO-HNNXBMFYSA-N 412.519 2.097 10 20 HECD COc1ccc(C)cc1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335516 NZRZHCRTMQPFLT-UHFFFAOYSA-N 402.516 2.097 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(N2CCOC2=O)cc1 919839144 CZVHQHBUSIMGKK-UHFFFAOYSA-N 415.471 2.130 10 20 HECD COC(=O)c1cccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 920255575 ZSWYPJXZNMLKNT-ZHACJKMWSA-N 423.469 2.325 10 20 HECD C[C@H](NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1ccc(N2CCOCC2)cc1 920882002 ULYZSZHJMJBYSP-PWIZWCRZSA-N 413.518 2.266 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)CN(C)C2)c1ccc(N2CCOCC2)cc1 920924472 BZJJJXHUCKRPCE-MRXNPFEDSA-N 408.502 2.285 10 20 HECD CC(C)CN1C(=O)/C(=C/Nc2ccccc2C(=O)N2CCCC2)C(=O)NC1=S 920980118 XTIIMDLEWQMWSX-RVDMUPIBSA-N 400.504 2.118 10 20 HECD O=C(CCCC(F)(F)F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598942 NPTABCAFOWTUDW-CLLJXQQHSA-N 401.385 2.477 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)CC[C@H]2CCOC2)C1 1846729573 NGLMQVUTUBKYNY-ZDUSSCGKSA-N 408.882 2.385 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(=O)n(-c2ccccc2)n1 303036159 VCKVGOVGGXGUDC-UHFFFAOYSA-N 422.460 2.263 10 20 HECD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nnn1C 745167690 SIFXQJAGRRJQDG-LBPRGKRZSA-N 418.409 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)cc1 746364305 HLKADOLEAQQSDV-UHFFFAOYSA-N 406.490 2.428 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCN([C@H](C(N)=O)c4ccccc4)CC3)ccc21 746982986 KIXCJLPDPMTSQO-QFIPXVFZSA-N 421.545 2.123 10 20 HECD CCCCCn1nc(C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 748980110 GKLYABJAYRYEKG-UHFFFAOYSA-N 413.522 2.473 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 751229088 SXWCILZYXHJBJU-UHFFFAOYSA-N 409.439 2.174 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1 753643378 JMVYYTAAZDEHAH-HZPDHXFCSA-N 401.482 2.495 10 20 HECD Cc1ccn(-c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 759499289 HKHBANCNEVICOY-UHFFFAOYSA-N 419.485 2.272 10 20 HECD Cc1nccn1-c1ccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cn1 761920176 VGTGCUBAIXCEQD-UHFFFAOYSA-N 412.431 2.370 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768385946 WDFHWLWAGFBPCX-ZMSDIMECSA-N 413.465 2.438 10 20 HECD COc1cccc(C[C@H](C(=O)N[C@@H](C)c2cc(OC)ccc2O)n2nnnc2C)c1 768912138 WDFJNPSBTQMVIG-ORAYPTAESA-N 411.462 2.366 10 20 HECD C[C@H](Sc1nncn1C)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913280 XSKFYNJXRJNGBN-SWLSCSKDSA-N 409.943 2.436 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)C)nc1 769845431 GMJCGJWASNBZLL-UHFFFAOYSA-N 404.536 2.449 10 20 HECD Cc1cc(C(=O)N[C@H]2CC(=O)N(C)C2=O)c(C)n1-c1cccc(Br)c1 773660599 ZUWLNGDWEBFWLF-HNNXBMFYSA-N 404.264 2.344 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCc3nccs3)CC2)cc1 778393824 MQVWDYMFXASYQG-FPLPWBNLSA-N 414.531 2.058 10 20 HECD COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1cc(Br)cc(OC)c1O 780784270 SKJQGWAHCMPVLN-MFKMUULPSA-N 416.268 2.090 10 20 HECD COc1cc(NC(=O)c2ccc(C)c(O)c2O)ccc1S(=O)(=O)N1CCCC1 780943287 INZUMZRXVVRFSU-UHFFFAOYSA-N 406.460 2.452 10 20 HECD CC(=O)N1CCN(Cc2ccccc2NC(=O)NCCc2ccc(O)c(O)c2)CC1 782079283 XGQIFAJCZBWNMB-UHFFFAOYSA-N 412.490 2.126 10 20 HECD CC(C)CNC(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785407669 MVQXGBKADJLJDG-UHFFFAOYSA-N 412.489 2.184 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C 785597296 DUTOCOSIQSACQQ-HXUWFJFHSA-N 405.502 2.317 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCCCSc2nccs2)n1 786733374 RSUHOWYLEODUDX-UHFFFAOYSA-N 417.582 2.387 10 20 HECD O=S1(=O)C=C[C@@H](N(c2ccccc2)S(=O)(=O)c2cccc3nsnc23)C1 799185960 VNKFNNCIWTZXQX-CYBMUJFWSA-N 407.498 2.197 10 20 HECD C[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2ccccc2C1 803882370 VRGKOFDYTPHMOB-HNNXBMFYSA-N 418.588 2.305 10 20 HECD CCc1cc(N2CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)ncn1 806270062 OSQOPWZCLICICV-QFBILLFUSA-N 424.549 2.067 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC12CCCCC2 807291756 HOKRGTLTYXRSCW-UHFFFAOYSA-N 424.545 2.073 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N(Cc1ccco1)C[C@H]1CCCO1 807291872 PIJVQRKOJOOHJD-OAQYLSRUSA-N 409.486 2.480 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)COc3cc(F)cc(F)c3)CC2)cc1 811360946 ONMCMJARTQSOJY-UHFFFAOYSA-N 420.412 2.244 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)c3ccc(Cl)cc3)nc12 815498830 OIDIMRDYVFFACA-LJQANCHMSA-N 419.821 2.216 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1Cl 912984051 BBZSLLIPKKRSLW-UHFFFAOYSA-N 422.843 2.350 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCC[C@@H](C)C1 918117426 KOHNNDFLZPIQGG-WSTZPKSXSA-N 415.582 2.308 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)C2CC2)cc1 918455603 DLJNZHLLKYKLNP-UHFFFAOYSA-N 421.501 2.412 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)CC2)cc1 1319859293 RWEAILCTUXGCPM-QHCPKHFHSA-N 422.485 2.102 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC1CCCC1 1795419960 JUXDDSSZMDFKCN-MUJYYYPQSA-N 423.604 2.455 10 20 HECD Cc1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1795730649 TYXSRCATLYBFRD-BJWYYQGGSA-N 411.458 2.132 10 20 HECD CCc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)co1 1810546535 IOUIDIIHLDJTRT-UHFFFAOYSA-N 414.462 2.202 10 20 HECD O=C(c1cc(-c2ccccc2)on1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248848 SMSBEZRMDVHOIG-UHFFFAOYSA-N 420.425 2.279 10 20 HECD Cc1cc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)no1 1846558009 CNLMJQILWJMKKY-UHFFFAOYSA-N 405.838 2.107 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3cccc(N4CCOCC4)c3)ccc21 60749729 PWJZNTHCMKJAQR-UHFFFAOYSA-N 408.502 2.161 10 20 HECD CCOc1cccc(N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 730266331 UCOGXYYAZGGYKI-UHFFFAOYSA-N 411.550 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@](C)(CC(C)C)C3=O)CC2)cc1 740873124 QFEITUSFXIVRJH-QFIPXVFZSA-N 401.507 2.155 10 20 HECD NS(=O)(=O)c1ccc(OCC(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 743428937 SGYMCGPNGCDUII-UHFFFAOYSA-N 416.455 2.240 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CC(N)=O)C3)cc2F)C[C@@H](C)O1 746758150 KVSFJNMOBIILQM-INMHGKMJSA-N 406.502 2.236 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3ccc(F)cc3F)c2)CC1 748676191 XHRCJNBAKGLXIM-UHFFFAOYSA-N 402.444 2.000 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 753132751 NVRAOOJSCZKJBB-IRLDBZIGSA-N 402.539 2.074 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@@H]3CCN(C)C[C@H]3C)cc2F)CC1 754370870 WDVABUGAKGNQER-YLJYHZDGSA-N 405.562 2.449 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2CN2CCNC2=O)cc1 755204843 YWJYCJRTVYZGMJ-UHFFFAOYSA-N 423.517 2.313 10 20 HECD CN(C)c1ccc(CNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1F 758428454 JPXHSTBNKRXLSC-UHFFFAOYSA-N 424.454 2.073 10 20 HECD COC(=O)[C@H]1CCC[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759225624 RRCRYOHZSDYBDT-CVEARBPZSA-N 420.506 2.340 10 20 HECD CCCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)CC(C)(C)O 761951280 YKQXEWNYTRQUSW-UHFFFAOYSA-N 421.563 2.407 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cnn(CCO)c1-c1ccccc1 764427545 PZYRAWLHVQPHBD-UHFFFAOYSA-N 406.486 2.309 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccncc2)Cc2cccnc2)c1 769767233 DGPYYLWFXVXTHE-UHFFFAOYSA-N 412.471 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncnc3-c3ccccc3)nc12 773609282 STTYIKAFHHGWFH-UHFFFAOYSA-N 419.397 2.426 10 20 HECD Cc1c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nnn1-c1ccc2c(c1)OCCO2 773759932 APSRUZHLCRJMJB-GFCCVEGCSA-N 410.430 2.119 10 20 HECD CC(=O)N(Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1)C(C)C 774363035 QCKDEIROSDMNIC-UHFFFAOYSA-N 413.474 2.152 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 785868446 DHZMNFDIHLODIJ-CALCHBBNSA-N 405.539 2.135 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCC2(CC1)OCCO2 787414543 ZITXHWWSOCASGR-UHFFFAOYSA-N 403.523 2.292 10 20 HECD CC[S@@](=O)CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787947714 HCXKQIDDCHBYLI-XETJZTBLSA-N 413.451 2.101 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H](C)S(C)(=O)=O 788282781 LKGIFCANVBLXFW-QWHCGFSZSA-N 422.469 2.227 10 20 HECD C[C@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788311222 RXKAVFXPYHIKBA-UWJYYQICSA-N 408.502 2.144 10 20 HECD CSC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 788796428 YTMNUSPRVAABMT-UHFFFAOYSA-N 401.511 2.454 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCN(c4ccccc4)C3)ccc21 788822254 KQMKJKGQIUMJFW-LJQANCHMSA-N 406.530 2.328 10 20 HECD CC1(NC(=S)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 789209234 ZZDZKTUWJNJEPO-UHFFFAOYSA-N 400.527 2.459 10 20 HECD CCN(CCc1cccs1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798990 HDSIQOUCQQHFCS-UHFFFAOYSA-N 419.522 2.431 10 20 HECD CC(C)CCOCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822563 BOCUKOOVHVHCLS-CALCHBBNSA-N 423.529 2.234 10 20 HECD CC[C@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845246 UJRYUHBYUBEAFM-QFBILLFUSA-N 405.514 2.488 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@]4(CCO[C@@H]4C)C3)cc2F)CC1 792077140 WQACAGOMLMSTEU-VGOFRKELSA-N 420.529 2.057 10 20 HECD COCC1(C(=O)NCCc2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)CC1 793679123 CEBRCIVGCCOUOZ-UHFFFAOYSA-N 408.495 2.420 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ncccc3Br)cc2)CC1 793923079 GYXMITXIRFDPII-UHFFFAOYSA-N 417.307 2.443 10 20 HECD COc1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C(C)C)ccc2F)c(O)c1 794383895 SCWJSQSIMNCUHC-UHFFFAOYSA-N 410.467 2.499 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3CCc4ccccc4OC3)CC2)cc1 801571424 SMKBMUOHEMWVAO-UNMCSNQZSA-N 411.546 2.162 10 20 HECD O=C1N[C@@H](Cc2cnc[nH]2)C(=O)N1[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174572 HATJLFADSIQAOM-ZBFHGGJFSA-N 405.405 2.143 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCO[C@@H](c4ccccc4)C3)CC2)cc1 804316214 SYNAWKFKDORGNL-JOCHJYFZSA-N 423.513 2.380 10 20 HECD CCc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 805192242 CIEDWUMGJILWRZ-INIZCTEOSA-N 403.504 2.235 10 20 HECD Cc1cc(N2CC[C@@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C2=O)n(C)n1 806877807 CZHAQOSGDPVWFN-CYBMUJFWSA-N 412.277 2.346 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C12CCC2 807609266 LJLSHDFPNCDGSY-DFQSSKMNSA-N 416.518 2.364 10 20 HECD CN(Cc1nccs1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771821 XDVQIWYOVMGJAT-CYBMUJFWSA-N 424.473 2.488 10 20 HECD Cc1cc(C)c(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3)C2=O)c(C)c1 808213237 OZOPCWHIPGADKJ-HXUWFJFHSA-N 422.529 2.216 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1C[C@H](OC)C1(C)C 809124176 XLPPKOFWOGFUQW-CABCVRRESA-N 413.312 2.433 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C)c4nccn4c3)CC2)cc1 818045964 XAPFLEVKSNNXTB-BQYQJAHWSA-N 419.485 2.495 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)cc2)C1 917835091 ZDOOARSQXBCMLS-RTBURBONSA-N 420.513 2.058 10 20 HECD COCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1824480161 ADTYXLONXITCBS-KRWDZBQOSA-N 417.506 2.153 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@]2(F)Cl)C1 1846443307 ARSSOXBJWHLRTM-BMLIUANNSA-N 403.237 2.493 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(CC(F)(F)F)C1 60990639 HJCCAKMJPQRBGY-AWEZNQCLSA-N 404.408 2.098 10 20 HECD C[C@H](NC(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 145482672 NCKZWPYPJHGCCP-INIZCTEOSA-N 407.470 2.387 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCCN3C[C@H](C)O[C@H](C)C3)CC2)cc1 726609783 FRXFFCXYJTXDDV-HDICACEKSA-N 404.555 2.463 10 20 HECD CCN(CC)c1ccc(CNC(=O)COc2ccc(S(N)(=O)=O)cc2)cc1F 731374339 UICBYSFQLRAUBB-UHFFFAOYSA-N 409.483 2.015 10 20 HECD CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(=O)OC 732204824 DXHFQGXETUSNQE-WCJKSRRJSA-N 423.529 2.377 10 20 HECD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 750554400 MKDWOLNHCRGBQD-UHFFFAOYSA-N 403.350 2.171 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1c[nH]c(C(=O)OC)c1 751468342 UWDFMMFOQFPPDR-UHFFFAOYSA-N 417.281 2.480 10 20 HECD O=C(CN1CC(=O)N[C@H]2CCCC[C@H]21)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 758780904 UWNVQMSRHRCNEM-VQTJNVASSA-N 417.465 2.144 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(C)cc3)CC2)cc(OC)c1OC 758829529 JIUZPCVQQMBFSL-UHFFFAOYSA-N 413.474 2.308 10 20 HECD CCOC(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1C 759506129 XMFJLZYJRFDGBP-UHFFFAOYSA-N 404.442 2.499 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(c4ccncc4)CC3)CC2)cc1 759929039 SCNZDFNKRIREHL-QHCPKHFHSA-N 410.562 2.453 10 20 HECD CCN1CCN(c2ccc(CNC(=S)NCC3CCN(C)CC3)cc2F)CC1 760481613 AEBNXPBDOVEPCP-UHFFFAOYSA-N 407.603 2.274 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)N1CCCCCC1 760918324 GFXXNCFDZKUPGQ-UHFFFAOYSA-N 400.567 2.043 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3=Cc4cc(F)ccc4OC3)nc12 761636422 HDPCBTDGTVUDOW-UHFFFAOYSA-N 413.361 2.270 10 20 HECD Cc1ccc(F)c(OCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 764938249 FCWCKZHPWQESIK-UHFFFAOYSA-N 406.479 2.064 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(=O)n(-c2ccccc2F)n1 765668764 HVECCXSATISLIN-UHFFFAOYSA-N 408.433 2.138 10 20 HECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)CCC3)c1C 767392876 BPKLYGYPHJHGFW-UHFFFAOYSA-N 418.515 2.248 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 772452068 PPQVRQKYFMFFQQ-OALUTQOASA-N 410.536 2.269 10 20 HECD CCC(=O)c1cccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 772856934 TXRXUVPEMNCMIX-UHFFFAOYSA-N 422.528 2.315 10 20 HECD COCC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(N)=O 775978188 YWRRXNHUOXFZMN-INIZCTEOSA-N 408.296 2.477 10 20 HECD O=C(CCN1CCOCC1)Nc1cc(NC(=O)c2cccc(O)c2O)ccc1F 776622611 IVUAECGLBMPNHA-UHFFFAOYSA-N 403.410 2.150 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 779517846 GNCXMRRHEHPUQH-VQHVLOKHSA-N 416.499 2.222 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3Cc4cc(C)c(C)cc4O3)nc12 786387302 UFVLEVXBUUXMHF-KRWDZBQOSA-N 411.414 2.275 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)nc2)cc1 787182119 OYIPEFXGBRKGTH-UHFFFAOYSA-N 409.534 2.461 10 20 HECD CCOc1ccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 787191376 GIGBSYUPZUMJDK-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-c4nc[nH]n4)cc3)cc2)CC1 787321467 GIGOIGHOCBBTHM-UHFFFAOYSA-N 404.474 2.070 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)c1ccc(N(C)C)cc1 787635597 FFZFIDCZHCGZCW-YWZLYKJASA-N 400.498 2.488 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCO[C@@H]3CCCC[C@@H]3C)CC2)cc1 787991256 UOAYXYFKIXMPEG-GHTZIAJQSA-N 417.550 2.445 10 20 HECD O=C(NCCN1Cc2ccccc2C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793863940 FXFKJAFIYATVSO-OAQYLSRUSA-N 423.513 2.032 10 20 HECD Cc1nc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 804812798 AGRJENILRANKQZ-SECBINFHSA-N 407.477 2.172 10 20 HECD O=C(O)c1cc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc2c1OCCO2 808114423 XOJBGQAVSCMKJR-UHFFFAOYSA-N 403.771 2.455 10 20 HECD COC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@@H]1CCCO1 809451993 DKWWMHPWUDADCX-ICSRJNTNSA-N 404.507 2.364 10 20 HECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1cc(OC)c(OC)cc1O 809719884 RFRXEPVXZKZKIM-HNNXBMFYSA-N 424.494 2.394 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ccc4ccncc4c3=O)cc2F)C[C@H](C)O1 810009175 RRGCMFACRRNMNP-HOTGVXAUSA-N 424.476 2.466 10 20 HECD O=S(=O)(CC[C@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 814992242 HGWHNCJCYDZGMH-CQSZACIVSA-N 422.469 2.388 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCc4c(cccc4NC(C)=O)C3)CC2)cc1 917412238 JDFIDUFFFYIIDD-UHFFFAOYSA-N 422.529 2.361 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CC[S@@](=O)C1 1116279715 ZELJYANLVJFANP-KUTDKUPRSA-N 414.599 2.367 10 20 HECD Cn1cncc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1787453662 MEMQNFFPBZOXPX-UHFFFAOYSA-N 407.430 2.288 10 20 HECD COC(=O)[C@H]1CCCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 27560828 FHKYHAKIUSCOEC-GOSISDBHSA-N 406.438 2.428 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1 139805487 OIATXSQEIRKGFS-UHFFFAOYSA-N 411.461 2.074 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 148595478 JASUKPQXRWUNCO-INIZCTEOSA-N 417.531 2.312 10 20 HECD COc1cc(Br)c(/C=C2/SC(=S)N(CC(N)=O)C2=O)cc1OC 727177376 ZUFGEEMEYALVDR-NYYWCZLTSA-N 417.306 2.153 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CC2 727226017 WUMNTJNPCMVLPV-VBQJREDUSA-N 416.501 2.153 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCc3cccc(OC)c3O)cc(C3CC3)nc21 729861286 KDISYYSAEVUMNS-UHFFFAOYSA-N 424.457 2.429 10 20 HECD CCN1CCC(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 730125183 NBFTUBZGEDSRNA-UHFFFAOYSA-N 405.562 2.499 10 20 HECD CCNS(=O)(=O)c1ccc(F)c(C(=O)NCCCSc2nccs2)c1 733974427 RMPCZDQPCYBBPM-UHFFFAOYSA-N 403.526 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](Cc3ccccc3)n3nnnc3C)CC2)cc1 735630652 RZMATDGLRMHVBU-NRFANRHFSA-N 406.490 2.123 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3N(C)C(C)=O)CC2)cc1 737138070 HXEKESXLNBKXAO-UHFFFAOYSA-N 424.501 2.355 10 20 HECD C[C@]1(c2ccc(CNC(=O)NCc3c(O)ccc4c3CCCC4)cc2)NC(=O)NC1=O 745796055 ODOBYBXBTQSRIP-HSZRJFAPSA-N 422.485 2.325 10 20 HECD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 747018210 XCAUMXDSWGQYOY-HNNXBMFYSA-N 424.501 2.297 10 20 HECD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1c(-c2ccccn2)nc2ccccn12 751308168 RSKJOIFSSDPOEF-KODHJQJWSA-N 413.437 2.142 10 20 HECD COc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754040031 JMPVHZGLKHCLEM-UHFFFAOYSA-N 410.467 2.362 10 20 HECD CC(C)n1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 757247239 IOXBAMXTJNKVNE-HUUCEWRRSA-N 417.485 2.472 10 20 HECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN(C)c2ccc(OC)c(F)c2)C1=O 757851089 CBWDKVKPRHWHLW-NRFANRHFSA-N 414.437 2.159 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3nc(-c4ccccc4)ccc3=O)CC2)cc1 758201889 FTCYVVRTXASVDI-NRFANRHFSA-N 420.513 2.102 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)CC2)cc(OC)c1OC 759293935 OYWUYHFHPLVECL-CVEARBPZSA-N 418.538 2.169 10 20 HECD COc1cc(Cl)cc(CN2CCN(CC(=O)NCc3ccccc3)CC2)c1O 761190616 DZVFVOCYLHLXAQ-UHFFFAOYSA-N 403.910 2.488 10 20 HECD COc1cc(Cl)cc(CNCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1O 761197664 AYMWHJRCYIOTQN-UHFFFAOYSA-N 415.855 2.031 10 20 HECD Cc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 762619918 RCDDFTSLYJXXRR-OAHLLOKOSA-N 423.485 2.453 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2cccc(Br)c2O)C[C@H](C)O1 764764116 YBKOHIIBZHQDLN-STQMWFEESA-N 400.317 2.453 10 20 HECD O=C(NC[C@H]1CCCO1)Nc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765038553 WESMSWZIQGABTK-CQSZACIVSA-N 417.447 2.324 10 20 HECD C[C@H](NC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccc(N2CCOCC2)cc1 767937859 ITAUBUZZSPPNKS-WTOYTKOKSA-N 416.566 2.261 10 20 HECD Cn1ncc2c(N3CCN(Cc4cc(Br)ccc4O)CC3)ncnc21 768233883 AKQATJLIALXGDY-UHFFFAOYSA-N 403.284 2.154 10 20 HECD COc1cc(O)c(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1OC 768447619 AJCPQAZPBJXVAY-INIZCTEOSA-N 424.494 2.491 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)Cc2cc(Br)ccc2O)C1 769301689 CIEPGOONKQGWGF-ZDUSSCGKSA-N 413.312 2.388 10 20 HECD COc1ccc2c(c1)nc(CNC(=O)NCc1ccc(N3CCOCC3)cc1)n2C 770354154 YEESWIAELUOEET-UHFFFAOYSA-N 409.490 2.418 10 20 HECD COC(=O)[C@@H]1CCN(Cc2cc(Br)cc(C)c2O)[C@@H](C(=O)OC)C1 780784026 NUUCVCXIZMOQJZ-BXUZGUMPSA-N 400.269 2.390 10 20 HECD CSCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786794520 WMEHJHNQMHGZOY-CYBMUJFWSA-N 401.479 2.242 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ncnn1-c1ccccc1 787001642 STSTWJGXHFNPIO-UHFFFAOYSA-N 410.453 2.242 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1 788969078 YQISEUPVHDHSSD-CZUORRHYSA-N 401.429 2.327 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1c(C)noc1C 789810689 BXPYCUZUHGJOSW-QGZVFWFLSA-N 418.469 2.151 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C 792703446 WOXXAGWSICMGIP-UHFFFAOYSA-N 402.519 2.165 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC4(CCOCC4)CC3)CC2)cc1 792934304 UNPOKTYZGUILNJ-NRFANRHFSA-N 403.567 2.071 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c(OC(F)F)c1 797389421 HDQXIZAEGRFRRP-UHFFFAOYSA-N 424.356 2.044 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1 797675367 PYQTVOHMECSRRB-ZDUSSCGKSA-N 420.491 2.463 10 20 HECD COCCS(=O)(=O)CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800049164 GTFAMKCHNJNDIP-CQSZACIVSA-N 402.944 2.254 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CC(C)(C)OC1(C)C)c1ccc(N2CCOCC2)cc1 803307898 PATHHGIYPZFVIT-YJBOKZPZSA-N 403.523 2.163 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2[C@H]3C=C(c4ccnn4C)C[C@H]2CC3)cc1F 803661676 JMXFLUJMMODMHI-IAGOWNOFSA-N 411.481 2.088 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)cc1 804318403 JXKURRGDCVTDCK-OAQYLSRUSA-N 408.502 2.443 10 20 HECD COc1c(C)cnc(CN(C)C(=O)C(=O)NCCCSc2nccs2)c1C 806280365 OMBCRCLJBNFNEA-UHFFFAOYSA-N 408.549 2.421 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)c(F)c1 807287932 PBOXFNWVFURDAN-FQEVSTJZSA-N 415.440 2.461 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@H](C)CC2(C)OCCO2)cc1 807423229 OSBYLUGNVVPWNQ-QGZVFWFLSA-N 405.539 2.397 10 20 HECD COCC1(CCNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 818017189 YTRUHHALVSPGIZ-CMDGGOBGSA-N 415.534 2.223 10 20 HECD Cc1c(C(=O)O)cccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 871792513 FABUSWBCDOHDRN-UHFFFAOYSA-N 404.488 2.351 10 20 HECD CC(=O)NCCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 914453980 SLHGMOBNNNDJPH-KAMYIIQDSA-N 411.574 2.372 10 20 HECD COc1ccc(N2CCCN(C(=O)NC[C@@H](C(C)C)N3CCN(C)CC3)CC2)cc1 918065054 OHKPPPKKGAWBQO-QFIPXVFZSA-N 417.598 2.189 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(CC(N)=O)CC3)cc2F)C[C@@H](C)O1 918210924 ZGKMZDQFZCRECI-GASCZTMLSA-N 406.502 2.236 10 20 HECD COC(=O)CNS(=O)(=O)c1cccc(NCc2ccc(N3CCCC3)cc2)c1 1323765177 JAJFDHBZJDLRJU-UHFFFAOYSA-N 403.504 2.350 10 20 HECD O=C(CN1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800713016 CDCCKLSCPNVRJG-QDMKHBRRSA-N 407.898 2.099 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccn2)CC1 1825809449 ZSLUFVJNEKRZDJ-SFHVURJKSA-N 410.474 2.435 10 20 HECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)nc2ccccc12 1843249439 JIVGQTGDWQLKCZ-UHFFFAOYSA-N 418.453 2.480 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1F 731408623 SMCAKEDPGHQUIY-UHFFFAOYSA-N 400.454 2.334 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCN(c3ccccc3Cl)C2=O)c1 732331799 JRMSGBXXFGLQAE-INIZCTEOSA-N 424.862 2.379 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c[nH]nc3-c3ccncc3)CC2)cc1 732924357 SLAHNJIUEZFSOD-UHFFFAOYSA-N 406.490 2.032 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H]3c3ccco3)cc2)C1 735188499 ZSOJKAHJFHPZIX-PKOBYXMFSA-N 412.490 2.264 10 20 HECD CC(C)CNC(=O)NC(=O)[C@@H](C)OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 744474347 RULVGYIZHJJXBH-CYBMUJFWSA-N 422.437 2.489 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3C[C@H](C)O)CC2)cc1 752640131 FYGQXQJXWRAVML-AZUAARDMSA-N 404.555 2.152 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1Br 753828786 OKQWTIWJTAAHAZ-UHFFFAOYSA-N 411.275 2.213 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3CCN(CC(C)C)C3)CC2)cc1 756930407 YITZJNSQHXXPIE-HXUWFJFHSA-N 417.598 2.094 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3Cc4cccc(O)c4C3)cc2)C1 758434544 BQPIAWZZXXMKBZ-ZWKOTPCHSA-N 408.502 2.061 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3nn(C)c4ccccc34)CC2)cc1 759246277 WSSYKOPHCDCJFX-UHFFFAOYSA-N 422.533 2.203 10 20 HECD C[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)cc1Cl 772999467 LLIZVHBJEXMDLD-KUHUBIRLSA-N 403.914 2.366 10 20 HECD Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773740606 RPTWJJAPVMZKDW-AWEZNQCLSA-N 404.488 2.307 10 20 HECD C[C@@]1(CCCO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 776123821 NGFUHTOEMPXAKN-GCJKJVERSA-N 402.539 2.225 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnc4c(c3)COCC4)cc2)C1 777740287 ZQISAUDIKDDAFY-MRXNPFEDSA-N 409.490 2.178 10 20 HECD CC(C)N1CC[C@H](OC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1=O 785407128 DNNUPJINFKPNFN-HNNXBMFYSA-N 424.500 2.421 10 20 HECD CCOc1ccc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 785746036 VJRBMLLMMDALKT-KRWDZBQOSA-N 411.502 2.416 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)c(F)c(O)c3F)cc2)CC1 787324629 JBRHDZHADRBEBX-UHFFFAOYSA-N 407.392 2.408 10 20 HECD COc1c(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)oc2ccccc12 788319522 LJBUOPCGKGYTBL-UHFFFAOYSA-N 423.469 2.211 10 20 HECD CCN(Cc1c(F)cccc1F)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323176 JXMQGOMQTSUMFY-UHFFFAOYSA-N 417.456 2.466 10 20 HECD CCOC(=O)C1(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CCC1 789216706 XMFGVOGPDGFIKE-UHFFFAOYSA-N 401.507 2.095 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccccn3)cc2F)C[C@H](C)O1 789816710 FHBSBCCMVOPXPN-HOTGVXAUSA-N 414.481 2.109 10 20 HECD O=C(COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1cnccn1 791493063 FCAXUHJGSMIPJY-UHFFFAOYSA-N 417.333 2.200 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3cnccn3)cc2Cl)C1 793497982 NEFUFJSWACJIHD-OAHLLOKOSA-N 415.925 2.341 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3[C@H]4[C@@H]5C[C@@H]6[C@@H]7C[C@@H]([C@@H]4[C@@H]75)[C@@H]63)cc2)CC1 793924063 IVRNIOZLKPWQKW-ADQURYLOSA-N 405.542 2.365 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687974 JANZIBAYZHXQHE-OAHLLOKOSA-N 418.538 2.057 10 20 HECD CC(C)(CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)CN1CCCC1 807665063 GGSYFIOXFXTATB-LJQANCHMSA-N 417.550 2.138 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807676477 GYYUXVBGEWUWEP-DLBZAZTESA-N 402.539 2.085 10 20 HECD CSc1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccn1 808329603 UEVWKCZFUUCZDY-QGZVFWFLSA-N 415.515 2.333 10 20 HECD Cc1cc(Br)cc(CN[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)c1O 809693502 WDKHQVSMJMHKHJ-NSHDSACASA-N 419.263 2.375 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@]34CCC(=O)N3CCS4)cc2F)C[C@@H](C)O1 917709818 GEQWHTQMDZSQTP-JZKQVHKSSA-N 407.511 2.121 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cn2)CC1 919814745 PBCOSDNONLTSRN-UHFFFAOYSA-N 418.519 2.325 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 919859774 FJBICLDOXROIQE-UHFFFAOYSA-N 424.476 2.457 10 20 HECD CCc1ccc([C@@H](CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)N(C)C)cc1 920980564 QEVHLNCYISZZQG-ZKTNYTPDSA-N 402.564 2.225 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c(Br)c3)cc2)C1 1116068744 QOXQULFYPDVWEC-CYBMUJFWSA-N 405.296 2.409 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@H]3C[C@@H](O)c3cnn(C)c3)cc2F)CC1 1324777557 ZLTXUYTZHCHXCW-SIKLNZKXSA-N 401.530 2.399 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CN)CCO3)cc1 1781753180 DTUMZCOUBPLDII-MZNJEOGPSA-N 424.545 2.132 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccns1 1794874986 ARXSONNUDVBZGJ-LJWNITHASA-N 415.471 2.225 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426105 LEUXZXVLUJQGOP-JNAXZKDPSA-N 418.538 2.100 10 20 HECD Cc1cc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cnc1C 1842155257 NYUVENGUSJTFQK-FNORWQNLSA-N 423.469 2.346 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)NC=O)C2)cc1 1845180019 CWFMXGPURCYQOV-SFHVURJKSA-N 408.502 2.046 10 20 HECD O=C(c1cnc(Cl)nc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500344 QQMCEAOXEIFZGQ-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCc2ccoc2)C1 1846676942 IWXBQYYVMFMBIV-QPJJXVBHSA-N 412.442 2.246 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)cc1OC 140299182 CFGAYZXFDHWQSD-QGZVFWFLSA-N 410.536 2.098 10 20 HECD CCN1C(=O)/C(=C/c2ccc(OCC(=O)N3CCOCC3)c(OC)c2)SC1=S 207810134 UGLNTNYASOOMKV-WJDWOHSUSA-N 422.528 2.154 10 20 HECD CNS(=O)(=O)Nc1ccc(NC(=O)C2=S=C(c3ccc(F)cc3)C=C2)cc1 684825094 KGSNICMTLSSJQD-UHFFFAOYSA-N 405.476 2.336 10 20 HECD COc1cccc(O)c1CNCc1ccccc1OCC(=O)NC[C@H]1CCCO1 725848493 WOVWVVROYOZDFF-QGZVFWFLSA-N 400.475 2.365 10 20 HECD COC(=O)c1ccc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)o1 730767486 XADBIXQDLYODBK-UHFFFAOYSA-N 404.448 2.178 10 20 HECD COc1ccc(O)c(CNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1 734067573 QPKGKRPNPWZIBW-IBGZPJMESA-N 403.454 2.413 10 20 HECD COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(C(N)=O)cc3)CC2)cc1F 753857822 PXNLEWYSFACCGS-AWEZNQCLSA-N 400.454 2.082 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@H](C)N(C4CCC4)C3=O)CC2)cc1 760949739 HYLLOUITIVTWMC-KRWDZBQOSA-N 400.523 2.413 10 20 HECD CC(=O)Nc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1F 764802093 YHTWGXXQAIIXQQ-UHFFFAOYSA-N 405.451 2.271 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 766201313 QYRBRJDCPXVVSC-UHFFFAOYSA-N 413.293 2.269 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 772375762 QYZFIZIZLWGSIG-SFHVURJKSA-N 417.550 2.255 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)[C@H](C)c3ccccc3)CC2)cc1 774359767 JMEWIGPWCVVPQH-LJQANCHMSA-N 424.545 2.153 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@H](c1ccco1)N1CCCC1 774872035 QVIINOIGOCRIBJ-CQSZACIVSA-N 408.549 2.288 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CC(=O)NCC(F)(F)F)cc2F)C[C@@H](C)O1 779658348 WLNMFGCFOLVUBJ-TXEJJXNPSA-N 405.392 2.124 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCc4ncsc4C3)CC2)cc1 782919221 TXAUHTSYPGLBFO-UHFFFAOYSA-N 415.563 2.432 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)C(C)(C)C)cc2)CC1 786655562 FQGBZLPYIXBLHC-HXUWFJFHSA-N 414.550 2.008 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cnn(Cc2ccccc2)c1 788828620 UVACEWFVMBMQCY-UHFFFAOYSA-N 415.544 2.303 10 20 HECD COc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788912431 STUFJLGDOSYFHP-UHFFFAOYSA-N 411.502 2.497 10 20 HECD CC(C)c1ncc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 796705317 IIBFQAJQCGYLQO-UHFFFAOYSA-N 411.506 2.064 10 20 HECD COC(=O)c1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1C(=O)OC 797631424 RBHBVTTXNKLMMO-LLVKDONJSA-N 402.403 2.424 10 20 HECD COC(=O)CCN(C)S(=O)(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800149039 VNTIUXHMLYRUMS-AWEZNQCLSA-N 417.959 2.406 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@]4(C3)OCc3ccccc34)ccc21 803687661 OQUUZGGDZWQMOS-XMMPIXPASA-N 405.498 2.343 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](c3cccnc3)C3CC3)CC2)cc1 804318402 JXKURRGDCVTDCK-NRFANRHFSA-N 408.502 2.443 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1COCCN1CC(F)F 807107828 LZJYNBWWQPNDQR-CVEARBPZSA-N 417.884 2.092 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1)c1ccc(N(C)C)cc1 807677985 UBMRFGFSTYAKDB-CVEARBPZSA-N 418.538 2.398 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(CCO)CC(F)F)cc2Cl)C1 807952410 HRSVTOQREWZMHY-CYBMUJFWSA-N 417.884 2.279 10 20 HECD CCC1(O)CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 809321128 QWZGUZXCDCNLIV-WUZYXKQASA-N 404.507 2.100 10 20 HECD C[C@H]1CN(S(=O)(=O)N2CCN(Cc3ccc4ccccc4c3O)CC2)C[C@@H](C)O1 816491311 HXVLBNSRZIOWJL-CALCHBBNSA-N 419.547 2.017 10 20 HECD CCC(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 914672584 UNWPLUGAFVUDSF-QWHCGFSZSA-N 422.437 2.247 10 20 HECD O=C(CCOc1ccccc1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335060 LKENQWIYRJWACQ-UHFFFAOYSA-N 406.479 2.146 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c[nH]c(C(=O)N2CCCC2)c1 919969978 MOCUCHFBJJAXFK-UHFFFAOYSA-N 410.518 2.389 10 20 HECD c1nc(N2CCOCC2)cc(N2CCN(Cc3ccc(N4CCCC4)cc3)CC2)n1 1337041779 CFFWWBWWSNKZHS-UHFFFAOYSA-N 408.550 2.236 10 20 HECD COCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1824480162 ADTYXLONXITCBS-QGZVFWFLSA-N 417.506 2.153 10 20 HECD CC(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898190 FBZONXQVWJAYQO-OAHLLOKOSA-N 411.593 2.122 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(CS(C)(=O)=O)o3)cc2F)CC1 303280200 IIPUGRDCYVXPOQ-UHFFFAOYSA-N 423.510 2.035 10 20 HECD O=C(Cc1occc1C(=O)N1CCOc2ccncc21)N1CCOc2ccncc21 498639969 QXJUMYBWJMKHOY-UHFFFAOYSA-N 406.398 2.077 10 20 HECD C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(=O)N1CCCC[C@H]1C 726616169 ZWBVTWQWHOQBAX-MSOLQXFVSA-N 402.539 2.454 10 20 HECD COc1ccc(N2CCCN(C(=O)Cc3cccc(NS(C)(=O)=O)c3)CC2)cc1 730211529 CVKFQQLOOJAJEJ-UHFFFAOYSA-N 417.531 2.348 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3noc4c3CCCC4)CC2)cc1 731279123 FAUCSZYTJKDNFH-GDLZYMKVSA-N 417.531 2.160 10 20 HECD COC(=O)C1=C(COC(=O)c2cc(O)cs2)N(C)C(=O)N[C@H]1c1ccccc1 732353807 WKWWEPGJTSQFHZ-INIZCTEOSA-N 402.428 2.434 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](CO)c1cccc(F)c1 734660650 UACNRTOGRUHDDR-LJQANCHMSA-N 405.445 2.459 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccccc3)n3nnnc3C)CC2)cc1 735630655 RZMATDGLRMHVBU-OAQYLSRUSA-N 406.490 2.123 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc([S@@](C)=O)c1)c1ccc(N2CCOCC2)cc1 737157168 HSHHOMDPUXXARA-PEGYKEAPSA-N 415.515 2.077 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(CCc3ccccc3)no2)c1 744854562 KDEUKYRBSQIYSC-UHFFFAOYSA-N 417.443 2.289 10 20 HECD COCCN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)CC(F)(F)F 745167492 ATDNOCNFLPYVKI-UHFFFAOYSA-N 404.429 2.438 10 20 HECD CCn1c(N)c(C(=O)CN(Cc2ccco2)c2ccc(OC)c(F)c2)c(O)nc1=O 749334829 GNPSPKYTLCNBHN-UHFFFAOYSA-N 416.409 2.181 10 20 HECD Cc1nnc2n1C[C@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CC2 750729535 OYXDDUPCRZVJGO-OAHLLOKOSA-N 423.439 2.321 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751229563 YMTQTBGMWVZXKE-UHFFFAOYSA-N 409.439 2.174 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(OC[C@H]2CCCO2)CC1 751604903 BQYWBPMMBHGIFS-OAQYLSRUSA-N 403.523 2.393 10 20 HECD Cc1oc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCCC1 753637646 XCEBZJGMEVHHBL-LBPRGKRZSA-N 408.476 2.145 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccnc(O[C@H]2CCOC2)c1 755045264 DJDCJAQNOHZUSR-IBGZPJMESA-N 413.474 2.131 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(OCCO)CC1 757122161 VVKFODUVEQKQTM-HNNXBMFYSA-N 422.481 2.262 10 20 HECD COc1cccc(OCC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759241332 ORCKHXRZSARNPE-UHFFFAOYSA-N 416.474 2.449 10 20 HECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 760948709 DOSWSGNJMXUYMH-NSHDSACASA-N 423.878 2.218 10 20 HECD CCc1cc(O)nc(CSCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 763210716 MZMHSDQCXFRPDM-UHFFFAOYSA-N 402.520 2.335 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 763654270 DJJWKLPFELEUHM-UHFFFAOYSA-N 404.536 2.392 10 20 HECD CCOc1ccc(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c(O)c1 770394795 MPKDIRZCURQIHJ-UHFFFAOYSA-N 405.520 2.485 10 20 HECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1cc([N+](=O)[O-])ccc1O 770542496 OIANPORNJGCUAI-UHFFFAOYSA-N 400.435 2.309 10 20 HECD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774357622 UZTSGBKYFYLTID-UHFFFAOYSA-N 413.474 2.089 10 20 HECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2cccc(Cl)c2O)CC1 776175485 MMSBLGSVKSUOPG-UHFFFAOYSA-N 409.939 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn([C@@H](C)C4CC4)c3)CC2)cc1F 778652509 MRYLMQSEHZHTNA-AWEZNQCLSA-N 415.469 2.289 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3c(C)cccc3[N+](=O)[O-])c2)CC1 780408165 YECVIWRXJBGFRA-UHFFFAOYSA-N 418.475 2.373 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782107076 MWYTWPLMMBWEHA-UHFFFAOYSA-N 421.375 2.489 10 20 HECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785295621 XNESIDBETTYOKI-ZDUSSCGKSA-N 415.446 2.376 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)CCC(=O)N4C)cc2)CC1 786259201 MKEWVYCKCIXYGJ-UHFFFAOYSA-N 420.513 2.194 10 20 HECD Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 788153771 QJGFVHQXLDBABB-IYBDPMFKSA-N 414.481 2.075 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 788937047 MKISRMJHTYGAPF-UHFFFAOYSA-N 410.493 2.391 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccnn1-c1ccccc1 792066476 MEZGRHGBLMRHRN-UHFFFAOYSA-N 410.499 2.037 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803298464 UHVMFUDGVHVCMS-ICSRJNTNSA-N 416.566 2.081 10 20 HECD COCCN(C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@H]1CCOC1 803677346 NAULAHZUOUEMHP-NRFANRHFSA-N 417.550 2.336 10 20 HECD CCO[C@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803679678 VEFUIQWGIFJLCW-RTWAWAEBSA-N 417.550 2.382 10 20 HECD O=C(NCCCOC1CCCC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804019351 HIAHZXCEXRLHHK-IBGZPJMESA-N 404.507 2.365 10 20 HECD CC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)S1(=O)=O 804990385 XXLXFCVLOMSGTC-GPMSIDNRSA-N 409.552 2.191 10 20 HECD Cc1cnccc1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805726425 HDVJVDRZQTYEEC-INIZCTEOSA-N 418.444 2.393 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1C[C@@H](OC)C1(C)C 809124179 XLPPKOFWOGFUQW-LSDHHAIUSA-N 413.312 2.433 10 20 HECD COc1ccc(O)c(CNc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1 809680395 SIVJBYPXPBCPTD-UHFFFAOYSA-N 408.476 2.042 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnn(-c4ccccc4)c3)nc12 918908749 MUFSDPFFJQEEEB-UHFFFAOYSA-N 407.386 2.154 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ncoc3[C@H]3CCCO3)CC2)cc1 1116070342 JDXWMPJNHUQIKT-LJQANCHMSA-N 414.506 2.477 10 20 HECD NC(=O)[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1 1263064505 CXLMDZRBOZQLHY-GOSISDBHSA-N 402.882 2.202 10 20 HECD COC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1319832910 RRSLEGFEWUDZID-OCCSQVGLSA-N 424.500 2.326 10 20 HECD CC1=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CCO1 1817694587 FWQOWOIKHMLGCG-HNNXBMFYSA-N 413.434 2.216 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCC(CNC(=O)c4cnn(C)c4)CC3)ccc21 726710138 XKTRROYADCPWKA-UHFFFAOYSA-N 424.549 2.154 10 20 HECD Cc1cccc(NC(=S)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 727979621 RPWJAKILYRSART-UHFFFAOYSA-N 419.576 2.245 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(CC(C)C)C3)cc2F)CC1 730194964 SXOTWTQVQZFXRJ-SFHVURJKSA-N 404.530 2.088 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NCCS(=O)(=O)NC[C@H]2CCCCO2)cc1 732030785 ROEIOVXVFGCOEC-HXUWFJFHSA-N 419.547 2.312 10 20 HECD COc1ccc(O)c(CNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c1 734015257 DAJSYIHUKYXKQU-UHFFFAOYSA-N 406.504 2.311 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 734065470 BWAJZSAJYRJWIY-INIZCTEOSA-N 412.490 2.102 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[S@](=O)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 736653541 PRZNNLORADBYFK-SVPAVIKBSA-N 411.543 2.490 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)COC4)c2)CC1 740609110 CROKIULYZXKTDK-UHFFFAOYSA-N 401.488 2.219 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)c3cccs3)cc2)C1 741081417 QDSMWZRSUMWXPA-AEFFLSMTSA-N 416.547 2.373 10 20 HECD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)N(C)Cc2ccccc2O)c1 751235961 OSSAHTPYMVLUTQ-MDZDMXLPSA-N 421.471 2.416 10 20 HECD Cc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 752383168 XFZOIZUKCJNZEN-VXGBXAGGSA-N 406.483 2.459 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(N4CCOCC4)nc3)CC2)cc1F 753738091 LRMGLJALUVDUAQ-UHFFFAOYSA-N 400.454 2.028 10 20 HECD CO[C@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H]1OC 753806007 IIQKWYVRQTWUCR-QTJFZDIUSA-N 408.454 2.135 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCOCC3CCOCC3)CC2)cc1F 753920123 ZOMKRSPZLLFZKK-UHFFFAOYSA-N 409.502 2.499 10 20 HECD C[C@@]1(c2cccc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2)NC(=O)NC1=O 768957869 SPGUXHVHOWAXLF-QFIPXVFZSA-N 424.526 2.224 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](C(C)(C)C(=O)OC)C3)nc12 772369379 FTWROJMIZGHAJG-ZDUSSCGKSA-N 404.467 2.023 10 20 HECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1 773847164 PQOKTVQNOGHLIU-HNNXBMFYSA-N 407.478 2.161 10 20 HECD C[C@@H](Cn1cccn1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 774150299 UICNYYQNACRKLL-KRWDZBQOSA-N 409.490 2.276 10 20 HECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1cnn(CC(F)F)c1 777896300 SYPAOKMZKAUDAH-UHFFFAOYSA-N 402.492 2.180 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)CC2)cc1F 778685259 NSWYGYYJPPAWKE-UHFFFAOYSA-N 403.366 2.434 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cn4c(n3)CCCC4)n2)c[nH]1 779800450 ZYBJQQWQASPZFY-UHFFFAOYSA-N 407.477 2.258 10 20 HECD O=C(NCCN1CCCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 782972243 PSFSODQBLWFQNB-MRXNPFEDSA-N 412.481 2.278 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1 785421273 BKKOGPUESFSALD-IBGZPJMESA-N 422.529 2.037 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786655571 FQRHBQUJDSJNSL-OAQYLSRUSA-N 414.550 2.153 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4ccccc43)cc2)CC1 786657430 XWCMTDVONJTJMI-HXUWFJFHSA-N 406.486 2.097 10 20 HECD CCN1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1=O 786711210 YNUAUGNTMNBUBF-IYBDPMFKSA-N 406.502 2.203 10 20 HECD C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 787332246 ZNXBLWCYQJIMTB-RHSMWYFYSA-N 415.465 2.311 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2cnn(C)c2)nn1 788786542 HXCLFHLZMRQDNM-UHFFFAOYSA-N 407.478 2.378 10 20 HECD O=C(c1cccc(O)c1O)N1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1 790920804 DSZIFOXBNGKVCW-IBGZPJMESA-N 409.486 2.047 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)nc1 792400671 RZNMQTWWXAHOTK-UHFFFAOYSA-N 405.524 2.498 10 20 HECD CCN(CC)[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccco1 793850513 YUGHXJLVKZFKLO-HXUWFJFHSA-N 412.534 2.478 10 20 HECD COc1ccc(CNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c(O)c1 795358685 SCFAVKNCRDTQSU-UHFFFAOYSA-N 418.393 2.171 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccnc1 797833930 AGYQXXBZANPNKM-HXUWFJFHSA-N 401.532 2.372 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 803686853 IPAVSCPXHJQRPV-UHFFFAOYSA-N 411.502 2.361 10 20 HECD COCCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805024977 YMRPXNDTTVRQFE-OAQYLSRUSA-N 417.550 2.193 10 20 HECD C[C@@H](OC(=O)[C@](C)(O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 805581643 ZLYKKLGBZVEGJZ-SFDCACGMSA-N 407.422 2.493 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(N(C)C)cc1 807671689 SCUIUBMWZNPIPS-PBHICJAKSA-N 410.522 2.332 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1 807840364 AKXWDXYAURDJAD-KRWDZBQOSA-N 401.507 2.181 10 20 HECD CCO[C@H](CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 809139542 YNRWQIONDPRZSV-HXUWFJFHSA-N 405.539 2.049 10 20 HECD COc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(c4ccccc4O)CC3)CC2)cc1 856903316 NWNRKRIBAXSPCY-IBGZPJMESA-N 424.545 2.260 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)S(C)(=O)=O)c2C)cc1 919344903 GGJQNEBWZOILOM-AWEZNQCLSA-N 421.471 2.040 10 20 HECD CS(=O)(=O)Cc1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919971446 YNJKVKYXRSOSEP-UHFFFAOYSA-N 420.506 2.261 10 20 HECD CCN1C(=O)c2ccc(C(=O)Nc3c(Cl)ccc4nonc34)cc2S1(=O)=O 1117549043 ZWAURECTPPOWDO-UHFFFAOYSA-N 406.807 2.293 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)n(C)n1 1795105789 HBXZZOFDKYCZJR-BTTYYORXSA-N 418.881 2.359 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccco1 1796932567 JVIHCEJLPOYHSV-ACHSLPGTSA-N 406.442 2.324 10 20 HECD CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846046 GLMCPCLZDRDUPX-SWLSCSKDSA-N 417.466 2.335 10 20 HECD CCc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1842358845 VVVCCWDVRMYGRA-RMKNXTFCSA-N 423.469 2.291 10 20 HECD O=C(c1ccccc1SCc1nnnn1-c1ccccc1)N1CCS(=O)CC1 111025490 VGNRQNSAHZJTKU-UHFFFAOYSA-N 413.528 2.159 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c(OC)c1 479450742 DXRPUJQGJGNUSO-UHFFFAOYSA-N 409.486 2.479 10 20 HECD O=S(=O)(Nc1cccc(N2CCCS2(=O)=O)c1)c1cccc2nsnc12 604117292 ROUCFJGYRHEHIS-UHFFFAOYSA-N 410.502 2.032 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 731454176 VIKXVIDXKDCXJT-UHFFFAOYSA-N 422.445 2.284 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4c(nc3O)CCCC4)cc2)C1 731577557 WUORUKYPMAFCFA-QGZVFWFLSA-N 408.502 2.298 10 20 HECD C[C@@H](NC(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732572717 XZSLDMFVVJPEKW-CZUORRHYSA-N 414.428 2.047 10 20 HECD CN(C[C@H](O)COCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1 732884234 HFCFFAYYSFMYKR-QFIPXVFZSA-N 413.518 2.242 10 20 HECD COC(=O)Cn1cc(S(=O)(=O)Nc2nc(-c3sc(C)nc3C)cs2)cn1 743046777 RADOLYWDCPQJKH-UHFFFAOYSA-N 413.506 2.054 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1 748465946 KYLQBNJRBVPEPT-UHFFFAOYSA-N 414.481 2.325 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc([N+](=O)[O-])c3N)CC2)cc1 749336158 XVDSLYILEROFRJ-UHFFFAOYSA-N 413.478 2.128 10 20 HECD CC(C)(C)OC(=O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751067027 QJIBXYJQRFLHMS-UHFFFAOYSA-N 412.489 2.326 10 20 HECD O=C(N[C@@H]1CCc2n[nH]cc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068588 QPKAQJIGVOZCKC-GFCCVEGCSA-N 418.500 2.265 10 20 HECD C[C@@H](CC(=O)OCc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 753852853 GPNORTHJKMABCJ-ZDUSSCGKSA-N 406.460 2.016 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753858547 WSBDMYFICYUQCP-MRXNPFEDSA-N 421.513 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1F 753932100 RKBWTCIXTUWZGA-HOCLYGCPSA-N 413.515 2.022 10 20 HECD Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1 755984042 HSORJLXHGJIXDU-UHFFFAOYSA-N 406.460 2.439 10 20 HECD Cc1cc(C(=O)COC(=O)C(C)(CO)CO)c(C)n1-c1ccc(OC(F)F)cc1 759835572 HCEUJBCLCJSLBD-UHFFFAOYSA-N 411.401 2.412 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCSC1 762051682 CJJAXSTYVZJAKY-MRXNPFEDSA-N 401.511 2.312 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)n(C)n1 765928218 WOUSGBUXFZWLSZ-UHFFFAOYSA-N 409.284 2.342 10 20 HECD COCCCN(Cc1ccc(N(C)C)cc1)c1c(O)nc(=O)n(CC(C)C)c1N 768192044 MYUFYOQJJQVKNW-UHFFFAOYSA-N 403.527 2.296 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cn1 769024051 RPECUMINVCGVFH-UHFFFAOYSA-N 407.518 2.177 10 20 HECD CCC[C@]1(C(=O)OCC)CCCN1Cc1cc(O)n2ncc(C(=O)OCC)c2n1 770003227 QYOVZUOXTSNAJM-HXUWFJFHSA-N 404.467 2.309 10 20 HECD Cn1cnn(-c2ccc(NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)c1=O 771462495 SAWJCIJJGRJAIE-LJQANCHMSA-N 423.473 2.490 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3COCCN3CC(F)F)cc2F)C[C@@H](C)O1 771623877 QYNUCRXLSYDGDA-LBTNJELSSA-N 415.456 2.021 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(Cc3noc(C(C)(C)C)n3)CC2)c1O 774905539 QGZNNYCMSYOCIO-UHFFFAOYSA-N 405.455 2.307 10 20 HECD C[C@@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 777720579 HVEQOMGYUZDAQU-VGOFRKELSA-N 418.559 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOCc3ccccc3)CC2)cc1 778311214 PSXUPBZBJNIDFF-QXMHVHEDSA-N 423.513 2.233 10 20 HECD Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785980809 OMXLBQIJOSVZNV-UHFFFAOYSA-N 408.502 2.456 10 20 HECD COC(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787325965 GMHVYIQNJYRNDG-UHFFFAOYSA-N 410.474 2.463 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)Cc3csc(C)n3)cc2F)CC1 790361668 ZYWHOZPGEMYBAS-UHFFFAOYSA-N 412.556 2.352 10 20 HECD CN(C)c1ccc(CNC2CCN(CCS(C)(=O)=O)CC2)c(C(F)(F)F)c1 792962109 XOCBOLXHLWLUNX-UHFFFAOYSA-N 407.502 2.370 10 20 HECD Cc1n[nH]cc1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248361 AHKJRORYDHCUDD-INIZCTEOSA-N 423.539 2.328 10 20 HECD CNC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCO1 799994154 NSAFBLIQKQSTBF-KDOFPFPSSA-N 408.930 2.233 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1 801242039 NOPXCIALZUHEHC-CQSZACIVSA-N 418.471 2.083 10 20 HECD C[C@@H](c1cccnc1)N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806278121 NGYSCESZAQTNFL-HNNXBMFYSA-N 419.576 2.042 10 20 HECD Cc1cccc(C)c1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 806449419 FWGZEQCTJMMBSN-UHFFFAOYSA-N 409.530 2.457 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@]3(O)C[C@H]4CC[C@H]3C4)cc2)C1 813594865 OGHNVYFFAAOXRI-YWNPBTLJSA-N 414.550 2.129 10 20 HECD Cc1cc(C(=O)N[C@H]2CCCc3nc(O)c(C(N)=O)cc32)c(C)n1-c1ccccn1 916159541 GYLWZZSXFSXUIW-KRWDZBQOSA-N 405.458 2.496 10 20 HECD CC(C)C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 917355970 PPKUQKOMRAFJCK-BBWFWOEESA-N 400.475 2.122 10 20 HECD CCC[C@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1=O 917836354 LTGMWAGLXZHKLJ-WDSOQIARSA-N 414.550 2.042 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(c2ccccc2O)CC1 918217549 FTXJDZFCDLFBBU-UHFFFAOYSA-N 414.481 2.400 10 20 HECD COc1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1OC(C)C 919813029 RKVOZJSYFAGDHA-UHFFFAOYSA-N 408.476 2.490 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1 920195486 TZLCEHQTNSPFQK-UHFFFAOYSA-N 422.485 2.127 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](NC(C)=O)c1cccs1 1320394634 SZWYKQAONFFRMW-GJZGRUSLSA-N 420.487 2.017 10 20 HECD NC(=O)[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1357127659 HFVGWKMRVWPQEN-GOSISDBHSA-N 420.872 2.342 10 20 HECD Nc1ccccc1/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600663 XRKMMTJBQJDKPB-ORIYUZMUSA-N 408.458 2.040 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C23CC(C2)C3)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998116 IRMTUYUZKHNUPU-BAQLXYBTSA-N 408.458 2.008 10 20 HECD CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CCC1 1816720239 HSSLRWLOQGGCKM-NSHDSACASA-N 402.476 2.365 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccnc2)CC1 1827202105 QPIKUKCXGKZLFG-LJQANCHMSA-N 424.501 2.364 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CC2Cc3ccccc3C2)C1 1847114898 WMGFYVCNLXWGLC-UHFFFAOYSA-N 407.470 2.115 10 20 HECD C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848269300 NBRFYCPNGHNWGI-RCBQFDQVSA-N 418.881 2.099 10 20 HECD COC(=O)c1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(OC)c1 6533427 FCQIVQKALSCCPQ-UHFFFAOYSA-N 414.458 2.218 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O 195683678 LFCRQUZLFCUGGL-GJZGRUSLSA-N 401.454 2.313 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 248052209 NPQOILKMUVTZGP-YHDSQAASSA-N 407.514 2.442 10 20 HECD C[C@@H](Nc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1)c1ccc(N(C)C)cc1 302760109 JWNVMRYLONDOOW-OAHLLOKOSA-N 402.520 2.191 10 20 HECD Cc1c(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)n(C)c2ccccc12 576732095 NAWALQGQDUBBNR-KXNSMUHISA-N 413.518 2.288 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cccc4c3COC4=O)CC2)cc1 726600546 AUJHIRZHHCXFOS-UHFFFAOYSA-N 402.472 2.313 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c(O)c1O 727004478 WIICSZQWYLSODZ-AWEZNQCLSA-N 400.431 2.427 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cc2)C1 727941058 QUYCDFUBGIBZAV-ZWKOTPCHSA-N 410.522 2.201 10 20 HECD C[C@H](NC(=O)CNC(=O)N1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 732277066 DEGKTNPVJMTVBQ-SFHVURJKSA-N 422.529 2.468 10 20 HECD CN1CCC(N2CC[C@H](NC(=O)NCc3ccc(N4CCSCC4)cc3)C2)CC1 734269626 IOBIUYJPJCXNDJ-IBGZPJMESA-N 417.623 2.208 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](OCCO)C1 734485691 PYGBMWRSPFDWTQ-WBVHZDCISA-N 422.481 2.262 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(Br)cc2)c1 735326734 PGIZHYXGUXRACZ-UHFFFAOYSA-N 413.293 2.499 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1OC 739937372 XCHAMWFUKUZNGB-UHFFFAOYSA-N 420.487 2.001 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(N2CCCNC2=O)c1 743883304 KAVXTUXMXXPCHJ-UHFFFAOYSA-N 421.501 2.461 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)cc2)C1 743895309 KYZYEJIGQHATIQ-QGZVFWFLSA-N 419.485 2.125 10 20 HECD C[C@@H]1CC[C@@H](CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)O1 745708369 KTFZTZWQUSQKKI-WBVHZDCISA-N 408.470 2.169 10 20 HECD COc1cccc(CNC(=O)NCc2ccccc2OCCN2CCOCC2)c1O 745784711 YWBMFFBNMNDZNJ-UHFFFAOYSA-N 415.490 2.111 10 20 HECD O=C(CCN(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)NCC(F)(F)F 751477249 AMBQSHKMDYQZCA-CQSZACIVSA-N 403.401 2.151 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc(C(C)(C)C)nc3)CC2)cc1F 754212652 NWTJYMPMLDMPJU-UHFFFAOYSA-N 415.469 2.209 10 20 HECD CC[C@@H](CN1CCCC1)NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760127040 BVWSDHGIIDWLBY-KRWDZBQOSA-N 420.554 2.418 10 20 HECD COc1ccc(OC)c(CCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 760814471 BNEBVOIRWVRICL-UHFFFAOYSA-N 408.476 2.144 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C(F)(F)F)nc1 761898104 ODFQIRDZSKXOTQ-UHFFFAOYSA-N 408.380 2.192 10 20 HECD Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 764383720 VNIXCNKYBMFSEY-UHFFFAOYSA-N 412.469 2.128 10 20 HECD C[C@H](NCc1ccc2c(c1)CCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1 765607980 GHNZUVGTNPXBAC-INIZCTEOSA-N 402.516 2.493 10 20 HECD O=C(Cc1cc(F)c(F)cc1F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 767885063 XUHGBZYTCFJTAQ-UHFFFAOYSA-N 412.433 2.198 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 769320446 PKWSKUXKDAJKLT-IFMALSPDSA-N 414.594 2.336 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(-n2cccn2)c1 769934197 PKFGOMWTFUNDCL-ZDUSSCGKSA-N 400.460 2.440 10 20 HECD COC1(CO)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 770262517 VFUUBDKPCYPCDL-HOTGVXAUSA-N 409.502 2.122 10 20 HECD CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775260815 QBGXXCKHLXKJSR-PXNSSMCTSA-N 403.523 2.118 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@H]4c5ccccc5CCN4C3=O)CC2)cc1 777628605 SGEYWBOEHUJCHG-JOCHJYFZSA-N 420.513 2.379 10 20 HECD O=C(NC[C@@H]1COC2(CCOCC2)O1)N(Cc1ccccc1O)C[C@H]1CCCO1 777757324 YSVQUKUXULQVOH-QZTJIDSGSA-N 406.479 2.005 10 20 HECD CC(C)CCn1nccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 779468476 DDELYXRNJGHMQR-UHFFFAOYSA-N 419.551 2.486 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1F 781828760 YPNHEUULNNTZEY-IBGZPJMESA-N 400.498 2.458 10 20 HECD CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785296053 BFBDVGOVVJPCNR-KGLIPLIRSA-N 413.474 2.312 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 785298598 WNJNBIMZRAQPRO-ZCFIWIBFSA-N 404.291 2.479 10 20 HECD CCOC(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 785674341 KTOPYPYGUFNPDR-UHFFFAOYSA-N 416.430 2.337 10 20 HECD CCN1CCCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1=O 786711208 YNUAUGNTMNBUBF-HZPDHXFCSA-N 406.502 2.203 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCN3CCC[C@H](C)C3)cc2)CC1 787673185 YYGUBQOLPVRLNS-IBGZPJMESA-N 400.567 2.387 10 20 HECD CCOC(=O)C1(CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 789188525 WZCBIPHZACLZCK-UHFFFAOYSA-N 418.490 2.011 10 20 HECD COc1ccc(O)c(CNC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1 789772671 CDFORCLGQDVRSB-SFHVURJKSA-N 402.466 2.347 10 20 HECD CC[C@H](NC(=O)NCc1ccc(OC)cc1O)c1ccccc1OCC(=O)NC 792887953 TYNLJGRQGMLXHX-KRWDZBQOSA-N 401.463 2.476 10 20 HECD COc1ccc(CNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c(O)c1 792919941 POUGSSADIGJMAV-IBGZPJMESA-N 413.474 2.309 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795397320 PQHFZBMHQXSBRS-DOTOQJQBSA-N 418.538 2.165 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@@H]3C[C@H](C)O)CC2)cc1 796382877 JIJHIIFBRHRCET-NNWRFLSQSA-N 405.583 2.194 10 20 HECD CON(C)S(=O)(=O)c1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 797609875 CJKVKQOBAXOECG-LBPRGKRZSA-N 409.464 2.032 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 806420894 KFCMRLBDEMLLEA-LJQANCHMSA-N 409.486 2.443 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COc4ccccc43)cc2)C1 808368323 ZNGLPFYKFLOHEE-QZTJIDSGSA-N 408.502 2.364 10 20 HECD CCCCN(C)C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 811929579 HCXJSMJAEPQZST-MJGOQNOKSA-N 403.571 2.308 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNc2ccc(S(=O)(=O)N3CCC[C@H]3CO)cc2)c1 864041299 RXLNYEXSGXKTRZ-INIZCTEOSA-N 407.448 2.058 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918440311 QANGZGIAYUWEOR-UHFFFAOYSA-N 412.515 2.453 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)C2CC2)cc1 918455695 MJWCNVUJHGWNNV-UHFFFAOYSA-N 415.515 2.286 10 20 HECD O=C(CN1C(=O)CCOc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 919968352 GJWNFACYQHALMV-UHFFFAOYSA-N 423.513 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1 920251921 UVQOOHUTYSZAOR-QXMHVHEDSA-N 422.485 2.497 10 20 HECD CCOc1ccc(N2CCN(CC(=O)N(CCC(N)=O)Cc3ccccc3)CC2)cc1 1116415596 BULXXIPLPSSANA-UHFFFAOYSA-N 424.545 2.112 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(=O)c2ccc(F)cc2o1 1323575211 NKNGMAHMBHKCJV-AWEZNQCLSA-N 415.373 2.248 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC=CCC1)C2)c1cc(O)c(O)c(Cl)c1 1799768980 IQPOHSRNYGKWPF-FRQROOTJSA-N 420.893 2.311 10 20 HECD O=C(CCc1ccc[nH]1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543418 CGCFKYYLOUVBSL-UHFFFAOYSA-N 412.490 2.299 10 20 HECD CO/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428561 WDLDYMPMRBGEHQ-CLVCIHKQSA-N 403.479 2.276 10 20 HECD C[C@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)CC1(F)F 1828046814 IPKJOADHHGTPDM-HUTHGQBESA-N 424.429 2.220 10 20 HECD CC[C@H](C)CC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833394717 YAAPGIWRCBSWBU-HNNXBMFYSA-N 418.538 2.114 10 20 HECD CN(C)c1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1846505935 PSEHVHLJDKIPQX-UHFFFAOYSA-N 424.501 2.009 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CC(F)(F)C1 1847333788 VOWBPNOKJIXPAC-BZRVQBCOSA-N 408.401 2.064 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(CCC(=O)O)cc1 13313652 UKOAFSMUPLSPPQ-UHFFFAOYSA-N 418.515 2.361 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnn4c(C)cc(C)nc34)CC2)cc1 31219508 ABPJFVZMJMCWQF-UHFFFAOYSA-N 422.533 2.297 10 20 HECD CCCN(CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@H]1C)Cc1ccccc1O 110076263 OBFPJUIDXMFDHE-OAHLLOKOSA-N 417.531 2.229 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O 437028426 YGLDBRLKQYRDOO-UHFFFAOYSA-N 418.453 2.115 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3nc(-c4ccccc4)oc3=O)CC2)cc1 726560777 MUNVILKKDWBOKN-UHFFFAOYSA-N 408.458 2.297 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc1 726628317 YHFDKAHJAUEDIG-UHFFFAOYSA-N 403.429 2.488 10 20 HECD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NCCCSc1nccs1 733973245 WSFUUEIONPGYBH-UHFFFAOYSA-N 421.516 2.388 10 20 HECD O=C(CCNS(=O)(=O)c1ccccc1F)NCCCSc1nccs1 733973442 KBVRFYIFAYKWOO-UHFFFAOYSA-N 403.526 2.249 10 20 HECD COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741090691 LVGAMONPGRQIDY-HKUYNNGSSA-N 400.523 2.136 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741100290 XSUXIJGBNFYBOL-UHFFFAOYSA-N 413.499 2.111 10 20 HECD CN(Cc1nccn1Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 743731679 UQEWIHFTOZQBOV-UHFFFAOYSA-N 414.487 2.281 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCCC[C@H]3CCNS(C)(=O)=O)ccc21 746982647 HCIMZNSWUQROKD-SFHVURJKSA-N 408.568 2.072 10 20 HECD CCc1nc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)co1 753483322 FGFWIDGFKMFXQT-UHFFFAOYSA-N 410.453 2.423 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3ccnc(-n4cccn4)c3)CC2)cc1F 753833519 ZMUIJVJBEZRVIF-UHFFFAOYSA-N 410.453 2.447 10 20 HECD COC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 757634332 OUNCMDMXHRUCDA-UHFFFAOYSA-N 401.438 2.448 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3n[nH]c(C(C)(C)C)n3)CC2)cc1 758189533 AWIHTBPIBJKQMX-INIZCTEOSA-N 405.568 2.386 10 20 HECD COc1cc(N2CCN(c3nnnn3-c3ccc(C)cc3)CC2)cc(OC)c1OC 758940206 JTHLSQYHARPNCZ-UHFFFAOYSA-N 410.478 2.323 10 20 HECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCCCSc2nccs2)C1 759578408 FMNBEQMDZXSADM-ZDUSSCGKSA-N 405.549 2.302 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCc1ccc(N2CCCC2=O)cc1 759594975 OVIKRTKKCIVUKF-POHAHGRESA-N 410.426 2.097 10 20 HECD C[C@H]1CN(CCCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCCO1 764279393 QHFGGVJZFCMERZ-RBUKOAKNSA-N 404.555 2.384 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 764407976 GAZNBNVVLJOVRQ-AWEZNQCLSA-N 418.454 2.380 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 764952816 AQUAONLCHRXQCU-IBGZPJMESA-N 419.522 2.370 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(OC)ccc4O)n3)CC2)cc1 771069571 XBFFHMGPHMGDED-UHFFFAOYSA-N 424.457 2.351 10 20 HECD C[C@H]1[C@@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 771404438 JBFRSNQCTIBNEF-QWHCGFSZSA-N 409.533 2.419 10 20 HECD Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 775286439 RPQXGWFIACLWNV-UHFFFAOYSA-N 400.434 2.122 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3C3CCOCC3)cc2)C1 777719243 ANRXEXQRFLTJOF-FPOVZHCZSA-N 414.550 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CCc3cccn3C)CC2)cc1 778295083 NHCBLXZQPIKMOP-HSNDNRACSA-N 424.545 2.376 10 20 HECD CC1CCN(S(=O)(=O)c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2)CC1 778918738 ULJPMNSGVBIDQH-UHFFFAOYSA-N 404.488 2.448 10 20 HECD COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)/C=C/c1ccc(O)c(O)c1 779483034 XMEYLJPDSLFEDT-XBXARRHUSA-N 411.458 2.146 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(O)cc1O 780908285 YBBQFOUDMIJCRN-UHFFFAOYSA-N 423.448 2.284 10 20 HECD COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786762552 TUDWVYAUECCAQN-OAHLLOKOSA-N 415.465 2.165 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cccc(N2CCOC2=O)c1)c1ccc(N(C)C)cc1 789573835 WJYOUOVLHCSGHU-OAHLLOKOSA-N 410.474 2.203 10 20 HECD COC[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)[C@H]1CCCO1 791042137 QNCQCEUXDOEECV-DLBZAZTESA-N 424.409 2.294 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 793862860 LIKWEFJPIIZDHS-LJQANCHMSA-N 422.504 2.461 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 797710010 PUILLACDUXRJMQ-DZASIIFFSA-N 423.485 2.118 10 20 HECD C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 799316903 NIJMYMWKQYEULT-QGZVFWFLSA-N 413.493 2.416 10 20 HECD CCCCN(C)CCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 804031897 WONZAZKFFNSYGZ-UHFFFAOYSA-N 414.344 2.351 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H](C)N3CCCCC3)CC2)cc1 804319069 XJTDSHVIFGQNHA-GOSISDBHSA-N 416.566 2.161 10 20 HECD COCCN1CCC[C@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 804352018 NAFOAWJHGZYKJC-FQEVSTJZSA-N 417.550 2.281 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCCN3CCCC3)cc2)CC1 805026368 LAFYVNRHUMHSBO-UHFFFAOYSA-N 400.567 2.483 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CC3(N(C)C)CCC3)cc2)CC1 805026667 VZGAPCJECCLVPH-UHFFFAOYSA-N 400.567 2.482 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21 807286986 GANJMMKSAQUNMT-FGTMMUONSA-N 403.573 2.175 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](c4ccccc4)OC3=O)cc2)C1 809617366 OJSIXVTYXIBQBC-NRSPTQNISA-N 421.497 2.309 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNCc3cnc(C4OCCO4)s3)cc2)C1 809632317 NYEBIWPIEHLVGI-HNNXBMFYSA-N 402.520 2.180 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(C(C)=O)ccc3OC)CC2)cc1 811823879 YMHWXUQSTUJXTL-HXUWFJFHSA-N 414.502 2.468 10 20 HECD COC[C@H](C)[C@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 812811644 YTMBXCMYUIEOTE-HOTGVXAUSA-N 402.495 2.356 10 20 HECD COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914903544 NSNQJFPEJCRDAT-MRXNPFEDSA-N 413.474 2.446 10 20 HECD CC[C@@H](C)[C@@H](N)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715569 UHYGTSNEZOCKFL-LHNVCGPYSA-N 409.914 2.376 10 20 HECD CCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CCC1 1804333581 SKVDMZWNEFJOQT-BTTYYORXSA-N 409.577 2.065 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c[nH]1 1817845877 ZVKKIWZIRHGULZ-HNNXBMFYSA-N 410.434 2.472 10 20 HECD C=CCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 60749534 OPYDIHJJSHVRGN-UHFFFAOYSA-N 406.486 2.240 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(c4cnn(C)c4)C3=O)ccc21 522737350 JLDMGIAIYYETLB-LJQANCHMSA-N 409.490 2.173 10 20 HECD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)Nc1cc(S(C)(=O)=O)ccc1C 685830634 GDWWYIPRIKAJPV-UHFFFAOYSA-N 418.496 2.355 10 20 HECD C[C@@H]1CCC[C@H](OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 733020784 HQAQQBJFVLEYKC-AEFFLSMTSA-N 422.497 2.417 10 20 HECD CC1CCN(c2cccc(NS(=O)(=O)c3ccc4[nH]c(=O)c(=O)[nH]c4c3)c2)CC1 740609032 AKYQICFVZROVRC-UHFFFAOYSA-N 414.487 2.254 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(C)c1 741097805 ZAPOYSLGECKXSU-UHFFFAOYSA-N 423.469 2.178 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@]3(C)CCCC[C@H]3O)CC2)cc1 748617262 XVVOHGSIWQQOLS-GGAORHGYSA-N 418.582 2.448 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)o1 751388204 FIUOZBCXILXSSP-HNNXBMFYSA-N 408.476 2.023 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3(CO)CCCCC3)CC2)cc1 752832277 GMBJKBAMJCQADW-UHFFFAOYSA-N 418.582 2.449 10 20 HECD Cc1nc2n(n1)CCN(C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 753007025 MFUBPUCBAWOFLN-CQSZACIVSA-N 406.437 2.382 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cc1 756153527 RILUBQUEWCFPKH-UHFFFAOYSA-N 422.460 2.357 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@H](O)c3ccccc3)CC2)cc1 758231677 PVHOUDDDUYNTPH-FYYLOGMGSA-N 422.529 2.157 10 20 HECD CCOC(=O)C1=C(COC(=O)c2cccc(O)c2O)NC(=O)N[C@H]1c1ccccc1 758559876 GTESSOODMFUQBF-KRWDZBQOSA-N 412.398 2.126 10 20 HECD COc1cc(N2CCN(CC(=O)Nc3ccc(O)cc3)CC2)cc(OC)c1OC 759873631 XGEVCFPXFHCKSO-UHFFFAOYSA-N 401.463 2.179 10 20 HECD COc1ccccc1-n1c(C)nnc1SCC(=O)NCCc1ccc(O)c(O)c1 762261430 LMPFKUYUGDEBML-UHFFFAOYSA-N 414.487 2.447 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc3c(c2)CCCN3C)cc1 763654312 GZFDKONMZSXUKA-UHFFFAOYSA-N 416.547 2.367 10 20 HECD COCCNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cccc3nonc23)c1 765083628 RXSUZEOGXAOFNU-UHFFFAOYSA-N 410.839 2.053 10 20 HECD Cn1cnnc1[C@H]1CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767757079 OLMSFHMFBOOTHR-LJQANCHMSA-N 415.453 2.366 10 20 HECD CS(=O)(=O)[C@@H]1CCCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 767780108 XZPHRTYBZHCJQV-GOSISDBHSA-N 411.593 2.349 10 20 HECD Cc1c[nH]ccc1=NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 767899909 AEJOCTANFWEOSV-UHFFFAOYSA-N 421.480 2.389 10 20 HECD CC[C@@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1=O 767942568 LKOOMTFKZOQYEA-KIMHZCHSSA-N 419.497 2.231 10 20 HECD COc1ccc2c(c1)OC[C@@H](NC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 768042050 XWKOLYIVXZQJHD-KRWDZBQOSA-N 415.465 2.474 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc(F)c(F)cc3F)nc12 768079696 WJXQSYYPFFOJHY-UHFFFAOYSA-N 409.320 2.315 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 770705300 KASOOYBJSIMWAD-MRXNPFEDSA-N 415.440 2.471 10 20 HECD CN(C)C(=O)COc1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771877999 MBKIPHSFCKCZTF-UHFFFAOYSA-N 417.849 2.481 10 20 HECD C[C@@H](NC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773020124 OAAUDCWXIPJRMY-OAHLLOKOSA-N 417.531 2.106 10 20 HECD COCC[C@@]1(NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCOC1 773949366 WWQOJUZQPLROLG-HSZRJFAPSA-N 408.454 2.186 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc(F)ccc3OC)nc12 775103322 IRPFAHWQHCDWFW-UHFFFAOYSA-N 403.366 2.045 10 20 HECD C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(c2ccccn2)CC1 775259696 XHRBQNLEPTUKQI-UXHICEINSA-N 423.561 2.306 10 20 HECD C[C@@H](NC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)c1ccc(N(C)C)cc1 775404486 MZXGHPIMERAXAL-QGZVFWFLSA-N 415.559 2.474 10 20 HECD CCc1nnc(-c2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2)o1 785296261 MYDRPWNQMLAXFR-LBPRGKRZSA-N 410.430 2.396 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cc1 785421063 ABROASRBSSKVIG-UHFFFAOYSA-N 420.966 2.428 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3nnn(CC4CCCC4)c3C)cc2)CC1 788774168 HIESXWZNMKZZJU-UHFFFAOYSA-N 424.549 2.375 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)cc2F)C[C@@H](C)O1 789823028 XUIMEBFTVMUXCR-KDEDHMBESA-N 415.509 2.216 10 20 HECD COc1ccc(S(=O)(=O)N2CC(NCc3c(O)ccc(Cl)c3F)C2)cc1 792174085 GHVXEZHVVBAMAZ-UHFFFAOYSA-N 400.859 2.356 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 792329962 GXPQXUOHJTWONI-MRXNPFEDSA-N 411.506 2.328 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793723453 WWRYVCBJXFGHRP-NZSAHSFTSA-N 414.550 2.090 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)NC(=O)Cc2ccccc2)c(O)c1 794390042 FPIALJGRUQJCQK-SFHVURJKSA-N 402.516 2.498 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(Br)cc(C(N)=O)c1 799539821 BOWJLNCUUZWAKT-UHFFFAOYSA-N 415.265 2.453 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)Cc3ccccc3)cc2)C1 799557119 TUAMKHAYQDYGEB-LEWJYISDSA-N 424.545 2.181 10 20 HECD COc1ccc2c(c1)CN(C(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)CC2 803302098 HFDLWLCPWSWNFF-KRWDZBQOSA-N 423.513 2.294 10 20 HECD CC[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc2n1CCCCC2 804102445 YNUQZRFTODUXRP-SFHVURJKSA-N 412.538 2.296 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nccn1CC(F)(F)F 804565084 XHXFJBMXAGLJAY-UHFFFAOYSA-N 411.428 2.176 10 20 HECD NS(=O)(=O)c1ccc(CCNC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 806282631 ONZHCTKQFTZVPB-UHFFFAOYSA-N 418.302 2.388 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2csc(N(C)C)n2)C2CC2)cc1 806662347 BZCFPMALYNRLOM-UHFFFAOYSA-N 401.536 2.083 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCN(c2ncccc2F)CC1)c1ccc(N(C)C)cc1 807671835 TVUIHXPXDCUIAB-MRXNPFEDSA-N 413.497 2.203 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3COc4ccccc43)CC2)cc1 808250341 YTBGCNREBJMYMJ-GOSISDBHSA-N 410.518 2.293 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 809240315 VIKKPKAJLOHILS-QZTJIDSGSA-N 401.507 2.084 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)ccc1O 917913557 LGGDNAAFAVZAID-UHFFFAOYSA-N 409.489 2.332 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 918703242 UHMJBSYUMMKXDE-ZIAGYGMSSA-N 421.494 2.017 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c1 919811989 UYXNNBGUGOSJTM-UHFFFAOYSA-N 423.535 2.019 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920880168 BATWSXWYBJZOPQ-INIZCTEOSA-N 406.486 2.419 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)C2CC2)c1 1254760652 FELGRRPHWCNWNP-KRWDZBQOSA-N 412.442 2.351 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(=O)n(C)c4ccccc34)cc2)CC1 1344390884 FAUCYJUAGRKRDS-UHFFFAOYSA-N 418.497 2.137 10 20 HECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)C1CC1 1813719121 XDHUYVRFAAKSRT-ASZUZNPLSA-N 423.469 2.328 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 108790272 NUSUWTFENGGXOY-HXUWFJFHSA-N 423.579 2.076 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)n(C)c2ccccc12 571952593 IZZJNFCWFOBNHV-KRWDZBQOSA-N 412.534 2.114 10 20 HECD COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 726611773 SRGYEHUMADKKQB-ZOBUZTSGSA-N 422.501 2.469 10 20 HECD CCOc1ccc(N(Cc2ccccc2O)C(=S)NCCNS(C)(=O)=O)cc1 727068092 XKNRJOVRFQCBDD-UHFFFAOYSA-N 423.560 2.221 10 20 HECD CCN(C)C(=O)c1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 729178393 KTVYMGFCGPSHCS-UHFFFAOYSA-N 415.515 2.266 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)Cc1ccccc1 729597495 QNROBKDAXCFZKH-LJQANCHMSA-N 401.482 2.190 10 20 HECD CC1CCN(c2ccc(CNC(=O)COCC(=O)NCc3cccnc3)cc2)CC1 731194738 VMWCKLAILWJTNL-UHFFFAOYSA-N 410.518 2.267 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCCN1CCOC1=O)c2[N+](=O)[O-] 733386043 OHGMQULYAMKUGG-UHFFFAOYSA-N 424.365 2.369 10 20 HECD CC(C)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)NC(=O)OC(C)(C)C 734558399 SMMNZFSORJQOLS-AWEZNQCLSA-N 415.512 2.043 10 20 HECD Cc1nccn1CCCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 743632066 XQUZEFXYNCOAER-LJQANCHMSA-N 412.538 2.173 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ncn(Cc2ccccc2)n1 743955379 JAZSVVHQYYKSAD-UHFFFAOYSA-N 405.458 2.166 10 20 HECD C[C@H](c1ccncc1)N1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 749296182 GICFZPRCSYUFQW-CQSZACIVSA-N 418.519 2.114 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC3(O)CCCC3)cc2F)C[C@H](C)O1 752142840 MGXCTTHNAFHLRJ-IRXDYDNUSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@@H]3CCN(C)C[C@@H]3C)CC2)cc1 754365169 XGBLXBAMANEUHK-SIKLNZKXSA-N 417.598 2.189 10 20 HECD O=C(O)c1cc(Br)cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 762473438 LBIUQLIBRWQWDP-UHFFFAOYSA-N 416.205 2.352 10 20 HECD Cc1ccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cn1 764884917 IRIYMRMUCNMJCW-NVNXTCNLSA-N 405.526 2.439 10 20 HECD C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(-n2cnnn2)cc1 765257124 WONIATYDOADGGI-LPHOPBHVSA-N 405.506 2.215 10 20 HECD CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCCCSc2nccs2)c1 768126557 UMBNBCFRYSZNQJ-UHFFFAOYSA-N 401.535 2.011 10 20 HECD CCCCCCn1cc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c(O)nc1=O 769653111 GEGFCMYVPLWZDO-UHFFFAOYSA-N 422.551 2.382 10 20 HECD COC(=O)C1=S=c2nc(/C(Cl)=C/c3cccc4nccn34)nc(O)c2=C1C 771281165 JSMZIMCCIHAQIK-FLIBITNWSA-N 400.847 2.080 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Oc3ccc(NC(C)=O)cc3)CC2)cc1 778226675 ICDQJJNYSFUSDO-VAWYXSNFSA-N 423.469 2.464 10 20 HECD Cc1cc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc2cccnc12 783693311 LJGSTTQLOWQMOA-UVTDQMKNSA-N 407.542 2.294 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCc2c(O)cccc21 789742070 CEKTXIBWRFCUCE-HXUWFJFHSA-N 414.527 2.363 10 20 HECD C[C@H]1CC(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H](C)C1 789835085 NYTUIJQUWLVGEQ-HUUCEWRRSA-N 405.514 2.344 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC(OCC2CC2)CC1 789854479 AXQXDGWFNRVHQR-UHFFFAOYSA-N 417.575 2.274 10 20 HECD Cn1nccc1[C@@H]1CCC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 790486160 MRUUHDFTVBFYPC-MOPGFXCFSA-N 402.564 2.471 10 20 HECD CCOC(=O)[C@H](C)[C@H](C)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 801541677 UCTGTMIUEZGMLF-NXOAAHMSSA-N 423.529 2.233 10 20 HECD C[Si](C)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 802012334 KIOMRPGRYVYNGE-IBGZPJMESA-N 424.621 2.342 10 20 HECD CCn1c(C(=O)N2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802060796 MKCKJBDANQOCSB-UHFFFAOYSA-N 402.474 2.008 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc4ccccn4n3)CC2)cc1 804378053 ZWCHXMZZYUAWKB-KTKRTIGZSA-N 405.458 2.186 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(N(C)C)cc1 807671687 SBYYJZDKSNSXCE-INIZCTEOSA-N 400.548 2.336 10 20 HECD Cc1cc(C(F)(F)F)nn1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 810182908 LAOGZOSHUJAMOZ-HNNXBMFYSA-N 423.439 2.228 10 20 HECD NC(=O)[C@@H]1CCCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 920428316 LWZYGALSEGFEIM-XTCQQWIJSA-N 423.585 2.453 10 20 HECD O=C(CSCCN1CCOCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1115821475 LYQCUCSPMCLSRF-UHFFFAOYSA-N 410.495 2.466 10 20 HECD Cc1cc(CC(=O)NC[C@H](O)CN2CCCC2=O)c(C)n1-c1ccc(Cl)cc1 1319394786 RCFRRJPNDHPILO-IBGZPJMESA-N 403.910 2.390 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc(C)c(C(N)=O)c3)CC2)cc1 1319825462 ZMWTULOAMQXADC-UHFFFAOYSA-N 403.504 2.004 10 20 HECD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1341407164 QQGPVTVLMKSWRM-HXUWFJFHSA-N 423.579 2.328 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C1CCCC1 1800118705 TYAYVDXODRGYLB-PYNLGSQFSA-N 421.588 2.231 10 20 HECD O=C(c1ccnc(F)c1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810547613 VMAKTYXGWXBRFY-UHFFFAOYSA-N 414.437 2.186 10 20 HECD O=C([C@@H]1[C@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250185 SSXKCNWLKYPZPE-FHWLQOOXSA-N 423.494 2.198 10 20 HECD CCOC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)NC(=O)N[C@H]1c1ccco1 109998421 BZOCRWAFWMFAOY-HNNXBMFYSA-N 416.386 2.027 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(OC(F)F)c1 147124660 IIFMWASESUTLAD-UHFFFAOYSA-N 405.401 2.380 10 20 HECD CCN1CCC(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 726087521 MRUPNWIDDHEJTF-UHFFFAOYSA-N 417.598 2.238 10 20 HECD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NCc2ccc(N(C)C)c(F)c2)c1 727602693 XXGSXLGYIPBJBA-CYBMUJFWSA-N 408.499 2.360 10 20 HECD COC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 728467279 JMJAAFZFIGKNBA-KRWDZBQOSA-N 410.474 2.497 10 20 HECD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 728948497 BJSVMHARTYFMFW-CHWSQXEVSA-N 407.492 2.430 10 20 HECD COc1ccccc1-c1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 729529200 UGYUGCROXOCGSL-UHFFFAOYSA-N 402.432 2.415 10 20 HECD C[C@@H](NC(=O)N1CCN([C@H]2CCCN(C)C2)CC1)c1ccc(N2CCOCC2)cc1 734665487 XMQCOASUHTUQLS-KNQAVFIVSA-N 415.582 2.006 10 20 HECD COCCCn1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 737010605 ITZCTXRKXRBVMN-UHFFFAOYSA-N 401.511 2.450 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)CC(C)(C)C)CC2)cc1 746313135 YWLQIPVZBHAPCT-SFHVURJKSA-N 406.571 2.304 10 20 HECD CCN(CC)Cc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)o1 746876925 MYWIXDQVYNYUER-UHFFFAOYSA-N 419.547 2.286 10 20 HECD CCN(CC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)cc1 748305945 QSNAQDFHIZRZGV-MRXNPFEDSA-N 406.508 2.025 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CCS(=O)(=O)N(C)C)c2C)cc1 753877974 LGVAXOKHYZQKDX-UHFFFAOYSA-N 406.504 2.410 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3c3noc(C)n3)CC2)cc1 754015057 ZAEHMMOLOVIXMD-CTNGQTDRSA-N 415.538 2.097 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(F)c(F)c(O)c3F)CC2)cc1 755188769 MAMJXGUMYQMJKV-UHFFFAOYSA-N 409.408 2.370 10 20 HECD COCCCNC(=O)C1CCN(C(=O)NCCCSc2nccs2)CC1 759588888 FOBMVQOPLRFUSV-UHFFFAOYSA-N 400.570 2.200 10 20 HECD CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 761358504 HNSNRAZFKLYYKR-UHFFFAOYSA-N 413.493 2.370 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc([C@@H]2CCOC2)c1 761371290 FJGKWONNLMUSSG-HXUWFJFHSA-N 414.527 2.355 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O 762263183 AECLFBLRXFJRLQ-UHFFFAOYSA-N 406.394 2.460 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2cc(OC)c(C)cc2O)c(O)nc1=O 768446419 XDXGRCJFTBXZMA-UHFFFAOYSA-N 406.483 2.007 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(F)ccc3OC)CC2)cc1F 768971891 GAQPCXFTGOYSPD-UHFFFAOYSA-N 405.401 2.269 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC3CCN(C4CC4)CC3)cc2)C1 770299801 MPCHYDHRMSZWAV-LJQANCHMSA-N 413.566 2.062 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)/C=C\c1ccccc1 773750849 XIWNEMXUUYBNAU-KUGGDMIFSA-N 404.488 2.125 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1 775286415 IEHGMJUKEPAECR-UHFFFAOYSA-N 422.434 2.355 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1 775703428 OWAAOLKGADLBSG-GOSISDBHSA-N 408.458 2.343 10 20 HECD O=C(CN1CCC(O)(C(F)F)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 778309518 QMDXURRNHGALEM-UHFFFAOYSA-N 414.408 2.493 10 20 HECD COCc1ccccc1S(=O)(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 780407816 PMOUISBGIRRGME-UHFFFAOYSA-N 403.504 2.302 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3c(F)cccc3[N+](=O)[O-])c2)CC1 780407986 SIVSYEAHIZJWMJ-UHFFFAOYSA-N 422.438 2.203 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cccc1N1CCOC1=O 785293999 ISPDWWOYEPABGH-LBPRGKRZSA-N 413.430 2.049 10 20 HECD C[C@H]1CN(CCN(C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@H](C)O1 788882892 FJMTXHUHIIDYQK-CALCHBBNSA-N 422.545 2.037 10 20 HECD CSC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 789210795 UZXPLILQDVTQPN-OKILXGFUSA-N 410.511 2.494 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@@H](C)c3cc(OC)ccc3O)ccc2[nH]1 792345459 YWAKLDMIUQWIEA-NSHDSACASA-N 410.430 2.058 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2C[C@H](O)c2ccco2)cc1F 803664209 GOWIJQCTABNHCW-YJBOKZPZSA-N 403.454 2.216 10 20 HECD COC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803677047 DSGMPVKHFAUIAX-SFHVURJKSA-N 415.534 2.483 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CN1Cc1ccccc1 803688324 OTRSAVSHUDIKOG-XMSQKQJNSA-N 420.557 2.464 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN(C(C)C)C(C)C)CC2)cc1 804319206 KYWNKEYKNDRVAU-UHFFFAOYSA-N 418.582 2.405 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NCc2ccc(OC)cc2O)s1 805877967 CBFXNTOTNLVUOB-QWRGUYRKSA-N 407.496 2.277 10 20 HECD O=C(COC(=O)c1cnn(CCF)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808574055 VKMFOEUNCGVOSJ-UHFFFAOYSA-N 421.384 2.424 10 20 HECD CCn1ccnc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 813422122 RQZSZXHAPCQHQQ-UHFFFAOYSA-N 409.469 2.089 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3noc4c3CCCC4)CC2)cc1 813821400 TYUOGJAEAWXQPY-ZHACJKMWSA-N 424.501 2.083 10 20 HECD CCOC(=O)[C@H](CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)=O 816890934 CPGFPWAESPMJIS-CKEIUWERSA-N 408.470 2.214 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](C)[S@](=O)CC3)cc2F)C[C@@H](C)O1 821568968 RNQYUBVSJJLABH-LAFCVAKXSA-N 411.543 2.492 10 20 HECD CCN(CC)c1ccc(CNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)cc1 916502159 BVKPGHNQZVLKKE-UHFFFAOYSA-N 408.502 2.346 10 20 HECD CC(C)CN1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 916971012 QIVZNDCAXIOHRX-RTBURBONSA-N 420.573 2.329 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cc3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 917712119 HEMZVOJXUXQOGC-HZPDHXFCSA-N 424.480 2.274 10 20 HECD CC(C)(C)CCN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 917836837 FHMGYBUAWLUIEN-UHFFFAOYSA-N 420.573 2.332 10 20 HECD Cc1cc(C)n2nc(C)c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2n1 918371683 IRURHWWVBMZNLC-SFHVURJKSA-N 420.517 2.286 10 20 HECD CS(=O)(=O)Nc1ccccc1CC(=O)NCc1cccc(Br)c1O 1255876705 GTDGEJZMENFXRK-UHFFFAOYSA-N 413.293 2.385 10 20 HECD CCOC(=O)C[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1320484262 VQBJKJLADFZKTB-HKUYNNGSSA-N 416.522 2.016 10 20 HECD CC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C[C@@H]21 1786347365 OKECEKIFHIFGOY-BVSLBCMMSA-N 423.513 2.276 10 20 HECD CC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1806250620 SDSNLXXPMQJIBN-SUMWQHHRSA-N 417.849 2.055 10 20 HECD C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 140260297 UWFIVQCADHJRDE-CQSZACIVSA-N 404.492 2.053 10 20 HECD CCN(CC(=O)NCc1ccc(F)cc1)CC(=O)NCc1ccc(N(C)C)cc1 215942927 DGIHREVGVPLPHP-UHFFFAOYSA-N 400.498 2.146 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC3CCN(C4CC4)CC3)cc2F)CC1 303308611 OJCKSIGRYLPFIT-UHFFFAOYSA-N 403.546 2.394 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3[C@H]4C[C@H]5[C@H]([C@@H]4O)[C@@H]4C[C@H]5[C@@H](O)[C@H]43)ccc21 555544107 MLOBBGUBEUMCKI-LEGHLSJKSA-N 410.514 2.105 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 727616738 DBNMYFXDEYQIEQ-UHFFFAOYSA-N 415.465 2.488 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCOCC3(C)C)cc2F)C[C@H](C)O1 728396677 UKHRJEXVVIGBBK-IRXDYDNUSA-N 422.545 2.349 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(N(C)CCCO)CC3)CC2)cc1 741086153 XNDWDRLEZHESAI-UHFFFAOYSA-N 404.555 2.152 10 20 HECD O=C([C@@H]1Nc2ccccc2S(=O)(=O)N1)N(Cc1ccco1)Cc1ccccc1O 752088478 KPSURXBEHNVSRX-LJQANCHMSA-N 413.455 2.244 10 20 HECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 752893223 ZFTODRPVMUJDGS-TYPHKJRUSA-N 413.566 2.157 10 20 HECD Cc1nc2n(n1)CCN(C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)C2 752962468 SETDMRZRTGRMFK-UHFFFAOYSA-N 406.437 2.382 10 20 HECD COc1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 759247945 SABORRZLZKOAON-CQSZACIVSA-N 421.475 2.480 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 759381056 YNMCARXMWLEPLF-CQSZACIVSA-N 415.465 2.498 10 20 HECD COc1cc(N2CCN(C(=O)CCC(=O)NC3CCCC3)CC2)cc(OC)c1OC 760084199 LSJHNLZKWURWBT-UHFFFAOYSA-N 419.522 2.200 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H]2CCSC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760890049 PYFJLDCZIWSFES-MRXNPFEDSA-N 407.561 2.362 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3ccn4ccnc4c3)CC2)cc1 762266007 HJYWCRSUAKBMPE-UHFFFAOYSA-N 422.533 2.354 10 20 HECD CCn1cc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1C 767237835 UCJRBLIASPFVNS-OKILXGFUSA-N 410.515 2.443 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)c3ccncc3)CC2)cc1 768715409 SXQGEZNPJHOVBZ-UHFFFAOYSA-N 411.550 2.489 10 20 HECD COc1cccc(CNC(=O)CS(=O)(=O)Nc2ccc(OC(C)C)cc2)c1O 769508332 XUVPOLOAKQCWBF-UHFFFAOYSA-N 408.476 2.246 10 20 HECD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(C)c(O)c1O 770476493 MVUGXHJAPIYABT-UHFFFAOYSA-N 413.474 2.344 10 20 HECD CC[C@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)ccc1O 775511725 JGBFDGFBTFPZAE-AWEZNQCLSA-N 418.313 2.303 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4ccccn4)n3)cc2F)C[C@@H](C)O1 776293691 YINFREQLFKWMLA-IYBDPMFKSA-N 424.480 2.409 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(-n2ccnc2)c1 777828918 PPSXBOKOWZSLDQ-UHFFFAOYSA-N 400.822 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)cc1 778388673 JWDOSLCEYDXCLT-JYBLJSLWSA-N 423.513 2.353 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC[C@@H](OCCO)C1 780388220 XDBAPWZFQCXZIX-GOSISDBHSA-N 413.465 2.440 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCc1nnc2n1CCCCC2 785922859 DFXFIMCYIMKZCV-UHFFFAOYSA-N 413.522 2.198 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc2c(s1)CCCC2 789370732 SZJKQOPEHCQQJT-UHFFFAOYSA-N 414.531 2.456 10 20 HECD COc1ccc(C)cc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 789374072 LDZYDTAPPMDZQU-KRWDZBQOSA-N 411.502 2.334 10 20 HECD CO[C@@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 795835736 OILOWGVGAPPRBM-LAPQFRIASA-N 408.470 2.024 10 20 HECD CO[C@@H]1CCC[C@@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 796052047 FXUOXQGLHLRVIV-SJLPKXTDSA-N 422.497 2.417 10 20 HECD CCN(CC)c1ccc(CNc2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 796420252 RTYNMMXFYGLOEJ-UHFFFAOYSA-N 416.547 2.265 10 20 HECD COCC[C@@H](CO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 799086453 BFYPKMLMIBCBLT-LQELWAHVSA-N 414.574 2.243 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 803304145 WFMCONVBRQVCAK-IBGZPJMESA-N 422.529 2.049 10 20 HECD Cc1cc(C(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)c(C)n1-c1ccccn1 804272985 MPLWDDMLQPQBSR-CQSZACIVSA-N 418.441 2.041 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H](C)N(C)C1CC1 804431552 UGWZSKIDKACKLL-GFCCVEGCSA-N 412.328 2.102 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 806178003 AYGWOFPKCYBVPU-ROUUACIJSA-N 414.550 2.007 10 20 HECD CN(C)C(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806510896 AXJUFZBQRJMOIP-LJQANCHMSA-N 404.511 2.286 10 20 HECD COCCc1ccnc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 806657545 HOHYDSDFDPLAPP-SFHVURJKSA-N 411.506 2.294 10 20 HECD CC(C)c1ccnc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 807673339 QYXFNVGBDVPIPY-QGZVFWFLSA-N 424.549 2.192 10 20 HECD CCn1ncnc1CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807900413 XADCVDJHJHORMA-CQSZACIVSA-N 418.929 2.120 10 20 HECD Cc1cc(C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1-c1ccc(Cl)cc1 807943296 ROVBPINMWXOCMS-UHFFFAOYSA-N 414.893 2.428 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1N(C)C 808785634 NVJYZCPCEMPAMJ-UHFFFAOYSA-N 414.525 2.477 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCCCSc2nccs2)c1F 810372565 IOVFWUXBMMQTSM-UHFFFAOYSA-N 415.443 2.445 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 918287336 PVPRGCKSERVTPK-UHFFFAOYSA-N 419.428 2.455 10 20 HECD C[S@](=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918373358 WTDUBECZSQMEKH-XBBWARJSSA-N 413.543 2.197 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 1324626713 GEQTUFSLDBVULP-VDGAXYAQSA-N 413.518 2.298 10 20 HECD C[S@](=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1330730868 NLMMXFNGVUWOSP-OFJJUDJNSA-N 414.531 2.447 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)Cc3cccc(F)c3)CC2)cc1 11900625 RJQVUFBGQYUALB-UHFFFAOYSA-N 407.511 2.076 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCNC(=O)c1ccccc1F 195599344 DWUIISOFBGFTRC-UHFFFAOYSA-N 414.481 2.234 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)cc1 725802832 KXCZSCASVJNLHM-UHFFFAOYSA-N 419.529 2.308 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C[C@@H]2CCCN2CC)C1 729628351 SCHLFMQYRXZFRP-FPOVZHCZSA-N 400.567 2.434 10 20 HECD Cc1cc(CC(=O)NCCCN2C(=O)CNC2=O)c(C)n1-c1ccc(Cl)cc1 731008021 CISREHLIXYUCCL-UHFFFAOYSA-N 402.882 2.348 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 734219955 CLRJYIXXNKCTCW-RBUKOAKNSA-N 402.539 2.312 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1O 743915847 NWDPGRFAXCVOMK-UHFFFAOYSA-N 401.488 2.209 10 20 HECD CC(C)n1cnnc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751060488 FSVVGVGLQUQHBY-UHFFFAOYSA-N 421.504 2.357 10 20 HECD COc1cccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)n1 752296878 YEAZRXOMVIJJNX-UHFFFAOYSA-N 422.464 2.276 10 20 HECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 752893221 ZFTODRPVMUJDGS-NRSPTQNISA-N 413.566 2.157 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc(S)s3)CC2)cc1F 753739160 QWCFLBMAECBGBO-UHFFFAOYSA-N 400.526 2.415 10 20 HECD COc1ccc(N2CCN(CCC(=O)Nc3sccc3C(N)=O)CC2)cc1F 753860576 ISMPHCWFCTVDGM-UHFFFAOYSA-N 406.483 2.146 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)NC1CCN(S(=O)(=O)C2CC2)CC1 753968319 VESVOXCCAJUNMI-UHFFFAOYSA-N 407.536 2.027 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(CN(C)C)CCCC3)CC2)cc1 759245650 TXTLHQMJXCAKSY-UHFFFAOYSA-N 417.598 2.238 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])c(O)c3)CC2)cc(OC)c1OC 760085359 PZEHRHWUMMJYEZ-UHFFFAOYSA-N 417.418 2.289 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCc2c(F)cccc21 763383290 RXKSMGDULOGXSO-UHFFFAOYSA-N 415.440 2.131 10 20 HECD O=C(CN1CCOC2(CCOCC2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 767906963 UZMWZFYXTYIFJY-UHFFFAOYSA-N 420.465 2.282 10 20 HECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1 769022486 MKOLMRVXDTWFKJ-UHFFFAOYSA-N 416.503 2.174 10 20 HECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(Cl)n1 774122331 DMWRABKNUPHTOE-UHFFFAOYSA-N 418.881 2.177 10 20 HECD O=C(NCCc1ccccn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774123384 MILXIWCVYDWLOE-MRXNPFEDSA-N 418.444 2.127 10 20 HECD COc1ccccc1C(=O)N1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 774834840 BHJHEAFENMEZHP-UHFFFAOYSA-N 401.419 2.276 10 20 HECD C[C@H](NCC(=O)NC[C@H]1COc2ccccc2O1)c1ccc(N2CCOCC2)cc1 775255464 QZTCJJNYFAQKAX-PXNSSMCTSA-N 411.502 2.130 10 20 HECD C[C@H](OC(=O)Cc1ccn(C)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782389751 SYFZLEJKYAQZBW-ZDUSSCGKSA-N 417.421 2.308 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CO[C@H](C)C3)cc2F)C[C@@H](C)O1 784281307 FLWYIJIESBMZNQ-PNBKFKSVSA-N 408.470 2.024 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H](F)C(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 784310141 MGXGFKJIPDMKIR-GOSISDBHSA-N 410.467 2.462 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1 785295477 HUXZAHSBYVJMBX-GJZGRUSLSA-N 413.474 2.009 10 20 HECD C[C@@H]1N(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCOC1(C)C 789815886 BFZHPSLORVVYTP-OAGGEKHMSA-N 421.513 2.081 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 804007214 CZPITJLZLMMXLX-IBGZPJMESA-N 409.486 2.048 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCC(=O)N1CCCCCC1 804080075 GGCFQZHPXCIOJD-UHFFFAOYSA-N 403.523 2.430 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC3(OC)CCC(C)CC3)CC2)cc1 804320123 WOHDLFCNXPKGML-UHFFFAOYSA-N 417.550 2.492 10 20 HECD O=C(NC[C@H]1CC(=O)N(C2CC2)C1)C(=O)N(Cc1ccccc1O)C1CCCCC1 805758830 PWUBOOLNHZIAAH-MRXNPFEDSA-N 413.518 2.181 10 20 HECD CC(C)c1cc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)on1 806430918 FMRNEBFGLMUWAZ-INIZCTEOSA-N 401.463 2.328 10 20 HECD CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)OCC(=O)C(C)=O 808491586 ZQZDLUXRJYPOCO-UHFFFAOYSA-N 409.394 2.196 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2cc(Cl)c(F)cc2O)c1 816547247 PIXVTNYQLNHMCD-SNVBAGLBSA-N 415.874 2.210 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(CN2CCOC2=O)c1 915778753 NNJRLBRGTZSOHN-UHFFFAOYSA-N 422.485 2.494 10 20 HECD CCN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916633670 KGUKFXNNHOIIBV-UHFFFAOYSA-N 400.445 2.389 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCC4)C3)cc2)C1 918122412 KRHMKKZSPLLHNA-CTNGQTDRSA-N 413.566 2.158 10 20 HECD Cn1nc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2c1=O 919968831 LSBNRBUGIXPPSR-UHFFFAOYSA-N 406.486 2.072 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 920865859 PMRVRYMGXOPAEH-CYBMUJFWSA-N 410.517 2.411 10 20 HECD C/C=C/C=C\C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008742 JNJGOZZTFSNKQT-DMZRHTGOSA-N 406.866 2.327 10 20 HECD CC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CCCCC1 1802219157 IRFWJFXVZCTMCF-QDMKHBRRSA-N 423.604 2.455 10 20 HECD Cc1c[nH]cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725824 PVDKFLQLSUZTLL-LLVKDONJSA-N 413.459 2.125 10 20 HECD CCN(C)[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429697 PCIJYPUZZKDUDI-MAUKXSAKSA-N 418.538 2.066 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)NCc2ccco2)cc1 302981456 DEKVFFLDHJIKMO-FQEVSTJZSA-N 414.506 2.353 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)n(C)c2ccccc12 472792114 TUJKZTVVZLIUBL-UHFFFAOYSA-N 421.436 2.165 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2nnc(COc3ccccc3)n2N)cc1 729032812 JHHJVFPQDQWRPG-UHFFFAOYSA-N 412.519 2.045 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Cc3cnn(-c4ccccc4)n3)cc2F)CC1 730194277 FFBHXZVUMKOPTR-UHFFFAOYSA-N 422.508 2.407 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(S(=O)(=O)CC)CC2)cc1F 731364864 QBDSJPIQLZGOJU-UHFFFAOYSA-N 414.547 2.285 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCN1CCCC1=O 733195703 UMWHECYEPSEVIK-OAHLLOKOSA-N 419.481 2.343 10 20 HECD Cc1nc(C)c(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)o1 746155275 GSWREOSPKIBSLK-UHFFFAOYSA-N 410.453 2.477 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC3CCC(C)(O)CC3)CC2)cc1 749609359 XABZCDIRLRNLPT-UHFFFAOYSA-N 404.555 2.200 10 20 HECD CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 753154061 LBKNAQVGQGGWIX-ACSYHNTCSA-N 413.547 2.294 10 20 HECD Cc1ccccc1CN1CCN(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)CC1 759578331 HRUYZOMSBQNIJG-VQHVLOKHSA-N 410.470 2.307 10 20 HECD O=C(CS(=O)(=O)Cc1cccc(Br)c1)NCc1ccc(O)c(O)c1 768914473 WALJNTNOORKMFZ-UHFFFAOYSA-N 414.277 2.092 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)CCS(=O)(=O)N(C)C)c2C)c1 772266154 MEXOGTBFDLKSFE-UHFFFAOYSA-N 406.504 2.410 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(Oc4ncccc4F)CC3)nc12 773975419 MNMOZOSCJIVZCF-UHFFFAOYSA-N 415.425 2.189 10 20 HECD COc1ccc(CCNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 774536102 DWFZEWSWTALQIP-UHFFFAOYSA-N 411.502 2.148 10 20 HECD CCc1oc(C(=O)OC)cc1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)cc1 778560238 PHRDJMKECVWPFK-UHFFFAOYSA-N 416.477 2.191 10 20 HECD C[C@@H]1CN(C)C(=O)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 782881349 RZKMZXJMRXEOFL-ZMTLZGASSA-N 423.585 2.419 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCC(=O)N2C)c(C)n1-c1ccc2c(c1)OCCO2 786179668 ACPYLAXEPBDYCL-QGZVFWFLSA-N 412.442 2.212 10 20 HECD CO[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 786659169 XSUGOBDFQCELRU-TZIWHRDSSA-N 412.486 2.404 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 788951273 OSXXATPWZQFLKA-OAQYLSRUSA-N 422.529 2.066 10 20 HECD C[C@H](NC(=O)C1CCCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 800854162 QDQUOKTZKQJFCB-QFBILLFUSA-N 414.550 2.090 10 20 HECD CCC[C@@]1(C2CC2)NC(=O)N(CN2CCN(c3ccc(OC)c(F)c3)CC2)C1=O 802734554 RYOICFAXJFSEIB-NRFANRHFSA-N 404.486 2.415 10 20 HECD CN(Cc1nc(-c2cccs2)no1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 804139844 MZBZLPOIRVIYRD-UHFFFAOYSA-N 408.461 2.147 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C)C(=O)OC(C)(C)C 804180973 XJTROMOKVKQKFX-UHFFFAOYSA-N 406.527 2.084 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCC(C)(C)CN2CCCC2)C2CC2)cc1 807664752 ASWNWJYXFVYRLU-UHFFFAOYSA-N 400.567 2.482 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1)c1ccc(N(C)C)cc1 807676295 DTKUBZDKSVLEJZ-QRQLOZEOSA-N 414.550 2.227 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCO[C@H](C2CC2)C1 807769074 DBKPQVDZTNHJNI-QAPCUYQASA-N 423.460 2.010 10 20 HECD C[C@@H]1OCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]1C 807770538 MAPHBMIOERPSBN-QLFBSQMISA-N 411.449 2.009 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)c1 817946051 QVVCRYCNMHEUNU-UHFFFAOYSA-N 401.516 2.320 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](CO)CC1 819232397 BQXMSGNUHNNKSZ-CYBMUJFWSA-N 410.517 2.489 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 916589588 SINPFWPJQNCDME-UHFFFAOYSA-N 407.444 2.168 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(CNC(C)=O)cc3)CC2)cc1 917759689 UHHWPRLDRWZRES-UHFFFAOYSA-N 417.531 2.232 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)c1ccc2c(c1)OCO2 1343961405 OUDMHAKBXHOGKL-HNNXBMFYSA-N 415.442 2.395 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1347369373 HTHPNEBZOOEENK-OAHLLOKOSA-N 405.520 2.307 10 20 HECD C[C@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1521771527 YOIHICRWWXRKQT-INIZCTEOSA-N 406.502 2.110 10 20 HECD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1781123378 NWWWQZIXGYMBKD-OXQOHEQNSA-N 408.882 2.289 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnccc1Cl 1796600855 JWHQLWFWKSOHHZ-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C1CCC1 1816674364 KJDXQPRBFFUAIY-ZDUSSCGKSA-N 421.548 2.062 10 20 HECD Cc1ocnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846434 XSVLWKYTPVIDFR-CYBMUJFWSA-N 412.406 2.132 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1)c1cc(O)nc(O)c1 1817848724 ZHQASMSTJGGWRU-CYBMUJFWSA-N 403.414 2.414 10 20 HECD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cc(=O)n(C)c(=O)n1C 14707700 HCRANJVHGTXCBA-UHFFFAOYSA-N 414.487 2.031 10 20 HECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1 18215515 IZZUTBBAWMLULD-UHFFFAOYSA-N 403.504 2.132 10 20 HECD COc1ccc(N2CCC(NC(=O)CCNS(=O)(=O)c3cccs3)CC2)cc1 726563100 UGHWJTUFYBDMSZ-UHFFFAOYSA-N 423.560 2.210 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc1 726793926 UFINLQKXBVYMKD-UHFFFAOYSA-N 402.476 2.441 10 20 HECD Cn1ccc2c(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cccc21 727037223 LFUNBYSGJSLOQZ-UHFFFAOYSA-N 410.449 2.409 10 20 HECD O=C(c1ccccc1)c1ccc(O)c(CN(C2CC2)[C@@H]2CCS(=O)(=O)C2)c1O 728194088 FUUGJCOKFZFOQE-MRXNPFEDSA-N 401.484 2.480 10 20 HECD CC1(C)C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 732071129 HFQALNRCKRKWCS-ACCUITESSA-N 423.585 2.467 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)cc1 734502239 KYFHZQUGLNZAOV-UHFFFAOYSA-N 406.504 2.481 10 20 HECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1C 737135530 YEOXQNZDYMEWOH-UHFFFAOYSA-N 419.503 2.449 10 20 HECD Cc1nnc(-c2cccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2)n1C 746309800 JXQFHFZTPNLGCU-UHFFFAOYSA-N 401.448 2.120 10 20 HECD Cc1cc(NC(=O)NCc2ccc3c(c2)CCCN3C)n([C@@H]2CCS(=O)(=O)C2)n1 746759248 DKFZRLZEBSSFOX-QGZVFWFLSA-N 417.535 2.255 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)c(OC)c1 752125149 PWJMFGQPSMIUQL-MRXNPFEDSA-N 410.536 2.098 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3c(OC)ncnc3N(C)C)CC2)cc1 754453691 ZVNPHIXXBNLFQN-UHFFFAOYSA-N 400.483 2.350 10 20 HECD CN(CCOCc1ccccc1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 756901968 XHPHLGPCCOQLEL-UHFFFAOYSA-N 415.509 2.427 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cncc(N2CCOCC2)c1 757007986 FTRRXDSFMHHTOX-UHFFFAOYSA-N 410.518 2.057 10 20 HECD COC(=O)CC(C)(C)CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759220829 JIFVXLZHCIUEFC-UHFFFAOYSA-N 408.495 2.340 10 20 HECD COc1cc(N2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759879426 VOQDZLAEEBSXFZ-SFHVURJKSA-N 417.462 2.476 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@@H](c4ccc(O)cc4)C3=O)cc2F)CC1 761282727 RKPPOGFYYXUDNJ-FQEVSTJZSA-N 412.465 2.466 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 763283913 MBDFZYPUGOIRKA-DOTOQJQBSA-N 418.515 2.246 10 20 HECD CCNS(=O)(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 770772142 WEYFMCGPYCRSFQ-LJQANCHMSA-N 408.568 2.146 10 20 HECD Cc1cccc(CN2CCCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1O 775667515 KEFQZUUYWFMJAM-UHFFFAOYSA-N 418.515 2.368 10 20 HECD CCS(=O)(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(O)c(Cl)c2)s1 776749068 WBUXSJVRORXWCR-UHFFFAOYSA-N 424.953 2.390 10 20 HECD CCc1cc(NC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)n(C)n1 785195268 MSZMCKZKMKRXQQ-UHFFFAOYSA-N 409.284 2.438 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1 785298817 ZRUNSTMYEVQUCY-LLVKDONJSA-N 419.865 2.139 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C(C)C)N3CCCCC3)cc2)CC1 787321378 DRQLVZDVIPMIHQ-QFIPXVFZSA-N 400.567 2.482 10 20 HECD COC(=O)[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[C@@H]1C 787328787 UKJBEAWJYMXBQS-HIFRSBDPSA-N 406.438 2.284 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1N1CCNC1=O 787558617 JYVIIEYYGOZDRH-OAHLLOKOSA-N 409.490 2.407 10 20 HECD CNC(=O)c1cccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 787863702 NJLKSKZOINUORG-UHFFFAOYSA-N 410.518 2.166 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(O[C@@H]4CCOC4)cc3)cc2)C1 788741442 GYBTYFZHNMAVDS-DENIHFKCSA-N 423.513 2.486 10 20 HECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934709 YIVGSVCNOHCJRQ-LJAQVGFWSA-N 413.543 2.299 10 20 HECD C[C@H]1[C@H](C)CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798200 DAYARHDIQSWDHZ-RYRKJORJSA-N 405.514 2.467 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCSCC3)cc2F)C[C@H](C)O1 789816122 BVNUPZYJEWJQLI-GJZGRUSLSA-N 423.554 2.315 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@@H]1C1CCC1 789840637 LSIRVEVFWAQTEK-LJQANCHMSA-N 403.498 2.194 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cnc(CC2CC2)nc1)c1ccc(N2CCOCC2)cc1 792969576 FBOPXAMNDDMZBP-OAHLLOKOSA-N 409.490 2.082 10 20 HECD COc1ccc(CNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)c(O)c1 798342141 BHMCHNFMVOSKSI-UHFFFAOYSA-N 416.455 2.402 10 20 HECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)o1 803687446 MRIPMUWOVJPBEK-FQEVSTJZSA-N 411.502 2.441 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)cc1 804318200 CTBDVVWVFUYJAD-GOSISDBHSA-N 403.523 2.243 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C 804569914 PYLHWRCVXREABO-OAHLLOKOSA-N 408.502 2.074 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1CN(C(=O)OC(C)(C)C)C1 804756357 NOEITHRQUMCHTD-UHFFFAOYSA-N 405.495 2.114 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1 807512643 BJSBEJZGIQBOKC-CYBMUJFWSA-N 413.261 2.329 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1cnn2c1OCCC2 816203819 FMJASJSPJVJCLH-UHFFFAOYSA-N 406.489 2.253 10 20 HECD COc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1C(=O)O 915216549 PQNKSRFWDHDLTD-UHFFFAOYSA-N 420.487 2.051 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cncc(Br)c1 916676154 AVSKLYRRBBWDJY-UHFFFAOYSA-N 424.320 2.009 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)cc1 918229648 LWJBZGHQGFDODM-UHFFFAOYSA-N 415.582 2.373 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CN1CCCCC1 919654472 LRTIHFISMLFZHA-UYAOXDASSA-N 415.582 2.310 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@H](O)c1cccc(F)c1 921123943 ZGSISWVWIRYKIT-FQEVSTJZSA-N 405.445 2.459 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C)c(NC(C)=O)c1 1323860049 ORTSNIFZIDVCPJ-KRWDZBQOSA-N 400.431 2.269 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=Cc2cccc(OC)c2OC1 1342917291 VMHJMOKJMJMAJP-INIZCTEOSA-N 413.426 2.173 10 20 HECD CC(C)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccccn1 1796602378 BKDJUBUAJZSARU-MUJYYYPQSA-N 410.474 2.117 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc(=O)oc1 1800715300 HEHQPTDMIQTOBO-BTTYYORXSA-N 418.833 2.270 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C[C@H]2OCCc3ccccc32)C1 1841553085 SMZCQUFHHFTYDC-GOSISDBHSA-N 423.469 2.014 10 20 HECD CNc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847039123 OABLECWYKBOLPF-UXBLZVDNSA-N 423.469 2.376 10 20 HECD CC(C)(C)OC(=O)NC(C)(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 116024714 DCNPXSOODXUPJX-MRXNPFEDSA-N 418.538 2.308 10 20 HECD Cc1cc(NC(=O)CN2CCN(C(=O)NCc3c(C)c4ccccc4n3C)CC2)no1 472279901 VYCILEOCJHOSMO-UHFFFAOYSA-N 424.505 2.249 10 20 HECD CC(C)Oc1cccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 727176887 ROTJAAGMJCWSAJ-UVTDQMKNSA-N 400.547 2.224 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 729484060 GSXWHUFZIPYEKO-INIZCTEOSA-N 405.495 2.314 10 20 HECD COc1ccc(C(=O)NCc2cccc(OC)c2O)cc1S(=O)(=O)NC(C)(C)C 729859163 IIVIOFUTCWJBON-UHFFFAOYSA-N 422.503 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)=O)cs3)CC2)cc1 730353979 UIQOVACHTYGXKR-UHFFFAOYSA-N 402.472 2.465 10 20 HECD CCn1nc(C)c(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)c1C 741647443 CWBZZLRBPDLBHR-UHFFFAOYSA-N 400.526 2.391 10 20 HECD COc1ccc2ccc(O)c(CN3CCN(S(=O)(=O)Cc4ccon4)CC3)c2c1 743379779 CKJJHDBHOKZXKI-UHFFFAOYSA-N 417.487 2.190 10 20 HECD CNS(=O)(=O)c1cc(C(=O)NCc2c(O)ccc3c2CCCC3)ccc1OC 743719803 ULVGZFPVHXIPTK-UHFFFAOYSA-N 404.488 2.118 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3ccc(N(C)C)cc3)C2=O)c1 747873535 UQTFCVCXCMOIRJ-FQEVSTJZSA-N 412.490 2.375 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H]1C 748962287 WBVYSLJONRBAKC-CUWPLCDZSA-N 415.582 2.403 10 20 HECD Cn1cc([C@H](CO)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757652961 ARBBGQBVPSREQJ-YOEHRIQHSA-N 409.437 2.023 10 20 HECD CC(C)OC[C@H](CO)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 764227032 CPVAGGVJYOMJHG-JZXOWHBKSA-N 411.518 2.367 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)CCc3cccs3)cc2)C1 767489466 AHAHGBSORTYMPZ-MRXNPFEDSA-N 407.561 2.112 10 20 HECD CCOc1ccc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c(O)c1 768157093 RHFIZNUHGRQNFG-UHFFFAOYSA-N 421.475 2.206 10 20 HECD O=S(=O)(c1c[nH]c2ncccc12)N1CCN(Cc2cc(Cl)ccc2O)CC1 769023831 QGXSEJCJIGAAMY-UHFFFAOYSA-N 406.895 2.428 10 20 HECD COCC1(C)CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 773515247 LHMIGWARKAZKMD-UHFFFAOYSA-N 404.555 2.275 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(S(N)(=O)=O)cc2C)cc1 775204265 YVACQYWDOBUEMK-UHFFFAOYSA-N 404.536 2.488 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 781952005 QKHQMYZQXCEGED-HXUWFJFHSA-N 410.430 2.241 10 20 HECD CN(CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 785625778 WXGZGSDUYJIXCM-HXUWFJFHSA-N 411.502 2.152 10 20 HECD O=C(NCCc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1 786688835 IRFCVXDYGJXJKQ-UHFFFAOYSA-N 401.894 2.152 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21 788933331 UPHDIEDTACWNTO-FGTMMUONSA-N 405.589 2.399 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]2CCCC[C@@H]12 789798975 HAAFWNQCVGINSW-AYBZRNKSSA-N 403.498 2.316 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC[C@H](c2ccccc2)C1 789799606 KMTXKIMITRMQBK-IBGZPJMESA-N 411.477 2.295 10 20 HECD Cc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 789822378 WGUXVTCUFQHFPA-STQMWFEESA-N 420.510 2.137 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1cnn(C)c1-n1cnnc1 789989903 PGTYEJSWXRTRQM-UHFFFAOYSA-N 405.256 2.131 10 20 HECD Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 790013498 XNWIFMOGNPYUHJ-UHFFFAOYSA-N 419.595 2.481 10 20 HECD C[C@H](O)C[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790666235 PMYINDIDAIKLPH-HQRMLTQVSA-N 402.539 2.223 10 20 HECD O=C(Nc1cccc(F)n1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 793052883 ZQLZGIDMMDDHSN-CQSZACIVSA-N 406.845 2.299 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 796203448 OIIGZYDKLOTPFT-QGZVFWFLSA-N 405.520 2.035 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H]1c1cccnc1)c1ccc(N2CCOCC2)cc1 803306692 WGWLYIVGRSTXEI-UTKZUKDTSA-N 408.502 2.459 10 20 HECD CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 803996599 XREZMZJQQMIINQ-FQEVSTJZSA-N 417.550 2.281 10 20 HECD O=C(NCCC1(O)CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 805771803 AEOALLWBZZUANY-UHFFFAOYSA-N 413.465 2.488 10 20 HECD CC(C)[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 806336885 ZSTPAUCOPWADGF-SFHVURJKSA-N 420.554 2.377 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](CC(=O)NC)c1ccccc1 807731512 CWHPZDCMJPBUPV-FQEVSTJZSA-N 410.518 2.095 10 20 HECD Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809527182 YZKPXPNYPRIFJV-KSSFIOAISA-N 415.490 2.425 10 20 HECD CNS(=O)(=O)c1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c(C)o1 820006450 YCUOSKUFJFLVAJ-UHFFFAOYSA-N 411.443 2.458 10 20 HECD Cc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C(=O)O 871792440 AXNCOTOTFNEJJR-UHFFFAOYSA-N 404.488 2.351 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 918303863 IJSGIJBHAKAXAS-UHFFFAOYSA-N 403.504 2.143 10 20 HECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(S(=O)(=O)NCC2CC2)c1 918371054 BRWSEYRNDIGKAU-UHFFFAOYSA-N 415.515 2.464 10 20 HECD CS(=O)(=O)Nc1ccccc1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 1321219543 HFQYZCHCGFMHBX-UHFFFAOYSA-N 423.878 2.382 10 20 HECD CN(C)[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1321731002 URGKHFONZXDHOV-YSIASYRMSA-N 401.555 2.060 10 20 HECD Cc1noc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)n1 1788426863 YIUVJDMLHGRDLN-UHFFFAOYSA-N 423.429 2.175 10 20 HECD Cc1c[nH]cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818217377 YOJVLUCTZGGZGO-OAHLLOKOSA-N 410.434 2.472 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Cl)C1 1841831619 ICHPGOVDOKQMTM-UHFFFAOYSA-N 419.840 2.345 10 20 HECD Cc1nscc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441226 GDTFCPBBHSHHEO-UHFFFAOYSA-N 423.498 2.061 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2c(=O)n3ccccc3nc2n1C 439526148 PWARWIDEYUHCOE-UHFFFAOYSA-N 403.442 2.291 10 20 HECD CCN(CC)c1ccc(CNC(=S)NCc2ccc(S(N)(=O)=O)cc2)cc1 726467558 CGFLLHCHRWCJKJ-UHFFFAOYSA-N 406.577 2.345 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](CO)Cc1c[nH]c2ccccc12 729599391 GVITZOMFTLEBOT-LJQANCHMSA-N 408.502 2.407 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](CO)Cc3ccccc3)cc2F)CC1 730134527 DPDVMTANUOLAOM-HXUWFJFHSA-N 414.525 2.370 10 20 HECD CCNC(=O)NC1(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCC1 736194815 FJWLLXVQMURBJQ-UHFFFAOYSA-N 402.539 2.143 10 20 HECD CN(CC(=O)NCCOc1cccc(F)c1)Cc1ccc(N2CCOCC2)cc1 738298785 HYEUJIGNEOKLLA-UHFFFAOYSA-N 401.482 2.289 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c1O 746414751 KVTNSVOQPBKJCW-UHFFFAOYSA-N 400.460 2.270 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)[C@H]2c2ccccc2)c1 748798401 YAGKLRQUUFMOKZ-JOCHJYFZSA-N 423.513 2.100 10 20 HECD CC(C)NC(=O)C(=O)N1CCN(Cc2ccc(OCc3ccccc3)cc2O)CC1 753537951 MMTBSUGKMQFSCW-UHFFFAOYSA-N 411.502 2.140 10 20 HECD CS(=O)(=O)NCc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)o1 753643407 MQQSCJLLSUNHAA-UHFFFAOYSA-N 411.443 2.291 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCS(=O)(=O)[C@H]2CCCC[C@@H]21 753857560 NDSJSPXEQHASNZ-OALUTQOASA-N 423.604 2.491 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)NC(=O)c1cc(C)n(-c2ccccn2)c1C 754639987 UFFFEEVJRDVTJV-UHFFFAOYSA-N 415.519 2.466 10 20 HECD COC(=O)c1sc(NC(=O)CN(C)c2ccc3c(c2)OCO3)c(C(=O)OC)c1C 756654597 JDPRBKDTHYMACL-UHFFFAOYSA-N 420.443 2.433 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H]3COc4ccccc4C3)CC2)cc1 758196704 DPRHJECGXVEKHI-DENIHFKCSA-N 411.546 2.019 10 20 HECD C[C@H]1C(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C(=O)N1C1CC1 761120557 MMGGXDZGMVNZDQ-HNNXBMFYSA-N 424.480 2.257 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnnc3/C=C\c3ccccc3)CC2)cc1 764496722 AHTQZJLTWRCRMD-GHXNOFRVSA-N 404.474 2.201 10 20 HECD C[C@H](OC(=O)C[C@H]1COC(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767603388 UKPDEEFDWBJGDA-STQMWFEESA-N 421.405 2.285 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)Nc1ccccc1 768231091 UXIMWBJIFRZQNW-UHFFFAOYSA-N 412.509 2.419 10 20 HECD CCOCCO[C@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771057392 NSHZQQXXMVTTPR-MRXNPFEDSA-N 418.494 2.084 10 20 HECD CCNS(=O)(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 771401181 ZROIPEVWDOBTNE-GOSISDBHSA-N 405.520 2.257 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCCCO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 772313976 MPNWFJFGVNIZQE-IBGZPJMESA-N 420.487 2.037 10 20 HECD CC(C)CN1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)[C@H](C)C1=O 777470952 XEXLHMMFSSYSDA-ZWKOTPCHSA-N 402.539 2.483 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)[C@H]2CCCN(C(=O)C3CCCC3)C2)cc1F 781524195 SGOAYQUBIOIRQV-KRWDZBQOSA-N 411.543 2.492 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 785439570 RFWFZCQSDDWBIH-JOCHJYFZSA-N 408.546 2.492 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2ccccc2)CCC1 785822055 OWBKRJLOFPHOPC-UHFFFAOYSA-N 407.514 2.378 10 20 HECD CN(C)[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(F)cc1 787644090 ZSZPYTANDSSXQD-OAQYLSRUSA-N 410.493 2.237 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccc(F)c1 788311591 XLDARYWRDGQCFC-UHFFFAOYSA-N 413.493 2.373 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccccc1N1CCOCC1 788332428 MSPIHXNLUUPNOY-UHFFFAOYSA-N 424.545 2.254 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCN(c4ccccc4)C3)ccc21 788822253 KQMKJKGQIUMJFW-IBGZPJMESA-N 406.530 2.328 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cc1 788976294 WHQRJNCAZBMBGM-OAHLLOKOSA-N 414.472 2.244 10 20 HECD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)C1 789171200 JNBYFIXDMWWASJ-SFHVURJKSA-N 401.507 2.396 10 20 HECD Cc1nn(C)c(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1Br 790467529 GTABMNCYHVXKPC-HNNXBMFYSA-N 420.355 2.483 10 20 HECD CNC(=O)[C@@]1(C)CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 797525809 SENRZQDAAKHPRR-SHACYNPGSA-N 419.481 2.247 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC2CCN(CC(F)F)CC2)C2CC2)cc1 803651047 VEXIEEYJINAUJP-UHFFFAOYSA-N 408.493 2.089 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H]3C[C@H](O)c3ccco3)ccc21 803688827 CEKRBZVGQBGUIX-ICSRJNTNSA-N 411.502 2.393 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3n[nH]c(C)n3)C2)cc1F 804851789 OYEWTDAIOWCQDQ-MRXNPFEDSA-N 416.501 2.121 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)cc1F 804851842 QQDGJGKOUNTMTO-CVEARBPZSA-N 420.529 2.194 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC4(CCOCC4)CC3)cc2)C1 806495654 JXFIQWZFLZVMIJ-LJQANCHMSA-N 414.550 2.491 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 806845373 LTHCSQFQSFOHAQ-SFHVURJKSA-N 413.522 2.040 10 20 HECD CCCNS(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 813700708 SAVOUHJRACQVAR-MRXNPFEDSA-N 400.545 2.152 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3O)cc2)C1 918672852 MBBSDPRGZPGKSW-ZDUSSCGKSA-N 422.407 2.438 10 20 HECD C[C@H](NC(=O)N1CCN(C(=O)c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 920866780 KZGOUWNFPCTGRV-SFHVURJKSA-N 423.517 2.147 10 20 HECD CCO[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C[C@H]1CNCc1ccc(OC)c(C)c1 1087068219 QLICURVQIFHEBM-QMYDJURMSA-N 414.546 2.380 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ccn1 1115886192 VPZILIARVGQNOW-UHFFFAOYSA-N 422.464 2.276 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(c(OC)c1)O[C@@H](C)C2 1116669081 FRAVVDQTIMZXBH-LRDDRELGSA-N 415.442 2.334 10 20 HECD Cc1cc[nH]c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005015 SRPIGUKEOIOHQL-HXUWFJFHSA-N 419.865 2.145 10 20 HECD CO[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791635221 KXPLQIQWZJFADX-GFCCVEGCSA-N 421.544 2.016 10 20 HECD Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)n1 1796598946 OUVNWNPRKMNZSL-BCDXTJNWSA-N 410.474 2.081 10 20 HECD C[C@@]1(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)CC1(F)F 1846985573 WBOBJMNMAHXABZ-IBGZPJMESA-N 416.428 2.028 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 110353308 JDDBTWZEEWQQDS-BGYRXZFFSA-N 413.518 2.346 10 20 HECD Cc1c(CNC(=O)NC[C@@H]2CC(=O)N(C)[C@H]2c2nccn2C)n(C)c2ccccc12 553797486 LQJNIBBAPCEBNK-MGPUTAFESA-N 408.506 2.239 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NCc3cc4c(cc3O)OCO4)CC2)cc1 725845145 PAUXFFLUGGTCOV-UHFFFAOYSA-N 404.488 2.372 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)c1 729064753 WJBGBLUEEYFPGY-VIFPVBQESA-N 407.373 2.453 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)CC(C)(C)O 734149248 DAEDYRNUYPFXMS-UHFFFAOYSA-N 407.536 2.017 10 20 HECD COC(=O)[C@@H]1CCC[C@@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 742241686 TVFSPSZNBAMESZ-RTBURBONSA-N 417.550 2.303 10 20 HECD CSC[C@H](C(=O)NCc1ccc(N(C)C)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 744380764 DQYRMXNULORRII-KZNAEPCWSA-N 403.548 2.276 10 20 HECD CCOc1ccc(N(CC)CC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 744391943 QMKWILRTXBXOIW-ICSRJNTNSA-N 424.563 2.106 10 20 HECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 747016718 DFYXFPSCEAQWSD-UHFFFAOYSA-N 410.518 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)CCn3c(S)nc4ccccc4c3=O)CC2)cc1 747470006 ISLATGGPSMEOJL-UHFFFAOYSA-N 424.526 2.433 10 20 HECD CC(C)(CNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)S(C)(=O)=O 748965032 SATSJMYILRQFJG-ZDUSSCGKSA-N 419.494 2.379 10 20 HECD CON(C)C(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 749658722 XZWCQPZYLJDAKS-UHFFFAOYSA-N 411.458 2.159 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2cnc3c(N)ncnc32)c(C)n1-c1cccc(F)c1 750506435 NIWCUORHOFVMJZ-UHFFFAOYSA-N 422.420 2.381 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 750637450 JHYJGPPHGLYMCZ-LZWOXQAQSA-N 404.486 2.002 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)nn3)cc2F)C[C@H](C)O1 750871900 JGQBVFWCTXBYOK-GJZGRUSLSA-N 410.453 2.345 10 20 HECD COc1ccc(N2CCN(CC(=O)N[C@H](Cc3ccccc3)C(C)=O)CC2)cc1F 753856628 IVPMMUJJTULRLM-OAQYLSRUSA-N 413.493 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3cc4c(nc3O)CCC4)CC2)cc1F 753930489 HBKAQTRKETWSFO-UHFFFAOYSA-N 400.454 2.455 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754039928 GJEWBXMDEOPCGG-UHFFFAOYSA-N 422.478 2.273 10 20 HECD COCc1noc(-c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n1 758284207 UWDZUJYEANETHU-UHFFFAOYSA-N 406.376 2.298 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)[C@H]3CCCOC3)CC2)cc(OC)c1OC 759295965 CDAYFBUBCSXJRK-CVEARBPZSA-N 407.511 2.359 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N(C)C[C@H]1COc2ccccc2O1 759594726 IDWKAINFTHOHDW-ITIMPDFMSA-N 413.426 2.341 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc([C@@H]4CCOC4)c3)nc12 761537411 ADUGZXJKQBESEX-OAHLLOKOSA-N 411.414 2.473 10 20 HECD Cc1ccc(S(=O)(=O)NCCCC(=O)NCCc2ccc(O)c(O)c2)cc1C 762275462 QVLRNESWBFSRQL-UHFFFAOYSA-N 406.504 2.132 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc2c(c1)ncn2C 762282033 UDXMKQPHGPEFEP-UHFFFAOYSA-N 400.504 2.231 10 20 HECD Cn1ccnc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 767779866 XAPGAUVSYYHIHP-QGZVFWFLSA-N 401.486 2.485 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2cccc(OC)c2O)cc1OC 769507281 CKYDEAAQJGLIFB-UHFFFAOYSA-N 406.391 2.273 10 20 HECD Cn1ccnc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769638053 YMRZSQYZYAGGKW-QGZVFWFLSA-N 400.460 2.017 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc4c3OCCO4)c2)CC1 769848920 RRJLPFHGFJESQU-UHFFFAOYSA-N 403.504 2.401 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc([S@@](C)=O)c3)CC2)cc(OC)c1OC 770251990 LMTNDHKFCSSRBF-GDLZYMKVSA-N 418.515 2.412 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CC(=O)N(C2CCCCC2)C1 772439233 DIDMSLLFZDZNHA-QGZVFWFLSA-N 418.513 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)c3c(C)n[nH]c3C)CC2)cc1 776289873 RCSQPEYQHBTDJV-CQSZACIVSA-N 400.479 2.031 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@H](C)[C@@H](OC)C3(C)C)CC2)cc1 778420579 XQJPASOJXRHWBG-NJYQFSDFSA-N 415.534 2.076 10 20 HECD CCO[C@@H]1C[C@](CO)(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 780337596 DXTCTDKGCFBASX-DKZVUGQWSA-N 405.539 2.450 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(NS(=O)(=O)C(F)(F)F)c1 782739052 NRWDEGOGQODTFQ-UHFFFAOYSA-N 404.366 2.332 10 20 HECD O=C(COC(=O)c1ccccc1S(=O)(=O)C(F)(F)F)c1ccc(O)c(O)c1 782796733 ACBIFARVMPGENZ-UHFFFAOYSA-N 404.318 2.431 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(C)c(F)c3)cc2)CC1 786122541 SHZGIMFKKKAHRH-UHFFFAOYSA-N 419.522 2.422 10 20 HECD COc1ccc(OCCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786259882 RRQREIAJQCYPQZ-UHFFFAOYSA-N 411.502 2.449 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2c(Br)cnc2C1 787997646 NGTQBMPVIYTBTQ-UHFFFAOYSA-N 406.328 2.186 10 20 HECD CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799143 JLRAEMMSTICCBD-IAGOWNOFSA-N 423.554 2.411 10 20 HECD COc1ccc(OC)c(C2=NO[C@@H](C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)C2)c1 792306987 LUCBFEITYLHQSP-MPBGBICISA-N 400.431 2.355 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 793723455 WWRYVCBJXFGHRP-QRQLOZEOSA-N 414.550 2.090 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN1CCc2sccc2C1 793856633 CFFVQTGZYBIOBP-UHFFFAOYSA-N 414.575 2.337 10 20 HECD Cc1cnn(C)c1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 795815029 JKTMKUXRSOUXJS-UHFFFAOYSA-N 400.451 2.277 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](N4CCCC4)C[C@@H]3C)CC2)cc1 805014401 ZAFFQXGJFAYPIN-FPOVZHCZSA-N 415.582 2.085 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 809660729 VAKKVWMHBOFZLL-UHFFFAOYSA-N 415.538 2.112 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H](c4ccccc4)OC3=O)cc2)CC1 809793284 BNLFFYRYUDCVRT-VXKWHMMOSA-N 421.497 2.276 10 20 HECD CN(C)c1ccc([C@@H](CNC2CCS(=O)(=O)CC2)NC(=O)OC(C)(C)C)cc1 812842760 SIBXLIZPGLSNNV-GOSISDBHSA-N 411.568 2.485 10 20 HECD Cc1cc(CCNC(=O)C2(S(C)(=O)=O)CCOCC2)c(C)n1-c1ccccc1 814100681 QTOKXKZFDFCLDM-UHFFFAOYSA-N 404.532 2.347 10 20 HECD CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 815329040 QILXOZNINUVDMI-UHFFFAOYSA-N 413.474 2.331 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2)C1 917833966 FDRRUHYRBVJUCY-DNVCBOLYSA-N 424.476 2.270 10 20 HECD CC(C)C(=O)NC1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918223885 LMWTVKZRWVQVII-UHFFFAOYSA-N 406.502 2.109 10 20 HECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(N2CCCS2(=O)=O)c1 918371160 FTSJWGNPRQAQSK-UHFFFAOYSA-N 401.488 2.315 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3ccc4c(c3)OCO4)CC2)cc1 918550932 OQUOZJQNDOTCOM-UHFFFAOYSA-N 411.502 2.295 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cc1 921160526 VOZOTLBFAXQKGH-UHFFFAOYSA-N 415.515 2.098 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(CC)nc1C(F)(F)F 1322537549 PFLGHUCDZQSVHS-LBPRGKRZSA-N 415.368 2.237 10 20 HECD CN1CCN(c2ccc(CNc3ccc([C@@H]4CC(=O)NC(=O)N4)cc3)cc2F)CC1 1350294791 TZEDEARDWYLBCC-IBGZPJMESA-N 411.481 2.460 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2CC=CCC2)C1 1841294582 OUOPESWIESGIMX-QGZVFWFLSA-N 406.486 2.339 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 3555527 WJPIPLOGMWZCSR-UHFFFAOYSA-N 413.430 2.417 10 20 HECD C[C@H]1Cc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc2N1S(C)(=O)=O 108559653 NCZVUSMWTDLSMW-HNNXBMFYSA-N 415.515 2.486 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)n(C)c2ccccc12 519435793 WYPZOPNROQKFLB-UHFFFAOYSA-N 419.529 2.279 10 20 HECD COc1ccc(N2CCC(NC(=O)CCc3ccc(S(N)(=O)=O)cc3)CC2)cc1 726562590 PUNXDKCZGGAFBU-UHFFFAOYSA-N 417.531 2.060 10 20 HECD COc1ccc(N2CCC(Nc3cccc([N+](=O)[O-])c3S(N)(=O)=O)CC2)cc1 726594809 YFEXKDCBEVWBED-UHFFFAOYSA-N 406.464 2.332 10 20 HECD Cc1ncc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 728689558 GIETVMQMURDPEF-UHFFFAOYSA-N 422.468 2.362 10 20 HECD CC1CCN(c2ccc(CNC(=O)COc3ccc(S(N)(=O)=O)cc3)cc2)CC1 731053298 MPVWOBDLRHNPKE-UHFFFAOYSA-N 417.531 2.266 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)CS(C)(=O)=O)cc2F)C[C@@H](C)O1 732675201 XLCIPNURJCKOCM-KFWWJZLASA-N 415.531 2.014 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1N1C(=O)CCC1=O 733045817 ATYRHXVOQKKAPV-UHFFFAOYSA-N 422.485 2.312 10 20 HECD C[C@@H](N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1)C(F)(F)F 749561207 FDBLMLWRGIGTOI-OAHLLOKOSA-N 400.445 2.301 10 20 HECD CC(C)Cn1cnc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227878 MVLHLRBUJZARIN-UHFFFAOYSA-N 410.515 2.118 10 20 HECD CC(C)(C)OC(=O)N1CC(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 752424062 BHMFJBYZVYOVFS-UHFFFAOYSA-N 403.523 2.378 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 758222651 GQGQCMNLGJZYGW-SFHVURJKSA-N 417.462 2.174 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN(C)[C@@H](C)C3)CC2)cc(OC)c1OC 759280562 AUOIUMVNHLVDBP-JKSUJKDBSA-N 406.527 2.027 10 20 HECD COc1cc(N2CCN(Cc3ccc(S(C)(=O)=O)cc3)CC2)cc(OC)c1OC 761218834 KGZGGUSPSVQEQP-UHFFFAOYSA-N 420.531 2.438 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc(S(N)(=O)=O)nc2)cc1 763631895 PTPMNSXPUYVTMX-UHFFFAOYSA-N 414.487 2.231 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1 768010000 FZJBGLGWIOUUHC-UHFFFAOYSA-N 419.489 2.203 10 20 HECD O=C([C@@H]1CCCO1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768182238 XOXXDQDYMWGPKN-FQEVSTJZSA-N 402.495 2.408 10 20 HECD O=C(CNC(=O)OCC(F)(F)F)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768911887 JJHULQAIMZGSJW-CYBMUJFWSA-N 423.819 2.415 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCn1cc([N+](=O)[O-])cn1 769227034 DREAPSBXKZUFJT-UHFFFAOYSA-N 412.244 2.491 10 20 HECD Cc1noc(C)c1S(=O)(=O)NC1(C(=O)N(C)Cc2ccccc2O)CCCC1 769282476 NBOXRKJWWAZEKW-UHFFFAOYSA-N 407.492 2.247 10 20 HECD CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 773317431 OOABWZKQTGTTBA-IBGZPJMESA-N 416.522 2.498 10 20 HECD CCOc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1S(=O)(=O)N(C)C 779476021 SSPVQZZUVLDHAM-UXBLZVDNSA-N 406.460 2.399 10 20 HECD CNC(=O)[C@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCO1 782041292 JTPFMRXYEKMYTD-QGZVFWFLSA-N 420.307 2.444 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(F)c(F)c1 786686101 YTTXLJFVZGUABL-UHFFFAOYSA-N 403.429 2.076 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(-c4nc[nH]n4)c3)cc2)CC1 787323795 ZLQIJSMTJDUTPC-UHFFFAOYSA-N 404.474 2.070 10 20 HECD COC(C)(C)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789816278 CPKPMXANEWQYFA-JYJNAYRXSA-N 423.529 2.375 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 793689940 QLLPNXMSWGVRSU-OAHLLOKOSA-N 400.928 2.094 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2ccccc2C1 803886259 IGKCNWHIPZACLP-LJQANCHMSA-N 418.541 2.242 10 20 HECD CC[C@H]1C(=O)N(CC)CCN1C(=O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 805022823 FNOLMHBRUFYMCM-FQEVSTJZSA-N 414.550 2.008 10 20 HECD CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)N(C)Cc2ccccc2O)n1 806855260 FGEWANGNDGZWIV-UHFFFAOYSA-N 405.476 2.287 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 807099389 UJEDTKRPHKYKOO-QFIPXVFZSA-N 408.546 2.410 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807674414 KNOOGVKBBKCHTA-NVXWUHKLSA-N 403.523 2.368 10 20 HECD CC(C)C[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCO1 808076089 MHQZPYCRYQDZLU-PZJWPPBQSA-N 417.550 2.192 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C3(c4ccccc4)CC(=O)C3)CC2)cc1 810395624 QTDWRSWEKCTXCZ-UHFFFAOYSA-N 407.514 2.234 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H](O)c1ccccc1 812010213 NFBVERROQIHTOK-LRQRDZAKSA-N 410.518 2.310 10 20 HECD CC(C)[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCN(C)CC1 916258183 MUHCEAWNICRKKV-NHCUHLMSSA-N 418.582 2.355 10 20 HECD COCCN(C)CCCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918209478 MPNVTGQEXOLDGK-IAGOWNOFSA-N 410.534 2.207 10 20 HECD CC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 918905155 OGHFZWVLDNFZHL-UHFFFAOYSA-N 420.462 2.400 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1CC1(F)F 1818836431 MRYGXGLVHGRSFM-PWSUYJOCSA-N 407.377 2.177 10 20 HECD O=C(CC1CCC1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838032346 MTSMVSFCDPKSDR-UHFFFAOYSA-N 417.506 2.295 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN(C(=O)c3ccccc3)CC2)n(C)c2ccccc12 580971925 HKJMLOKJPJZFJV-UHFFFAOYSA-N 418.497 2.088 10 20 HECD COCc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 727453106 UEXGTXDYXBSUAW-SFHVURJKSA-N 417.531 2.013 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@](CC)(C(=O)OC)c3ccccc3)nc12 731843448 RREXRFPJVKOQPU-OAQYLSRUSA-N 412.446 2.180 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)OCC(F)(F)F)cc2F)C[C@H](C)O1 732059645 DNQDZFCZOOLGGI-RYUDHWBXSA-N 421.391 2.344 10 20 HECD COC(=O)C1=C(COC(=O)c2cc(O)cs2)N(C)C(=O)N[C@@H]1c1ccccc1 732353808 WKWWEPGJTSQFHZ-MRXNPFEDSA-N 402.428 2.434 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 732592298 FTCWEVKBTIJXSA-INIZCTEOSA-N 414.428 2.126 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 734276832 SRJNTFGFZYBFTN-IBGZPJMESA-N 415.582 2.132 10 20 HECD O=C1CCc2cc(F)c(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2N1 741097463 RPBCGOAWAZEGLN-UHFFFAOYSA-N 408.433 2.342 10 20 HECD Cc1nsc(N2CCCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 743859998 NPLABEMKJADHFI-UHFFFAOYSA-N 402.568 2.083 10 20 HECD CC[C@@](C)(NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)OC 748676383 WBQFKNBQMZZRRF-OAQYLSRUSA-N 410.382 2.442 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)c1 749349359 KILVVXXBEAAZFW-SFHVURJKSA-N 418.563 2.356 10 20 HECD O=C(COC(=O)/C=C\c1cccc(O)c1)NCc1ccc(N2CCOCC2)c(F)c1 753461398 MJYJPBJICXDRAU-ALCCZGGFSA-N 414.433 2.241 10 20 HECD COc1ccc(N2CCN(C(=O)CCNC(=O)c3ccc(C)cc3O)CC2)cc1F 754027933 KLXCEHNCBVBVLZ-UHFFFAOYSA-N 415.465 2.317 10 20 HECD COc1cc(N2CCN(CN3C(=O)[C@@H]4[C@H]5CC[C@@H](C5)[C@H]43)CC2)cc(OC)c1OC 758965669 SSXQMOIZPICBCK-IQGAEYHTSA-N 401.507 2.049 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)c(=O)c4ccccc34)cc2)CC1 759323502 NQQWBPZXUSEUQG-UHFFFAOYSA-N 418.497 2.137 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)c1 759434021 CPPWCNSYAARDTC-UHFFFAOYSA-N 421.519 2.335 10 20 HECD Cc1ccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cn1 764884919 IRIYMRMUCNMJCW-OVCLIPMQSA-N 405.526 2.439 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H]3[C@@H](CCCN3C)C2)c1 765105772 KUUDMXIDLWEAHE-PGRDOPGGSA-N 401.551 2.343 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)cc1 766319470 NWMQILCBVURVMO-UHFFFAOYSA-N 400.526 2.107 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(=O)(=O)N(C)C)ccc1O 767873824 DSQXCIZVUHFKHU-UHFFFAOYSA-N 405.520 2.371 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1OC 768451070 LSKLURBSGHVIIN-FUHWJXTLSA-N 405.539 2.222 10 20 HECD CN1CCN(c2ccc(Cl)cc2NS(=O)(=O)c2cccc3nonc23)CC1 769276977 PQFSXJITRIRFFS-UHFFFAOYSA-N 407.883 2.429 10 20 HECD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362454 MCHVBFLAZHWLBY-UHFFFAOYSA-N 419.865 2.187 10 20 HECD COc1cccc(NC(=O)CN(C)C(=O)CN[C@H](C)c2cc(OC)ccc2O)c1 775365003 TXQIBZBKVFNFNH-CQSZACIVSA-N 401.463 2.157 10 20 HECD Cc1cc(S(N)(=O)=O)cc(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)c1C 775832801 CCRMKWASEQNPGF-HNNXBMFYSA-N 404.536 2.306 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(F)c(F)c3)CC2)cc1 778237537 PTDLWBGSLUJVES-CMDGGOBGSA-N 415.440 2.495 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC3(O)CCCCCC3)CC2)cc1 778286488 OZHIFQOROZYBBV-NRFANRHFSA-N 405.583 2.195 10 20 HECD COCC(=O)N1CCc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)ccc21 778730636 WYMLOLFFHHLERV-OAHLLOKOSA-N 424.501 2.104 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]nc3-c3ccsc3)nc12 781314964 MTSYILYELMKDRO-UHFFFAOYSA-N 413.415 2.420 10 20 HECD CN(C)CCN(Cc1ccc(F)cc1F)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422105 IIKLACCQYPFSKV-UHFFFAOYSA-N 418.488 2.237 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CN1C(=O)OC(C)(C)C 785439952 XULHRAMRTJEIQU-HZPDHXFCSA-N 418.538 2.225 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4cncn4)cc3C)cc2)CC1 786661336 TULKQCHKVZRUGP-UHFFFAOYSA-N 418.501 2.174 10 20 HECD C[C@@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 787954873 XMDSMUQHFDQRFD-SFHVURJKSA-N 424.545 2.175 10 20 HECD CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788912642 YFRKBBSTIABVHA-KRWDZBQOSA-N 416.522 2.029 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccs1 789799503 HVQJVPIMECGXPK-OAHLLOKOSA-N 419.522 2.335 10 20 HECD CCC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 805023648 YQEGTPZLSCZGIN-UHFFFAOYSA-N 414.550 2.010 10 20 HECD COC(OC)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 806539196 JQVSYYRTLICVAM-OAHLLOKOSA-N 401.463 2.203 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCOC2(CCSCC2)C1 807289682 DYAJNNXQBWLOEA-SFHVURJKSA-N 415.559 2.240 10 20 HECD CS[C@@H](C)CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769427 FUCGWPDXSMRADM-QWHCGFSZSA-N 401.479 2.241 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(C)[C@H]3[C@@H]3CCCO3)CC2)cc1 810024777 RHVOWGWURRQACX-ILWGZMRPSA-N 403.567 2.068 10 20 HECD Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915659839 AUBPKQBSXYZOGA-UHFFFAOYSA-N 422.478 2.490 10 20 HECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCSCC2)cc1)N1CCN(C)CC1 916258478 XSFSQNIKUKTDTD-NRFANRHFSA-N 419.639 2.311 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)Nc4ccccc4)CC3)nc12 917060135 VBAOIXHLHUGUEZ-UHFFFAOYSA-N 423.473 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccccc3OC)CC2)cc1 920254856 QOKFPYZWFZFKOJ-QXMHVHEDSA-N 423.513 2.268 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(CC2CCCC2)c1C 1116860493 UIGVSZQRVUKMSF-INIZCTEOSA-N 416.478 2.092 10 20 HECD CCOc1ccc(N2CCN(c3ccc(S(=O)(=O)NC)cc3[N+](=O)[O-])CC2)cc1 1320358613 CPASLLJUYTZAOI-UHFFFAOYSA-N 420.491 2.228 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)c[nH]1)c1cc(O)nc(O)c1 1797011723 YKXQVPGCPJLIOJ-CLLJXQQHSA-N 424.379 2.405 10 20 HECD O=C(C1=COCCC1)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550232 FMQTVPBZINJQPY-UHFFFAOYSA-N 401.463 2.032 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)C(F)(F)Cl)CC2)C1 1810550902 WHIQHSKRFQRUON-UHFFFAOYSA-N 403.813 2.169 10 20 HECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 110946460 NBEHCZWUSJXZHY-UHFFFAOYSA-N 418.519 2.355 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)N(C)C[C@@H]2COc3ccccc3O2)c(O)c1O 727003703 CVCAYGPEDHOJMO-ZIAGYGMSSA-N 401.415 2.250 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 734073398 JKKBLEAFNSJLOY-UHFFFAOYSA-N 415.515 2.254 10 20 HECD CC(C)(C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)n1cc([N+](=O)[O-])cn1 735828901 UCXJUCUAWISYEE-UHFFFAOYSA-N 401.467 2.052 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@]3(C(=O)OCC)CCc4ccccc43)nc12 735875140 ZHEAGUKSAFDXFX-JOCHJYFZSA-N 424.457 2.106 10 20 HECD CC(=O)NC[C@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 742615585 UXELXNSPENIWJW-MRXNPFEDSA-N 419.481 2.249 10 20 HECD CC1CCN([C@H](C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 743334144 OOGCBGHJSBSEIN-UYAOXDASSA-N 415.582 2.308 10 20 HECD Cn1nc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)c2ccccc2c1=O 749132124 XOUULYKPLOTOJX-UHFFFAOYSA-N 404.451 2.402 10 20 HECD O=C(c1cccc(CN2C(=O)CNC2=O)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 752150043 QSVVPKCDKXFHCC-LJQANCHMSA-N 423.469 2.265 10 20 HECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1C(=O)NCc1ccc(N2CCOCC2)cc1 752901579 CLDYHAXSBNTFTL-UXHICEINSA-N 402.539 2.454 10 20 HECD CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)Nc1ccc(O)cc1C 761271777 NVVGADWKPRIPNI-UHFFFAOYSA-N 400.478 2.272 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(O)c3)cc2F)C[C@H](C)O1 762849757 RHSIAWSFDIEOFW-KBPBESRZSA-N 417.437 2.013 10 20 HECD O=C1NC(=S)S/C1=C/c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1 763109839 VOBILYJCYQZJCH-WUXMJOGZSA-N 410.864 2.198 10 20 HECD Cc1cc(C(=O)CN2CCN3C(=O)OC[C@H]3C2)c(C)n1-c1ccc2c(c1)OCCO2 763714705 MARIPHSGDQZUGP-QGZVFWFLSA-N 411.458 2.184 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 764894361 GBAVCGFWQFIUSN-IBGZPJMESA-N 411.506 2.292 10 20 HECD C[C@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)C[C@H](C)O1 765063372 YNCMRXIVWNOALU-STQMWFEESA-N 416.459 2.273 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC[C@@]2(C)NC(=O)NC2=O)cc1 771832267 KHZXHCITVPQBLU-PGRDOPGGSA-N 416.522 2.029 10 20 HECD Cc1cc(N2CC[C@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)n(C)n1 773030904 XUJAJSPNOFMSTO-YJBOKZPZSA-N 401.486 2.160 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1 774356747 MBQXXEKZQXGQTO-UHFFFAOYSA-N 405.401 2.274 10 20 HECD COCc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 774776097 POUVQPPMSQXJRO-UHFFFAOYSA-N 408.495 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](C)c3ccc([S@@](C)=O)cc3)CC2)cc1 775620439 YXKRCVLUBSSWFD-CQGGRAHPSA-N 415.559 2.432 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C)n([C@@H](C)CC)n3)nc12 778159766 JUXLXIPLRCFOCU-NSHDSACASA-N 401.423 2.445 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3Cc4ccccc4O3)CC2)cc1 778237430 PCPWWOXVZFQEKH-ZJVMWOEPSA-N 421.497 2.020 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCC[C@H]3CCO)CC2)cc1 779518896 HMRPACLHVNAXHJ-RXVVDRJESA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)N(C)c3ccccc3)CC2)cc1 787638450 MLTWQSBQVHTCMZ-IBGZPJMESA-N 424.545 2.375 10 20 HECD CCS[C@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321069 SJTRTDMFBCWBIN-OALUTQOASA-N 405.564 2.272 10 20 HECD C[C@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2sccc2C1 789720592 AAFUDCRKADKXIV-CYBMUJFWSA-N 424.617 2.366 10 20 HECD COc1cc(OC)c(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1 790107112 KAKZBNHQKLWMPF-UHFFFAOYSA-N 415.490 2.053 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1c(C)cc(O)cc1=O 791245714 FHWLSYVCVOYUSQ-UHFFFAOYSA-N 415.490 2.251 10 20 HECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)S1=O 792389336 SJLTVWIOKJCQBE-ZIAGYGMSSA-N 410.495 2.242 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2)c(O)c1 794376870 CJMSTFPBRAXODP-KRWDZBQOSA-N 424.544 2.117 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)[C@@H](C)C1 804852382 ABYJMZYRLXKEND-LPHOPBHVSA-N 406.546 2.477 10 20 HECD CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2 807361787 BVFYOHZSTOVMEK-UFYCRDLUSA-N 415.534 2.031 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](n4cccn4)C3)cc2F)C[C@@H](C)O1 812874735 FOVSVTKQUUWEQD-SCTDSRPQSA-N 415.513 2.199 10 20 HECD NC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cccs1 919969125 ORYLXIWKUWYIMX-GOSISDBHSA-N 416.547 2.373 10 20 HECD CC(C)CN1C(=O)/C(=C/NC2CCN(Cc3ccccc3)CC2)C(=O)NC1=S 920976570 LBRAUEJIHMSHFG-LDADJPATSA-N 400.548 2.024 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OCC)cc3)CC2)o1 1116410036 QOIIYCCUORBTBJ-UHFFFAOYSA-N 408.476 2.366 10 20 HECD C[C@H]1CCCN(C(=O)CCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 1122406907 MPZGONHZFDPABL-SFHVURJKSA-N 402.539 2.313 10 20 HECD C[C@H]1C[C@]1(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1789783898 HOQQGICHKPAJMT-JOQLLSBZSA-N 422.909 2.391 10 20 HECD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)C1CC1 1813719124 XDHUYVRFAAKSRT-YSKVMHACSA-N 423.469 2.328 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727108 DTPQWTBXZLLABD-HGXZOFBTSA-N 402.476 2.221 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)CC2)cc1 303475498 RSFBXASNXQGHIP-INIZCTEOSA-N 414.428 2.080 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)CC2)cc1 725907694 RNCAVSDMJVSFPM-UHFFFAOYSA-N 423.922 2.349 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCCN(CC)C3)cc2F)CC1 730126923 VSGPYMBGQFWZHA-IBGZPJMESA-N 405.562 2.499 10 20 HECD Cc1nc(COc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)no1 731126606 WLFGANPZTVXTGK-UHFFFAOYSA-N 409.446 2.278 10 20 HECD COc1ccccc1[C@H](CO)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 734942725 QNBWCYCAABBYDS-SFHVURJKSA-N 403.454 2.204 10 20 HECD O=C(NC[C@H]1CCCO1)c1c(NS(=O)(=O)c2cnc[nH]2)sc2c1CCCC2 736540190 VPQAQTOHGGLUQB-LLVKDONJSA-N 410.521 2.060 10 20 HECD COC(=O)[C@@H](O)C1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 747402268 IIMONROEOBGTKY-FQEVSTJZSA-N 403.523 2.378 10 20 HECD CNC(=O)CN1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 747587801 KTEYYKVHWJCOTE-UHFFFAOYSA-N 402.926 2.180 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)C1 751097461 KOKBEIWBAMMNPV-CQSZACIVSA-N 400.410 2.366 10 20 HECD C[C@]1(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO[C@H]1C1CC1 753123201 XOBGWSXGXSTGLG-LZNRXBQRSA-N 400.523 2.145 10 20 HECD COC(=O)c1cc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc([N+](=O)[O-])c1 753732178 RDPUXQKRIFFBFA-UHFFFAOYSA-N 417.393 2.492 10 20 HECD COCC(C)(C)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 756374774 YOZJZHLJUYGEND-GASCZTMLSA-N 410.486 2.271 10 20 HECD Cc1c(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cnn1C 757258104 IJOXLOFHSLOZDM-UHFFFAOYSA-N 407.421 2.054 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2cccc(Cl)c2O)C1=O 757906152 KCXCYPRPFUCNET-UHFFFAOYSA-N 402.838 2.151 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)N1CCC2(CC1)OCCO2 759771988 VQNKCIYLQPUBHJ-UHFFFAOYSA-N 409.552 2.192 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCCN3C3CC3)cc2)C1 764848911 FOIIZGADHSFQNK-NQIIRXRSSA-N 413.566 2.204 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1 769540210 GSOKWAUJLNUFDA-ZACQAIPSSA-N 420.531 2.314 10 20 HECD CCOC(=O)CN(CCc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769813755 BTNLUIJVIRAAEQ-UHFFFAOYSA-N 420.487 2.012 10 20 HECD O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1ccc(N2CCCC2)cc1 773784068 DCGIASRRBKTPSE-UHFFFAOYSA-N 409.458 2.160 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1O 774978631 XUMQIVXCMKXPBD-GFCCVEGCSA-N 409.464 2.410 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 775501317 HDUARILGQCFJJO-HNNXBMFYSA-N 412.490 2.467 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3scnc3C)CC2)cc1 778266129 LPDBISATKKTQNM-HJWRWDBZSA-N 414.531 2.324 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)C3CCC(OC)CC3)CC2)cc1 778280819 YAMTUSZNIYBVGR-OUKQBFOZSA-N 415.534 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(CC(F)F)c3)CC2)cc1 778284741 REFBXICZFHLHNK-VOTSOKGWSA-N 419.432 2.000 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC(N4CCCCC4)CC3)CC2)cc1 779221679 MFBCYAUUKMIAPE-QHCPKHFHSA-N 416.610 2.128 10 20 HECD CCC[C@H]1C[C@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 780157003 AVEBAIZTOOGYET-XLIONFOSSA-N 404.507 2.482 10 20 HECD O=C(C1CCCC1)N1CC(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)C1 781522621 CTPYGODJPFOJJY-UHFFFAOYSA-N 423.604 2.060 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)ccc1-n1nnnc1C(C)C 784670524 JUMLIKJDILYTAH-UHFFFAOYSA-N 408.462 2.397 10 20 HECD CO[C@@H]1Cc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2C1 784689655 KALCAXBIKDZRJR-OPAMFIHVSA-N 423.513 2.453 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n(Cc2ccccc2)n1 785298753 YRCOKOPQYKKZAM-AWEZNQCLSA-N 408.458 2.337 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1nc(C)cs1 788309235 DFQWGYZBZPSXPT-QGZVFWFLSA-N 402.520 2.172 10 20 HECD Cc1cnc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789856565 VYXSKUGEYUZKKL-CQSZACIVSA-N 404.561 2.498 10 20 HECD COc1ccc([C@@H](CNC(=O)c2c(F)ccc(O)c2O)N2CCOCC2)cc1OC 790069399 AXSYDHQIWLKMTR-OAHLLOKOSA-N 420.437 2.057 10 20 HECD C[C@@H]1OCC[C@]12CN(CC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CCO2 791584506 HKSRRPMVOWIWQQ-OWJWWREXSA-N 420.465 2.280 10 20 HECD CCOc1ccc(CN[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c(O)c1 793245957 FOHXFNMGMJNURV-FQEVSTJZSA-N 401.511 2.101 10 20 HECD O=C1CC[C@@H](OC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C(=O)N1 798590819 UWBQMELNNDEYOH-LWMMSDEHSA-N 424.525 2.078 10 20 HECD CN(C)c1ccc(CN(C(=O)NCc2cccc(CS(N)(=O)=O)c2)C2CC2)cc1 800719184 SCXOCCURMJAYPY-UHFFFAOYSA-N 416.547 2.415 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 803306400 TXMFAYBOBJFQTM-KRWDZBQOSA-N 411.502 2.368 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3nc(C4CC4)cs3)CC2)cc1 804317998 VNYMTZRIPCAJES-UHFFFAOYSA-N 414.531 2.431 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCC[C@H]3C)cc2F)CC1 805007959 WGFMASUNEYLZRS-SJLPKXTDSA-N 404.530 2.136 10 20 HECD C[C@H](CCc1cccn1C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807651423 YZECZROBJZLGQP-XLIONFOSSA-N 413.518 2.376 10 20 HECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCO1 807952043 CTBABFNYMSZALV-RDJZCZTQSA-N 423.941 2.066 10 20 HECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F 808114075 PPMWMWNXWOGKLG-UHFFFAOYSA-N 408.860 2.236 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnn(C)c4C4CC4)n3)CC2)cc1 809465508 XCVRYGVVDNOKLZ-UHFFFAOYSA-N 422.489 2.247 10 20 HECD COc1cc(Br)cc(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)c1O 809688551 LUZRSINFNILIMK-LBPRGKRZSA-N 421.357 2.267 10 20 HECD CC(C)C(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917836396 NGHNLBGNYQZHOP-UYAOXDASSA-N 414.550 2.042 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)c1 918305120 BSHPCZSVSAJABI-UHFFFAOYSA-N 413.474 2.210 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 919815834 FQPYQGTTXDNKFN-UHFFFAOYSA-N 421.544 2.247 10 20 HECD COCc1ccc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 920256255 VQXLFBOVIVIOSX-VAWYXSNFSA-N 423.513 2.363 10 20 HECD COc1ccc(C)cc1NC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637309 DZDFVXHOOBQJER-GFCCVEGCSA-N 422.459 2.265 10 20 HECD NC(=O)c1ccc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc1 1342883544 MCXPWTBCWOJRMV-UHFFFAOYSA-N 407.453 2.048 10 20 HECD CC(C)(C)OCC(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806573574 PRVJJLNLBQSNTI-UHFFFAOYSA-N 405.495 2.153 10 20 HECD CC(C)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425982 FUYJVUQICOIDMO-SFHVURJKSA-N 418.538 2.114 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C/c3ccc4c(c3)OCO4)CC2)cc1 23472066 CMCHUFJFPOGGTN-YCRREMRBSA-N 424.453 2.329 10 20 HECD COc1ccc(C(=O)NCc2ccc(N(C)C)c(F)c2)cc1S(=O)(=O)N(C)C 60214236 QVRYUAGPUUSHKX-UHFFFAOYSA-N 409.483 2.081 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ncnn2-c2ccccc2)n(C)c2ccccc12 557934616 FIUKCSCOKMGFCV-UHFFFAOYSA-N 402.458 2.000 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)Nc3cccnc3)cc2F)C[C@H](C)O1 725863244 AXIKTZNJYNZUPZ-GJZGRUSLSA-N 415.469 2.272 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC(=O)N1CCc2ccccc2C1 726617758 AUAFJSFSZOSUFR-UHFFFAOYSA-N 422.529 2.250 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C(=O)c4ccccn4)CC3)CC2)cc1 726714024 BHEZXDSQBPHLKS-UHFFFAOYSA-N 423.517 2.227 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1F 731408432 KQRARWSXWNAUTA-UHFFFAOYSA-N 414.437 2.372 10 20 HECD COC(=O)COc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1 733900482 ZFGTZOALTYBCRC-UHFFFAOYSA-N 402.519 2.156 10 20 HECD C[C@H](NC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 743321589 HWMQRNFIBSRTLC-OXJNMPFZSA-N 421.497 2.219 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC(OCC4CC4)CC3)CC2)cc1 743568464 XEXJFBJKXYYSET-UHFFFAOYSA-N 416.566 2.418 10 20 HECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NCc1ccc(N(C)C)cc1 743813413 YRYCPNYRAMFHAE-KRWDZBQOSA-N 405.524 2.247 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1 743889692 SJTCOAHTBKZIQJ-UHFFFAOYSA-N 409.490 2.269 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 746355123 RMGVBGKQCUJBSB-BETUJISGSA-N 417.485 2.045 10 20 HECD CN1CCCc2cc(CNC(=O)NC[C@]3(N4CCOCC4)CCSC3)ccc21 746725042 XTFJRLCFUPVABD-OAQYLSRUSA-N 404.580 2.076 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCCCn3cnc4c(N)ncnc43)cs2)cc1 751931275 PBCVHXRXDDWQRO-UHFFFAOYSA-N 409.475 2.285 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc1F 753933431 WEPTWNPZPJRLBZ-HZPDHXFCSA-N 406.502 2.313 10 20 HECD C[C@H](NC(=O)N[C@H](CO)C[C@H](O)c1ccccc1)c1ccc(N2CCOCC2)cc1 754584933 YQLAOOCPMWCZOS-XJABCFGWSA-N 413.518 2.368 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 756094394 KNVDKTQBMGHECP-FMWKFLBASA-N 424.545 2.480 10 20 HECD COc1ccc(O)c([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1 756411416 PTPWOCYWEYINLY-MRXNPFEDSA-N 420.531 2.414 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(C)c3[N+](=O)[O-])CC2)cc1 758226621 YSBVGUUIJIHJEC-GOSISDBHSA-N 401.463 2.474 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN(c2cccnn2)CC1 765561544 HFJARTLODUKNHO-UHFFFAOYSA-N 406.284 2.413 10 20 HECD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769618591 XDJMXYSMWSNFEN-ZDUSSCGKSA-N 415.475 2.178 10 20 HECD COc1ccc(/C=C/C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1O 772320570 TVAXYLXCAMHLFO-DBEXCURXSA-N 409.486 2.432 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@@H](C(=O)N(C)C)O3)cc2)CC1 774715887 LTQFHISMZRCGHN-PMACEKPBSA-N 402.539 2.358 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)Cc3cccc(O)c3)CC2)cc1 778388172 CPDHZZYDGCTPDS-ZGKFYVQTSA-N 423.513 2.353 10 20 HECD CNS(=O)(=O)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(C)c2)c1C 783192627 ZXUOTHCAWPKOEP-UHFFFAOYSA-N 406.504 2.376 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3cc(C(F)(F)F)nc4ncnn34)cc2)CC1 786075232 UEAYXYONUTVPAX-UHFFFAOYSA-N 419.411 2.424 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CSCc3cscn3)cc2)CC1 786257202 OPGFWTVSIIOJBY-UHFFFAOYSA-N 404.561 2.361 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCS(=O)(=O)c1ccccc1 788734284 KYSMQNXNCSPUCN-UHFFFAOYSA-N 418.515 2.111 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCc2c(O)cccc21 789742069 CEKTXIBWRFCUCE-FQEVSTJZSA-N 414.527 2.363 10 20 HECD C[C@@H]1CN(C(=O)c2ccc(CNC(=O)c3c(F)ccc(O)c3O)cc2)C[C@@H](C)O1 790068855 FVIRYXXUSVDJGJ-CHWSQXEVSA-N 402.422 2.416 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCC(O)CC3)cc2F)C[C@H](C)O1 795644725 CCEPDQKSEFKVOK-QEFXCSQDSA-N 422.497 2.150 10 20 HECD COc1ccc(CNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)c(O)c1 796350990 RHOPFJVUJNUCNL-UHFFFAOYSA-N 417.443 2.428 10 20 HECD C[C@H]1c2nncn2CCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676858 SZIQDMNQYMVCRL-INIZCTEOSA-N 410.522 2.267 10 20 HECD CS(=O)(=O)C1(CNC(=O)NCc2ccc(N3CCSCC3)cc2)CCCC1 804970577 YCAXUWFDUCKFMI-UHFFFAOYSA-N 411.593 2.396 10 20 HECD CC[C@@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@@H](C)S1(=O)=O 805396656 PNLAOEPCHHXZER-HZPDHXFCSA-N 424.588 2.439 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1 807101567 ZNCCRHNYANVNKX-INIZCTEOSA-N 406.490 2.135 10 20 HECD C[C@@H]1C[C@]2(CCO1)CN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C[C@@H](C)O2 807673336 QWROJJGATKYKHE-PEOGOYOCSA-N 403.523 2.115 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C3(c4ccccc4)CC(=O)C3)cc2)CC1 811358103 MVBMBGPAEZDFMG-UHFFFAOYSA-N 405.498 2.272 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnc1C 813653879 FAMMBWNAAVQQQE-UHFFFAOYSA-N 419.503 2.086 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1 815612709 VDAMJCCSFRUMEU-QMMMGPOBSA-N 403.382 2.345 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(NC(N)=O)c3)CC2)cc1 920255887 YRDYGFNDCKDVGA-KTKRTIGZSA-N 423.473 2.029 10 20 HECD Cc1ccn(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)n1 1786917123 HSZXVIGYIVDXOT-UHFFFAOYSA-N 421.457 2.446 10 20 HECD O=C(c1cncs1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427170 QXFHZVQBLYYIGD-OAHLLOKOSA-N 416.503 2.496 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(CS(C)(=O)=O)cc1 7019784 DDYREDODJANOHW-UHFFFAOYSA-N 418.515 2.113 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(C(N)=O)cc(C(N)=O)c3)ccc21 590807778 WHAXUJLJRMLTAE-UHFFFAOYSA-N 408.458 2.355 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1 729033000 GBUPTZFRADALMC-LBPRGKRZSA-N 409.464 2.465 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 729484062 GSXWHUFZIPYEKO-MRXNPFEDSA-N 405.495 2.314 10 20 HECD C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc2c(c1)CCCN2C 735518850 MVEYQFRHYDOKCI-IBGZPJMESA-N 422.577 2.474 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccc(-n4cccn4)n3)cc2F)CC1 736478289 HSWOJOIYTVFLHF-UHFFFAOYSA-N 408.481 2.478 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741058014 OBBPMGLKLAWXTI-UHFFFAOYSA-N 408.458 2.287 10 20 HECD CNC(=O)Cn1cnc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 741998244 WJPMHGIHDNAFNX-UHFFFAOYSA-N 400.870 2.266 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCc3nc4ccccc4[nH]3)CC2)cc1 742939896 LGVSXMOXNANYIA-UHFFFAOYSA-N 422.533 2.235 10 20 HECD NC(=O)[C@@H]1CCCN(CCCNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 745829492 FQSRJBCRFQJWFD-GOSISDBHSA-N 414.506 2.284 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)c1c(F)cccc1Cl 748396421 OMHKOMIITNIZFE-ABKXIKBNSA-N 416.858 2.408 10 20 HECD Cc1cc(C(=O)NC[C@@H](O)CS(=O)(=O)c2cccs2)c(C)n1-c1ccccn1 752340334 NFXNULZSUAJUMZ-OAHLLOKOSA-N 419.528 2.115 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)NCc3ccc(N4CC=CC4)cc3)C2)nc1 753197351 FVOWMONMMQENBF-UHFFFAOYSA-N 421.501 2.323 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@H]3CCN(C)C[C@@H]3C)cc2F)CC1 754370867 WDVABUGAKGNQER-PXNSSMCTSA-N 405.562 2.449 10 20 HECD C[C@H](NCCNS(=O)(=O)Cc1ccon1)c1cc(Br)c(F)cc1O 756635107 PMXZZWTTZIGCLH-VIFPVBQESA-N 422.276 2.052 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(C)n3C3CC3)CC2)cc1 758194319 XEEKGJQCEQVQKN-SFHVURJKSA-N 403.552 2.205 10 20 HECD COc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c(O)c1 759223629 RRMITQRIOJQWEK-UHFFFAOYSA-N 402.447 2.389 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)[C@H]4Cc5ccccc5CN4C3=O)cc2)C1 761117167 DMYXLYHUIJKBEE-PZJWPPBQSA-N 418.497 2.277 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3ccc(OCC(=O)O)c(F)c3)ccc21 761286316 HFSBWFYXDBIPOK-UHFFFAOYSA-N 408.451 2.150 10 20 HECD O=C(COC/C=C/c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 763279272 AOMMETVIOATOOQ-QPJJXVBHSA-N 414.527 2.268 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1 765564346 DKQAZMLVSITYQU-UHFFFAOYSA-N 409.534 2.201 10 20 HECD CCOCCCN1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H](C)C1 765976821 AZHXAQWUGADPQX-DENIHFKCSA-N 423.623 2.148 10 20 HECD O=C(Nc1cnn(-c2ccncc2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 768712180 AASRIBGBTPCEQY-IBGZPJMESA-N 421.457 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCO[C@@H](C)C4)n3)CC2)cc1 771069522 WLNYTGZNHHISKO-JKSUJKDBSA-N 400.479 2.252 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCn3ccnc3)cc2F)C[C@@H](C)O1 774738246 OATBZRDEHAXFSI-HDICACEKSA-N 417.529 2.274 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N(C)C)c1 774947108 MUYXSIGFJHWMBA-HRAATJIYSA-N 412.534 2.358 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2ccc(Cl)s2)c1O 775038529 UQJNBFYPXSNGIS-UHFFFAOYSA-N 421.884 2.092 10 20 HECD COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 775258011 OISSSGDDGNRNOZ-UWJYYQICSA-N 414.502 2.400 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 775374107 XBXQAZIJGSSIFD-DAXSKMNVSA-N 406.435 2.106 10 20 HECD Cc1cc(S(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)c(C)o1 776563315 BVDKRZFUUHDETD-UHFFFAOYSA-N 404.469 2.231 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[C@H](n3cncn3)C2)c([N+](=O)[O-])c1Br 776839322 NGPOWYZCOPPNTK-QMMMGPOBSA-N 413.188 2.317 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCOc3ccc(F)cc3)CC2)cc1 779213619 GQFCFSJQZLIULE-OAQYLSRUSA-N 417.525 2.328 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1 779510157 ISKVWFACFFRRRQ-FNORWQNLSA-N 415.877 2.229 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3csc(-c4cnccn4)n3)cc2)CC1 786659033 FSSAPTBKDIYURF-UHFFFAOYSA-N 422.514 2.199 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(N3CCOCC3)c(F)c1)C2 793610769 YDWGBHGUKNPMQS-UHFFFAOYSA-N 419.522 2.129 10 20 HECD COc1ccc(CNS(=O)(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c(O)c1 795357147 BGSWSSLGDDZWGE-SFHVURJKSA-N 404.488 2.125 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795397326 PQHFZBMHQXSBRS-RDJZCZTQSA-N 418.538 2.165 10 20 HECD Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NCc1ccc(N(C)C)cc1 796642903 UJOOWDKGKYQCBD-UHFFFAOYSA-N 424.954 2.492 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)CC1 804761096 VUOAPYMDWFRIIR-XTKXOIQPSA-N 417.506 2.265 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21 806275854 XTHSXRADIGUPHT-WOPDTQHZSA-N 403.620 2.237 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)c1O 809765252 LRLULFVJEIYSPG-ROUUACIJSA-N 401.463 2.282 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c1 810042250 YBNGBWUQIPXRSO-UHFFFAOYSA-N 420.556 2.434 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(CN2CCCC2)on1 812476877 BRSOQZIKVNFTOE-UHFFFAOYSA-N 402.470 2.301 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CN(c5ccccc5)C[C@H]4C3)CC2)cc1 917082206 KWJWSOILJWAVEH-NHCUHLMSSA-N 420.557 2.412 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3O)cc2F)C[C@@H](C)O1 918138764 RRDKGAOGDWZJTN-VXGBXAGGSA-N 404.398 2.378 10 20 HECD COc1ccc(N2CCCN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)cc1 919786497 VPTQXXQFQDKUGH-UHFFFAOYSA-N 422.485 2.213 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccccc3OC)CC2)cc1 920255569 ZHAHETPYWXNBCP-QXMHVHEDSA-N 409.486 2.225 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)oc3C)CC2)cc1 1320023150 BWOINPIHJPGYBR-UHFFFAOYSA-N 421.519 2.199 10 20 HECD O=C(N1CCOCC1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 1320475816 NXYHGIGEQGZXRG-UHFFFAOYSA-N 417.510 2.155 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@@H]3C[C@H](O)c3cnn(C)c3)cc2F)CC1 1324777555 ZLTXUYTZHCHXCW-KNQAVFIVSA-N 401.530 2.399 10 20 HECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c1 1339378383 UBIKEBKEOORODI-HNNXBMFYSA-N 424.954 2.393 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242943 FDZSKBDPVDVKQG-GGNBYKKCSA-N 420.893 2.311 10 20 HECD CO/C=C(\C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285641 FCUSZXPYLOKEIU-ZBYHAXBZSA-N 402.447 2.005 10 20 HECD CO/C=C(\C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846357 TZGMTAIWZVFUSP-VNDWYCCKSA-N 401.423 2.072 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)C1 1846443308 ARSSOXBJWHLRTM-BTDLBPIBSA-N 403.237 2.493 10 20 HECD COC(=O)N(C)CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754952 SGWJHFLANUVTEF-MRXNPFEDSA-N 408.499 2.133 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCOC3CCOCC3)cc2F)CC1 745807194 ADOBAFFOCBMHJO-UHFFFAOYSA-N 422.545 2.353 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3cccnc3)CC2)cc1 748469948 MCMYPLGFAVSSEN-UHFFFAOYSA-N 413.474 2.141 10 20 HECD CCc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 751243445 QSDUMUDYMPQTOF-SFHVURJKSA-N 401.532 2.429 10 20 HECD COc1ccc(O)c([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1 756411414 PTPWOCYWEYINLY-INIZCTEOSA-N 420.531 2.414 10 20 HECD CN1C(=O)CCc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 758576161 LCVIQPKXAKIXAR-LJQANCHMSA-N 420.513 2.227 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](NC(C)=O)C3CCCC3)CC2)cc(OC)c1OC 759239680 OJAKPIMXMFSZSZ-HXUWFJFHSA-N 419.522 2.056 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1O[C@H]1CCOC1 760109677 IRICAFPHLGQHJJ-IBGZPJMESA-N 407.470 2.485 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc(C(=O)O)c1F 763283972 VKSUXHXQYIAFAS-UHFFFAOYSA-N 402.425 2.005 10 20 HECD O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)cn1 768302052 FPEAYMYMAZXYNH-UHFFFAOYSA-N 401.442 2.288 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccnc(-n2cncn2)c1 768913179 VXUJRQBGOJHTLT-QGZVFWFLSA-N 412.881 2.416 10 20 HECD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cc(C)cc(C)c1 769631420 YMKIHWVDTFZMSA-KRWDZBQOSA-N 406.460 2.025 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1 771181935 JQIDZACVIGJAAN-UHFFFAOYSA-N 415.512 2.050 10 20 HECD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779498885 GJXCGVDGQBGVOU-PMGBHYCQSA-N 413.449 2.422 10 20 HECD COC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 781732267 WDGCZFNOEASPJU-GASCZTMLSA-N 408.470 2.168 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 785296660 OMZKSRVJWWSNPS-KDOFPFPSSA-N 414.458 2.342 10 20 HECD CC(C)COCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 785550659 LTNDGYKJOVBYHH-IRXDYDNUSA-N 423.529 2.234 10 20 HECD Cc1cccnc1OC1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 788223481 BCACKWJDVKLICN-UHFFFAOYSA-N 405.476 2.151 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 788931976 KZQOPXVPPLPRGM-HNNXBMFYSA-N 415.494 2.042 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCCS3)cc2F)C[C@@H](C)O1 789816268 CNJCSJLXYMHYSN-BFYDXBDKSA-N 423.554 2.457 10 20 HECD CS[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 789824224 HEWCXODIRNUYTJ-HDEZJCGLSA-N 423.554 2.456 10 20 HECD O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832644 BQKJUVICGWMSMT-RYQLBKOJSA-N 417.525 2.346 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C12CCC2 789855014 HGGDMZJAPGUOQR-RTBURBONSA-N 417.575 2.320 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc([N+](=O)[O-])c1C 790490635 PXZHXHWJKHGICC-UHFFFAOYSA-N 419.459 2.399 10 20 HECD COCCC1(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCC1 803305335 LJMYQYPGZDJRMB-KRWDZBQOSA-N 403.523 2.023 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1 808105147 YDMYWAWQHZUWIL-GOSISDBHSA-N 415.534 2.342 10 20 HECD Cc1cnn([C@H]2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2)c1 812009963 LEIZFRFKRLVNTL-ICSRJNTNSA-N 410.522 2.050 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)cc1 916197218 XONIQEFWTNVPSO-PZJWPPBQSA-N 415.582 2.133 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(C(N)=O)cc3)cc2F)C[C@@H](C)O1 917918847 UDYLHVCIEVPTEL-OKILXGFUSA-N 421.494 2.017 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3COc4ccc(F)cc4C3)cc2)C1 1320297237 NZPZFTKTICYADK-WMZOPIPTSA-N 411.477 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H](Cc4nccn4C)C3)CC2)cc1 1323071085 MIPZYZYEEGETDG-LJQANCHMSA-N 411.550 2.032 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(F)ccc1-n1cccn1 1326849315 NDYRCJXTRAVQQS-INIZCTEOSA-N 413.405 2.327 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nccnc2c1)c1cc(O)nc(O)c1 1797589004 UKTRVIIDXDMPCG-MUJYYYPQSA-N 419.441 2.002 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc21)c1cc(O)nc(O)c1 1802527683 YUQCIVKCIWGTGD-ZMMAXQRCSA-N 407.470 2.475 10 20 HECD O=C(c1cccc2ccncc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250820 RFAKGPJZFHCDDO-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(c1ccc(OCC2CC2)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251307 RTMICMLVCTWVFJ-UHFFFAOYSA-N 423.469 2.412 10 20 HECD COc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1844982800 MMAUJKGPIGERBV-UHFFFAOYSA-N 417.849 2.286 10 20 HECD COc1ccc(-c2nc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)no2)cc1 138538791 BBHQFKPPMVKSRB-UHFFFAOYSA-N 419.415 2.179 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C)C[C@@H]3c3ccccc3)CC2)cc1 216735811 UQUUQMHICYEXBM-HSZRJFAPSA-N 408.546 2.333 10 20 HECD Cn1ncc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c(Br)c1=O 301244641 PKKCDKCZKIGMAW-UHFFFAOYSA-N 411.275 2.255 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21 734407440 WATPTXKKSJRHKJ-UHFFFAOYSA-N 414.531 2.272 10 20 HECD O=C(CN1CCOc2cc(F)ccc21)NCc1ccc(N2CCOCC2)c(F)c1 735672177 JUFMUGXNOCTULJ-UHFFFAOYSA-N 403.429 2.317 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCOC3)cc2F)C[C@@H](C)O1 740388304 LUDLLTWTEAVAJL-HLLBOEOZSA-N 408.470 2.025 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1 742241048 KYHAQBUNPZMGML-UHFFFAOYSA-N 418.450 2.179 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](CN4CCCC4)C3)cc2)C1 746413185 CIJGWPLZSVIEKL-VQTJNVASSA-N 413.566 2.016 10 20 HECD CCN(CC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1)c1ccc(OC)cc1 748305943 QSNAQDFHIZRZGV-INIZCTEOSA-N 406.508 2.025 10 20 HECD O=C1CSc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2N1 749731167 KZOMVYVCVZBGDC-UHFFFAOYSA-N 408.530 2.424 10 20 HECD COC(=O)c1ccccc1CS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 751013431 HNTTULYGMLJVBM-UHFFFAOYSA-N 422.478 2.069 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccccc3)[C@H](C)C(=O)OC)nc12 751033079 KZHBRAKXSQTWGC-SCLBCKFNSA-N 412.446 2.252 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN(C[C@@H]4CCOC4)CC3)CC2)cc1F 753920283 URUYDANATBKOPY-KRWDZBQOSA-N 420.529 2.167 10 20 HECD CC1(C)CN=C(N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)S1 754103657 JBRXSKJJNTULBV-UHFFFAOYSA-N 417.579 2.232 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)c3nccs3)CC2)cc1 754163981 IGKMITSECBAAHQ-MRXNPFEDSA-N 403.552 2.377 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-n4ccnc4)c3)CC2)cc1F 754211572 GKTRQNMHEQJVOM-UHFFFAOYSA-N 423.448 2.307 10 20 HECD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)CN(C)c3ccc4c(c3)OCO4)CC2)C1 756646374 VMIKUICZAVLRTA-MRXNPFEDSA-N 401.507 2.349 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 758222968 JYHMNNWAGQHZQY-SFHVURJKSA-N 417.462 2.174 10 20 HECD CCS(=O)(=O)NCC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 759042359 VUVFMDGZBJRYPV-UHFFFAOYSA-N 405.520 2.234 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N(C)C[C@H]1COc2ccccc2O1 759594737 IDWKAINFTHOHDW-ZYUDAIQPSA-N 413.426 2.341 10 20 HECD COC(=O)[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)C 759725358 FOEYQJISZBGVBH-QEEYODRMSA-N 423.529 2.233 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4ccnn4)cc3)cc2F)CC1 760389030 HPQAGBOWUPLNJT-UHFFFAOYSA-N 408.481 2.478 10 20 HECD COc1cc(S(=O)(=O)NCCCSc2nccs2)cc(C(=O)O)c1OC 761296553 KCUUITZUMKHUJX-UHFFFAOYSA-N 418.518 2.319 10 20 HECD Cc1cc(C(=O)COC(=O)Cn2cc([C@@H](C)O)nn2)c(C)n1-c1cccc(F)c1 762958144 MRNGPMOJADCEAT-CQSZACIVSA-N 400.410 2.304 10 20 HECD CC(C)NC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 767296777 BBUWZEJPNORHMD-FQEVSTJZSA-N 422.529 2.457 10 20 HECD CCS(=O)(=O)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 767777942 FEPPROWHLBTUSP-UHFFFAOYSA-N 411.593 2.349 10 20 HECD CC(C)(C)OCc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)no1 771233631 JPXMWUMSOJMUAU-UHFFFAOYSA-N 421.519 2.155 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)CCNC(=O)OCc2ccccc2)c1 771763363 WXGGVFGNYDSLTP-AWEZNQCLSA-N 408.476 2.308 10 20 HECD CN1CCN(c2ccc(CN[C@H]3CN(Cc4ccccc4)CC[C@H]3CO)cc2)CC1 771841819 LPSAJVTYXNGCHD-ZCYQVOJMSA-N 408.590 2.411 10 20 HECD COc1ccc(CNC(=O)[C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 772777712 XUNIBFYAGVOTBC-OYVUYXNMSA-N 401.415 2.376 10 20 HECD C[C@@H](NC(=O)NCCN(C)S(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773394883 ARHMIHLHEHMSAT-CQSZACIVSA-N 410.565 2.495 10 20 HECD CC(C)(C)OC(=O)NC[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 776017468 NVMUQGLSUZFTHY-KRWDZBQOSA-N 409.502 2.388 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3nc(C(F)(F)F)n[nH]3)CC2)cc1F 776257862 VEIATIKLKIQUFN-UHFFFAOYSA-N 402.352 2.003 10 20 HECD CC1(C)CN(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 776861551 KLQTXJAMWORARS-AWEZNQCLSA-N 419.494 2.202 10 20 HECD CCCCN(CCOC)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778267668 DJCHDPGQPIDRDR-ZHACJKMWSA-N 403.523 2.175 10 20 HECD COc1ccc(N2CCC(Nc3cccc(S(N)(=O)=O)c3[N+](=O)[O-])CC2)cc1 779430806 XLMWXVJYYOJKLD-UHFFFAOYSA-N 406.464 2.332 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1CN1CCNC1=O 784023578 DOVXHFOAVRLMPG-UHFFFAOYSA-N 410.474 2.295 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(COC)ncn1 785192771 CYIGNKNONCNAIS-UHFFFAOYSA-N 423.267 2.078 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cc1 785424882 WFEKQTAJJNRXMU-GOSISDBHSA-N 414.575 2.459 10 20 HECD CN(C)CCN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785425421 PTIBGPRFRYUCES-UHFFFAOYSA-N 400.498 2.098 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2)CC1 786261953 HPCNQUDUTKVCEU-HXUWFJFHSA-N 424.476 2.236 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(-n2ccnc2C)nc1 787487402 WVEVXFWLHRKONW-UHFFFAOYSA-N 420.517 2.307 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 788669221 RSLUUASLKLMQCY-QZTJIDSGSA-N 421.453 2.348 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 796556999 SWRAMMTZBKTZNE-OWJWWREXSA-N 420.465 2.280 10 20 HECD CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C 800726525 NYRKKDHVXPHSAZ-UHFFFAOYSA-N 400.527 2.207 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803307646 JSTFJWCLSBCIMH-PXNSSMCTSA-N 405.539 2.268 10 20 HECD CCCCCNC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803665085 WQDHBAOYHSCACT-UHFFFAOYSA-N 420.529 2.053 10 20 HECD COc1cccc([C@H]2CN(C(=O)C(=O)NCCCSc3nccs3)CCO2)c1 806282716 QZNWMAUZLCXNAW-MRXNPFEDSA-N 421.544 2.350 10 20 HECD O=C(NCCc1ccc(Cl)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806592293 UYULVGPGORPBCB-QGZVFWFLSA-N 417.893 2.307 10 20 HECD Cc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)sc1C 807333533 LUCRGGIACSJEMJ-QGZVFWFLSA-N 417.531 2.332 10 20 HECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385163 CMOXZWHIBUOODB-UHFFFAOYSA-N 420.263 2.392 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1)c1ccc(N(C)C)cc1 807672891 JZYCWFZMAITVHW-VHJYZYJHSA-N 410.518 2.271 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807673025 LSTMICRPQBWYPP-AWEZNQCLSA-N 404.536 2.370 10 20 HECD CN(C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCSC1 807771865 YHQKRYCSNBHUIM-DZGCQCFKSA-N 413.490 2.337 10 20 HECD COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cc(OC)ccc2O)c([N+](=O)[O-])c1 811805577 XDOGSENJFAAKNB-LLVKDONJSA-N 403.391 2.212 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1 815612708 VDAMJCCSFRUMEU-MRVPVSSYSA-N 403.382 2.345 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 917364915 RWZZQYYQSPCTKB-GOSISDBHSA-N 413.430 2.238 10 20 HECD CCC[C@@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971245 NHHWKBBIDRFXRA-NVXWUHKLSA-N 405.514 2.440 10 20 HECD CCOC(=O)[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 1318368757 GSYDCLBKKIOZHP-KRWDZBQOSA-N 422.393 2.442 10 20 HECD O=C(CCOc1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599191 COZKNOCABOXQFN-BJWYYQGGSA-N 411.458 2.214 10 20 HECD CC/C=C(\C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770035 BQHBSQDPNCRRGI-QEJRZYKFSA-N 408.882 2.311 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccoc2cn1)c1cc(O)nc(O)c1 1800870320 GREAWQUBYZPTCK-QDMKHBRRSA-N 408.414 2.200 10 20 HECD COCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423841 KJIBPJALPMKCEU-QGZVFWFLSA-N 405.495 2.153 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccccc2O)C1 1842316073 GWGWQRTUKTZREH-UHFFFAOYSA-N 418.453 2.002 10 20 HECD Cc1occc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441417 VBTJFYNSHBEAAZ-UHFFFAOYSA-N 406.442 2.198 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(C)c1 60749673 TVACJFPLSBNMQQ-UHFFFAOYSA-N 408.502 2.382 10 20 HECD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 106159033 LWEASYFRNRLXHI-UHFFFAOYSA-N 403.504 2.399 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 437003998 COSGVNABZPHXGZ-UHFFFAOYSA-N 401.488 2.233 10 20 HECD Cc1c(CNC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)n(C)c2ccccc12 472221768 KPFHRMLRWGCHNM-MRXNPFEDSA-N 407.522 2.275 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Oc3cccc(C(=O)NCC(N)=O)c3)ccc21 734715248 KFMTWVWNOIOILS-UHFFFAOYSA-N 423.469 2.339 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 735392682 HXPPHHJGPNMQBD-UHFFFAOYSA-N 410.474 2.180 10 20 HECD COc1cc(F)ccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 738896276 NNIRTRRZLFFSEN-UHFFFAOYSA-N 407.467 2.391 10 20 HECD COc1ccc([C@H](CNC(=O)NCc2cccc(OC)c2O)N2CCOCC2)cc1 745289079 GARONKYXUQXADQ-IBGZPJMESA-N 415.490 2.282 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Br)nc1 746589381 LWLSQOVQZHRFKD-UHFFFAOYSA-N 424.320 2.009 10 20 HECD CC(=O)N1CC[C@](C)(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 746834701 VFLVKKPVTOZVKO-IBGZPJMESA-N 413.440 2.417 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)CC2)cc1F 753741460 FYOGHKHXPKECQY-UHFFFAOYSA-N 423.448 2.081 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@]3(N(C)C)CCC[C@H](C)C3)CC2)cc1 758202245 HGMHLSAGSKPSRH-FJIJXJHWSA-N 418.626 2.278 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCc1nc[nH]n1 759218880 LTTQXWRVFTXTGT-XFXZXTDPSA-N 407.546 2.207 10 20 HECD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NCCCSc1nccs1 759554217 SDRKQPQTFJZKHK-UHFFFAOYSA-N 414.578 2.375 10 20 HECD CNC(=O)Cc1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 759706862 LUZBQUUAXJCONV-FLIBITNWSA-N 408.530 2.254 10 20 HECD COc1cc(N2CCN(C(=O)c3c[nH]nc3-c3ccncc3)CC2)cc(OC)c1OC 760091053 WUUFJQZOGPBGGS-UHFFFAOYSA-N 423.473 2.460 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@@H](c4ccc(O)cc4)C3=O)CC2)cc1 760953342 ZLEJSJWTPFIUSP-NRFANRHFSA-N 424.501 2.206 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC[C@H]21 766878939 KRHXVYCQKGQYMJ-YLJYHZDGSA-N 404.530 2.413 10 20 HECD CC(C)(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 767288752 FNKNRRMLVXSNGO-UHFFFAOYSA-N 422.469 2.372 10 20 HECD COc1cccc(CNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c1O 769499275 SFUAPMLNONBFMX-CQSZACIVSA-N 407.492 2.010 10 20 HECD C[C@@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 777720581 HVEQOMGYUZDAQU-VGSWGCGISA-N 418.559 2.485 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779473345 NLNGRHNATLHFFV-CSKARUKUSA-N 409.486 2.456 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H](CO)C1CCOCC1 782718788 NQJREXVHVTZRIP-GOSISDBHSA-N 413.465 2.344 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCc1cscn1 786625813 TYFFPSNTLGXKJO-UHFFFAOYSA-N 412.309 2.319 10 20 HECD C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)(C)n1cncn1 788563337 OZPLACSQRPGWQH-QGZVFWFLSA-N 424.528 2.447 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 790411296 JRQJSPYAAYDLBP-UHFFFAOYSA-N 404.441 2.102 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CCS(=O)(=O)c4ccccc43)CC2)cc1F 791052727 BGTPEIMORAEOTA-KRWDZBQOSA-N 418.490 2.444 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cnn(C)c3)cc2Cl)C1 793940088 VKYCOOPTMRDZIS-AWEZNQCLSA-N 403.914 2.242 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c(O)c1 797390306 TYBPIYKRYWDMKK-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCc1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 803297925 KFHKTEMXJLMZKY-AWEZNQCLSA-N 402.520 2.036 10 20 HECD CN(Cc1ccon1)C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450635 MYMLPDISSYJQGV-UHFFFAOYSA-N 408.405 2.020 10 20 HECD O=C1[C@@H]2C[C@H](F)CN2C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 804145742 DSNJXXBSIQOYOJ-WFASDCNBSA-N 401.360 2.417 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 806280986 KBPXAUWAYZNFBK-OAHLLOKOSA-N 409.508 2.481 10 20 HECD CN(Cc1ccccc1O)c1nnc(CN2CCN(C(=O)c3ccccc3)CC2)n1C 809824931 XBBQPZPOVXHKFT-UHFFFAOYSA-N 420.517 2.115 10 20 HECD CNC(=O)CN1CCC(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 914829716 NVMJUCPYFKLXPS-UHFFFAOYSA-N 411.550 2.146 10 20 HECD Cc1cc(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccn1 914907624 UHAYLXZCQUBKFZ-UHFFFAOYSA-N 415.471 2.372 10 20 HECD CC(C)C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 916590508 IFRKPZGKPVFLLI-HRCADAONSA-N 415.442 2.190 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc2c1OCCO2 918439223 VCUBZIDLBXRQIR-UHFFFAOYSA-N 413.499 2.266 10 20 HECD NC(=O)CSc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971433 XWKRKYSVTBILEV-UHFFFAOYSA-N 417.506 2.294 10 20 HECD Cc1cc(CC(=O)N2CCCN(CC(N)=O)CC2)c(C)n1-c1ccc(Cl)cc1 920450530 SCPKBLAJGWRHPH-UHFFFAOYSA-N 402.926 2.310 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2ncccc12)c1cc(O)nc(O)c1 1800998669 ZXZHFKHARUQBIZ-QDMKHBRRSA-N 419.441 2.002 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)C3CC3)sc2C1 1827475233 ALJSNBPAIJHICJ-WNPFHQFXSA-N 415.471 2.295 10 20 HECD CC1(C)CC(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)C1 1846420229 QNJAGMPRPNYKAA-FNORWQNLSA-N 400.475 2.456 10 20 HECD COc1ccc(CN2CCN(C(=O)CN(C)c3ccc(OC)c(OC)c3)CC2)cc1 63617959 DLKPFHQTOPVCFD-UHFFFAOYSA-N 413.518 2.493 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2)cc1 139805639 ZUSVEFBJVFQKBY-UHFFFAOYSA-N 412.489 2.426 10 20 HECD Cc1cccc(C)c1OC[C@@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 150044261 FFVRBTCJXWWXOB-NRFANRHFSA-N 413.518 2.379 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)COC)CC3)ccc21 590665507 BYKNTZURYGITAI-UHFFFAOYSA-N 401.507 2.272 10 20 HECD Cc1ccc(C(=O)OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c(O)c1O 727003786 GIGUEKHEJOBNOA-UHFFFAOYSA-N 418.490 2.251 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)c3ccc(Cl)cc3)CC2)cc1 727103469 JRGPTOBSTGIURD-UHFFFAOYSA-N 401.894 2.470 10 20 HECD O=C(CN1CCC[C@@H](C2OCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 728055712 XOADGHZWSFVJGV-OAHLLOKOSA-N 420.465 2.485 10 20 HECD COCCCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCS(=O)(=O)C1 729342253 RYVZNBVNMWZENJ-QGZVFWFLSA-N 405.520 2.155 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1O 737285059 YMEXHGYKSXOUFF-UHFFFAOYSA-N 417.849 2.436 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CCCCO)C3CC3)cc2F)C[C@@H](C)O1 741250131 INFRYKLSGMEMTE-CALCHBBNSA-N 407.530 2.292 10 20 HECD Cc1cc(CC(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 743755665 DSAJEXPZUDIIKH-UHFFFAOYSA-N 424.950 2.346 10 20 HECD CN1CCCc2cc(CNC(=O)NC[C@H](O)COc3ccc4c(c3)OCO4)ccc21 746981175 OEBYYHOXAURPOH-KRWDZBQOSA-N 413.474 2.037 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3sc([C@@H](C)OC)nc3C)nc12 750436943 CNKXOTFYXXLVDJ-SNVBAGLBSA-N 420.447 2.441 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)CC2)cc1F 753741238 FBSWSLCUKTZOAQ-UHFFFAOYSA-N 403.366 2.434 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757248966 SOKOYWLJGWVUIV-UHFFFAOYSA-N 424.423 2.464 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnn(C)c3C(F)F)CC2)cc1 758990632 HXIKQUCHDGKYFY-UHFFFAOYSA-N 407.421 2.090 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(-n4ccnn4)cc3)CC2)cc(OC)c1OC 759225632 RWBUOSFNEYCQNY-UHFFFAOYSA-N 423.473 2.256 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@H](Cc4ccccc4)C3=O)CC2)cc1 760948087 CTXHORCJIPGQLV-JOCHJYFZSA-N 422.529 2.370 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)c1 761973414 PQPXFYHMBXWBNO-CQSZACIVSA-N 415.490 2.195 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCc4cc(O)ccc4C3)cc2)C1 770302487 WSABABMMIBKWCX-WOJBJXKFSA-N 422.529 2.451 10 20 HECD COCc1cccc(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778238293 YUKUCLSIBHTTGR-ZHACJKMWSA-N 423.513 2.363 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(Br)n1 785302148 BKQKDYCDOYTIQD-JTQLQIEISA-N 408.252 2.250 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCc4c(O)cccc43)nc12 789248570 DFVHMGSXVOLUFE-OAHLLOKOSA-N 411.414 2.481 10 20 HECD O=C(c1c(F)ccc(O)c1O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 789946448 JNLGOQMKNWFDPR-UHFFFAOYSA-N 404.423 2.306 10 20 HECD C[C@@H]1OCC[C@@]12CN(CC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CCO2 791591994 YCNFXRNCNGPJOY-IZHWHUGBSA-N 420.465 2.280 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(F)c(S(C)(=O)=O)c1 792451717 PUTNBDRCXJJBHQ-UHFFFAOYSA-N 422.478 2.111 10 20 HECD CC(C)[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 794829792 GXOVREHONKLYHS-YJYMSZOUSA-N 416.482 2.172 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)c2cnc[nH]2)NC(=O)OC(C)(C)C)cc1 795248937 NCQLGIZZVVSVPQ-OAHLLOKOSA-N 409.512 2.020 10 20 HECD COc1ccccc1CONC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 798382824 ALJFWGPQQZUEGO-QGZVFWFLSA-N 412.490 2.328 10 20 HECD CC(C)[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 806336884 ZSTPAUCOPWADGF-GOSISDBHSA-N 420.554 2.377 10 20 HECD CC(=O)NCC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 806458207 WCHDRJKXOYRQDU-QGZVFWFLSA-N 406.502 2.110 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCO[C@@H](COc2ccccc2)C1)c1ccc(N(C)C)cc1 807673484 UMUQTBCWUYXISL-DYESRHJHSA-N 411.502 2.236 10 20 HECD CC(C)(C)OCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770979 QNFIKROANCMWNP-CQSZACIVSA-N 413.465 2.304 10 20 HECD Cc1cc(C(=O)N2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)c(C)n1-c1ccccn1 807900544 ZLCWYTKEFWZEAH-KRWDZBQOSA-N 416.547 2.423 10 20 HECD NC(=O)C[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 809318225 NGPHGUYQKLTHHD-GVIGZQTCSA-N 423.585 2.453 10 20 HECD COc1ccc(N2CCC(N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)CC2)cc1 809693525 WQROYOHZYWJSSX-MRXNPFEDSA-N 409.474 2.076 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2c(Br)nnn2C)cc1 810028538 LGGLXXIKPPDPEV-HNNXBMFYSA-N 422.327 2.465 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CO)C3CCCC3)cc2F)C[C@@H](C)O1 810114653 GHNYXWCOCGWOQF-YRNRMSPPSA-N 407.530 2.196 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 815446472 WRSPUNMWPJPRCY-UHFFFAOYSA-N 422.482 2.054 10 20 HECD Cc1cc(C(=O)O)ccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 871792490 CYHUTENCXKCHLS-UHFFFAOYSA-N 404.488 2.351 10 20 HECD CCN(CC(=O)NC(C)C)C(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 914905378 IBZXQEKNTKRVJC-UHFFFAOYSA-N 400.479 2.019 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 917751550 GKPRYIWUEXUXPH-UHFFFAOYSA-N 403.413 2.296 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C 920635005 AXZCSHPTQVOFMD-NFFDBFGFSA-N 412.508 2.250 10 20 HECD CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 920635064 CFSNAWRXVWMUHU-GFCCVEGCSA-N 420.443 2.150 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(c(OC)c1)O[C@H](C)C2 1116669082 FRAVVDQTIMZXBH-WBMJQRKESA-N 415.442 2.334 10 20 HECD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c[nH]1 1808774848 HFAQZTYGECWNSD-FOIQADDNSA-N 421.457 2.158 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F 116151259 RSFIVFYMCOVHLL-UHFFFAOYSA-N 406.439 2.307 10 20 HECD COc1ccc(N2CCN(c3ncnc4c3c(Br)nn4C)CC2)cc1 301182773 NVBBLXNHBDJEEN-UHFFFAOYSA-N 403.284 2.461 10 20 HECD COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 726611772 SRGYEHUMADKKQB-UXLLHSPISA-N 422.501 2.469 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1 727229560 CNMLKDXUVTVCLQ-UHFFFAOYSA-N 401.438 2.234 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c1O 727763011 XDXWQZFOLLGEQW-HNNXBMFYSA-N 424.544 2.488 10 20 HECD CSC[C@H](CCO)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 741078606 LTVAYLCDHXOHNE-AWEZNQCLSA-N 421.485 2.455 10 20 HECD COc1cc(C(=O)NCc2ccc(N(C)C)cc2)cc(NS(C)(=O)=O)c1OC 742487406 GCGIXBBRZKHWJH-UHFFFAOYSA-N 407.492 2.071 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H](O)Cc1ccccc1 747390634 UBTJJFPFIUFAIV-HRAATJIYSA-N 401.482 2.454 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cnc(-c4ncccn4)s3)CC2)cc1 749600089 TULGIUIZAHFKFY-UHFFFAOYSA-N 424.530 2.161 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCC(=O)N2C)NC(=O)OC(C)(C)C)cc1 752481187 OVPRYUQLINZSGA-IRXDYDNUSA-N 404.511 2.055 10 20 HECD COC[C@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 754347553 MSEOLWBDCPMXQK-FPOVZHCZSA-N 403.523 2.057 10 20 HECD COc1cccc(NC(=O)CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759886130 IHKREMWGJNISQP-UHFFFAOYSA-N 415.490 2.482 10 20 HECD C[C@@H](OC(=O)c1cncnc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 760803786 KCLIAUPXWRHVRO-GFCCVEGCSA-N 401.378 2.436 10 20 HECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)O 761258427 FNKIYYJVEHKJEQ-UHFFFAOYSA-N 420.487 2.099 10 20 HECD COc1cc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc(C(=O)O)c1OC 761286151 CKCOWBUOTICQGS-UHFFFAOYSA-N 412.439 2.086 10 20 HECD O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NCCc1ccc(O)c(O)c1 762268606 OAQRLKOGJAKHRS-OAHLLOKOSA-N 417.849 2.315 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1noc(Cc2ccccc2)n1 764537625 YMJHEUDYALERJR-LBPRGKRZSA-N 416.459 2.229 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)[C@]2(O)CCSC2)NC(=O)OC(C)(C)C)cc1 765836491 NJUOIDSEEPKNGG-JXFKEZNVSA-N 409.552 2.303 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=NN(CC(C)C)C(=O)CC1 768390023 UTLCHNQZBVEBIB-UHFFFAOYSA-N 409.870 2.182 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 768945721 UTVJPTZUIMRKAB-CQSZACIVSA-N 401.438 2.487 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 769294482 ASZBDCKYDAUOOI-UHFFFAOYSA-N 418.247 2.347 10 20 HECD COc1cc(NC(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)cc(OC)c1OC 772770835 UZQHRJBYKRDDOW-FNORWQNLSA-N 403.387 2.319 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=N)C(F)(F)F)cc2F)C[C@@H](C)O1 773180326 ORMKNPDDKDCDDO-PHIMTYICSA-N 406.380 2.116 10 20 HECD COc1ccc(C(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 773992773 FMERYYCVANIQFH-ZDUSSCGKSA-N 400.435 2.277 10 20 HECD CCN1CCN(Cc2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)CC1 774729796 MMHVKGSTBNGCME-UHFFFAOYSA-N 401.492 2.161 10 20 HECD COCCO[C@@H]1C[C@H](CO)CN(Cc2cc(Br)cc(OC)c2O)C1 775203546 LUAWLOJFZYIJPM-SWLSCSKDSA-N 404.301 2.009 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)Nc2cc(-n3nnnc3C)ccc2F)c1 775375961 QCYOAOXHAZRBGW-LLVKDONJSA-N 400.414 2.113 10 20 HECD Cc1cccc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1O 775644794 VJWMOPNVPJPGJW-UHFFFAOYSA-N 405.476 2.335 10 20 HECD CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)/C=C/c1ccc(O)c(O)c1 779502815 GXKMOIBJMHGCGC-VZUCSPMQSA-N 405.472 2.442 10 20 HECD COc1ccc(CN(C(=O)c2ccc(C)c(O)c2O)[C@H]2CCS(=O)(=O)C2)cc1 780934176 HUFUIEKHJNQCMN-HNNXBMFYSA-N 405.472 2.244 10 20 HECD CNC(=O)[C@@H]1CN(CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)CCO1 782098689 QHZGAQOVYDEZFS-FQEVSTJZSA-N 401.532 2.446 10 20 HECD CN(CC(=O)N1CCOCC1)C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 783330189 LIKQNQPVASYLTO-UHFFFAOYSA-N 409.446 2.358 10 20 HECD O=C(OCC(=O)[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413356 PJEOTXAPMFLCCP-NSHDSACASA-N 411.457 2.017 10 20 HECD Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 786225175 OQFSQKBVDSRPGA-LEWJYISDSA-N 424.545 2.100 10 20 HECD CCC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCO1 789819955 PICFJUXHDYATNT-XYJFISCASA-N 421.513 2.083 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccco3)cc2F)C[C@H](C)O1 789821348 SEXRBMRHPTYXNC-GJZGRUSLSA-N 403.454 2.307 10 20 HECD CCc1nn(C)c(CC)c1CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 790523112 JUCYKZLEVIXPTI-UHFFFAOYSA-N 413.566 2.034 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 798331922 DZRSSOPMXRGCPT-UHFFFAOYSA-N 406.504 2.057 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCCc3ccccc3N)CC2)cc1 798681340 ALALIYBBZPDSAV-UHFFFAOYSA-N 411.502 2.492 10 20 HECD CNC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCO1 799994153 NSAFBLIQKQSTBF-KBXCAEBGSA-N 408.930 2.233 10 20 HECD Cc1cc(Cl)nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 803306463 VNAWYASGVKKXFC-HNNXBMFYSA-N 416.909 2.374 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(n3ccnc3)CC2)cc1F 804852087 YTCHJWYZJAPJCV-UHFFFAOYSA-N 401.486 2.348 10 20 HECD Cc1cc(F)cc2c1S(=O)(=O)N(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 804916356 BEGRYYLSXHRKRV-UHFFFAOYSA-N 419.478 2.003 10 20 HECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)NCCCSc1nccs1 806280553 QSFIYJRPZGAZHG-ZDUSSCGKSA-N 407.517 2.390 10 20 HECD Cc1noc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 806493930 ITJCRXXUHLCHIQ-FUHWJXTLSA-N 412.494 2.126 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(C[C@H]2CCOC2)CC1 807100579 FSOQCVOAODPGGE-GOSISDBHSA-N 417.550 2.138 10 20 HECD COc1ccc(OCCN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 807289827 KCORHMJLWSLSPX-UHFFFAOYSA-N 409.486 2.225 10 20 HECD CC[C@@H]1C[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852464 UQQLFBOIWXUQDX-GHTZIAJQSA-N 412.578 2.482 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c2ccccc21 809181301 PHSQTWXPHFFQFD-HXUWFJFHSA-N 408.502 2.325 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H](C)CN(C)C(C)C)CC2)cc(OC)c1OC 811952311 HQLRAHXKGSXCRJ-MRXNPFEDSA-N 408.543 2.273 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc([N+](=O)[O-])c1 920854232 JNHSPYMXJXMDRM-UHFFFAOYSA-N 403.460 2.068 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)Nc3c(Cl)ccc4nonc34)ccc21 1323420360 XJZWLYDHBGEGAV-UHFFFAOYSA-N 413.821 2.154 10 20 HECD CC(=O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1793417386 OEICOCCZXOWPGJ-BEVBHUTCSA-N 416.474 2.070 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3ccc(F)cn3)C2)CC1 1808716561 OJMCQSMLENBSFM-UHFFFAOYSA-N 414.437 2.186 10 20 HECD CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814163094 YPARCOUUSNQHAT-AKTGSIICSA-N 411.458 2.328 10 20 HECD CO/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1828796451 SLSSJRXBJANILT-TUQDCPSNSA-N 403.479 2.276 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)Cc2ccccc2)C1 1842697707 CQVUKWQMVUOHLZ-CSKARUKUSA-N 408.454 2.263 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc4n3CCCCC4)CC2)cc1 6098067 SBHOMEOFKLLYHJ-UHFFFAOYSA-N 401.536 2.454 10 20 HECD CS(=O)(=O)Cc1ccc(C(=O)Nc2c(C3=S=CC=C3)nc3ccccn23)o1 509805400 IQWNGTDPYWBXJO-UHFFFAOYSA-N 401.469 2.350 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)n(C)c2ccccc12 673315431 CWULAHBGTFVTEZ-BTYIYWSLSA-N 401.532 2.274 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc2c(c1)COC2 726867725 ROOQKWDMMFHMBX-UHFFFAOYSA-N 417.531 2.110 10 20 HECD Cc1nc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1C 727171269 HSBHZIJLQNAVDO-UHFFFAOYSA-N 418.441 2.062 10 20 HECD CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC 732204822 DXHFQGXETUSNQE-MCFFVMPBSA-N 423.529 2.377 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn4nccc4c3=O)c2C)c1 732864182 LFLVOXDKEFOTJJ-UHFFFAOYSA-N 419.441 2.033 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN([C@@H]4CCCN(C)C4)CC3)CC2)cc1 734667229 VZIWGNGKSIPZLN-OAQYLSRUSA-N 415.582 2.085 10 20 HECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)ccc1C 736329823 NCYRZNVYSRGRFE-UHFFFAOYSA-N 403.504 2.269 10 20 HECD Cc1cc(NS(=O)(=O)c2cccc(C(=O)NCCc3ccc(O)c(O)c3)c2)no1 750793667 ATJFPEJZFXYGTP-UHFFFAOYSA-N 417.443 2.168 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc4nc(O)oc34)CC2)cc1 751941032 ZXXNPIRTKFJCJC-UHFFFAOYSA-N 411.414 2.048 10 20 HECD CCc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 755064053 NDLPEVCMNWSNEL-UHFFFAOYSA-N 400.479 2.009 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 758224163 OLIAPRYZSOGGOC-GOSISDBHSA-N 401.463 2.474 10 20 HECD C[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@]1=O 759867113 INWAYJYUZADQTE-IZPCHGGPSA-N 410.495 2.243 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1nc(C)n(-c2n[nH]c(C(F)(F)F)n2)n1 761749202 BXXMNMWGBZXWRS-UHFFFAOYSA-N 409.372 2.471 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccn2c(I)cnc12 762267438 MTIDORKPQIZWJF-UHFFFAOYSA-N 423.210 2.323 10 20 HECD C[C@@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)c(F)c1 765326173 UXSOVIPBOPDVTE-WBVHZDCISA-N 418.465 2.482 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CCNC(=O)C(C)C)c([N+](=O)[O-])c1Br 767319030 PGQGUDVFIRTONN-UHFFFAOYSA-N 419.232 2.483 10 20 HECD Cc1ccc(O)c(CN2CCC(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1 768207949 LPRIBBNVHHWAFV-UHFFFAOYSA-N 403.504 2.199 10 20 HECD C[C@@H](NC(=O)N1CCN(c2nccn3cnnc23)[C@H](C)C1)c1ccc(N(C)C)cc1 773613421 QSGKMXVHFZWCGK-HZPDHXFCSA-N 408.510 2.172 10 20 HECD COc1cc(C(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OC 773987722 GRDILCKNSJTBJX-CQSZACIVSA-N 415.490 2.386 10 20 HECD COc1ccc(C(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 773992771 FMERYYCVANIQFH-CYBMUJFWSA-N 400.435 2.277 10 20 HECD COc1ccc(Br)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774355735 BVPAIYQPRQVTEM-UHFFFAOYSA-N 409.236 2.166 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NCc1ccccc1Cl 774552220 XFFUBQMLJWUFSL-UHFFFAOYSA-N 419.884 2.373 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1[C@@H](C)C1CC1 777361948 XEGKXBXCWBNMSQ-INIZCTEOSA-N 416.547 2.327 10 20 HECD CCOC(=O)[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 779403352 GKOKPMIRUXLWAJ-HXUWFJFHSA-N 402.516 2.315 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1 779500463 YGHGHZHOIAZDRJ-KRXBUXKQSA-N 420.462 2.220 10 20 HECD COc1ncncc1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 782425195 ROLWOSJVUQHRFU-UHFFFAOYSA-N 409.446 2.312 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1 783590600 VGJDTRXUQVWUML-LLVKDONJSA-N 401.444 2.087 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1NC(=O)OC(C)(C)C 785424641 RXSIILKNKHSZIQ-MAUKXSAKSA-N 418.538 2.131 10 20 HECD CN(Cc1cc(Br)cn1C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427975 IEWWCHRRRYEYAR-UHFFFAOYSA-N 407.312 2.128 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(N2CCCC2)nc1 787183671 XMRVQRJBSJOGAN-UHFFFAOYSA-N 405.549 2.053 10 20 HECD C[C@H](Cc1ccco1)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 787952999 LYQGLQWCIZVCFF-BZUAXINKSA-N 417.481 2.396 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)Cc1cccs1 788312553 JAVXDEUALVPHAE-MRXNPFEDSA-N 401.532 2.196 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cccc(CN(C)C)c3)CC2)cc1 788458577 AXQRXVVSFVCNAF-UHFFFAOYSA-N 424.545 2.112 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C 789779707 ZHJWOFBWJUBIQP-SUMWQHHRSA-N 413.474 2.169 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@](C)(O)CC3)CC2)cc1 792003630 BBHYJWWKRIWFKS-JOCHJYFZSA-N 404.555 2.154 10 20 HECD COc1c(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc(Cl)cc1C(N)=O 792986783 OBBLKSRAGFLZST-UHFFFAOYSA-N 418.881 2.077 10 20 HECD COc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 793131549 IKQRMDOMJAYCDS-OAHLLOKOSA-N 412.446 2.235 10 20 HECD Cc1nccn1CCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 804030790 MVDXATMYQGNMEY-UHFFFAOYSA-N 409.490 2.196 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1nncn1C 805766268 FAPVIDDSFLUKOB-SFHVURJKSA-N 404.490 2.112 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)o1 807672124 WRMWRGBBBZWRPO-KRWDZBQOSA-N 400.523 2.422 10 20 HECD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1 808489248 JMMQPZRONPDCHK-UHFFFAOYSA-N 401.440 2.143 10 20 HECD C[C@@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccccc1 812051126 JMTVBRNZGGVPJI-OAHLLOKOSA-N 415.519 2.279 10 20 HECD COC(=O)C1(CS(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCC1 813642492 OMOOLZGNTRNYIR-UHFFFAOYSA-N 410.536 2.271 10 20 HECD COc1cc(NS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)ccc1O 814211661 LQSCMGOTAWMENZ-UHFFFAOYSA-N 404.444 2.219 10 20 HECD CC(C)C(CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)C 1324096765 MTGJRFCZIXMJIU-UHFFFAOYSA-N 407.530 2.447 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N(C)C)cc2C)cc1 1327545006 PGBPSAMDNMXNHZ-UHFFFAOYSA-N 405.520 2.054 10 20 HECD CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1337049234 APYPQZXNSXRTKP-HNNXBMFYSA-N 420.487 2.456 10 20 HECD CC(C)/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801626213 FQSMCTMCADTBAT-HLUIXWDSSA-N 408.882 2.167 10 20 HECD C/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361721 CVMDBNNEAAOLQI-ZABGRMTBSA-N 423.498 2.424 10 20 HECD O=C(Cc1ccccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441920 HTHARPIDZLIVLW-UHFFFAOYSA-N 416.481 2.225 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccccc4)n3)cc2F)C[C@H](C)O1 117529344 UYKCTKCKDCZWPN-HOTGVXAUSA-N 424.480 2.409 10 20 HECD C[C@H](CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)NC(=O)C1CCCC1 727198649 ADCDFSFWCNPFFK-MRXNPFEDSA-N 403.523 2.339 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)c3ccc(F)cc3)cc2F)CC1 730286078 CWCVEVRIHUVICK-UHFFFAOYSA-N 416.472 2.153 10 20 HECD CCOc1cc2c(cc1CNC=C1C(=O)N(CC)C(=S)N(CC)C1=O)O[C@@H](C)C2 730970970 JISYIYGAZJQBCN-ZDUSSCGKSA-N 417.531 2.378 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NC)cc2)cc1F 731409165 MNRKUOXZKACCSK-UHFFFAOYSA-N 400.454 2.286 10 20 HECD O=C1CC(=O)Nc2cc(S(=O)(=O)Nc3cccc(N4CCCC4)c3)ccc2N1 732526060 IECYCXYKCQBTAX-UHFFFAOYSA-N 400.460 2.368 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c1 734502975 PJVGIHLGSNZJBK-UHFFFAOYSA-N 420.487 2.113 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CS4)ccc21 747016739 DPPKSBLQFIWPIN-UHFFFAOYSA-N 410.499 2.368 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2CCN(Cc3cccs3)CC2)c1 747218268 KEZCCBHELAVTBF-UHFFFAOYSA-N 423.560 2.467 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 749348806 XBXILAAHMLMIMK-OXQOHEQNSA-N 410.518 2.441 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc(O)c(OC)c3)CC2)cc1 754027071 AYMNKPBSOXSNOV-FQEVSTJZSA-N 415.534 2.024 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]4(CCOC4)C3)cc2F)C[C@@H](C)O1 756903417 TVDVRXFNWNDCLA-DRSNIGMVSA-N 405.514 2.168 10 20 HECD COc1ccccc1Nc1nc(N)nc(COC(=O)/C=C/c2ccc(O)c(O)c2)n1 759597347 RELXFNWZBKIVEK-VQHVLOKHSA-N 409.402 2.374 10 20 HECD O=C(NCc1cccc(Br)c1O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 765531988 AWAVWKWWYBZTOW-CVEARBPZSA-N 412.328 2.332 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 765658973 MMMBLPOOATWKLR-KMCQBPLKSA-N 406.502 2.153 10 20 HECD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cc(-c2ccccc2)ccc1O 768160838 SWTNDPAVIFEZGN-IBGZPJMESA-N 402.516 2.184 10 20 HECD COCCc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)n(C)n1 768720772 VUWMMMQERCALTM-UHFFFAOYSA-N 413.522 2.100 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3nccs3)cc2F)C[C@@H](C)O1 773491106 UNZDNNXSAILFQT-BETUJISGSA-N 407.467 2.369 10 20 HECD COc1cccc(/C=C(\C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n2nnnc2C)c1 773739254 CZPQMFWTIVAOCH-FHXOWUIVSA-N 409.446 2.147 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3C3CCOCC3)cc2)C1 777719246 ANRXEXQRFLTJOF-PZJWPPBQSA-N 414.550 2.489 10 20 HECD COCC1(C)CCN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778420253 UBLZWTZSXXFODL-CMDGGOBGSA-N 415.534 2.175 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1Br 785753866 OAJXJSFLMCUVKG-JGVFFNPUSA-N 417.216 2.364 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 788187116 JVQFILFEPUEZQV-HZPDHXFCSA-N 414.481 2.075 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1)c1ccc(N(C)C)cc1 788827846 PGKCKYGTBXSSDN-QGZVFWFLSA-N 405.502 2.491 10 20 HECD C[C@@H]1CC(=O)C[C@H](C(=O)NCc2ccccc2O)[C@H]1C(=O)NCc1ccccc1O 791138409 HCACSOHCXAQTTQ-IBZMOEQTSA-N 410.470 2.262 10 20 HECD Cc1cc(C(=O)CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1cccc(F)c1 794786195 NIESZCQEEYDIBQ-GOSISDBHSA-N 407.511 2.382 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCC(O)CC3)cc2F)C[C@@H](C)O1 795644723 CCEPDQKSEFKVOK-BXXOZEPKSA-N 422.497 2.150 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OC[C@H]1CNC(=O)O1 801222396 XAMKWTDOYPQGSZ-CEXMDJMXSA-N 412.514 2.381 10 20 HECD CCOC1CC(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 805638114 CSYAQXSRMXPXHS-RCDYEMGKSA-N 422.497 2.414 10 20 HECD CN1CCCc2cc(CNC(=O)CNS(=O)(=O)c3ccc(Cl)cc3)ccc21 810265896 AJNJTIBYVQWTEU-UHFFFAOYSA-N 407.923 2.317 10 20 HECD Cn1ncc2ccc(CNC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc21 812913999 FJHNQVBVXOULGM-LJQANCHMSA-N 420.517 2.274 10 20 HECD CCN(CC)CC1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 917060321 OTNABGPDYTUWCX-UHFFFAOYSA-N 420.573 2.332 10 20 HECD Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 917912895 YZCVLGMBPRYXRC-UHFFFAOYSA-N 422.528 2.431 10 20 HECD CN(C)C(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918030083 MGQIRDCNSILKNP-GOSISDBHSA-N 423.517 2.412 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cc(F)ccc1F 918440910 UJRUAAJAESCXFC-UHFFFAOYSA-N 407.392 2.320 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1 920482095 IHLFSSICUSOTNJ-UHFFFAOYSA-N 409.489 2.134 10 20 HECD CS(=O)(=O)Nc1ccccc1CNC(=O)NCCCSc1nccs1 1319099497 JQKAMEGXPABKRM-UHFFFAOYSA-N 400.551 2.496 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)C(F)F)C2)CC1 1809147068 WAGREUCSQGIUTQ-HWKANZROSA-N 410.417 2.313 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1ccc(F)cc1F 21414824 UNFUIGLFEDQXBA-UHFFFAOYSA-N 403.429 2.190 10 20 HECD Cc1c(CNC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)n(C)c2ccccc12 472240605 OTHSWZWGLDKUOL-UHFFFAOYSA-N 418.505 2.195 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)CCO4)cc2)C1 725874623 HBAIFTXBATWEKF-LJQANCHMSA-N 408.502 2.323 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](n4ccnc4)C3)cc2)C1 728747463 NYVIXDWWWWJVQL-ICSRJNTNSA-N 410.522 2.132 10 20 HECD CC(=O)NCc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 733633052 IEPUUVLPDUMOPO-IBGZPJMESA-N 423.517 2.346 10 20 HECD O=C(NCc1cccc(-n2cncn2)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 735515988 CTSHJQSTHRRMJS-UHFFFAOYSA-N 424.480 2.367 10 20 HECD C[C@@H]1Oc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2NC1=O 741097486 SOZCCAIBMYJJSD-AWEZNQCLSA-N 406.442 2.037 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCN(CC[S@@](C)=O)CC3)c2C)cc1 742182467 KIWSMFKNUJIXOW-MUUNZHRXSA-N 403.548 2.239 10 20 HECD COC(=O)CCCS(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742333974 BRZUVVXOFZXPBS-CYBMUJFWSA-N 406.451 2.129 10 20 HECD O=C(CSc1nnnn1C1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742802043 WCFDEDSTYVUGKG-GFCCVEGCSA-N 424.477 2.487 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccccc1N1CCOC1=O 743957807 BDGFWPHDDILVEP-UHFFFAOYSA-N 409.442 2.483 10 20 HECD COCCN(CC(=O)Nc1cccc(S(C)(=O)=O)c1)c1ccc(OC)c(OC)c1 746474236 HEMZUNDPEVDIQX-UHFFFAOYSA-N 422.503 2.199 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccc4c(c3)OCO4)CC2)cc1 754000620 PJGUSBFTTIOYEC-FQEVSTJZSA-N 413.518 2.039 10 20 HECD Cc1oc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1S(N)(=O)=O 756031777 ADLOTLSKBGVNCM-KRWDZBQOSA-N 421.519 2.123 10 20 HECD C[C@H](N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(Cl)c(Cl)c1O 756736366 FIXNOTZVSKAQSM-QWHCGFSZSA-N 402.322 2.283 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c2C)c1 758487223 PUMOOVLAYJAKMY-HNNXBMFYSA-N 406.504 2.375 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(F)c3cccnc23)SC1=S 759117275 LPOJABLIPZUVNS-UKTHLTGXSA-N 411.505 2.124 10 20 HECD Cc1nnc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)o1 759630585 ASNWFNAJFUGXPH-SECBINFHSA-N 408.461 2.437 10 20 HECD COc1cccc(CN2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)c1O 768195583 NQGRROYXRRMPPU-UHFFFAOYSA-N 402.516 2.396 10 20 HECD O=C1[C@@H](N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)CCN1c1ccccc1 769404858 RGCUPUDWISTSMK-DEOSSOPVSA-N 420.557 2.446 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3cc(F)ccc3OC)CC2)cc1 772972950 MEXMNFYXXKDADO-UHFFFAOYSA-N 401.482 2.324 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2 773739780 KCSKWRUHJDKCRA-QYSRSOONSA-N 405.472 2.114 10 20 HECD C[C@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1ccc(N2CCOCC2)cc1 780337541 BHCWDFDBEZAAAN-KRWDZBQOSA-N 400.523 2.238 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)c(F)c3)cc2)CC1 786121955 KYEJEOPWPFGBCG-UHFFFAOYSA-N 405.495 2.281 10 20 HECD C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 787708952 VMHSLZJYLVLINS-HDICACEKSA-N 400.567 2.169 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2ncccn2)C1 790256029 WXYFUTGNDWXTJM-SFHVURJKSA-N 411.506 2.096 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCO[C@H](C(C)(C)C)C3)CC2)cc1 791153752 GWBSCRGXVLUACY-XTXLJPNXSA-N 415.534 2.174 10 20 HECD C[C@@H](CCC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793719178 LEYLDVQBGTUYQZ-WMZOPIPTSA-N 416.566 2.336 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(CS(N)(=O)=O)c1 800717827 SQBSBUXKBROCBG-UHFFFAOYSA-N 404.536 2.273 10 20 HECD COc1cc(NCc2ccc(N3CCOCC3)cc2)ccc1S(=O)(=O)N(C)C 802646505 LTUIPFBUZNVIMO-UHFFFAOYSA-N 405.520 2.394 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCOC1CCCC1)c1ccc(N2CCOCC2)cc1 803297574 ACQFBMGDIGJCIO-QGZVFWFLSA-N 403.523 2.166 10 20 HECD C[C@H](NC(=O)C(=O)N1CCc2c(F)cccc2C1)c1ccc(N2CCOCC2)cc1 803297770 GOMOIULLGQPMJV-INIZCTEOSA-N 411.477 2.424 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(-n2ccnn2)cc1 803688926 FZHTWQWXLGGYHE-INIZCTEOSA-N 418.501 2.143 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3cccnn3)cc2Cl)C1 806463908 XVAIEPRABPKROU-CQSZACIVSA-N 401.898 2.299 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCC(=O)N2C)NC(=O)OC(C)(C)C)cc1 806945828 OVPRYUQLINZSGA-DLBZAZTESA-N 404.511 2.055 10 20 HECD Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 807639102 TTWHIWMYKDFCKU-OAHLLOKOSA-N 411.550 2.341 10 20 HECD O=S(=O)(c1ccc(CNCc2cc(Cl)c(F)cc2O)cc1)N1CCOCC1 816531052 DVHTWTSJZBTNIH-UHFFFAOYSA-N 414.886 2.495 10 20 HECD COc1ccc(N2CCN(CCCNc3cnc(N4CCCC4=O)cn3)CC2)cc1 820610234 MCMQOVJIUIKOSV-UHFFFAOYSA-N 410.522 2.236 10 20 HECD CCN(CC)c1ccc(CN(C)[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc1 857757925 WNEJNRNCXSRHSZ-IBGZPJMESA-N 410.566 2.492 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 917821384 DPLOJUFFRXGVAV-VDGAXYAQSA-N 413.518 2.298 10 20 HECD CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918118424 RUQKVZZWVNUTRE-SFHVURJKSA-N 424.501 2.459 10 20 HECD CS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918209801 ILEABOFMQGUVPR-UHFFFAOYSA-N 421.494 2.065 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)C1 1317954363 LLYXFESNURJFPE-UXADLVQTSA-N 411.546 2.336 10 20 HECD Cc1ccnc(O)c1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1320754276 QEHFAHHDRAPKIF-UHFFFAOYSA-N 422.464 2.281 10 20 HECD CC(=O)C[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934541 ABILABKZPRZKER-SKWUIDRYSA-N 424.501 2.033 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)C23CCC(CC2)CC3)C1 1846696560 DQCSVDVLQMRIFF-UHFFFAOYSA-N 421.588 2.021 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccco1 1848227512 YJVZHLZSKBDERU-SFXFJHKKSA-N 412.442 2.244 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(CS(C)(=O)=O)c1 7122267 GMWVLEUTTGQXKO-UHFFFAOYSA-N 418.515 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)CONC(=O)CCCc3ccccc3)CC2)cc1 729264089 VHZLBMQVYOFWCT-UHFFFAOYSA-N 411.502 2.415 10 20 HECD Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 730386602 HAFCYUMZTXCZIQ-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CCOC(=O)c1c(NC(=O)CN(C)Cc2ccccc2O)sc(C(=O)NC)c1C 731843511 MISWBWJHGSMRTM-UHFFFAOYSA-N 419.503 2.369 10 20 HECD CC[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C[C@@H](C)O1 732207935 DBDORSBFDNTZIR-CRAIPNDOSA-N 419.547 2.424 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O 734522547 QFQDPXWJVHAINZ-UHFFFAOYSA-N 401.511 2.115 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3OCCc4ccccc43)nc12 734606261 MQMPRSVDLCXCBD-KRWDZBQOSA-N 411.414 2.359 10 20 HECD C[C@H](COCC(F)(F)F)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 742760098 JHEADKLZYIHJED-HIFRSBDPSA-N 416.444 2.155 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCCn3nc(C)cc3C)CC2)cc1 743363940 XVBOROQBCXMCIE-UHFFFAOYSA-N 414.554 2.020 10 20 HECD Cc1cc(C(=O)[C@@H](C)N2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccc(OC(F)F)cc1 747835333 NQRBZAVRPHIHST-RDTXWAMCSA-N 421.444 2.453 10 20 HECD COC(=O)c1sccc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751044007 NZJFRCGCEFQUKG-ZDUSSCGKSA-N 410.517 2.411 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 752097677 XGWPEJAOLXKQBY-UHFFFAOYSA-N 424.501 2.252 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(F)cc1F 753362489 DJRWCFGRLRSBQW-UHFFFAOYSA-N 420.415 2.144 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](c4ccccc4)C3)CC2)cc1 754010316 OURHIOKPAIBGHQ-VWNXMTODSA-N 411.546 2.252 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 754563012 LNHIINYDNGGLLF-NTDBWNAOSA-N 407.530 2.460 10 20 HECD COCCCNC(=O)[C@H](C)N1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 754732640 RQYNGTNXTFJQMN-KRWDZBQOSA-N 421.582 2.357 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)cc(F)c1F 755976596 ZXBXKCGDMDIVQI-UHFFFAOYSA-N 412.414 2.405 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cccc(=O)n2C)NC(=O)OC(C)(C)C)cc1 757035324 NKUVJJVNNOBZSK-KRWDZBQOSA-N 414.506 2.447 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2cnn(Cc3ccccc3)c2)c1 757698086 MCPMGULXQAWILF-UHFFFAOYSA-N 401.444 2.366 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)N3CCCC[C@@H]3C)CC2)cc1 758207577 ATYOKSMJPCLPTQ-JAXLGGSGSA-N 404.599 2.031 10 20 HECD COc1cc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)cc(OC)c1OC 760124776 GDZCSXPCTAIDHM-UHFFFAOYSA-N 409.527 2.343 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765783449 OHTBNAWIBURDJG-IAGOWNOFSA-N 410.465 2.471 10 20 HECD CN(CCCOc1ccc(S(C)(=O)=O)cc1)Cc1cc2c(cc1O)OC[C@H]2O 768443579 SUVOGGDQWSEKMC-LJQANCHMSA-N 407.488 2.122 10 20 HECD CN(C)CCOc1ccccc1N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768444889 DBWIBWWTISOGKA-NRFANRHFSA-N 413.518 2.081 10 20 HECD CC(C)OCCS(=O)(=O)N1CCN(Cc2cccc(Br)c2O)CC1 769558592 UATCQIZNTMRBKB-UHFFFAOYSA-N 421.357 2.027 10 20 HECD CC(C)OC[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 771300605 BFQUITJEXGRMKR-GOSISDBHSA-N 409.502 2.122 10 20 HECD COC(=O)c1cccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772876916 RMDYKUICJIAYCL-UHFFFAOYSA-N 402.422 2.144 10 20 HECD COc1ccc([C@H](OC)[C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 772881052 JANGBIRMNOJGCQ-KPZWWZAWSA-N 408.476 2.278 10 20 HECD COC(CCCC(C)(C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)OC 773167136 WWOHTZQHJLMLGS-UHFFFAOYSA-N 402.513 2.309 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 788913226 VXROLXDCQCSDEH-SIKLNZKXSA-N 410.562 2.378 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1CCC(O)(c2cccnc2)CC1 788931201 YPVQUHVUFDHCHH-UHFFFAOYSA-N 422.529 2.245 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@](C)(O)CC3)cc2F)C[C@@H](C)O1 791625518 ASXWZMKVHPRXPP-DRSNIGMVSA-N 407.530 2.292 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 793366688 DSOFJBFBCNLAOJ-UHFFFAOYSA-N 420.487 2.257 10 20 HECD COC(=O)c1cn(CCNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)nn1 803644876 VRWLKZIECXITBH-UHFFFAOYSA-N 415.881 2.485 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1F 804853873 WQNTUTANJZXNAF-MRXNPFEDSA-N 401.486 2.417 10 20 HECD CCc1nc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cs1 806114389 DAFCGUADPKZTQN-HNNXBMFYSA-N 416.547 2.378 10 20 HECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806385568 ADWAMDKFBPQSEF-GUYCJALGSA-N 401.463 2.382 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOc2cc(O)ccc2C1 806457350 KIYZQBVKFDTECB-UHFFFAOYSA-N 401.438 2.472 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)c3ccncc3OC)CC2)cc1 807175710 PZKJQJSMORLOEX-MRXNPFEDSA-N 412.490 2.015 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C(=O)NC)ccc1OC 918304410 QANWLJSLJWMZNQ-UHFFFAOYSA-N 412.490 2.108 10 20 HECD CC(C)OCCC(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 919089525 LDGSEOAOWBBZNO-HZPDHXFCSA-N 410.486 2.414 10 20 HECD Cn1c(=O)cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 1317901715 ZLCGHHIBSMBXPK-QGZVFWFLSA-N 418.497 2.170 10 20 HECD O=C(Cc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285805 URGVXQXWZVGREY-DTUWPTEXSA-N 423.469 2.093 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=COCCC2)[nH]n1)c1cc(O)nc(O)c1 1817848404 HKCHILVFPIOVNN-OAHLLOKOSA-N 413.434 2.216 10 20 HECD COc1cc(C)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)c(C)c1 1845466704 XKIWTJUPGBPGJD-UHFFFAOYSA-N 411.458 2.249 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1cc(C(F)(F)F)ccc1=O 16134481 HMGFLSVLQIRZLE-UHFFFAOYSA-N 409.408 2.362 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(CCOC(C)C)CC2)n(C)c2ccccc12 570357615 XNXCHVCXWNXGPL-UHFFFAOYSA-N 414.550 2.109 10 20 HECD Cc1cc(C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 726939728 PAUSRTUGYDZHMZ-UHFFFAOYSA-N 409.939 2.208 10 20 HECD COc1ccc(N2CCCN(CC3=Nc4ccccc4S(=O)(=O)N3)CC2)cc1 727123242 OJIZLYOBOOEKGX-UHFFFAOYSA-N 400.504 2.229 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c1 728980978 RILDIXUDAJQZQM-PEBXRYMYSA-N 411.458 2.354 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)N1CCN(Cc2ccco2)CC1 732202413 PIKANWDLXVLJIG-OAQYLSRUSA-N 413.518 2.311 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2O1 732479004 RNEIGUCKIFVXOU-KRWDZBQOSA-N 423.513 2.326 10 20 HECD O=C(CN1CCCN(C2CCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 738335487 QTYUXIIJCXYYIB-UHFFFAOYSA-N 418.557 2.229 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(O)c(F)c3)cc2)C1 738987882 ZQWQASACGXNTNF-INIZCTEOSA-N 400.454 2.232 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCc2ccccc21 746878243 SZDQEMTWBAHTHU-YLJYHZDGSA-N 406.530 2.456 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(S(=O)(=O)N(C)C)CC3)c2C)c1 749340866 CIYSLFLUTPKKPR-UHFFFAOYSA-N 418.563 2.275 10 20 HECD COc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)NC(C)C 753645479 UBVIDBCPJCPCAR-ZDUSSCGKSA-N 422.503 2.154 10 20 HECD COC(=O)C12CCC(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)(CC1)C2 759255029 RJHXZEGSIQZQIZ-UHFFFAOYSA-N 402.491 2.378 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1csc(-c2ccccn2)n1 762640278 IPXGVZGRDLEYHO-UHFFFAOYSA-N 423.498 2.297 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)C1 765040826 KCDTVEMIWAHCGW-LJQANCHMSA-N 419.522 2.165 10 20 HECD CCN1C[C@H](C)N(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 766245139 YVVQKBSDYATAGG-PMACEKPBSA-N 417.598 2.331 10 20 HECD COC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 768702914 WGJCPUVENLFOEN-UHFFFAOYSA-N 415.465 2.491 10 20 HECD COc1cccc(CNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)OC)c2)c1O 769508334 XXTOJSUIWOAACV-UHFFFAOYSA-N 414.867 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H](C)OCC4CC4)n3)CC2)cc1 771055653 IGWCPZLGWOGZKY-OAHLLOKOSA-N 400.479 2.457 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1Cl 771195463 WJOSZJNWHRWTII-UHFFFAOYSA-N 419.865 2.213 10 20 HECD O=C(CNc1ccn(CC(F)(F)F)n1)NCc1ccc(N2CCOCC2)c(F)c1 772904827 RJUMHNLNLCZPSG-UHFFFAOYSA-N 415.391 2.149 10 20 HECD C[C@H](NS(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773089784 VTXAOZAYILZVMF-AWEZNQCLSA-N 411.549 2.042 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](C(=O)N(C)C)O3)cc2)CC1 774715898 LTQFHISMZRCGHN-WOJBJXKFSA-N 402.539 2.358 10 20 HECD COC(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 781450386 UDUZLWDLLQQZAD-UHFFFAOYSA-N 413.499 2.281 10 20 HECD O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)OCC(=O)c1ccc(O)c(O)c1 783768924 GAJOAVWLOAEBSV-UHFFFAOYSA-N 400.355 2.063 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1OC 784025425 DOALGBZJKMWMKL-UHFFFAOYSA-N 413.474 2.480 10 20 HECD CCN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)CC(F)(F)F 785429053 WHPYTEXERCNBPE-MRXNPFEDSA-N 414.472 2.102 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ncn1 786115481 CNBWVQVGNJFCRW-GJZGRUSLSA-N 416.453 2.011 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCOc2ccccc21 788321032 SHLSAIHOBMBPBT-FQEVSTJZSA-N 409.486 2.170 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NCc1ccc(OC)cc1O 797629500 HQAJULHZETVZCO-UHFFFAOYSA-N 423.491 2.372 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H](C)CCC3CC3)cc2F)CC1 805007303 PWZXOBJHGYTKAE-INIZCTEOSA-N 404.530 2.279 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCc1cccs1 808813051 CJVKBSGVMKRFKH-UHFFFAOYSA-N 401.532 2.292 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)C[C@@H]1CCCS(=O)(=O)C1 809388862 GBSDMHWWAZBEKA-GOSISDBHSA-N 414.593 2.263 10 20 HECD CCS(=O)(=O)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)[C@H](C)C1 809725276 NJKQXVPZVWWJAN-MRXNPFEDSA-N 410.540 2.441 10 20 HECD CCOC(=O)COc1cccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 918305583 LOLRVYKXRICOFC-UHFFFAOYSA-N 413.474 2.292 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1ccc(-n2cncn2)nc1 918308205 GFQCKERTDMLWMC-UHFFFAOYSA-N 419.489 2.250 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCn1cc(Br)cn1 919573254 MCPOKQGPPLCNBO-UHFFFAOYSA-N 423.311 2.304 10 20 HECD COc1cc(N2CCN(C(=O)CN(C)Cc3ccccc3)CC2)cc(OC)c1OC 1254784686 KJXPRGHWFAMKKV-UHFFFAOYSA-N 413.518 2.493 10 20 HECD CC1CCN(c2ccc(CNC(=O)NCCCN3C(=O)NC(C)(C)C3=O)cc2)CC1 1340415346 FYJVMVAZAHXINI-UHFFFAOYSA-N 415.538 2.443 10 20 HECD Cc1nccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1800714929 NUWUTFFSOKJYGW-BTTYYORXSA-N 416.865 2.415 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1 1832867066 BISREYOOOZRVLD-SJLPKXTDSA-N 417.506 2.153 10 20 HECD O=C(Cc1ccsc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039196 WIHSWIYYQGOQTB-HWKANZROSA-N 414.483 2.324 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1S(=O)(=O)N(C)C 46769466 MBFQWGYEOZGCBO-UHFFFAOYSA-N 417.531 2.476 10 20 HECD CN(C(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 63894862 WJPPLDZNQGGOEG-UHFFFAOYSA-N 408.366 2.148 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CN(C)C(=O)OC(C)(C)C)cc2F)CC1 303296320 LTWSUUWYEGMNFU-UHFFFAOYSA-N 408.518 2.451 10 20 HECD Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NS(=O)(=O)c1cccc2nsnc12 522756727 FAKBDIUEEGNOBF-HNNXBMFYSA-N 418.500 2.410 10 20 HECD O=C(CC1CCCCC1)NCCNC(=O)NCc1ccc(N2CCOCC2)cc1 725867248 VPKCHOANGGHOBF-UHFFFAOYSA-N 402.539 2.409 10 20 HECD COC(=O)CSCCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729856725 VIUDIDVBVPMOIZ-UHFFFAOYSA-N 417.478 2.462 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C(N)=O)ccc3F)cc2)CC1 731131329 KHAUFCXGLFQHID-UHFFFAOYSA-N 412.465 2.416 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)Cn2ncn3nccc3c2=O)c1C 732863713 ATVQSAJXTKJAST-UHFFFAOYSA-N 419.441 2.033 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(Cl)nc1 737132050 ULVCBRSRDCNNLU-UHFFFAOYSA-N 406.845 2.090 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc([S@](C)=O)c1)c1ccc(N2CCOCC2)cc1 737157158 HSHHOMDPUXXARA-HOLBHBGLSA-N 415.515 2.077 10 20 HECD CC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 743322894 MADSHJRDPYQSTM-BXWFABGCSA-N 420.529 2.497 10 20 HECD O=C(CN1CCC[C@H]1C(=O)NC1CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386690 OPMBOMVMFBDZHB-FQEVSTJZSA-N 417.465 2.144 10 20 HECD COCCN(CC(=O)NCc1ccc2c(c1)OCO2)c1ccc(OC)c(OC)c1 746474651 KBXGWAXNWOUFQN-UHFFFAOYSA-N 402.447 2.202 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1Cl 749144762 XNXRJGAPCIZVET-UHFFFAOYSA-N 422.843 2.350 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)CC2)cc(OC)c1OC 759286114 BQFRJKYWPDZRFP-YJBOKZPZSA-N 418.538 2.027 10 20 HECD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765777992 NZBSNINTZXLZMS-XYPHTWIQSA-N 410.465 2.471 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCN(CC(F)F)CC2)c1 766372661 ZWTOQTYAQNHIKE-UHFFFAOYSA-N 411.493 2.200 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](CC(=O)OC(C)C)C3)nc12 766910244 NHGHWLBABJTMSP-CQSZACIVSA-N 404.467 2.165 10 20 HECD NC(=O)[C@H]1CCC[C@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1 768130139 OBIQQYNXYHZUSR-RYUDHWBXSA-N 421.409 2.144 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3c(O)cccc3Cl)CC2)c1 768158311 YFVHQBNVPMJZHZ-UHFFFAOYSA-N 411.867 2.460 10 20 HECD CS(=O)(=O)Nc1ccc(OCCNCc2ccc(N3CCOCC3)cc2)cc1 773427944 SWOPAERYMRXGIA-UHFFFAOYSA-N 405.520 2.063 10 20 HECD C[C@@H](C(=O)Nc1ccccc1S(C)(=O)=O)N1CCOc2cc(N(C)C)ccc21 774752826 MPHYICJFHKTUGJ-AWEZNQCLSA-N 403.504 2.382 10 20 HECD CN(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1cccs1 774852800 FKFOSPXRHVORGX-SFHVURJKSA-N 400.548 2.384 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccc(F)cc3)c3cnn(C)c3)nc12 775753068 NSTOMRQJOYMIGD-IBGZPJMESA-N 424.436 2.363 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1 779610792 AUENVTMXLVEERE-HXUWFJFHSA-N 401.532 2.477 10 20 HECD COC(=O)c1cnc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 779671127 OZSQXKUYVZIONQ-LBPRGKRZSA-N 406.389 2.263 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@]3(C)CCCOC3)cc2F)C[C@@H](C)O1 781291007 RTWBDVCOUUMLDP-ZMPRRUGASA-N 422.497 2.415 10 20 HECD CC[C@]1(CO)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 784389239 NPICQLAADMOEIB-HYFFOGBASA-N 407.530 2.292 10 20 HECD O=C(NCc1cc(F)ccc1F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787041615 SYOBHJOISNLBEC-KRWDZBQOSA-N 404.413 2.494 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1C 788035855 YJCMJDRMCIIUKM-UHFFFAOYSA-N 424.545 2.091 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 788909255 FPMPGTDXYYUKAF-GOSISDBHSA-N 422.533 2.305 10 20 HECD C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933317 PIXZUMIDUCFXJY-INIZCTEOSA-N 418.538 2.323 10 20 HECD CC(=O)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C 789900990 WALQDFBXXQKBOD-UHFFFAOYSA-N 400.500 2.362 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CNCCNS(=O)(=O)c2ccc(F)cc2F)c1O 799344321 AWJWJRMEHHUNKY-UHFFFAOYSA-N 421.809 2.300 10 20 HECD CCN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCNC1=O 799445583 PPKPGXHDFXOAAI-UQRISPGASA-N 423.585 2.467 10 20 HECD O=C(COC(=O)[C@@H](O)c1cccnc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 803956856 HMFYFJKTKIZZBL-FQEVSTJZSA-N 416.389 2.072 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN(CC2CC2)C1 804734147 XHEOKTSXNJXPJW-MRXNPFEDSA-N 424.339 2.104 10 20 HECD C[C@H](NC(=O)N1C[C@@H](N2CCOCC2)C[C@H]1C)c1ccc(N2CCOCC2)cc1 804988327 ATZJNSDAUQVGJF-LQWHRVPQSA-N 402.539 2.089 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 805736726 CYWVQJRXQZJFBZ-HUUCEWRRSA-N 406.527 2.207 10 20 HECD Cc1noc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 806493932 ITJCRXXUHLCHIQ-WMZOPIPTSA-N 412.494 2.126 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)sn1 806841976 CKLXBPAFPLLZRL-STQMWFEESA-N 406.483 2.459 10 20 HECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)Oc2ccccc21 807095306 NOTONKOVHFZORN-HXUWFJFHSA-N 424.545 2.423 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCN(c3ccccn3)C2)cc1 807694777 OCZVPIYQPZWOGI-IBGZPJMESA-N 409.534 2.281 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 808288224 FFMBHNQZZVAQLA-UHFFFAOYSA-N 420.478 2.375 10 20 HECD CS(=O)(=O)c1ccc(N(CCN)Cc2cc(Cl)cc(F)c2O)c([N+](=O)[O-])c1 809727919 CQMFPIGPRKNGFC-UHFFFAOYSA-N 417.846 2.462 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc(OC)c1C 815409782 FPZFKIXRVHHHTF-UHFFFAOYSA-N 413.474 2.104 10 20 HECD CN(CC(=O)OCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)S(C)(=O)=O 914923610 LSHOXHNXTXNTJR-UHFFFAOYSA-N 404.448 2.475 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cnn(C[C@H]2CCCO2)c1 918221571 YFMBDNHNCNAMSQ-GOSISDBHSA-N 417.485 2.484 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccn1Cc1ccncc1 1320519809 MUZBBGKUJPNPNN-KRWDZBQOSA-N 409.442 2.247 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccco3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242053 JGTYNZURDZQCDH-BNLOLNQZSA-N 420.849 2.251 10 20 HECD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cn1 1794321666 ODFXHUGMBWCFJG-BCDXTJNWSA-N 410.474 2.081 10 20 HECD CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846044 GLMCPCLZDRDUPX-DOMZBBRYSA-N 417.466 2.335 10 20 HECD O=C(c1ccc(F)cc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442670 SLHTYWWGUHNLNR-UHFFFAOYSA-N 420.444 2.436 10 20 HECD O=C(c1ccnc(F)c1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500673 ZWOPMWUBBXRBAL-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CN1CCCc2cc(CNC(=O)CNC(=O)c3cnc4ccccc4c3O)ccc21 303026474 VWRMPGBJYOGMMM-UHFFFAOYSA-N 404.470 2.369 10 20 HECD CCn1nnnc1-c1cccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 472801437 CWQJSUJYNFHYDY-UHFFFAOYSA-N 417.473 2.415 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c1 734016799 HQVOGYUOKGECOI-JOCHJYFZSA-N 409.442 2.016 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1 742028088 QHXFBOSTZYPWDN-UHFFFAOYSA-N 411.505 2.232 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCSC[C@@H]3S(C)(=O)=O)ccc21 742178850 IPRCXUXHHFRNCD-SFHVURJKSA-N 410.561 2.464 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)OCCCO4)CC2)cc1 742927568 UYRNIYKINGEBQZ-UHFFFAOYSA-N 411.502 2.409 10 20 HECD COc1cccc(F)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 745314298 GIWNLJMMOOJJAM-UHFFFAOYSA-N 420.412 2.283 10 20 HECD C[C@@H](NC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 748532516 FVCYFWVFNBQLCX-IQMFZBJNSA-N 422.485 2.069 10 20 HECD C[C@H](NC(=O)N1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 749011087 XWUVDOQAPLZMHX-UWJYYQICSA-N 408.502 2.467 10 20 HECD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1c(-c2ccccn2)nc2ccccn12 751308172 RSKJOIFSSDPOEF-YXUGBTPSSA-N 413.437 2.142 10 20 HECD CC(C)[C@H](NC(=O)NCCCSc1nccs1)c1nc(-c2nc[nH]n2)no1 752690109 WVUODYMJELTRDL-JTQLQIEISA-N 408.513 2.490 10 20 HECD COc1ccc(N2CCN(C(=O)NCCNC(=O)c3ccc(F)cc3)CC2)cc1F 753904594 AICXWBXIYNDBRI-UHFFFAOYSA-N 418.444 2.235 10 20 HECD COc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1F 754214074 KPAPDOYLRWRBIR-UHFFFAOYSA-N 405.401 2.269 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](c3ccccc3)N(C)C)CC2)cc1 758184614 FEJVIYFSJLYUFW-LADGPHEKSA-N 412.578 2.071 10 20 HECD COc1ccc([C@H]2NC(=O)N(CCN3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1 761188352 ZKKAIUKBXYBRMB-OAQYLSRUSA-N 424.501 2.119 10 20 HECD CCC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1CCOC 766764507 NVFCUBCVENFHNG-IBGZPJMESA-N 422.545 2.305 10 20 HECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 771233547 IOZUSOCRMZDJSK-SJLPKXTDSA-N 418.538 2.308 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 771457714 ASUJHSUQBOUGNM-XMTFNYHQSA-N 406.546 2.080 10 20 HECD C[C@H](NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(N(C)C)cc1 773087250 HXLFTIXTYDBNMV-LBPRGKRZSA-N 407.448 2.472 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 774861262 YIFCLHIUXLJIHS-FQEVSTJZSA-N 408.502 2.225 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c1 776063323 RNMALUHAOBLQHR-UHFFFAOYSA-N 408.480 2.194 10 20 HECD O=C(NCc1ccc(O)c(O)c1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 778922949 MQTUZAIEVWGEBP-JLHYYAGUSA-N 416.499 2.427 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)[C@H]3CCCOC3)CC2)cc1 780044625 PPOMDPQSCYJDHA-MOPGFXCFSA-N 404.555 2.322 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(OCC(=O)NCC)c1 784030433 PJAHPTQWBFNSFD-UHFFFAOYSA-N 413.474 2.284 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(OC[C@@H]2CCOC2)CC1 784223968 SOPHRDVBJRNXAB-GOSISDBHSA-N 421.513 2.389 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(N4CCOCC4)ccn3)CC2)cc1F 784430867 LNDSYCAUYKEJIZ-UHFFFAOYSA-N 400.454 2.028 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1 785435385 YLWIUZVPWGDFCU-MRXNPFEDSA-N 423.439 2.448 10 20 HECD CC(C)OCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789822060 VHFHMVIQIRZALE-CALCHBBNSA-N 423.529 2.377 10 20 HECD Cc1ccn2cc(CNC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)nc2c1 789861844 SKZHSLHDNFXTQI-UHFFFAOYSA-N 423.542 2.129 10 20 HECD COc1ccc(Br)c(C(=O)NCCCNC(=O)c2cccc(O)c2O)c1 791180900 PMURZRZYSAABKP-UHFFFAOYSA-N 423.263 2.419 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 791250899 UYYHELVUEZTEAS-UHFFFAOYSA-N 403.439 2.180 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1 792206680 NCPZFBBYFDMJFV-UHFFFAOYSA-N 418.538 2.421 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c(O)c1 797390034 KWWYCQLRNDTNBC-UHFFFAOYSA-N 416.434 2.398 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@H](C)c3nccs3)CC2)cc1 804315811 SOJDBSSJTVNDQD-HNNXBMFYSA-N 416.547 2.499 10 20 HECD COC(=O)N1CCC(CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 805830525 KCMDIQLGJRKBJO-UHFFFAOYSA-N 404.511 2.395 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc(N(C)C)cc1 807672565 DJUHFIYRTQKBBZ-HBIPHATFSA-N 401.532 2.326 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)cc2)CC1 816665371 DOLGYIUSERWHHT-UHFFFAOYSA-N 423.517 2.305 10 20 HECD CCOc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1OC 916676749 QBYHFYXYSANOPG-UHFFFAOYSA-N 418.515 2.259 10 20 HECD COc1ccc(N2CCCN(CCC(=O)N3CCN(c4ccccn4)CC3)CC2)cc1 917208674 LUWHGQSGHKDOPE-UHFFFAOYSA-N 423.561 2.341 10 20 HECD Cc1cccc(NC(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918672890 MILVLDJVFIHHGL-SFHVURJKSA-N 423.517 2.135 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc(C(=O)OC)c3)CC2)cc1 1260844105 FVBOBXXOKQCQEX-UHFFFAOYSA-N 404.488 2.383 10 20 HECD C[C@@H]1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H](n2cncn2)C1 1261582494 VELQSRYJJJOLFD-NSISKUIASA-N 403.552 2.032 10 20 HECD CN1CCN(c2ccc(CN(C)[C@@H]3CCN(CC(F)(F)F)C3=O)cc2F)CC1 1319948143 IOMYQOOQXWLYFJ-QGZVFWFLSA-N 402.436 2.173 10 20 HECD CN1CCN(c2ccc(CN3CC[C@H](C(=O)NCC(F)(F)F)C3)cc2F)CC1 1320485336 CBTFGGNVVNADMT-HNNXBMFYSA-N 402.436 2.078 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2nc(C)cc2C)nc1 1323844071 DWYUYGPTMTYQHJ-KRWDZBQOSA-N 424.457 2.200 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)CC2)cc1 1324077712 LNCCBIYRCAFUDR-GOSISDBHSA-N 421.538 2.398 10 20 HECD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1782004476 WJZKTBMSQGQIMW-FQEVSTJZSA-N 420.849 2.410 10 20 HECD CC1=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)CCO1 1796931961 WJQPQWKBNXZTSK-VBUUOAMHSA-N 422.485 2.112 10 20 HECD Cc1ncc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)s1 1803191096 JTPMHJUERKFISE-HOYONBQMSA-N 414.487 2.223 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1=COCCC1 1822460230 RXVZPTBJKJSLJE-OAHLLOKOSA-N 413.434 2.216 10 20 HECD C[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1831647309 PTZDDOYYNOBZJS-MLGOLLRUSA-N 410.898 2.365 10 20 HECD C/C=C/C=C\C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031868 TZFNMMSGZDAKCB-IAROGAJJSA-N 415.490 2.237 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)COc3cc(Br)ccc32)c1O 727762206 CEFHUYBQJHXJDR-UHFFFAOYSA-N 421.247 2.205 10 20 HECD CCN1CCN(c2ccc(CNC(=S)NC[C@H]3CCCN3CC)cc2F)CC1 730157662 VQXUBESGBGBBJS-GOSISDBHSA-N 407.603 2.416 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(NC(=O)CN(C)Cc2ccccc2O)c1 731842838 JCIVCRJOCYJXIP-UHFFFAOYSA-N 405.520 2.493 10 20 HECD COc1ccc(N2CCC(NC(=O)c3sccc3S(=O)(=O)N(C)C)CC2)cc1 731986052 GGTITOYFYQGVAD-UHFFFAOYSA-N 423.560 2.406 10 20 HECD Cc1ccc(S(N)(=O)=O)cc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735515924 DRQOSNGYKRLUCF-INIZCTEOSA-N 404.488 2.169 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc21 737116756 KCERIADTYKMGMD-UHFFFAOYSA-N 409.490 2.346 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1SCCC(N)=O 737117775 RYTLFHOCGXIVBK-UHFFFAOYSA-N 414.531 2.317 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C(C)C)N3CCCCC3)nc12 741010663 JZCJZLHKBFCELS-KRWDZBQOSA-N 404.467 2.165 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cn(Cc4ccccn4)nn3)cc2F)C[C@H](C)O1 742556920 OLZYGMYJSDVNER-HOTGVXAUSA-N 424.480 2.404 10 20 HECD O=C(CNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCC(F)(F)F 743558695 VXKFJTKYSQFSRM-NSHDSACASA-N 424.370 2.235 10 20 HECD CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NCc2ccccc2O)c2ccc(Cl)cc21 743901162 ABZVSBFUWNOZMW-CQSZACIVSA-N 415.877 2.271 10 20 HECD COCCOC[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 744417096 NMFSTHUZOKKDLF-MRXNPFEDSA-N 422.481 2.385 10 20 HECD COc1cccc(CNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1O 745680836 MILQGICWNYQTJY-UHFFFAOYSA-N 413.474 2.100 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1 745990257 ACJCOYRCBPFKFY-UHFFFAOYSA-N 403.504 2.173 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3ccn(CC(F)F)n3)CC2)cc1 748952074 YSZHNZSTBISXGW-UHFFFAOYSA-N 422.480 2.491 10 20 HECD CCN1CC[C@H](N(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@H]1C 748962298 WBVYSLJONRBAKC-LMNJBCLMSA-N 415.582 2.403 10 20 HECD CCN(C)C[C@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 749198994 VAHWRXCVUYXKBJ-HXUWFJFHSA-N 417.598 2.191 10 20 HECD COc1ccc([C@@H](CNC(=O)c2ccc(C)c(O)c2O)N2CCOCC2)cc1OC 751533955 TXYGBCAUCRUYDB-QGZVFWFLSA-N 416.474 2.227 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3c3cc(C)no3)CC2)cc1 754009176 ZJUIDIWENUEMCR-CTNGQTDRSA-N 400.523 2.312 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@](C)(CO)C3CCCCC3)CC2)cc1 754043546 SHZDYEPMRLMMPF-FYYLOGMGSA-N 405.583 2.099 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)[C@H](O)C(C)C)CC2)cc1 754619837 QMYGSNPOCWCUSD-HXUWFJFHSA-N 406.571 2.160 10 20 HECD CC(C)C(=O)NCCCNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 756057877 PVGOGSITTNFOHS-HZPDHXFCSA-N 408.518 2.401 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC[C@H]3CCCO3)cc2F)C[C@@H](C)O1 760535824 CSGWSNJVDPSREY-HLLBOEOZSA-N 400.516 2.428 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)cc1 760796035 LKVMVSSVLZNQTF-UHFFFAOYSA-N 420.535 2.061 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[S@@](=O)C[C@H](C)C1 763853946 LXBACADSIPZQGC-FIXAZDJUSA-N 424.522 2.489 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@H](O)c3cccc(OC)c3)CC2)cc1 764635636 CVMMHYVNLVJGRE-JOCHJYFZSA-N 413.518 2.066 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2cccc(Br)c2O)C[C@@H](C)O1 764764111 YBKOHIIBZHQDLN-BETUJISGSA-N 400.317 2.453 10 20 HECD CC(C)CN1N=C(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCC1=O 768199877 OJYWPUSTUBFZRM-UHFFFAOYSA-N 404.486 2.037 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3c(ncn3-c3ccccc3)C2)c1 778454815 OTYZJUASKOPPDR-UHFFFAOYSA-N 412.471 2.148 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)cc1C 778914270 GMXYKCSSOLKODN-UHFFFAOYSA-N 418.515 2.432 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)O4)cc2F)C[C@H](C)O1 780313827 ZJMUBRVAUQWVED-GJZGRUSLSA-N 420.485 2.223 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc4c(c3)NC(=O)CCN4C)c2)CC1 781271677 NEJOVECRENBMSF-UHFFFAOYSA-N 421.501 2.386 10 20 HECD COC(=O)c1ccc(OC)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 781507319 QXWBFJGYEVIIJA-LLVKDONJSA-N 402.403 2.012 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cnc2c(c1)CCCC2 782778789 TXCUEZLTLLFHRP-UHFFFAOYSA-N 422.529 2.424 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCc2ccccc21 788910355 JWJJQRBXZCSJLL-GOSISDBHSA-N 406.530 2.470 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CN(C)CC3CC3)C2)cc1 788929401 VPAQPMHZRNJZQP-FQEVSTJZSA-N 400.567 2.339 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCCS3)cc2F)C[C@@H](C)O1 789816272 CNJCSJLXYMHYSN-INMHGKMJSA-N 423.554 2.457 10 20 HECD O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1c(F)ccc(O)c1O 789954854 NXSQYRQOZXHNFN-UHFFFAOYSA-N 408.451 2.342 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)c(O)c1 797390621 KGKJMXMWVGKSED-GASCZTMLSA-N 413.474 2.269 10 20 HECD CN1CCN(c2ccc(CNCCS(=O)(=O)CCc3ccccc3)cc2)CC1 800311214 LYBKUUHLTZXDQT-UHFFFAOYSA-N 401.576 2.186 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)nc12 802018257 KWUJADGNSQLATN-HZPDHXFCSA-N 408.462 2.165 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC(F)F)nc3)CC2)cc1 802554547 HBHZEXYVSNHOSS-UHFFFAOYSA-N 420.416 2.415 10 20 HECD CC[C@@H](C)N(C)CCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 804221224 KAEFGIIBSDDYCT-CYBMUJFWSA-N 414.344 2.350 10 20 HECD Cn1ccc(N2CCC[C@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C2=O)n1 805277214 RASSKGALYNKUOY-ZDUSSCGKSA-N 412.277 2.427 10 20 HECD COC[C@@]1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 811398780 DWIGUVHTKKHHIK-HXUWFJFHSA-N 409.435 2.097 10 20 HECD Cc1c(S(=O)(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1C 813675520 FPFPBFMHUUAQAO-ZDUSSCGKSA-N 400.451 2.277 10 20 HECD CC(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918006366 VUYRJJZSWVMLKI-LJQANCHMSA-N 423.517 2.346 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)oc2c1C(=O)CCC2 918337435 KEGMKFDGESJBEV-UHFFFAOYSA-N 416.499 2.272 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(S(N)(=O)=O)ccc3C)CC2)cc1 918369856 UERBSASAUMWKPR-UHFFFAOYSA-N 403.504 2.004 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920880169 BATWSXWYBJZOPQ-MRXNPFEDSA-N 406.486 2.419 10 20 HECD Cc1noc(C)c1S(=O)(=O)N1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1319687453 LPLLYAOENIWFQW-UHFFFAOYSA-N 404.536 2.398 10 20 HECD C[C@H](NC(=O)NC[C@@H](CO)CC1CCOCC1)c1ccc(N2CCOCC2)cc1 1343834260 CIBRLFIZPQCTOS-HKUYNNGSSA-N 405.539 2.309 10 20 HECD CC(C)/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007508 JNMCTNBCAGFBHJ-WUUFJKRQSA-N 408.882 2.407 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C1=CCCC1 1806213137 IMYJMWZGVZLHEN-JXFKEZNVSA-N 408.458 2.318 10 20 HECD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)CC1 1832898645 UISDQSKEKKKWAK-HNNXBMFYSA-N 423.604 2.267 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843970702 XHHPRBCYFYAFKK-XUDQMGBKSA-N 400.475 2.456 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1nnc(C(C)(C)C)s1)c1ccc(N2CCOCC2)cc1 65715994 JPYVTUHVSSYYKH-CYBMUJFWSA-N 417.535 2.488 10 20 HECD CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 729523022 CWVSACWLKYTHFR-SFHVURJKSA-N 408.518 2.401 10 20 HECD COCCN1C(=O)/C(=C/Nc2ccc(-c3csc(C)n3)cc2)C(=O)NC1=S 730984260 ZEQLJYSYULCUMF-NTEUORMPSA-N 402.501 2.304 10 20 HECD C[C@@H](NC(=O)CNC(=O)N1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 732277065 DEGKTNPVJMTVBQ-GOSISDBHSA-N 422.529 2.468 10 20 HECD COc1cccc(C(=O)N2CCN(Cc3cc4c(cc3O)OCO4)CC2)c1OC 738107763 OHXOJNVEHOJVLR-UHFFFAOYSA-N 400.431 2.096 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCN3Cc4ccccc4C3)cc2)C1 744305471 UCUQOUIGARGOFD-NRFANRHFSA-N 421.545 2.203 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1(C)C 745694568 HXTBMXVFUTXWRR-SGXKBVARSA-N 402.539 2.391 10 20 HECD CCN(CC(=O)Nc1ccc(OC)c(S(=O)(=O)N(C)C)c1)c1ccc(OC)cc1 746109474 QFWNHWPWFJLMIM-UHFFFAOYSA-N 421.519 2.419 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(OC[C@H]4CCCCO4)CC3)nc12 750064358 GVYKWMISPOCFDK-QGZVFWFLSA-N 418.494 2.162 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 759577542 AVSXEJHUMVIOJB-IGRFPYPBSA-N 410.470 2.433 10 20 HECD CN1C(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C(=O)[C@H]1Cc1ccccc1 761128923 ZTNFDLQTPQMSGO-PZJWPPBQSA-N 420.513 2.394 10 20 HECD Cc1nn(C)c(-n2ccnc2C)c1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 763990915 YMEASBWQNQMTHW-UHFFFAOYSA-N 408.506 2.331 10 20 HECD Cc1ccc([C@@H](C)[C@H](O)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 764861981 JHYRAHSBFPJHRK-UTKZUKDTSA-N 416.543 2.011 10 20 HECD CCC[C@H]1C(=O)NCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 766256006 HDZASEADODQJJV-IBGZPJMESA-N 405.454 2.001 10 20 HECD CSCC[C@@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 767774143 KHFZOOPSKRBDCG-XHSDSOJGSA-N 420.531 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(C(F)F)c3)CC2)cc1 767890582 MIVFLDKYLNPCJI-VOTSOKGWSA-N 405.405 2.130 10 20 HECD Cc1cc(O)cc(=O)n1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771064078 HISLBBBABYUOAC-MRXNPFEDSA-N 405.882 2.002 10 20 HECD Cc1cc(C(=O)COC(=O)Cc2ccoc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 772558395 CAHHVYOOKDECSP-UHFFFAOYSA-N 416.455 2.303 10 20 HECD CC(C)NS(=O)(=O)c1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1F 773740360 KSGXJEZVZNDEBK-GFCCVEGCSA-N 410.467 2.285 10 20 HECD CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774355479 ACFODLPCGISGRK-UHFFFAOYSA-N 422.865 2.464 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N(C)C)c1 774958568 QEARRLLZSNRIBD-NRFANRHFSA-N 412.534 2.105 10 20 HECD Cc1nc2ccccc2n1CCNC(=O)C(=O)NCCCSc1nccs1 785495153 DUAMYRNFMBHKHD-UHFFFAOYSA-N 403.533 2.216 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)O[C@@H](C)C2 786631471 UQDIODXYMQNMFS-HNNXBMFYSA-N 411.502 2.326 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCSC3)cc2F)C[C@@H](C)O1 789825433 LRYQFNPRZVPXMV-IJEWVQPXSA-N 409.527 2.019 10 20 HECD COc1cncc(S(=O)(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 798440044 GEXCTKUMYXAWHS-OAHLLOKOSA-N 411.911 2.392 10 20 HECD CCOCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 799558551 LAWKGFIRPIEEEI-IYBDPMFKSA-N 422.497 2.415 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(N2CCCC2)n1 803663969 CKVFZKUZEGZNQQ-UHFFFAOYSA-N 413.497 2.128 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(F)cc(OC)c3)CC2)cc1 806452738 CAAPCSLHQQYEKX-UHFFFAOYSA-N 415.465 2.198 10 20 HECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 806879217 XFWYXHQFHDXKHG-UHFFFAOYSA-N 401.364 2.207 10 20 HECD Cn1nnc2c1C[C@H](C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 810449804 OBOHPLMLKCMYBA-KGLIPLIRSA-N 405.449 2.307 10 20 HECD O=C(CNS(=O)(=O)c1cccc(F)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364630 LAZAKYKCWJPDCP-KRWDZBQOSA-N 422.478 2.017 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1 918305960 PUTPPDVZCZANSM-UHFFFAOYSA-N 410.474 2.302 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918461487 FOSXKQSMWZXHHH-UHFFFAOYSA-N 411.458 2.159 10 20 HECD CC(C)[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)c2ccccc2C1=O 919860055 MEJVIEQZLUGJAS-OAQYLSRUSA-N 421.497 2.460 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3nc(C)sc3C)CC2)cc1 1335397247 YWJGPRHCDACKMU-HHHXNRCGSA-N 407.561 2.366 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NCCCN3C(=O)NC(C)(C)C3=O)ccc21 1518730192 UPGSOIGIIWLOAQ-UHFFFAOYSA-N 414.506 2.355 10 20 HECD O=C(CC1CCC1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007191 DIZIJWHFQRACME-HXUWFJFHSA-N 408.882 2.385 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCCSC3)CC2)C1 1810549897 KHRIIFDXFFOESZ-OAHLLOKOSA-N 419.547 2.481 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1)CC2)c1cc(O)nc(O)c1 1816727346 PREWZVPXORIVGG-ZDUSSCGKSA-N 410.455 2.489 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843970700 XHHPRBCYFYAFKK-RXQWTSATSA-N 400.475 2.456 10 20 HECD CCCCNC(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 6428498 BNRMVDRGEKNXCE-UHFFFAOYSA-N 410.382 2.443 10 20 HECD CNC(=O)C1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 14300375 WOIWOSCQMKWLTB-UHFFFAOYSA-N 417.216 2.237 10 20 HECD C[C@H](NS(=O)(=O)c1cccc(C(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 65277556 DUFLZFPNSRFGNC-INIZCTEOSA-N 417.531 2.265 10 20 HECD COCCC(=O)N1CCN(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 476603070 STFAQIKIZRZOEN-UHFFFAOYSA-N 401.507 2.225 10 20 HECD NC(=O)CN1C(=O)/C(=C/c2cnn(-c3ccc(Br)cc3)c2)SC1=S 727175337 ACWNUVPPEBZDSQ-XGICHPGQSA-N 423.317 2.321 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@](C)(OC)c3ccccc3)CC2)cc1 730354934 MBGLBZLLRFZXIU-HSZRJFAPSA-N 412.486 2.449 10 20 HECD CC(C)c1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)on1 733832483 CVBOEQJHONEJDK-UHFFFAOYSA-N 405.426 2.247 10 20 HECD CCOc1ccc(N(C)CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1 739924693 UHPYBZQTHTZJRS-MRXNPFEDSA-N 406.508 2.025 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1NC(C)=O 743954590 CBJLGOKQHMPTOB-UHFFFAOYSA-N 411.458 2.493 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@H](O)c3ccccc3)cc2)C1 745692592 XSBHMENTJWFLQW-CTNGQTDRSA-N 410.518 2.311 10 20 HECD COc1cccc(CNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1O 745779946 FRJIVIXYRHWMNA-GOSISDBHSA-N 413.474 2.309 10 20 HECD COC1(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCOCC1 746714933 PVTPKCGPFMMDHF-HOTGVXAUSA-N 409.502 2.434 10 20 HECD CNC(=O)[C@@H](C)CN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747967466 NKQBHIQKOKVUQG-KBPBESRZSA-N 407.470 2.103 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnc(-c2ncccn2)s1 750195333 OMLDLMPMTPSXCC-UHFFFAOYSA-N 411.487 2.482 10 20 HECD Cc1cc(C(=O)CN2CC[C@]3(CCOC3)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756903079 JEIJUUFVTJFAMW-NRFANRHFSA-N 417.531 2.037 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CSc3ccc(O)cc3)nc12 757112246 HTPLBJNGJFQQLE-UHFFFAOYSA-N 403.416 2.153 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3Cc4cccc(O)c4C3)CC2)cc1 758286799 VQWKCDKWAXHNLK-IBGZPJMESA-N 424.545 2.380 10 20 HECD CC(C)Oc1ccc(N(C)CC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 759915975 SZZGVDXWKINONC-QUCCMNQESA-N 424.563 2.105 10 20 HECD CN(Cc1ccccc1O)C(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 760911187 NTVREGBVXSFWFU-MRXNPFEDSA-N 405.495 2.256 10 20 HECD COc1ncc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1C(N)=O 762221639 ILPWXPMIUNWZQI-HNNXBMFYSA-N 400.435 2.108 10 20 HECD CCN(CC)c1ccc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)cc1F 769501810 DBFXFEPGTKXOQV-UHFFFAOYSA-N 410.515 2.308 10 20 HECD C[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)cc1 773003270 CPDKSWLASFRZPI-CTNGQTDRSA-N 400.567 2.261 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773164279 BBFQLMMQFRBDPM-INIZCTEOSA-N 404.536 2.400 10 20 HECD Cc1cc(C)c(S(=O)(=O)NCCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)c1 773741643 LZJSUKHTQDNNMT-MRXNPFEDSA-N 420.531 2.439 10 20 HECD CC(C)CCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774538933 CZTQAZKECZTFKL-MJGOQNOKSA-N 416.566 2.336 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CCc3nc(N(C)C)no3)cc2F)C[C@@H](C)O1 776633612 REZRBMPHZRKOKT-ZIAGYGMSSA-N 405.474 2.137 10 20 HECD COc1cc(OC)cc(C(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c1 780881239 AITWJZLVEVYTAC-UHFFFAOYSA-N 400.431 2.022 10 20 HECD COC(=O)COc1cccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 781045246 GFWDPIMQUQOVOM-UHFFFAOYSA-N 411.458 2.159 10 20 HECD CNC(=O)CCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 781234457 OYSMPOQVQKZZIE-ZDUSSCGKSA-N 422.437 2.249 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1 785295074 QOYZQXYWKVWMPH-CYBMUJFWSA-N 408.414 2.366 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnnn3-c3cccc(F)c3)cc2)C1 789906033 XAVFRQUPALVJDD-MRXNPFEDSA-N 422.464 2.038 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC([C@H]2CCOC2)C1 792616912 ZQIVJENKZMTWIE-LBPRGKRZSA-N 408.501 2.363 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4cccc(F)c4)C[C@@H]3C)nc12 795194662 XZQZUZBLGGWSTB-AWEZNQCLSA-N 413.453 2.461 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1 796788570 FQASXVVGIDDLPI-LLVKDONJSA-N 417.393 2.312 10 20 HECD CC(C)N(c1ccc(CC(=O)N(C)C)cc1)S(=O)(=O)c1cccc2nonc12 799654350 WDLHLEFFCRSOSY-UHFFFAOYSA-N 402.476 2.457 10 20 HECD CCN(CCOCCO)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 800700462 GWZADZKJWPRVHX-UHFFFAOYSA-N 419.444 2.082 10 20 HECD Cc1nc(C)c(CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803300878 WOAHPBLGDLFGPI-CQSZACIVSA-N 416.547 2.133 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1F 804853738 UCHUCRMXJUOITB-MJGOQNOKSA-N 404.530 2.231 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1 807291599 YNWKIHWZZKOGDQ-HSZRJFAPSA-N 418.541 2.412 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N(CCO)[C@H]1CCc2ccccc21 807292175 NJRKMHZXLNZATK-QFIPXVFZSA-N 405.498 2.187 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671078 LDEFTINFDVKJAR-ZBFHGGJFSA-N 404.511 2.055 10 20 HECD CO[C@@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807768154 DBWPGHOSFSMHME-PBHICJAKSA-N 413.465 2.160 10 20 HECD CC[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(C(F)(F)F)cc1O 810216106 QKBVRDCPZFYYJF-HNNXBMFYSA-N 409.474 2.029 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C[C@@H](C)O1 918201060 CFZUURJNJDUHRN-RTBURBONSA-N 418.582 2.194 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[nH]c2c1C(=O)CCC2 918334374 FSIVQKBUZFIZOF-UHFFFAOYSA-N 415.515 2.007 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](C)Sc3nnnn3C3CC3)CC2)cc1 918664651 ZDDWQJODCHBGTC-CQSZACIVSA-N 402.524 2.236 10 20 HECD CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920195476 SWOBKQSWLBGYIB-UHFFFAOYSA-N 424.501 2.373 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H]4OCCC[C@H]4C3)cc2)C1 1319343823 FHYOTGOUGBAQEE-NSHGMRRFSA-N 400.523 2.099 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(C)c4c(O)nc(O)nc4n3)CC2)cc1 1323193468 POODVNXJCRXFFQ-UHFFFAOYSA-N 409.446 2.106 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc[nH]1)c1cc(O)c(O)c(Cl)c1 1794283903 WKEAANKMHWHLQF-QDMKHBRRSA-N 418.881 2.359 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991020 MQRWCKNPXMDZTN-JXFKEZNVSA-N 408.458 2.318 10 20 HECD C[C@H](CN)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708876 SBPATEJRWCAQIU-PSASIEDQSA-N 424.910 2.028 10 20 HECD CCOCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429546 WNBWIHXPCMVXCZ-QGZVFWFLSA-N 405.495 2.153 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)C1 1841243851 RLCFBLCCRKRUKV-SJORKVTESA-N 411.433 2.253 10 20 HECD Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847907583 VRBKDQBMVAVRLI-GJZGRUSLSA-N 418.881 2.231 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2nnc(-c3ccc(F)cc3)n2N)cc1 7484082 ZAVQZGXBOZRQAV-UHFFFAOYSA-N 400.483 2.273 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1 27960232 YUJAEVJXLWUSKZ-UHFFFAOYSA-N 423.513 2.237 10 20 HECD COC(=O)c1ccc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 32763942 PPJXJOMFBFTSNR-UHFFFAOYSA-N 411.502 2.424 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](CC(N)=O)C3CCOCC3)ccc21 466626776 GVWXWRZYYFOWGY-IBGZPJMESA-N 401.507 2.305 10 20 HECD O=C(NC1CCOCC1)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 530770341 CXEGTEOBFMHIDH-UHFFFAOYSA-N 418.500 2.401 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NCc3ccccc3O)CC2)cc1 725843724 CYEFHOGMZKOXNJ-UHFFFAOYSA-N 403.504 2.294 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 728981420 ZHGAQEQQEXQQND-KGLIPLIRSA-N 412.442 2.402 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)CCO1 737167445 SRCXXJGIGNVLCJ-OAHLLOKOSA-N 414.481 2.372 10 20 HECD CS[C@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 740469511 RBHDLQJEGGYUBA-MLGOLLRUSA-N 421.485 2.454 10 20 HECD COC(=O)CC(C)(C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 741189842 BFRXPKBADCMIDK-UHFFFAOYSA-N 410.382 2.442 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CCc3cccn3C)CC2)cc1 743568704 YCDSZOGKYCCKEA-LJQANCHMSA-N 413.566 2.476 10 20 HECD CN(CCOc1ccc(S(C)(=O)=O)cc1)Cc1ccc(N2CCOCC2)cc1 743839249 QLERROLCBCYBEK-UHFFFAOYSA-N 404.532 2.438 10 20 HECD COc1cccc(CNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1O 745503475 JOGTUZKDXKVKTK-UHFFFAOYSA-N 407.492 2.087 10 20 HECD O=Cc1ccc([N+](=O)[O-])c(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 748151193 QZXWICRKNDXAHD-UHFFFAOYSA-N 417.393 2.078 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@H](O)COCC3CC3)cc2F)C[C@@H](C)O1 749009292 KFTYTZKGXMYQHM-DAYGRLMNSA-N 409.502 2.026 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccccc2O)cccc1C(=O)N1CCSCC1 749033858 LCAFDOYKXRJKFE-UHFFFAOYSA-N 413.499 2.145 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757270325 DXCOUPXSHVZLRQ-UHFFFAOYSA-N 423.391 2.250 10 20 HECD COc1cc(N2CCN([C@H](C)C(=O)Nc3cc(C)no3)CC2)cc(OC)c1OC 759877308 FZNIAPACEJUIBA-CQSZACIVSA-N 404.467 2.158 10 20 HECD CCCN(Cc1ccccc1O)C(=O)Nc1cccn(CCS(C)(=O)=O)c1=O 760796151 TXDMHLVTFPEDTK-UHFFFAOYSA-N 407.492 2.043 10 20 HECD CN(Cc1ccccc1O)C(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 760911186 NTVREGBVXSFWFU-INIZCTEOSA-N 405.495 2.256 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccsc3)CC2)cc1 762640973 NKHYRRVABGATKX-UHFFFAOYSA-N 402.520 2.024 10 20 HECD CCN1C[C@H](C)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H]1C 766252514 GWWJJWYFSVPKTD-VJANTYMQSA-N 420.573 2.470 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(C(=O)NC(C)C)cc3)CC2)cc1 767334234 KTZVIXZCEGHVKK-UHFFFAOYSA-N 424.545 2.385 10 20 HECD COC(=O)C1(NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCCC1 767505346 DIIBKGHQDLQQPH-HOTGVXAUSA-N 421.513 2.131 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1 768718492 ITFAHSUVPQKYHM-JTQLQIEISA-N 401.448 2.074 10 20 HECD CCC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1nn[nH]n1 769958690 ZOTACPPQEVRCNE-LBPRGKRZSA-N 422.492 2.039 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nc(Cl)sc3=O)cc2F)C[C@@H](C)O1 772247078 SDPCCTSWLPMJBP-GHMZBOCLSA-N 414.890 2.027 10 20 HECD C[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 774537188 JJBBOBBEDMCOBX-KRWDZBQOSA-N 413.493 2.416 10 20 HECD CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)O1 775459743 GPRIHMUAJPLUOQ-WOJBJXKFSA-N 402.539 2.454 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)COC4)c2)CC1 780407882 QNCDDNVNJBSDHC-UHFFFAOYSA-N 401.488 2.186 10 20 HECD COCc1ccccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787504677 MCZNUSARZMQUEY-FQEVSTJZSA-N 412.486 2.363 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cccc(OC)c1OC 787926972 SNUGOAARWKJGEY-UHFFFAOYSA-N 413.518 2.477 10 20 HECD COc1cc(NCc2ccc(N3CCN(C)CC3)cc2)ccc1S(=O)(=O)N(C)C 802646546 NJRIOMDTZWTFAU-UHFFFAOYSA-N 418.563 2.309 10 20 HECD CC1CCN([C@@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 803542303 VLDJVGSUOLGNET-AZUAARDMSA-N 417.550 2.136 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC3CCC4(CC3)NC(=O)NC4=O)cc2)CC1 805091996 UIAMWRBZODHPHB-UHFFFAOYSA-N 413.522 2.243 10 20 HECD CC[C@@H]1CN(C(=O)c2ccccc2SCC(=O)NC(C)C)C[C@@H](C)S1(=O)=O 805392839 NOVNZDUTGQVVCF-HUUCEWRRSA-N 412.577 2.341 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1C[C@@H]2CC[C@H](C1)N2C 806495375 FYDFNEYOVNQDOT-YBVXAUJNSA-N 413.566 2.155 10 20 HECD CN(Cc1cccnc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771675 WYAPDIAZCOGVGZ-MRXNPFEDSA-N 418.444 2.427 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCOC(F)F 809839217 LDJBYUMIHDSZEL-UHFFFAOYSA-N 409.227 2.249 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](CO)C3CCCC3)cc2F)C[C@@H](C)O1 810114651 GHNYXWCOCGWOQF-JXXFODFXSA-N 407.530 2.196 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918461430 BZBRDBNMMJPMDP-UHFFFAOYSA-N 411.458 2.159 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(F)ccc(OC)c1OC 1320989384 QXZLKRPDUPAJNH-ZDUSSCGKSA-N 407.394 2.158 10 20 HECD CCOc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601549 XLZOHMPCAINTOD-MUJYYYPQSA-N 411.458 2.457 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1F)c1cc(O)nc(O)c1 1803690422 OMLJDWCBMQUQSV-CLLJXQQHSA-N 421.375 2.476 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C23CC(C2)C3)[C@H]1c1cccnc1 1813642769 QNNZHFTVLXGWBO-PDFHVRPRSA-N 408.458 2.008 10 20 HECD Cc1ncoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816536694 WSHLPSJOGDKBPG-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD COCCNC(=O)Cn1cc(NC(=O)c2cc(C)n(-c3ccc(C#N)cc3)c2C)cn1 303840762 CYXWDSOWWCHENY-UHFFFAOYSA-N 420.473 2.177 10 20 HECD O=C(C[C@@H]1C=CS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566043 XEKWUTPFXUOJRB-ZDUSSCGKSA-N 400.447 2.321 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C(=O)OC(C)(C)C)CC3)nc12 727437337 JXRJXYUMXQPUPV-UHFFFAOYSA-N 404.467 2.165 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCOc4ccccc43)CC2)cc1 728357044 QOSPTSNFKIANBV-HXUWFJFHSA-N 410.470 2.453 10 20 HECD COC(=O)CN(CCN1CCOCC1)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 731881153 DQQKMYCLOFGJSM-UHFFFAOYSA-N 413.518 2.350 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745799847 LISDZZKRVLQDAQ-CABCVRRESA-N 420.464 2.471 10 20 HECD Cn1cc(N2CCC[C@@H](OC(=O)c3csc(Cc4ccc(N)cc4)n3)C2=O)cn1 751932177 XQYSRDMMJBVOQQ-QGZVFWFLSA-N 411.487 2.402 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NCC(=O)c3ccccc3)cs2)cc1 751944626 HUUYQBKUHOKVQE-UHFFFAOYSA-N 409.467 2.472 10 20 HECD COc1cc(OC)cc(N2C[C@@H](C(=O)NCc3cc(OC)ccc3O)CC2=O)c1 752803820 GHVQKFKLONIBFM-AWEZNQCLSA-N 400.431 2.087 10 20 HECD Cc1nc2n(n1)CCN(C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)C2 752859666 AFMJTRWGQRLWKK-UHFFFAOYSA-N 424.427 2.167 10 20 HECD Cc1cc(NC(=O)CN(C)c2ccc(OC(C)C)cc2)n([C@@H]2CCS(=O)(=O)C2)n1 759929831 YPYSJQCRCCBEGF-QGZVFWFLSA-N 420.535 2.413 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc(N(C)C)cc1 773084626 RCOUASVMARICCE-OAHLLOKOSA-N 423.560 2.332 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCc1nc(O)n[nH]1 774915590 XXFFYYDEHBQJJJ-YFHOEESVSA-N 410.502 2.297 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(C(=O)N3CCOCC3)cc2)c1O 774949326 LGWCVOHSBSLNPA-UHFFFAOYSA-N 401.419 2.071 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](n2cncn2)C1 776879537 SUUVWHXNJKLPPC-GOEBONIOSA-N 415.453 2.328 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC(N3CCS(=O)(=O)CC3)CC2)cc1 779379746 HYPWSTFWTLLURO-UHFFFAOYSA-N 415.559 2.429 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCCNC(=O)c1ccc(Br)cc1 779501148 WAWPFTZMWQLHHF-KRXBUXKQSA-N 405.248 2.420 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1N1CCOC1=O 785295622 XNLGWLIUFDNRNR-CYBMUJFWSA-N 413.430 2.049 10 20 HECD CC(=O)Nc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1C 785537846 CVMBZKQNLJJCFI-UHFFFAOYSA-N 401.488 2.441 10 20 HECD Cc1csc([C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)n1 788322048 FQMOGWJYHDSOQY-GOSISDBHSA-N 414.531 2.172 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCc2cn3c(n2)CCCC3)C2CC2)cc1 788855054 NXYYNMQSDVFCNE-UHFFFAOYSA-N 409.534 2.135 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCSC2(CCOCC2)C1 788940532 WXEXTKWZVJJDJW-UHFFFAOYSA-N 403.548 2.028 10 20 HECD C[C@H](C1CC1)N(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CC1 789839824 ATTXTUMFOOVFKA-CQSZACIVSA-N 403.498 2.193 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 793862431 KQZOEYOFPRSOFS-SFHVURJKSA-N 412.509 2.493 10 20 HECD COc1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c(O)c1 794388857 BBBSEDJRMNCYDK-INIZCTEOSA-N 410.426 2.106 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCc2ccc(OC)cc2O)c1 794389075 IPDXMYXJEZHLOB-UHFFFAOYSA-N 422.503 2.370 10 20 HECD CC[C@](C)(OC)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 796408229 CJQRDLQXJRDIRV-FQEVSTJZSA-N 422.503 2.283 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 797466272 HVEWUZMFNFPVCV-JLTOFOAXSA-N 410.465 2.424 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1cc(F)ccc1F)c1ccc(N2CCOCC2)cc1 803296505 DJVXJUIBGAABIH-OAHLLOKOSA-N 417.456 2.338 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1COC2(CCCC2)O1 806688763 XZCWXPUABDGDTK-IBGZPJMESA-N 403.523 2.292 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(c2ccc(Cl)cn2)CC1)c1ccc(N(C)C)cc1 807674311 JVTGRSVPDIQUGO-OAHLLOKOSA-N 415.925 2.327 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCCN(C2CCC2)C1 808022295 IZXNGAQMAZZDDE-HKUYNNGSSA-N 400.567 2.480 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCC(=O)NCCN2CCCCCC2)cc1 814283104 BAQQZOOBASFMQY-UHFFFAOYSA-N 403.571 2.324 10 20 HECD C[C@@](O)(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cl)cc1 815065867 QSHGAJKJDOLPHW-FQEVSTJZSA-N 422.934 2.099 10 20 HECD CNC(=O)Oc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 815624084 OKXFAOOXIJLLMO-UHFFFAOYSA-N 422.235 2.128 10 20 HECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 915197959 ODJIOBSYRHZCMJ-QHCPKHFHSA-N 406.486 2.370 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccccc1Cn1cncn1 918264451 DKBKTRUHKVFFLI-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=C(NC[C@@H]1CCCO1)c1c(NS(=O)(=O)c2cn[nH]c2)sc2c1CCCC2 919956342 VHMOOEXLPISWKX-NSHDSACASA-N 410.521 2.060 10 20 HECD CC(C)n1cnnc1SCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971117 OYZMUOJCLAQICP-UHFFFAOYSA-N 407.515 2.368 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 920240237 OJECADYWTTWJFC-SFHVURJKSA-N 408.568 2.242 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 1319870801 NVXBXBZRKWGEOB-XMMPIXPASA-N 409.530 2.371 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=Cc2cc(OC)ccc2OC1 1320520323 VLLTZBSWSMTWEV-KRWDZBQOSA-N 413.426 2.173 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1C[C@H]1C1CC1 1796931200 SYOIHEJPXVSAQK-ZDNSCYFHSA-N 420.513 2.464 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1cc(O)nc(O)c1 1817843994 MGSUPAAVMDXRHA-LBPRGKRZSA-N 414.447 2.292 10 20 HECD Cc1cc(C(=O)CN(C)CCS(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 728055057 XRDSFVNXBLHFCB-UHFFFAOYSA-N 406.504 2.024 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1 729062126 NTWPNPUEKKSDOK-CYBMUJFWSA-N 413.430 2.169 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3(N(C)C)CCOCC3)cc2F)C[C@@H](C)O1 733847730 HLYMZWBZVUCHDU-IAGOWNOFSA-N 422.545 2.349 10 20 HECD CS(=O)(=O)NCCc1ccc(C(=O)NCCCSc2nccs2)s1 733973812 ANGFFQFVQUMLAC-UHFFFAOYSA-N 405.592 2.209 10 20 HECD COc1ccc(O)c(CNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1 734014813 CWFVWWJCQMHYMD-UHFFFAOYSA-N 418.247 2.190 10 20 HECD COCCOCc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097099 KQHLVHXUJWWHDC-UHFFFAOYSA-N 409.486 2.481 10 20 HECD CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NCc1ccc(N(C)C)cc1 742489063 UQOZVGCJBNWCGV-KRWDZBQOSA-N 404.536 2.362 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)cccc3OC)CC2)cc1 745314046 ANCNREYSHSNKPY-UHFFFAOYSA-N 402.422 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3CCC(C)C)CC2)cc1F 746435601 FWZIXHFCLGSOND-UHFFFAOYSA-N 417.485 2.364 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCc2nc[nH]n2)NC(=O)OC(C)(C)C)cc1 750620069 UDSBSSNJQYIBBG-MRXNPFEDSA-N 402.499 2.186 10 20 HECD COC(=O)c1nc(Cl)ccc1S(=O)(=O)NCc1ccc(N(C)C)c(F)c1 751058219 YCMJQZMUYQMSLM-UHFFFAOYSA-N 401.847 2.205 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1C 751144579 FNKGINSXQBAJLI-UHFFFAOYSA-N 421.500 2.399 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)N1CCc2ccccc2C1 751238132 XSDRJJMMVLCSMB-UHFFFAOYSA-N 415.559 2.288 10 20 HECD CO[C@H]1CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@H]1OC 753809672 XHWKLWHLFSDMPO-ZNOIYHFQSA-N 408.454 2.135 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc4c(c3)OCCCO4)CC2)cc1 758233370 WIMHFRPJSVPLCN-IBGZPJMESA-N 414.502 2.418 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)c1ccc(N2CCOCC2)cc1 759247975 SITCHECLIODNMO-OAHLLOKOSA-N 413.499 2.404 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(Br)o1 760364556 FVMWECPYKJWDTQ-UHFFFAOYSA-N 420.193 2.033 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)cn1C 760539558 WKXPNPBFTBVAEQ-UHFFFAOYSA-N 421.519 2.111 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)N1CCN(c2ncccn2)CC1 765306918 MJCBYMZTKIUTLS-UHFFFAOYSA-N 424.549 2.020 10 20 HECD O=C1CCC(=O)N(c2ccc(C(=O)NCc3cccc(Br)c3O)cc2)N1 765754244 TWLGIYCAVUMZHW-UHFFFAOYSA-N 418.247 2.243 10 20 HECD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768521474 BJNHINSENSDTEK-CYBMUJFWSA-N 424.408 2.361 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1 768719699 DDIQKRNMWISKDQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD COc1ccccc1NC(=O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769527268 DKSWUCFUNMOMCM-UHFFFAOYSA-N 424.545 2.288 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 772320778 WGRLFYAHKYXSHY-INIZCTEOSA-N 413.449 2.244 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc(F)cn1 773461080 LQKYHKNZMCZRGV-UHFFFAOYSA-N 411.481 2.008 10 20 HECD COc1ccccc1CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 775053581 MVUAWZZKUQFYOS-KRWDZBQOSA-N 411.502 2.068 10 20 HECD COC(=O)/C=C1/SCC(=O)N1CCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 775256191 WXQKRHUUYCNPTH-RZKQZQCBSA-N 419.547 2.154 10 20 HECD CC(=O)N1CCN(CCOc2ccc(CCNCc3cc(F)ccc3O)cc2)CC1 779069857 SAZCDHGKOUXSMX-UHFFFAOYSA-N 415.509 2.407 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1 785602122 YBYNQZSVXPWILW-LJQANCHMSA-N 409.465 2.147 10 20 HECD Cc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788313033 OEJPVDQACNJNPQ-GOSISDBHSA-N 411.502 2.032 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCC2=O)c1)c1ccc(N2CCOCC2)cc1 790915830 NKZUQWQBKVLJGU-MRXNPFEDSA-N 422.485 2.076 10 20 HECD CN(C)c1ccc(CNc2ccn(CC(=O)N3CCOCC3)n2)c(C(F)(F)F)c1 793010290 PURRYIQMZDGCHL-UHFFFAOYSA-N 411.428 2.439 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H]2c2nc(C)no2)c1 795754214 HSXPSINVGVUJDT-IBGZPJMESA-N 400.479 2.456 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1cccc(N(C)C)c1)c1ccc(N2CCOCC2)cc1 803298684 WIBUFLQGQPKHBP-SFHVURJKSA-N 424.545 2.425 10 20 HECD CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306214 RRHFHGRGMAJKNI-MBSDFSHPSA-N 417.550 2.100 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCC3CCC(OC)CC3)CC2)cc1 804315650 ORMJFNBZDZDQIC-UHFFFAOYSA-N 417.550 2.492 10 20 HECD CCO[C@H](CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)C(C)C 804319109 ZDRXVACQCMALSM-HXUWFJFHSA-N 405.539 2.348 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 806178005 AYGWOFPKCYBVPU-ZWKOTPCHSA-N 414.550 2.007 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCc1ccc2[nH]ccc2c1 806550499 LBOMQFAUNDUKTM-UHFFFAOYSA-N 420.513 2.322 10 20 HECD CC1=C(C(=O)N(C)C)[C@@H](c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)NC(=S)N1 916191882 CHABWTGUDVRKFN-QGZVFWFLSA-N 403.508 2.466 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3OC(=O)c4ccccc43)cc2)C1 917832500 BTWYKEMUIQYXEX-OXQOHEQNSA-N 407.470 2.306 10 20 HECD C[C@H](NC(=O)[C@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O)c1ccc(N2CCOCC2)cc1 920881995 UHYYLVRMGCGHTD-CPLUKWAASA-N 413.518 2.264 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)CC2)cc1 1319398417 DWDLVFKIHHUAFD-LJQANCHMSA-N 421.497 2.253 10 20 HECD CN1CCN(c2ccc(CN3CCC([C@H](O)c4nccn4C)CC3)cc2F)CC1 1341567835 OEBGGCFSZTZERZ-NRFANRHFSA-N 401.530 2.257 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncnc1)c1cc(O)c(O)c(Cl)c1 1795197362 OVZOJOIVTQYLCU-BTTYYORXSA-N 402.838 2.107 10 20 HECD O=C(CCCCn1cccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600739 HUZMREBXUNJUJF-BCDXTJNWSA-N 412.490 2.417 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817843844 DKKBPFUFQKOKER-CQSZACIVSA-N 412.406 2.132 10 20 HECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1F 1841577933 NRNDBNTYCBNUIT-UHFFFAOYSA-N 413.449 2.390 10 20 HECD CCN1CCC(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)CC1 1845502481 CSCFANVIXFOFAZ-UHFFFAOYSA-N 421.925 2.300 10 20 HECD CCO[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 149020551 YCIGUQJUEVYVKC-NRFANRHFSA-N 404.555 2.418 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3c(C)nn(C)c3C)ccc21 728762709 YLCYMFBKGHOGPW-UHFFFAOYSA-N 418.519 2.374 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)cc1 731498143 KIJVTUTWSMJGAX-UHFFFAOYSA-N 403.571 2.275 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1 737182235 FSWIBAOKVPBQRS-LSDHHAIUSA-N 413.474 2.442 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cc[n+]([O-])cc2)NC(=O)OC(C)(C)C)cc1 742755416 WJXHMOIQAHRMOF-SFHVURJKSA-N 400.479 2.382 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cccc(C[S@@](C)=O)c1 744530344 HXEDLIXINVPCCT-MUUNZHRXSA-N 402.516 2.447 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 744855257 VSMVQGQKMQHEHW-LBPRGKRZSA-N 414.480 2.178 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(-c4ccccn4)no3)CC2)cc1 750953586 FKLQASBMRDWTPE-UHFFFAOYSA-N 422.441 2.251 10 20 HECD CC[C@@H](C)OCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 751867909 TTWPSUQXBKEFTF-CQSZACIVSA-N 422.503 2.283 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753737748 DDEFULNMHBBXDH-UHFFFAOYSA-N 421.494 2.095 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)CC1(C)OCCO1 758704484 ZIFAXGWVAORYAJ-QGZVFWFLSA-N 405.539 2.484 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)cc1 760204321 QMEAGDLBXFDAHE-MJGOQNOKSA-N 400.479 2.090 10 20 HECD O=C1CCCC(=O)N1Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 760518650 BJHZBPBBABVCIO-UHFFFAOYSA-N 400.416 2.063 10 20 HECD CC(C)Cn1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn1 762416870 ZIGCLVMCHLBPOJ-SFHVURJKSA-N 400.479 2.391 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC1(CO)COC1 763644451 QJGHYSANUBDNKS-QPEQYQDCSA-N 413.542 2.282 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2ncco2)cc1 766575486 MVYGJRQNDYTYMB-UHFFFAOYSA-N 406.442 2.433 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H]3CN(C)CC[C@@H]32)c1 768498399 JBECZRGVBAUHML-GCJKJVERSA-N 401.551 2.343 10 20 HECD COc1ccc(O)c(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)c1 769530525 GDRRZCBIVTWFCL-UHFFFAOYSA-N 410.517 2.106 10 20 HECD COCCOCCCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769627709 XFDDAYWHEDJNFR-UHFFFAOYSA-N 414.505 2.037 10 20 HECD C[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)cc1Cl 772999464 LLIZVHBJEXMDLD-AUUYWEPGSA-N 403.914 2.366 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1 773740334 DOBVLSWRQJFUNH-ZDUSSCGKSA-N 404.488 2.147 10 20 HECD Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cccc(C)c3O)CC2)cc1 775687030 SXMMFFCBTXLJLV-UHFFFAOYSA-N 403.548 2.105 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCO[C@H](C)C3)cc2F)C[C@@H](C)O1 776403418 GFOJWBMMMGZEQY-XLMAVXFVSA-N 422.497 2.414 10 20 HECD COC(=O)N1CCC([C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 776856573 NGMXNZNIAWXTPW-MRXNPFEDSA-N 404.511 2.189 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCOc3ccccc3)CC2)cc1 778225736 NWHPEQATCIDNKU-SEYXRHQNSA-N 423.513 2.437 10 20 HECD CON(Cc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 780662887 WVRNBPCJHFEPDM-UHFFFAOYSA-N 403.504 2.195 10 20 HECD COC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 783319827 UUBNKFNCRUVEQN-UHFFFAOYSA-N 406.389 2.464 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)ccc1-n1nnnc1C(C)C 784621030 KLVQQJXIRWRPCN-UHFFFAOYSA-N 421.505 2.415 10 20 HECD O=C(NCCc1cnn(-c2ccccc2)c1)C(=O)NCc1ccc(N2CC=CC2)cc1 786120389 OCTBCNXWEAFYEY-UHFFFAOYSA-N 415.497 2.224 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cc(Cl)c2c(c1)OCCO2 787880606 RIZGMTNJDASYRT-UHFFFAOYSA-N 417.893 2.418 10 20 HECD CCC(CC)[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788318569 FDIDPLQSAHWIJB-CTNGQTDRSA-N 417.550 2.239 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCCS3)cc2F)C[C@@H](C)O1 789816273 CNJCSJLXYMHYSN-UXLLHSPISA-N 423.554 2.457 10 20 HECD CS[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789824227 HEWCXODIRNUYTJ-TXCZRRACSA-N 423.554 2.456 10 20 HECD Cc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803660766 CLCNLELHFZHUIU-UHFFFAOYSA-N 412.509 2.161 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@H](Cc4ccncc4)C3)CC2)cc1 804316583 DLTKTYGWSOJQLE-LJQANCHMSA-N 422.529 2.266 10 20 HECD COCCC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCCC1 804318136 ALSRMSWVIIXXOA-UHFFFAOYSA-N 417.550 2.493 10 20 HECD CC(=O)N1CCC(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 804715151 LBSAFMIHSROJBE-UHFFFAOYSA-N 414.550 2.010 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)O2 806706277 IBRVWEANAUFSHB-RPZWYYDSSA-N 403.523 2.368 10 20 HECD C[C@@H](Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 864004603 OXHOTPKESYRSNB-CYBMUJFWSA-N 406.464 2.252 10 20 HECD CCN(CC)C(=O)N1CCC(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918138416 MFPSNAHRERBDOE-UHFFFAOYSA-N 420.529 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCn4c(nnc4C4CCCC4)C3)CC2)cc1 1319356214 CWGMVHFEIKMWMW-UHFFFAOYSA-N 424.549 2.109 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3COc4ccc(F)cc4C3)cc2)C1 1320297233 NZPZFTKTICYADK-AEFFLSMTSA-N 411.477 2.395 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)n1cccc1 1846544223 LUAONWZULQXQKC-VFADXPBXSA-N 411.458 2.083 10 20 HECD Cc1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038740 HHPCSHCMEFXENQ-GQCTYLIASA-N 409.442 2.037 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NC[C@H](O)COc1ccc2c(c1)OCO2 149587866 DLDFCUOAMAGUMX-SFHVURJKSA-N 413.474 2.255 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCCC[C@@H]1C 726615841 HETNIIZACXPNJC-HOTGVXAUSA-N 420.529 2.376 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1 728948582 HAXBXANHFAYEIW-GTNSWQLSSA-N 416.400 2.335 10 20 HECD C[C@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 730216091 QRYBXFCOWXMAAW-INIZCTEOSA-N 417.531 2.315 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c1 730288049 RJINPFUPVZJGJK-CYBMUJFWSA-N 411.430 2.051 10 20 HECD CC[C@H]1COCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 734489232 PTVSYBDOMFLXRQ-INIZCTEOSA-N 405.520 2.035 10 20 HECD CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc21 736063025 BZDRIZTWLLMXJA-UHFFFAOYSA-N 423.516 2.158 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN(C[C@H]4CCOC4)CC3)CC2)cc1 736394051 JDCICSKHDUOOEQ-GOSISDBHSA-N 416.566 2.464 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(Br)cn3)CC2)cc1 742267381 SNVIYZHNJPMIFP-UHFFFAOYSA-N 412.309 2.364 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCO[C@@H](C(=O)OC(C)(C)C)C3)CC2)cc1 746761134 IYBIQJICKQPLTF-LJQANCHMSA-N 419.522 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1 747554122 RRQRKGRJPVZXPY-KRWDZBQOSA-N 422.485 2.255 10 20 HECD COCCN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCC1 749554721 JBAYPXMHYZXCQI-GOSISDBHSA-N 402.539 2.489 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CO[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 753857638 NRAIJDCOPVTJMG-XLMAVXFVSA-N 409.502 2.433 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)Nc3ccccc3F)CC2)cc1 755841880 VVAYCRCIAIVDBP-UHFFFAOYSA-N 413.497 2.358 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 756159982 OEVPLXDRDZRUOL-UHFFFAOYSA-N 409.417 2.338 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)[C@]12CCCO2 759321589 YAYIYHRAGRIZDF-QKNQBKEWSA-N 407.486 2.393 10 20 HECD CC[C@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(=O)OC 769741451 BPYDZLNLPIBWBC-KRWDZBQOSA-N 412.489 2.326 10 20 HECD COCCO[C@@H]1C[C@H](CO)CN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 775205281 RTIPZMACBMITLH-RBUKOAKNSA-N 407.511 2.431 10 20 HECD O=C(NCCc1cnccn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775588907 ZDQKBDPPBRQLET-UHFFFAOYSA-N 404.473 2.017 10 20 HECD CC(C)c1sc(NS(=O)(=O)c2cn(C)c(=O)n(C)c2=O)nc1-c1ccccc1 776784173 IKUWTKCSBXMIOY-UHFFFAOYSA-N 420.516 2.132 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3scnc3C)CC2)cc1 778266127 LPDBISATKKTQNM-CMDGGOBGSA-N 414.531 2.324 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(OC[C@H]2CCOC2)CC1 784242758 ZRUBKFGXCDJRKS-IBGZPJMESA-N 403.523 2.250 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N(C)C)cc2)cc1 786320191 CFEBJVDMSWUAGC-UHFFFAOYSA-N 410.518 2.167 10 20 HECD Cc1ccc2c(c1)nc(CNC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)n2C 788934734 YOSKMQUDFGKELH-UHFFFAOYSA-N 405.502 2.415 10 20 HECD CCCCN1CCC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789855076 IOBVRIINKIAPOP-UHFFFAOYSA-N 418.607 2.237 10 20 HECD C[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCCCC1 789856752 XWTDHTORGCNYAY-SFHVURJKSA-N 418.607 2.237 10 20 HECD Oc1cc2c(cc1CN1CCN([C@H]3CCN(Cc4ccccc4)C3)CC1)[C@@H](O)CO2 795696796 DIMAELKYSIWROH-REWPJTCUSA-N 409.530 2.210 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccccc2-c2cnn(C)c2)cc1F 803660990 LYIVXHWVHSUHBT-UHFFFAOYSA-N 409.465 2.225 10 20 HECD COc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ccccc2n1 803664554 OEEQNJLUAXLOOD-UHFFFAOYSA-N 410.449 2.381 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@@H]2CCc3c[nH]nc3C2)cc1)C1CCCCC1 803676323 DQUNTXKPXXYUNB-GOSISDBHSA-N 409.534 2.469 10 20 HECD COCc1cnc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 804304782 SAQXGNAYAHBUHX-BQYQJAHWSA-N 416.503 2.142 10 20 HECD CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1(C)C 804314892 BUHWVLXCDKUKBT-UXHICEINSA-N 417.550 2.442 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1 804967316 NOZLMCWRIHCJSW-HNNXBMFYSA-N 424.489 2.154 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1nc(C)n(C)c1Br 805006095 XTLPFFYUPGPMKZ-UHFFFAOYSA-N 401.330 2.344 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)C1CCN(C(=O)OC)CC1 807834817 OHDMXFNBFXRSCC-HNNXBMFYSA-N 405.495 2.114 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1nccs1 808816484 NVQYANUNPOROGC-HOCLYGCPSA-N 403.504 2.276 10 20 HECD CN(C)S(=O)(=O)N1CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)CC1 809544524 LFWKSQUQFUIVGS-UHFFFAOYSA-N 414.575 2.173 10 20 HECD CC(C)OCc1cc(NS(=O)(=O)c2cccc(-c3nnnn3C)c2)ccc1O 811703731 BWEWILJISMGOMK-UHFFFAOYSA-N 403.464 2.309 10 20 HECD CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@@H]1CCCO1 812269119 NVRIZUFMGWFBMW-INIZCTEOSA-N 408.462 2.446 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@@]3(O)C[C@H]4CC[C@H]3C4)cc2)C1 813594862 OGHNVYFFAAOXRI-KEXUJGGDSA-N 414.550 2.129 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c1O 815510330 RYNKDFUFIQAUBG-SCLBCKFNSA-N 411.458 2.417 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2c(C)nn(C)c2n1 917834557 KIYXEUINCOSHTD-KRWDZBQOSA-N 420.517 2.217 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917916749 BGFWUIJBXSNLAD-UHFFFAOYSA-N 422.478 2.318 10 20 HECD CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1116504915 CYTKDDBROHGWJI-GOSISDBHSA-N 412.538 2.272 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-c2nnc(C)o2)c1 1320275077 WKFPEULQGUQHEB-INIZCTEOSA-N 411.414 2.360 10 20 HECD O=C(/C=C/C1CC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1803183270 KIHILQPESBBBFT-OFGRBQKGSA-N 408.458 2.174 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824134530 QLYGQJZCDJCLTQ-LPHOPBHVSA-N 419.522 2.133 10 20 HECD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccnc1 1841467794 QUKNBUYJMCMGTF-LBPRGKRZSA-N 404.854 2.026 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc(N2C(=O)CCC2=O)cc1 7694786 KNUBMGYJCHZQRG-UHFFFAOYSA-N 423.469 2.221 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1nnn(C2CCOCC2)c1=S 729982330 XARXFHUEBLKEIV-UHFFFAOYSA-N 404.540 2.087 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc1F 734704197 XZIVNQBEYFVTKJ-UHFFFAOYSA-N 403.454 2.480 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(OC)nc3OC)CC2)cc1 743315564 XJFIEWXNIDVZAE-UHFFFAOYSA-N 415.494 2.051 10 20 HECD COCCN(CC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccc(OC)c(OC)c1 746475054 ROQZIYSCBKLLGQ-UHFFFAOYSA-N 415.490 2.497 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCCCN1CCOCC1)c2[N+](=O)[O-] 748492564 RORSIBIEEALDMU-UHFFFAOYSA-N 424.409 2.249 10 20 HECD Cc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1S(N)(=O)=O 751293355 AQXZXVLDYJBRCJ-KRWDZBQOSA-N 404.488 2.169 10 20 HECD CNC(=O)CCCN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 753206182 CJDBWMBZERFQFZ-CQSZACIVSA-N 407.470 2.247 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(CCCN(C)C)CC3)CC2)cc1 754083968 YUZCCRNRVASJIN-HSZRJFAPSA-N 418.626 2.232 10 20 HECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCCC3)cc2)cc1 759356512 WPXHXNJXUDFTCM-UHFFFAOYSA-N 401.532 2.444 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCc1ccccc1Cn1cccn1 759590651 DBYUEONGWSAJMX-VQHVLOKHSA-N 407.426 2.215 10 20 HECD COc1cc(N2CCN(CC(=O)N(CC(C)C)C3CC3)CC2)cc(OC)c1OC 759872641 MNEWKRDHYNVSSR-UHFFFAOYSA-N 405.539 2.481 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CC2(CCCC2)c2cccc(F)c21 762922765 WYOIGNBKEUANPB-UHFFFAOYSA-N 401.463 2.482 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1cnn(CC(F)(F)F)c1 763589735 ODIDVTYOATYQCS-UHFFFAOYSA-N 415.391 2.421 10 20 HECD CC(C)[C@H](CNC(=O)NCc1cccc(Br)c1O)N1CCN(C)CC1 765449524 YUMBODKZUBAZKB-INIZCTEOSA-N 413.360 2.226 10 20 HECD CCOC(=O)c1ccc(N2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)nc1 768449697 YNHOHMHTMPBCGA-LJQANCHMSA-N 413.474 2.102 10 20 HECD COc1ccc(F)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 768945720 UTVJPTZUIMRKAB-AWEZNQCLSA-N 401.438 2.487 10 20 HECD COc1cc(Br)cc(CN2CCCC[C@@H]2C(=O)N2CCOCC2)c1O 769309783 BFZSRJFRYZMBLP-OAHLLOKOSA-N 413.312 2.377 10 20 HECD CN(C)c1ccc(CNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1F 772017687 WVNYVRBTZZMAOJ-UHFFFAOYSA-N 414.528 2.073 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C4CC4)c(C)cc3=O)CC2)cc1 773733933 OTKXVEZYHSQPCT-UHFFFAOYSA-N 424.545 2.442 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccncc3)cc2F)C[C@@H](C)O1 774177578 IQUPICVTPHFCRP-IYBDPMFKSA-N 414.481 2.109 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccc(N2CCOCC2)cc1 774498407 OLZAZYXUPLPIIJ-MRXNPFEDSA-N 416.566 2.126 10 20 HECD CC(C)(C)OC(=O)N(CC(=O)OCC(=O)c1ccc(O)c(O)c1)C[C@H]1CCCO1 783888236 KAOUNGQKHIWEKG-CQSZACIVSA-N 409.435 2.240 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)cc4nccnc34)cc2)CC1 786257467 PJHBIEMOXBTZEU-UHFFFAOYSA-N 407.449 2.367 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1CCN(Cc2ccncc2)CC1 787433827 QYNHWYIWYLCNMF-UHFFFAOYSA-N 421.545 2.079 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(-n3ccnc3C)nc2)cc1 787480280 COQOKOLOTRICLO-UHFFFAOYSA-N 420.517 2.355 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H](c2ccccc2)C1 788913247 WDTWSBPTTOLCEZ-JOCHJYFZSA-N 406.530 2.418 10 20 HECD CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789812202 KJRHYSWUIXPKFH-IAGOWNOFSA-N 423.554 2.459 10 20 HECD CCN(C)c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cn1 790106605 QLOFYEXNOFSAQZ-DTQAZKPQSA-N 406.577 2.461 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 792691562 AJGMFVHDIDJSEC-HZPDHXFCSA-N 422.497 2.415 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC[C@H]4C3)cc2Cl)C1 800721238 YRRJIASRECFJNB-HOCLYGCPSA-N 405.930 2.495 10 20 HECD CC(=O)NCCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1ccsc1 801558875 XQQQTCHJSWZZDF-UHFFFAOYSA-N 402.564 2.411 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@H]3[C@@H]3CCCO3)CC2)cc1 803599975 NKWTWTWMLNJKDN-HZYCFNBMSA-N 413.518 2.070 10 20 HECD CN(Cc1ccn(-c2ccccc2)n1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803658896 HIUBFFWERLTSJU-UHFFFAOYSA-N 409.465 2.352 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807676052 CGTKDAHBXVALNZ-LAUBAEHRSA-N 422.529 2.189 10 20 HECD O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1c(-c2ccccn2)nc2ccccn12 820006129 JXONHKZBZBKDHD-UHFFFAOYSA-N 415.409 2.494 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H](C)c3ccc(-n4cncn4)cc3)nc12 917055412 KMHHVUZBLPDXCA-AWEZNQCLSA-N 421.461 2.385 10 20 HECD COc1cccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C=O 917201700 UCAUIDGLKIBANF-UHFFFAOYSA-N 402.422 2.179 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2cscn2)C1 1843051294 ZWYQYDKWYOSAOF-UHFFFAOYSA-N 407.879 2.267 10 20 HECD O=C(CCC(F)(F)F)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441952 KMKNSSDDYCOHGH-UHFFFAOYSA-N 422.407 2.325 10 20 HECD C[C@H](NC(=O)NC[C@H](O)COc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 139967176 YYLMKGYLQSWPDS-JXFKEZNVSA-N 417.481 2.462 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccnc(N3CCCC3)c2)n(C)c2ccccc12 550357421 AMMOAOYDWNLKCC-UHFFFAOYSA-N 405.502 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)CC2)cc1 726701482 PCHSNBQIDKZMIO-UHFFFAOYSA-N 423.477 2.342 10 20 HECD COC(=O)CCSCc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 729061237 YCCYUMMSWYZWLO-UHFFFAOYSA-N 402.472 2.443 10 20 HECD C[C@@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 730218311 JWGRCPQUWGSKTJ-COVOJHCQSA-N 409.558 2.076 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3CCO)cc2F)C[C@@H](C)O1 731751533 ZQQONIOXOYOREU-LMMKCTJWSA-N 407.530 2.292 10 20 HECD NC(=O)[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NN1c1ccccc1 731858211 INAGFSJYEPLTBT-ICSRJNTNSA-N 422.485 2.020 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc(OC)c1OC 741099493 AMUWIXMSERNUOJ-UHFFFAOYSA-N 411.458 2.344 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3c(C)nn(CC)c3C)cc2F)CC1 742293545 LMUJPMCKUJDVSJ-UHFFFAOYSA-N 423.558 2.279 10 20 HECD O=C(CCNS(=O)(=O)c1cccnc1)N(Cc1ccco1)Cc1ccccc1O 743431499 UPVXNNFFQAAXNU-UHFFFAOYSA-N 415.471 2.278 10 20 HECD COCCN1CC[C@@H](NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 743626817 NREPGVWNEDEOPR-HZPDHXFCSA-N 412.481 2.277 10 20 HECD Cc1cc(C(=O)CN2CCO[C@H](C(N)=O)C2)c(C)n1-c1cccc(Br)c1 747835392 WTWJCVXHFNPADI-SFHVURJKSA-N 420.307 2.225 10 20 HECD CCS(=O)(=O)NCCCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 747994759 GAGXHTJNFHEITM-UHFFFAOYSA-N 417.491 2.486 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCC[C@@H]1O 748619686 UNDUDAWBTWOZGY-ZWCUEREDSA-N 402.539 2.129 10 20 HECD COc1ccc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 749176341 SISPYHNAJJLJLC-SFHVURJKSA-N 411.506 2.134 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)CN(C)C[C@H](O)CN3CCOCC3)c2C)cc1F 751484731 HXEYHILEXUWBBW-FQEVSTJZSA-N 417.525 2.349 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCN(c2ncccc2F)C1 755308601 NKSQIRLZLMPQOT-SFHVURJKSA-N 413.497 2.478 10 20 HECD COCCc1noc(CN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)n1 758697727 WFTDTQPJRIYAKV-UHFFFAOYSA-N 405.524 2.153 10 20 HECD COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCCCSc2nccs2)C1 759589494 JHLWXJJVILRIHE-ZIAGYGMSSA-N 400.570 2.198 10 20 HECD COc1cc(N2CCN(CCC(=O)Nc3cc(C)on3)CC2)cc(OC)c1OC 759880133 XPZZYNRVTLUYPZ-UHFFFAOYSA-N 404.467 2.160 10 20 HECD CN(C)C(=O)c1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765931791 RNYIAVKEBHGXPH-UHFFFAOYSA-N 420.263 2.111 10 20 HECD CC(C)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(=O)OC(C)(C)C 766266334 LCHQVPQIKDEPGZ-UHFFFAOYSA-N 423.529 2.331 10 20 HECD CCc1cc(O)nc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 767063047 LZMXVCSQWHRUQO-UHFFFAOYSA-N 406.483 2.129 10 20 HECD Nc1nc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)nc2ccccc12 768218053 XDFFZLQSJZHVOZ-UHFFFAOYSA-N 418.545 2.366 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCOC4(CCC4)C3)cc2)C1 769037941 PINOQPVSXHSYBV-MSOLQXFVSA-N 400.523 2.289 10 20 HECD Cn1ccnc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(F)c1 769636808 KIDSNVIIHUHTCG-QGZVFWFLSA-N 418.450 2.156 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1 771458582 DXUROCVKDPBUMS-UHFFFAOYSA-N 422.489 2.072 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 775122177 QRCFKUXYVHQJCU-LAUBAEHRSA-N 407.514 2.374 10 20 HECD CC(C)CN1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)[C@@H](C)C1=O 777470950 XEXLHMMFSSYSDA-ROUUACIJSA-N 402.539 2.483 10 20 HECD COC(=O)CN1CCN(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)cc2)CC1 779482422 FBQZONOYEDMJQV-YCRREMRBSA-N 411.458 2.045 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CO)c3ccc(C(F)(F)F)cc3)nc12 782086372 AVZXQVKDVKIDPY-OAHLLOKOSA-N 424.379 2.454 10 20 HECD CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)cc1 782409588 VBRSFBRNZWLVAT-GFCCVEGCSA-N 407.444 2.214 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765937 DISYKSLDBZJTJO-HNNXBMFYSA-N 419.913 2.061 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1 785295504 INRAMPGTBLFTIP-AWEZNQCLSA-N 411.458 2.301 10 20 HECD O=C(NCCSCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1 785390884 MLBFMPVZDCARFU-UHFFFAOYSA-N 413.543 2.189 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cccc(N2CCCC2=O)c1 785423639 DUHJRILRKNMXNI-MRXNPFEDSA-N 408.502 2.373 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3c(F)cccc3F)cc2)CC1 786121081 AMDBPIHZLBFJJA-UHFFFAOYSA-N 409.458 2.112 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(-c4ccc(F)cc4)n3)cc2)CC1 786656030 JIHAAQRCLAEGCD-UHFFFAOYSA-N 422.464 2.005 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)cc1F 788828246 RDGXJODXVKFGOI-UHFFFAOYSA-N 409.465 2.069 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(Cl)cn1 789859386 CZPAZOUZXQAEER-UHFFFAOYSA-N 404.923 2.221 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4nc(C)n(C)c4c3)cc2)CC1 793922080 CFWCEJUSWWKZKC-UHFFFAOYSA-N 405.502 2.480 10 20 HECD COC[C@@H](C)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795248968 NLCJGORUOZTIIX-PBHICJAKSA-N 415.556 2.273 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1 797648783 HQNGMBSOFKGUIS-CYBMUJFWSA-N 417.437 2.462 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803448294 NUYUKWSCCAGNNL-MRXNPFEDSA-N 411.449 2.010 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)C(=O)Nc1ccc2c(c1)C(=O)NCC2 807511150 FZXZUXZNYMLKCN-UHFFFAOYSA-N 408.241 2.240 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccc(N(C)C)cc1 807671467 PMLAELNXABQNHP-CVEARBPZSA-N 418.538 2.398 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc2c1COC2=O 808920617 CFWPCAKKIBALMF-UHFFFAOYSA-N 411.483 2.165 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3ncn(C)c3Cl)n2)o1 914578023 OOFHQHPWVSNZRV-UHFFFAOYSA-N 415.884 2.227 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1CCN(C(=O)N2CCCC2)CC1 915624521 RNFJCGNZUFYSMW-UHFFFAOYSA-N 414.550 2.409 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CSc3nnnn3C3CC3)cc2F)C[C@@H](C)O1 917203863 JIBIKNAUFINKBG-CHWSQXEVSA-N 420.514 2.169 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)cc1C 917758431 XTSNAXKUZRRLLH-UHFFFAOYSA-N 423.516 2.076 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)CC2)cc1 918461586 HAAARRTWZZQBQU-UHFFFAOYSA-N 422.485 2.257 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3cccc(F)c3)CC2)cc1 920252045 GLDVDVOIDGDDLN-MDZDMXLPSA-N 411.477 2.398 10 20 HECD CCOC(=O)[C@@]1(COC)CCCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1321187470 KDUJMGIYGBRDOT-QFIPXVFZSA-N 407.530 2.369 10 20 HECD CC[C@H](C)CC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785503688 NSJVNLDJVYYXAY-UWLRISORSA-N 418.490 2.083 10 20 HECD C[C@H](CN)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821293735 NZNNSWWXAPXSAP-QMTHXVAHSA-N 421.885 2.375 10 20 HECD O=C(Cc1ccccc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249715 PJQBPOCTQFNSLR-UHFFFAOYSA-N 401.850 2.206 10 20 HECD O=C(c1cccc(F)c1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250487 FQWQWKJYAVZGSS-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1 437017208 JPBFVWFOKSHRPG-UHFFFAOYSA-N 407.492 2.462 10 20 HECD CC(C)CN1C(=O)/C(=C\NCc2cc(Cl)c3c(c2)OCCCO3)C(=O)NC1=S 730970819 OCSXJBUPRRPMON-LCYFTJDESA-N 423.922 2.374 10 20 HECD CCN1CCCC[C@H]1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732250917 MGPZCJISMFDMFA-ICSRJNTNSA-N 401.555 2.062 10 20 HECD CC(C)(C)OC(=O)NCCOCC(=O)NCc1ccc(N2CCSCC2)cc1 732551324 GISKZUMNWWHJMD-UHFFFAOYSA-N 409.552 2.397 10 20 HECD COc1ccc(CNC(=S)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742911087 RJTGKBQMNDVGDG-UHFFFAOYSA-N 414.575 2.490 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2[nH]ncc2c1 743893564 ZDZHPTZAZNDTBN-UHFFFAOYSA-N 407.474 2.027 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1C 745978341 SCTWZVCRVMSSHB-UHFFFAOYSA-N 416.452 2.395 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2C(=O)CN(C)C2=O)cc1 747573783 JADMHKMPLQBJRQ-UHFFFAOYSA-N 410.474 2.188 10 20 HECD CCN(CC(=O)Nc1ccc(C)c(S(N)(=O)=O)c1)c1ccc(OC)c(OC)c1 747681741 QJPXIQPAQILFBE-UHFFFAOYSA-N 407.492 2.125 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC1CCN(S(C)(=O)=O)CC1 749017126 JDRGTMMZPPNKQP-UHFFFAOYSA-N 422.595 2.490 10 20 HECD CN(CC(C)(C)CN1CCOCC1)C(=O)NCc1ccc(N2CCOCC2)cc1 752654823 DSQLIKXQFLZNKN-UHFFFAOYSA-N 404.555 2.023 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)cc1 753856340 BVMLZIBIUODSJJ-UHFFFAOYSA-N 408.568 2.289 10 20 HECD COc1cc(N2CCN(C(=O)COc3ccc(C=O)cc3)CC2)cc(OC)c1OC 760086433 LOHSCDCVPQGVBI-UHFFFAOYSA-N 414.458 2.253 10 20 HECD CCCCS(=O)(=O)NCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 761117961 ACJXQFKFEXNACH-UHFFFAOYSA-N 419.494 2.093 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](O)c3cccc(OC)c3)CC2)cc1 764635637 CVMMHYVNLVJGRE-QFIPXVFZSA-N 413.518 2.066 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1cccnc1OCC(F)F 765868794 QPAXTIWQHCJNPM-UHFFFAOYSA-N 402.401 2.357 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(CCCO)Cc3ccccc3)cc2)C1 769038471 SMRIZZYPIHHYAA-NRFANRHFSA-N 424.545 2.483 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](O)C[C@H]2CO)c(C)n1-c1cccc(Br)c1 770665301 IAXUMZVPUMYAOV-IRXDYDNUSA-N 407.308 2.467 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 774953430 IEUORTPDSHZKJM-GOSISDBHSA-N 400.548 2.384 10 20 HECD CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775868915 FNKRTLZHHPVAGN-PZJWPPBQSA-N 407.530 2.462 10 20 HECD CCO[C@@H]1C[C@@](CO)(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 780311895 LZXNZJVVQICGHC-KNQAVFIVSA-N 423.529 2.152 10 20 HECD O=C(NCCCN1CCc2ccccc21)C(=O)NCc1ccc(N2CC=CC2)cc1 787688807 OWDDNGDYIMSXPY-UHFFFAOYSA-N 404.514 2.248 10 20 HECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 788405058 ZDEOYURMFSMWLO-AWEZNQCLSA-N 403.454 2.100 10 20 HECD CCc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)s1 788719694 RNTLFYGBEJUOPZ-UHFFFAOYSA-N 401.532 2.422 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 789835299 KTSBADKLAIZCTA-GFCCVEGCSA-N 418.881 2.440 10 20 HECD Cc1cscc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842479 DCPAHPNIWWPFDD-UHFFFAOYSA-N 405.495 2.089 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1c(OC)cc(OC)cc1OC 790092008 WZXWJHWQXZIPLT-UHFFFAOYSA-N 416.474 2.473 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc3c(cnn3C(C)C)c2)ccc1O 790406770 HEYZBJOKKWNPIK-UHFFFAOYSA-N 424.504 2.032 10 20 HECD CN(C)c1cccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 792066021 GRTJQMHIBPQBOV-UHFFFAOYSA-N 415.559 2.236 10 20 HECD O=C(CN1CCOC[C@H]1[C@@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 796340594 MNSPSBXZLYNWFV-PMACEKPBSA-N 420.465 2.280 10 20 HECD C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(O)nn1 796701290 HDTFFMRTYNFIIO-OAHLLOKOSA-N 409.469 2.289 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)Cc3ccc(Cl)nc3)CC2)cc1 804316147 ZAOPDBJFOXYMFG-UHFFFAOYSA-N 416.909 2.487 10 20 HECD CCC(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)c(S(N)(=O)=O)c1 804321341 PBDUCHLPDZIREE-UHFFFAOYSA-N 403.504 2.262 10 20 HECD CNC(=O)Cc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 807512691 DUUQSNIVWYXXOO-UHFFFAOYSA-N 410.257 2.242 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC[C@H]1C 808851725 IXMGQTWQVJUYJV-RTBURBONSA-N 412.578 2.339 10 20 HECD Cc1nc(O)nc(O)c1CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 818033892 NOEVHZRUPSEMFX-GOSISDBHSA-N 414.506 2.403 10 20 HECD CC(=O)Nc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917917820 IGVGEUHWHYVOSS-UHFFFAOYSA-N 421.494 2.408 10 20 HECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 918117962 LHGGRVSHFYNFHK-IRLDBZIGSA-N 423.561 2.490 10 20 HECD COC(=O)N(C)CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 919290234 BQRUIFYXPKLQJB-GFCCVEGCSA-N 424.409 2.030 10 20 HECD CNC(=O)c1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 1333110805 GJWCGZAQLPTVKF-UHFFFAOYSA-N 404.417 2.441 10 20 HECD CN1CCN(c2ccc(CN3CCC([C@@H](O)c4nccn4C)CC3)cc2F)CC1 1341567836 OEBGGCFSZTZERZ-OAQYLSRUSA-N 401.530 2.257 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)[C@@H]1CCCOC1 1800720102 ZWTKAXVCYHPNKF-REBRKWNGSA-N 408.882 2.430 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(Cl)cc2)C1 1844935736 WYGWSYKEEAMMAW-UHFFFAOYSA-N 423.947 2.017 10 20 HECD CCn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N1CCNC(=O)C1 10085357 SELLFBMWHZXXGM-UHFFFAOYSA-N 423.336 2.383 10 20 HECD O=S(=O)(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc2nsnc12 19108302 IGEWXMUYKCAUHF-UHFFFAOYSA-N 405.429 2.488 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(C)cc3C)CC2)cc1 38598335 NIDWXJWKLSXFCN-UHFFFAOYSA-N 410.518 2.189 10 20 HECD O=C(CCN1C(=O)COc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 55523365 NTDOPSYQJGMKHD-UHFFFAOYSA-N 413.449 2.094 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(CNC(C)=O)s3)CC2)cc1 110468582 QOZMXQKVFKPOHU-UHFFFAOYSA-N 423.560 2.340 10 20 HECD C[C@H](NC(=O)CCn1c(=O)n(C)c2ccccc21)c1ccc(N2CCOCC2)cc1 145616867 IBXLUFFDKWCCMU-KRWDZBQOSA-N 408.502 2.444 10 20 HECD Cc1cc(C(=O)NCCCS(N)(=O)=O)c(C)n1-c1ccccc1Br 729330591 GHJODCOSGJPPNP-UHFFFAOYSA-N 414.325 2.265 10 20 HECD CC[C@H](C)NC(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731363492 HMBIUEMJZSZZMZ-KRWDZBQOSA-N 421.561 2.414 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCOc3cccc(C=O)c3)cc2)C1 731613281 XEURCXNFYVNYMA-LJQANCHMSA-N 409.486 2.286 10 20 HECD COc1cccc([C@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 732450183 OGNJPUWBNCOLPB-OAQYLSRUSA-N 417.481 2.328 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](OCCO)C1 734485160 BLLATDVBAVFFGT-JKSUJKDBSA-N 422.481 2.262 10 20 HECD CC(=O)N(C)c1ccccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 737156964 GLFFFUPZKIVYFG-INIZCTEOSA-N 424.501 2.322 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c1O 737283928 GTUQDEAEJTWRLS-UHFFFAOYSA-N 413.474 2.350 10 20 HECD CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745819513 AATBVFARMADEJX-KGLIPLIRSA-N 419.494 2.379 10 20 HECD CN1CCC[C@H](CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 751067790 AIYKBLLYZCLDPG-CYBMUJFWSA-N 409.533 2.326 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3c3cc(C)no3)CC2)cc1 754009179 ZJUIDIWENUEMCR-TZIWHRDSSA-N 400.523 2.312 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3C[C@@H](OC)C3(C)C)CC2)cc(OC)c1OC 759281217 PLKMNQMIHIPULS-QZTJIDSGSA-N 407.511 2.358 10 20 HECD C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(-n2cnnn2)c1 765241842 DTBDVUNBOGINLR-QFBILLFUSA-N 405.506 2.215 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)CCc3ccccc3[N+](=O)[O-])CC2)cc1F 766827324 MKORINIVSSXIAI-UHFFFAOYSA-N 423.466 2.437 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc4c(c3)[nH]c(=O)c(=O)n4CC)c2)CC1 770286545 NJHOZVXOHQYUBV-UHFFFAOYSA-N 421.501 2.104 10 20 HECD NC(=O)c1ccc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 771051881 CKRMHAUQZWPHBB-KRWDZBQOSA-N 417.893 2.304 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1O 773348172 ABKUCMNUHBIWMP-UHFFFAOYSA-N 423.469 2.345 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1O 774911588 HROMHJXASQMPET-WFASDCNBSA-N 411.455 2.423 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(S(N)(=O)=O)cc1C 775211012 FNNNVJALQAZXIR-UHFFFAOYSA-N 404.536 2.440 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4cccc(C)c4)CC3)CC2)cc1 779217336 UJSKWEOKUDNWPP-DEOSSOPVSA-N 424.589 2.309 10 20 HECD COC[C@@H]1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@H](C)O1 784069732 GHLUJFVFKGPDJE-OVWQWFNUSA-N 409.502 2.385 10 20 HECD Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C 785857949 PCKLUTUVPKFALI-IFXJQAMLSA-N 405.520 2.493 10 20 HECD COc1ccc2[nH]cc(CCNC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)c2c1 787048736 GVSKHJBQLLBVLU-UHFFFAOYSA-N 412.465 2.357 10 20 HECD CN(C)CCOc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 787159870 OGHVIWIKFJKYFN-UHFFFAOYSA-N 424.545 2.160 10 20 HECD Cc1nc2c(s1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)CCC2 788310122 IUZAFNXZVZGYLN-GOSISDBHSA-N 414.531 2.098 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@H](C)CN3CCOCC3)cc2F)C[C@@H](C)O1 788882349 BZHPYRXFRVNCPL-KURKYZTESA-N 422.545 2.301 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 789812151 JFLZPHGJVWSFSW-JZXOWHBKSA-N 421.513 2.083 10 20 HECD CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845245 UJRYUHBYUBEAFM-LPHOPBHVSA-N 405.514 2.488 10 20 HECD C[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793723451 WWRYVCBJXFGHRP-NEWSRXKRSA-N 414.550 2.090 10 20 HECD O=C1CCC(=O)N1c1cc(NS(=O)(=O)c2cccc3nsnc23)ccc1F 795385005 UUBXZHMTISSADY-UHFFFAOYSA-N 406.420 2.285 10 20 HECD CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCC(=O)NS(C)(=O)=O)cc1 800550190 UUDWXGSIJTULPX-UHFFFAOYSA-N 417.491 2.364 10 20 HECD C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NCc1ccc(N(C)C)c(F)c1 801798241 SGTSIBOQUVKRJG-HNNXBMFYSA-N 422.526 2.448 10 20 HECD CC(C)c1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)on1 803304795 HOHHNXSFJPMLSQ-HNNXBMFYSA-N 400.479 2.128 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(CCN(C)C)CC2)cc1F 804851955 ULQUBXFOKPTQFC-UHFFFAOYSA-N 406.546 2.478 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)C(C)(C)C)cc2F)CC1 805009087 GJAHUGWRXRKXOZ-INIZCTEOSA-N 406.546 2.477 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O 807653346 BQCBIMJXQQTTGW-VQIMIIECSA-N 409.486 2.441 10 20 HECD COc1cc(Br)cc(CN2CCC[C@@H]2C[C@@]2(C)NC(=O)NC2=O)c1O 809705792 ZUTCAJHPYKLWTR-SJKOYZFVSA-N 412.284 2.116 10 20 HECD CN(Cc1ccccc1O)c1nnc([C@@H]2CCS(=O)(=O)C2)n1C[C@H]1CCCCO1 812439065 UHKZXUBKRUGLBB-IAGOWNOFSA-N 420.535 2.091 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 917753157 KEZJUHJFSAELDL-UHFFFAOYSA-N 415.449 2.166 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1O 918123445 WXPDRBHCRQBCJQ-KRWDZBQOSA-N 412.490 2.102 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](O)COc1cccc(F)c1 918206955 RSOCHAGOQAKTGO-KRWDZBQOSA-N 421.444 2.041 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2COC3=O)cc1C 918728946 SYCPMPSGBBQAOF-UHFFFAOYSA-N 410.473 2.228 10 20 HECD COCCOc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919840678 IXBYCWMOPNNVSC-UHFFFAOYSA-N 404.488 2.199 10 20 HECD CCOCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920350907 GJYDMXREIQYZIX-UHFFFAOYSA-N 420.531 2.417 10 20 HECD C[C@H](CC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1327238393 KVRTXBVTTUCBJM-WBVHZDCISA-N 418.538 2.308 10 20 HECD O=C1CN(S(=O)(=O)c2cccc(NCc3ccc(N4CCCC4)cc3)c2)CCN1 1343287049 UVGQISBAIUDQCE-UHFFFAOYSA-N 414.531 2.019 10 20 HECD CC1=CC(NC(=O)C2CC2)=S=C1C(=O)Nc1ccc(-c2nnc(N(C)C)o2)cc1 1457789086 LWNAULWCTMMMTO-UHFFFAOYSA-N 411.487 2.263 10 20 HECD CCCCC[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790892361 CEEJWDMGUHMZLP-LAQRGFTBSA-N 419.522 2.303 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715572 UHYGTSNEZOCKFL-OBSCOMINSA-N 409.914 2.376 10 20 HECD Cn1cccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843998 MPXRALQWFRDLJW-CQSZACIVSA-N 410.434 2.174 10 20 HECD Cc1oc2cc(O)ccc2c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249562 YNZRTZLEZSSHFD-UHFFFAOYSA-N 423.425 2.384 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN(C)CC(=O)N3CCOCC3)c2C)cc1 7241978 KUURZYHOEWGWNV-UHFFFAOYSA-N 413.518 2.466 10 20 HECD CC(=O)N1C[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)Oc2ccccc21 21963301 JJDQNEULEBLEPI-QFIPXVFZSA-N 409.486 2.296 10 20 HECD C[C@H](NC(=O)NC[C@H](O)COc1cccc(F)c1)c1ccc(N2CCOCC2)cc1 139993755 TYYZWZVVDALQGM-JXFKEZNVSA-N 417.481 2.462 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 468385557 SYGYZDDQJRTAHD-UHFFFAOYSA-N 421.431 2.035 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccccc3F)cc2)C1 725825537 PEOFXICNLIZPHW-INIZCTEOSA-N 405.495 2.147 10 20 HECD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 726234565 ITGXHWVZIRPDCD-SFHVURJKSA-N 420.529 2.356 10 20 HECD Cc1noc2ncc(S(=O)(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc12 726793691 NEQPNPQRSLRGKO-CYBMUJFWSA-N 402.476 2.407 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccnc(OC)c3)cc2F)CC1 730113795 AWRPOPQJUKSFQQ-UHFFFAOYSA-N 401.486 2.371 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC3CCC(NC(C)=O)CC3)cc2F)CC1 730128087 YJNMGINOYWIHAL-UHFFFAOYSA-N 419.545 2.214 10 20 HECD CN1CCC(N2CC[C@@H](NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)C2)CC1 734281467 KXVGHJKJRDGKHL-TZIWHRDSSA-N 416.566 2.251 10 20 HECD CN(c1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1)S(C)(=O)=O 740914789 GBULCMAUGVGWDM-UHFFFAOYSA-N 414.531 2.458 10 20 HECD C[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)n1nnc(-c2ccccc2)n1 742496676 BJTVVAZPNHESSH-KRWDZBQOSA-N 406.490 2.396 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cn4ccsc4n3)CC2)cc1 743358657 NSTAVSBGXPBBRD-UHFFFAOYSA-N 414.535 2.026 10 20 HECD O=C(CNC(=O)c1ccncc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743735055 CHJLYEXTBBCCNM-HNNXBMFYSA-N 404.417 2.198 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(OCc2ncnn2C)cc1 746667983 GKGYDYWEKLCSOY-UHFFFAOYSA-N 415.519 2.247 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2)c1ccc(N2CCOCC2)cc1 749635260 BDGFDHSBRZDGHH-HNNXBMFYSA-N 422.485 2.224 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NCc1ccc(N(C)C)cc1 753782241 ODYNUUZUBPPGMM-ZCPGHIKRSA-N 423.435 2.354 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(-n4cccn4)c3)CC2)cc1F 754213249 PYFQBPJRQYVYNU-UHFFFAOYSA-N 423.448 2.307 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc([N+](=O)[O-])c3C)CC2)cc1 758222690 HOROIMQZLSOFRX-SFHVURJKSA-N 401.463 2.474 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c(C)n1-c1ccc2c(c1)CCC2 758493388 NFNIRPAYUYHOBS-CQSZACIVSA-N 418.515 2.246 10 20 HECD COc1cc(N2CCN(C(=O)Nc3c(C)ccn(C)c3=O)CC2)cc(OC)c1OC 759985956 JSJIBOAIMSCKMY-UHFFFAOYSA-N 416.478 2.074 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 762082961 NOXFSLHBPNTXBJ-INMHGKMJSA-N 406.502 2.249 10 20 HECD COc1ccc(C(=O)N2CCCC2)cc1NS(=O)(=O)c1cccc2nonc12 765059726 LPTWPYGEXXPHIR-UHFFFAOYSA-N 402.432 2.268 10 20 HECD COc1cc(N2CCC(Oc3ccnc(C(N)=O)c3)CC2)c([N+](=O)[O-])cc1OC 771682466 FUVUUTXMPOPYIB-UHFFFAOYSA-N 402.407 2.154 10 20 HECD CN(C)C(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772885696 WGVAUSARQAEPOT-UHFFFAOYSA-N 415.465 2.059 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(CCN2CCCCC2)cc1 774361690 IGWBQIZWMQTGDN-UHFFFAOYSA-N 411.502 2.424 10 20 HECD O=C(NCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774464176 IKINXRJKYMHAKV-UHFFFAOYSA-N 421.419 2.475 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](c4ccc(F)cc4F)C3)nc12 778281248 CTLBYTVSENWKDS-QGZVFWFLSA-N 418.400 2.463 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(CC)C[C@H](O)C(F)(F)F)cc2F)CC1 779557691 GEVWYWBETVGTRP-KRWDZBQOSA-N 420.451 2.422 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H](CO)C1CCOCC1 782718789 NQJREXVHVTZRIP-SFHVURJKSA-N 413.465 2.344 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CC3(N(C)C)CCC3)CC2)cc1 782919315 UWEREWFUOXCFHL-UHFFFAOYSA-N 417.598 2.333 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)cc1 785423698 GULBSYVNBLVBLK-LJQANCHMSA-N 405.502 2.410 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1nc(-c2ccccc2)no1 785423904 IHHWZELRXXSVBD-OAHLLOKOSA-N 407.474 2.339 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)NCc3ccc(O)c(O)c3)n[nH]2)C1 787448231 CFUNCAGRDPWKBL-ZDUSSCGKSA-N 402.451 2.475 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](c3ccc(F)cc3)N(C)C)ccc21 787637005 JKQANWAZMUPZLF-NRFANRHFSA-N 412.509 2.243 10 20 HECD CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788318571 FDIDPLQSAHWIJB-FPOVZHCZSA-N 417.550 2.239 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](OC)C[C@H]3C)CC2)cc1 799528898 LCUNPUNJOALHSK-NQIIRXRSSA-N 404.555 2.416 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1 800707259 QIGIJTDSMWIBNH-UHFFFAOYSA-N 408.568 2.161 10 20 HECD C[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803308372 DQAGAMRUDJEJHB-LSDHHAIUSA-N 402.520 2.077 10 20 HECD COc1ccccc1O[C@@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803658675 BMNZIFHDUBNHEW-AWEZNQCLSA-N 403.454 2.100 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3N(C)CCCC3(C)C)CC2)cc1 804318464 KPPGGEGHXPHBJJ-FQEVSTJZSA-N 416.566 2.017 10 20 HECD CN(Cc1ccccc1)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290603 ZFAWTEKMOGUVRR-HSZRJFAPSA-N 418.541 2.412 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCN(Cc2ccccc2)C1 807291602 YNWKIHWZZKOGDQ-QHCPKHFHSA-N 418.541 2.412 10 20 HECD COC(OC)c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)o1 807354534 DEOKTROJBFAJLD-UHFFFAOYSA-N 401.463 2.170 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)C2CC2)cc1 809495367 MIZXVPSKKYMDJG-JTSKRJEESA-N 417.575 2.415 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2[nH]c(O)nc2c1 809727645 QDYABZKQQBWYIY-AWEZNQCLSA-N 401.854 2.417 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccncc3)cc2)C1 918372802 PVPKQLFEFPWRPE-KRWDZBQOSA-N 404.474 2.103 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)Oc3ccccc3F)nc12 919075943 ZHGNLBNFLFTQDZ-LLVKDONJSA-N 403.366 2.261 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCn3c(=O)nc(O)c4ccccc43)CC2)cc1 1320024682 WXAITBADUPPHHY-UHFFFAOYSA-N 422.485 2.240 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(S(N)(=O)=O)ccc3C)CC2)cc1 1320394121 KRWNOBSWCZGALM-UHFFFAOYSA-N 403.504 2.004 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC(=O)N(C)c4ccccc43)CC2)cc1 1324500437 REUTVTQHDWEKRQ-OAQYLSRUSA-N 422.529 2.084 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1347369372 HTHPNEBZOOEENK-HNNXBMFYSA-N 405.520 2.307 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1c(F)ccnc1Cl 1796598790 IQNJCEQTTYNEMM-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3nccs3)C2)CC1 1808668713 COORVDQFAZPTMD-UHFFFAOYSA-N 402.476 2.108 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H]3CNC(=O)O3)C2)cc1 1841649538 BKJMYNZLWXRNIF-IBGZPJMESA-N 422.485 2.020 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)CC(N)=O)C3)cc1 1845398110 ZDXXYYQUMWFFLD-INIZCTEOSA-N 422.529 2.423 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)nnn1-c1cccc([N+](=O)[O-])c1 108808305 SKGBTFUNXHYKDI-UHFFFAOYSA-N 422.445 2.251 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(-n4ccnn4)cc3)CC2)cc1 727030604 UBJNGKKNOHWXSG-UHFFFAOYSA-N 421.505 2.220 10 20 HECD CCN1C(=S)N[C@H](c2ccc(N3CCOCC3)c(F)c2)C(C(=O)N(C)C)=C1C 727352177 XDKSVGGABJTLTF-GOSISDBHSA-N 406.527 2.276 10 20 HECD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)N(C)Cc3ccccc3O)n(C)c2)C1 730278067 KLISGRVUBOWJJU-HNNXBMFYSA-N 405.520 2.424 10 20 HECD O=C(CNC(=O)NC1CCCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 736195509 HWTWQUQZWUJDPF-UHFFFAOYSA-N 402.539 2.143 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)cc21 737168102 YLARXNBKEBJKTI-UHFFFAOYSA-N 413.453 2.143 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCOC3)cc2F)C[C@@H](C)O1 740388300 LUDLLTWTEAVAJL-BFYDXBDKSA-N 408.470 2.025 10 20 HECD Cc1noc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 754689999 SNWGONRDHZVXJC-IHRRRGAJSA-N 405.474 2.098 10 20 HECD C[C@@H](NCc1ccccc1S(=O)(=O)N(C)CCO)c1cc(F)cc(F)c1O 756705682 NOHKPPPIAQUHBB-GFCCVEGCSA-N 400.447 2.134 10 20 HECD O=C(CN1CCc2c(F)cccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 757148865 HAVFZWITAMKJPY-UHFFFAOYSA-N 401.457 2.476 10 20 HECD COCC1(O)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 759285130 CRCWKLFVKTWDRD-HOTGVXAUSA-N 409.502 2.122 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 761950728 SELQVSWKDJUTGO-CQSZACIVSA-N 424.457 2.470 10 20 HECD O=C1CC[C@]2(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)SCCN12 761983396 RELDXXKSULOSOE-HNAYVOBHSA-N 409.939 2.192 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO[C@@H]1C1CC1 767955933 QKNJWCACJBQLGP-KKLQWCBXSA-N 414.550 2.393 10 20 HECD Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 768725128 OIEYZTXCBBLCTM-UHFFFAOYSA-N 408.487 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@]4(C3)OCc3ccccc34)CC2)cc1 770677031 UFAXERCJOJVRFV-DEOSSOPVSA-N 407.514 2.475 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(C)c1 773844532 CPDBTGPTMSJQBV-HNNXBMFYSA-N 413.474 2.429 10 20 HECD CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)O1 775453314 BDYJIZAVVZJTNB-VQIMIIECSA-N 401.463 2.333 10 20 HECD CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)C1=O 775837338 RKBIIENWUAXLDN-QMHKHESXSA-N 423.517 2.292 10 20 HECD Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)c3ccc(O)c(O)c3)C2=O)c1 783565594 OCHBKMPJNHECPW-OAHLLOKOSA-N 412.398 2.037 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCCCSc1nccs1)O[C@@H](C)C2 786629829 NHGUXEIJJFUHMZ-LBPRGKRZSA-N 421.544 2.390 10 20 HECD CC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(OC)OC 788196385 FWULYMMPQHTWHC-CYBMUJFWSA-N 414.505 2.382 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1nc2c(s1)CCC2)c1ccc(N2CCOCC2)cc1 789392694 LQDFBSGBSMRHEW-CYBMUJFWSA-N 400.504 2.284 10 20 HECD CCc1cnc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789864520 PCLDJZQHZHJQBF-UHFFFAOYSA-N 404.561 2.191 10 20 HECD COc1ccc(N2CCN(CCN(Cc3ccccc3)S(C)(=O)=O)CC2)cc1F 792242153 ORQJMJZQRDOROO-UHFFFAOYSA-N 421.538 2.418 10 20 HECD CC[C@H](NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccc(C)cc1O 794795106 GOBIJMBMTLWZRL-IBGZPJMESA-N 418.563 2.288 10 20 HECD COc1ccc(N2CCC(NC(=O)c3nnn(Cc4ccncc4)c3C)CC2)cc1 795994775 SEYAJWVMBCELSF-UHFFFAOYSA-N 406.490 2.437 10 20 HECD O=C(COC(=O)CCc1cncnc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 796179670 GSDYULSNWFRLJL-UHFFFAOYSA-N 415.405 2.367 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1C(N)=O 796669979 JYRBVPMXFXSXHP-UHFFFAOYSA-N 424.501 2.428 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 803310834 KDDJLUFVBRWYMP-ILZDJORESA-N 417.550 2.410 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3cscc3C)cc2F)CC1 805007835 RMBXSPWKHHZWDC-UHFFFAOYSA-N 418.538 2.270 10 20 HECD Cc1cc(N2CC[C@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C2=O)n(C)n1 806877809 CZHAQOSGDPVWFN-ZDUSSCGKSA-N 412.277 2.346 10 20 HECD CCC[C@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 814435372 DNSAMVQVMUNJDF-KRWDZBQOSA-N 404.555 2.247 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@@H]1c1ccc(F)cc1 918340788 VCSCEGQTBAWURA-WOJBJXKFSA-N 402.491 2.480 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(OC2CCC2)c1 1116571509 XDXVLJLXKSYNGJ-INIZCTEOSA-N 400.431 2.328 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)nc1-c1cccs1 1342914822 HZASRMPGOISPFY-AWEZNQCLSA-N 415.471 2.464 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccncc2)CC1 1830174954 ZGLWOVKHVLKJOE-IBGZPJMESA-N 424.501 2.364 10 20 HECD O=C([C@H]1C[C@]1(F)Cl)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502415 VCJXURMFRTWJBP-BMLIUANNSA-N 403.237 2.493 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 571674292 QSZBSQWPIUQYET-UHFFFAOYSA-N 420.513 2.460 10 20 HECD CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 728068472 OGKFWSYKYPHGNV-LJQANCHMSA-N 423.554 2.495 10 20 HECD CC(C)CN(C(=O)/C=C\c1cncc(F)c1)c1c(O)nc(=O)n(CC(C)C)c1N 729647991 JDBYNFNCADUIFL-WAYWQWQTSA-N 403.458 2.424 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@]12CCc1ccccc12 743313043 JEMNBFCRDDIRAW-GMAHTHKFSA-N 410.539 2.442 10 20 HECD CSC[C@@H](C(=O)NCc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 744380762 DQYRMXNULORRII-KSZLIROESA-N 403.548 2.276 10 20 HECD CCN(CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 748039354 ZYGLXTGBHNYURL-UHFFFAOYSA-N 409.533 2.469 10 20 HECD CNS(=O)(=O)C[C@H]1CCCN1CC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 749852455 GXJCZPYFCUZHHA-GOSISDBHSA-N 407.511 2.430 10 20 HECD Cc1oc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 753593364 PFJPQUIKCOQFLW-AWEZNQCLSA-N 421.519 2.166 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CCc3nc[nH]n3)c2C)cc1 756761724 VCWZCIYPXLRUQB-UHFFFAOYSA-N 410.430 2.358 10 20 HECD COc1cc(N2CCN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1OC 759871636 CUIALLTWIMUBDX-GOSISDBHSA-N 417.462 2.476 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](c4ccccc4F)C3=O)cc2)C1 761116612 BKZBHOYEVSREBC-BEFAXECRSA-N 410.449 2.321 10 20 HECD Cc1cc(C(=O)CN2CCOC[C@H]2C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 761121227 FHPGAANAYUHSBO-FQEVSTJZSA-N 417.531 2.035 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N(C)C4(CCCCC4)C3=O)CC2)cc1 761184469 MDWAMOOQFJXKON-UHFFFAOYSA-N 400.523 2.414 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(N4CCOC4=O)cc3)no2)c1 761749969 GELFWPCGDFGSDA-UHFFFAOYSA-N 416.415 2.437 10 20 HECD CS(=O)(=O)[C@H]1CCCCN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 767780109 XZPHRTYBZHCJQV-SFHVURJKSA-N 411.593 2.349 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1 768197491 QYZUWOLPJCZODH-NSHDSACASA-N 413.386 2.020 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc2c(c1)COC2 768921506 YAIXWTPVYHIVEU-UHFFFAOYSA-N 401.488 2.273 10 20 HECD COCCC(=O)N1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 769166706 NCIXFIKGKDCGJX-UHFFFAOYSA-N 402.539 2.454 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 770272312 YHCPHLGUOJHCEA-UHFFFAOYSA-N 424.501 2.066 10 20 HECD C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1c1nccn2cnnc12 770279229 GXEXHRWQSCBIMA-LLVKDONJSA-N 403.830 2.102 10 20 HECD CCOC(=O)c1sc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)nc1C 785432355 ARKIDJVROFAJGP-CYBMUJFWSA-N 418.519 2.188 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(C)csc2C(=O)OC)cc1 785487190 BOQSFQCPKDQHDY-UHFFFAOYSA-N 418.518 2.406 10 20 HECD C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H]1C 789840475 JHVUYKIUFZNCFM-BFYDXBDKSA-N 405.514 2.344 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2F)cc1OC 790393517 HTKZCFIXJQJYRM-UHFFFAOYSA-N 418.468 2.405 10 20 HECD Cc1cc(C(=O)NC[C@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccc(Br)cc1 793902315 LUKYESVBOQQXSI-CQSZACIVSA-N 419.279 2.217 10 20 HECD COCCn1cc(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 799887273 RVMFCZXVPQLOPQ-HOTGVXAUSA-N 419.501 2.282 10 20 HECD COC(=O)N1CCC[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1 804016074 JOBREOTULQZJLK-QGZVFWFLSA-N 417.506 2.401 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCS[C@H](C(C)C)C3)CC2)cc1 804315072 DUCNQMMNBMRZCI-IBGZPJMESA-N 405.564 2.380 10 20 HECD CCSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805009841 OWEJCVKNKIGAFL-INIZCTEOSA-N 424.586 2.232 10 20 HECD Cc1cncc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 806489065 VSXJOJJKQNQMEE-INIZCTEOSA-N 418.444 2.393 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807676479 GYYUXVBGEWUWEP-IAGOWNOFSA-N 402.539 2.085 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c(O)c1 808942869 LBCBQEKNOHIMJO-UHFFFAOYSA-N 416.384 2.428 10 20 HECD C[C@](O)(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CCC1 813422368 ZENVGQBNGZQTAI-JOCHJYFZSA-N 413.497 2.110 10 20 HECD COC(=O)CNS(=O)(=O)c1cccc(NCc2cc(Cl)c(F)cc2O)c1 816607527 XCCCPLWABVUHEV-UHFFFAOYSA-N 402.831 2.248 10 20 HECD O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364967 UGRVINBBVSTRIQ-IPMKNSEASA-N 414.502 2.465 10 20 HECD COC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 920055056 BEXCWMHAHAXHBC-HUUCEWRRSA-N 422.501 2.469 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)CC2)cc1 1324088126 OGGYBZIBKPVKRI-GOSISDBHSA-N 421.538 2.444 10 20 HECD O=C(CS[C@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600722 GBTRXUOTZQSBMI-YGTYGHESSA-N 421.519 2.004 10 20 HECD Nc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cs1 1800715579 UVCROYHSBUXHSM-JGPRNRPPSA-N 422.894 2.356 10 20 HECD COC1(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)CCC1 1810549886 JSIVUSDNYPHKNV-UHFFFAOYSA-N 417.506 2.297 10 20 HECD COC(=O)c1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 29041806 DZZDLRDWQQMVMK-UHFFFAOYSA-N 418.471 2.049 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)OC(C)(C)C3)CC2)cc1 65689571 FBBAYTQFKWYKNU-SFHVURJKSA-N 404.555 2.416 10 20 HECD Nc1nc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)cc(-n2cccn2)n1 480848803 SYMCJXHFXGEDMI-UHFFFAOYSA-N 415.457 2.067 10 20 HECD COc1ccc(N2CCC(NC(=O)Cn3nnc(-c4ccc(C)cc4)n3)CC2)cc1 726560824 QRFOPLNBNBDVLM-UHFFFAOYSA-N 406.490 2.442 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1F 731356832 VPCYHVYKDLCSEC-UHFFFAOYSA-N 420.510 2.341 10 20 HECD CNc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc(Cl)n1 732274666 LJQINKNQDBEADL-AWEZNQCLSA-N 401.898 2.408 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCCCCC3)cc2)C1 735583501 YQKMVOWGBJIETC-SFHVURJKSA-N 402.539 2.273 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1O 737286340 VTTZVLNUBBZTPQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD Cc1ccnc2nc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn12 742799907 NJMPFHDDGSTTFN-ZDUSSCGKSA-N 402.405 2.433 10 20 HECD C[C@@H](NC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 743321590 HWMQRNFIBSRTLC-OXQOHEQNSA-N 421.497 2.219 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@](C)(c3cc(F)ccc3F)C2=O)cc1 749864041 TUTFMLAGIQTGLL-NRFANRHFSA-N 416.428 2.114 10 20 HECD COc1cc(OC)cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751235720 BWZCHXAXTGOYKE-UHFFFAOYSA-N 420.531 2.391 10 20 HECD COC(=O)[C@@H]1c2ccccc2CCN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 752301017 DRWOZRDIHUKUFC-QHCPKHFHSA-N 423.513 2.116 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)c4cc(F)ccc43)CC2)cc1 754063768 MOUKSGKBGGQBDC-HXUWFJFHSA-N 414.525 2.274 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C4CCOCC4)C3)cc2)C1 755060436 YKOIGQALZDEWPU-WOJBJXKFSA-N 414.550 2.346 10 20 HECD COCc1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 758818508 AYSHKDCQLBLIIT-UHFFFAOYSA-N 419.503 2.112 10 20 HECD O=C(N[C@H](Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1)c1cccnc1 762275238 PEJXMFXPGODTII-LJQANCHMSA-N 405.454 2.193 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 763008726 DQBHTLMVPUEOQG-MRXNPFEDSA-N 415.542 2.119 10 20 HECD O=C(NC[C@@H]1CCCO1)Nc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765038552 WESMSWZIQGABTK-AWEZNQCLSA-N 417.447 2.324 10 20 HECD CS(=O)(=O)N1CCC(NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 765643506 USLSSGAILMWWMC-UHFFFAOYSA-N 403.495 2.270 10 20 HECD O=C(CN1CC(c2nc3ccccc3[nH]2)C1)NCc1ccc(N2CCOCC2)c(F)c1 766941125 PBADVEKAFDQNKU-UHFFFAOYSA-N 423.492 2.254 10 20 HECD C[C@H]1[C@@H](C)N(C)CCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 771457712 ASUJHSUQBOUGNM-TVFCKZIOSA-N 406.546 2.080 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 772452080 PPQVRQKYFMFFQQ-RBUKOAKNSA-N 410.536 2.269 10 20 HECD COc1ccc(C(=O)N2CCOCC2)cc1NCc1ccc([N+](=O)[O-])c(OC)c1O 774933436 NVUNDAJJRXKGJC-UHFFFAOYSA-N 417.418 2.402 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc([S@@](C)=O)cc3)nc12 775618977 KSJPWUSXEMNZSU-PSBQPLHCSA-N 402.476 2.200 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)[C@H]4c5ccccc5CCN4C3=O)cc2)C1 777609250 BWCGRMHAMNETAA-WIYYLYMNSA-N 418.497 2.450 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCN(C)c3ccccc3)CC2)cc1 778221310 BQNKUPOVASTOHF-OUKQBFOZSA-N 422.529 2.153 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3COc4ccccc4C3)CC2)cc1 778231290 FSXPHVKZZRMEHV-VYENPZKTSA-N 421.497 2.020 10 20 HECD CNS(=O)(=O)CCN[C@H](C)c1cc(Br)cc(Br)c1O 784056987 OIROLAJFUBRLSD-SSDOTTSWSA-N 416.135 2.117 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4CCCO4)CC3)cc2)C1 784477907 IFUGHKSFBVFCAS-CTNGQTDRSA-N 414.550 2.489 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCc2ccccc21 788910357 JWJJQRBXZCSJLL-SFHVURJKSA-N 406.530 2.470 10 20 HECD COCCC(C)(C)CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789828799 YQBARBHRWDLJBD-HZPDHXFCSA-N 423.529 2.234 10 20 HECD C[C@H](O)C[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790666237 PMYINDIDAIKLPH-ILZDJORESA-N 402.539 2.223 10 20 HECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 792709085 DJLGIFBUIUNSLR-QGZVFWFLSA-N 414.568 2.268 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C)C(=O)N3CCCC3)cc2F)C[C@H](C)O1 798372402 JXLIEQDLHAGKNX-JYJNAYRXSA-N 406.502 2.249 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](C(N)=O)O3)cc2Cl)C1 799949889 CAPXXMDUFPMSTL-SIIHOXLZSA-N 408.930 2.408 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H]1c1cccnc1)c1ccc(N2CCOCC2)cc1 803306693 WGWLYIVGRSTXEI-UWJYYQICSA-N 408.502 2.459 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CC[C@@H]1CCCCN1C)c1ccc(N2CCOCC2)cc1 803310020 FMHKDGMAAQYGDQ-ICSRJNTNSA-N 416.566 2.033 10 20 HECD CC[C@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccn1 803661527 FLPXZWFLGSQCEG-AWEZNQCLSA-N 402.470 2.397 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCN(C)[C@@H]3c3ccccc3)ccc21 803686564 DTISPHLEUDPNJA-RBBKRZOGSA-N 406.530 2.247 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1F 806545267 QDQLPWLMPADUKD-UHFFFAOYSA-N 422.482 2.097 10 20 HECD C[C@@H]1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(=O)N1c1cnn(C)c1 806884111 QPDXNOVGCOCNJI-YMTOWFKASA-N 412.277 2.426 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C)Cc1ccc(F)cc1 807808698 YUVXXASENWZSRQ-UHFFFAOYSA-N 414.525 2.488 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(CN4CCCC4)on3)cc2F)CC1 812502470 WXQBSKSLAUPNIE-UHFFFAOYSA-N 415.513 2.481 10 20 HECD CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 857555065 MCUBIULRDAANTF-GOSISDBHSA-N 417.531 2.153 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc2N1 918439936 YQRIYICFTCGPNG-UHFFFAOYSA-N 424.526 2.379 10 20 HECD COC(=O)N1CCC(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 920055049 BEXCWMHAHAXHBC-GASCZTMLSA-N 422.501 2.469 10 20 HECD CCOc1ccc(N2CCN(C(=O)CSCC(=O)Nc3cc(C)on3)CC2)cc1 1253442698 MZSMKEGOSIUGQJ-UHFFFAOYSA-N 418.519 2.402 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 1320180090 HFQMYPGOEHEEKI-OLVMAOTFSA-N 403.460 2.183 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)C3CC3)CCC2)cc1 1792316244 XEDAPDQQDOBGEL-UHFFFAOYSA-N 403.529 2.391 10 20 HECD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)o1 1810550924 YXKRWWBLRGEGKL-UHFFFAOYSA-N 413.474 2.482 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H](CNC(=O)C2(F)CCC2)[C@@H]1c1cccnc1 1813682781 NKZPCECQTBHCLW-KDOFPFPSSA-N 414.437 2.100 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)Cc2cccnc2)C1 1843087427 BWILDILCOSDJJJ-UHFFFAOYSA-N 401.850 2.206 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 63617859 QMLZJGZDACJZSR-UHFFFAOYSA-N 417.481 2.432 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@@H]2CCO)c(C)n1-c1ccc(S(N)(=O)=O)cc1 71808358 IYGFRIPOLFNBEL-QGZVFWFLSA-N 419.547 2.161 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc(S(=O)(=O)NCC2CC2)c1 437010221 CBHMPDCRBUKXGJ-UHFFFAOYSA-N 415.515 2.480 10 20 HECD CS(=O)(=O)Nc1cccc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 727466826 JOYPHTSFZKGFFQ-GOSISDBHSA-N 416.547 2.050 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3csc(-c4cnccn4)n3)CC2)cc1 728270967 QZUXXTKXHLAOTC-UHFFFAOYSA-N 424.530 2.161 10 20 HECD COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NCc1cccc(OC)c1O 729566622 CFJGBSVIKALERM-UHFFFAOYSA-N 415.446 2.204 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccccc3[N+](=O)[O-])cc2F)CC1 730268689 DAEHQCLMWJECCL-UHFFFAOYSA-N 422.482 2.354 10 20 HECD CCc1cc(N2CCC[C@H](NC(=O)NCc3ccc(N4CCOCC4)cc3)C2)ncn1 732913985 FBRBUMHWKOWVQV-FQEVSTJZSA-N 424.549 2.344 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)cc1C(=O)N(C)C 734496496 ZUCZNJQSUZFSMX-UHFFFAOYSA-N 409.483 2.081 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)nc12 741802803 SEOFSCACSNCQBJ-ZDUSSCGKSA-N 419.482 2.053 10 20 HECD O=S(=O)(c1cnn(C2CCOCC2)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 751136764 MKWYDLVMNUCTBZ-SFHVURJKSA-N 421.519 2.310 10 20 HECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1cnn([C@@H]2CCOC2)c1 751590325 UIDUKWBDCRJIQQ-GFCCVEGCSA-N 420.472 2.498 10 20 HECD NC(=O)[C@H](Cc1ccc(Cl)cc1)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 760576632 OZHFPRQTERPWSI-XLIONFOSSA-N 414.937 2.228 10 20 HECD COC(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 761536483 WJGHKPGEFKUOOQ-NWDGAFQWSA-N 424.409 2.077 10 20 HECD CN(C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1)S(C)(=O)=O 769124608 FMAOHKQTLDMMFA-UHFFFAOYSA-N 410.540 2.441 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(-c4nc[nH]n4)cc3)cc2)C1 771232487 CSJDCBTXNPGUBF-SFHVURJKSA-N 404.474 2.103 10 20 HECD O=C(COC(=O)C=C1CCSCC1)NCc1ccc(N2CCOCC2)c(F)c1 772134292 UMDAWJMQNLMSLO-UHFFFAOYSA-N 408.495 2.275 10 20 HECD CCNC(=O)COc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773857656 MVJBTDPLLUYCFP-OAHLLOKOSA-N 412.490 2.083 10 20 HECD C[C@H](NCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 775835216 SMWLQHWAXALPSW-JXFKEZNVSA-N 407.580 2.362 10 20 HECD CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775868911 FNKRTLZHHPVAGN-FPOVZHCZSA-N 407.530 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H]3CSC)CC2)cc1 778388129 AQOPZIIMPDNQAE-BBVFFXRHSA-N 403.548 2.254 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nn1-c1cccc(F)c1 785297767 SGXXIZHWTAMTPY-LBPRGKRZSA-N 412.421 2.417 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1 785427330 CTPKQBOVKBVANJ-HBMCJLEFSA-N 411.502 2.110 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@H](c2cccc(O)c2)C1 788934323 VVUJQGUGTWCQFC-NRFANRHFSA-N 409.486 2.209 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3ccc(C)nc3Cl)CC2)cc1 790020841 NODFWIHFOSUVQB-UHFFFAOYSA-N 424.954 2.153 10 20 HECD CC(C)OC(=O)CC[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 792043440 FHKUMHVOGYUKIL-SJLPKXTDSA-N 418.538 2.308 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H]3CCCN(C(C)=O)C3)cc2F)CC1 792993937 YQXSLKIZYPLYTC-LJQANCHMSA-N 419.545 2.025 10 20 HECD Cn1ccc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc2c1=O 792998723 AYNNIOLXLXUSAN-UHFFFAOYSA-N 402.501 2.232 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1nc2ncccn2n1 798248732 KVLNQLWVTYWPSI-UHFFFAOYSA-N 410.478 2.055 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(OC(F)F)nc1 802550540 BTDMBGCDSGIKRX-UHFFFAOYSA-N 422.457 2.491 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 804315913 VLMGSDKWYGPDDO-DLBZAZTESA-N 403.523 2.102 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC[C@H](C)C3)cc2F)CC1 805007757 PHQTZHBFRYOIQE-DLBZAZTESA-N 404.530 2.136 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC(Oc2ncccc2F)CC1 806278362 RPBIYIXIUNCKBG-UHFFFAOYSA-N 424.523 2.346 10 20 HECD CN1CCCC(C)(C)[C@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809866049 JFKGWDKQXJJPII-AZUAARDMSA-N 417.550 2.136 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(C4CC4)ccc3=O)cc2F)C[C@H](C)O1 810010725 LCDVCMPGAFCVFI-GJZGRUSLSA-N 414.481 2.190 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)C1 813837393 KTUSUWKHONGWHD-UABRLCRWSA-N 417.506 2.265 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCNC(=O)[C@@H]1Cc1ccccc1 815140737 HYNMJOKWDSPECT-QFIPXVFZSA-N 408.546 2.144 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ccc(OC)c(F)c3)CC2)cc1 914522446 APURMJPMVSWGKS-GDLZYMKVSA-N 420.506 2.440 10 20 HECD COc1cccc(C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)n2nnnc2C)c1 915681280 WNFAPVFSCIBOKE-NRFANRHFSA-N 408.506 2.499 10 20 HECD CN(C)c1ccc(CNC(=O)CSCC(=O)NCc2ccc(N(C)C)cc2)cc1 915828152 NRUHLVCQLPKAGA-UHFFFAOYSA-N 414.575 2.484 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc2c(c1)OCO2 917364854 PKEJAVIGOFQJEJ-QGZVFWFLSA-N 412.442 2.059 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1 918310942 PPPJOMWYLDHCTH-UHFFFAOYSA-N 421.505 2.414 10 20 HECD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918643734 NTJDVHCHIYOKLT-YHYXMXQVSA-N 415.471 2.159 10 20 HECD CCOC(=O)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 920086612 DTMNBGIKTUKOOJ-IAGOWNOFSA-N 423.529 2.329 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1C1CC1)C1=NN(c2ccccc2)C(=O)C1 1792956122 CARDMWQCOWOPBE-ZDNSCYFHSA-N 420.513 2.464 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc2cccnc2n1 1796600947 UKRRUQKTCGQPAE-MUJYYYPQSA-N 419.441 2.002 10 20 HECD C[C@@H](c1ccccc1)N(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 138520599 KAEODFMUWACBPY-ZDUSSCGKSA-N 406.460 2.140 10 20 HECD CN(C)C(=O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 195638314 LKYBEEGHNBMCDW-UHFFFAOYSA-N 416.444 2.210 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cncc(Br)c2)cc1 314817527 OLHJIFXCANHTKN-UHFFFAOYSA-N 406.283 2.016 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](O)C3CCCCC3)CC2)cc1 727844254 YCHSJUOFMWFRCZ-NRFANRHFSA-N 404.555 2.058 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1 729063241 ICXYICDUWCVERI-AWEZNQCLSA-N 409.446 2.414 10 20 HECD CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730122306 CXDWYLVGWBKLHX-JKSUJKDBSA-N 407.534 2.070 10 20 HECD CN(CCO)S(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCC3)c2)cc1 732306522 AUUCAKBCEAJSNA-UHFFFAOYSA-N 403.504 2.152 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)NCc1cccc(OC)c1O 737286233 SXPLWOHVUAYQBW-UHFFFAOYSA-N 408.838 2.334 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccnc(N2CCCCC2)n1 740313272 PPLQDPDGIMTVHJ-UHFFFAOYSA-N 411.506 2.348 10 20 HECD O=C(NCCCOC[C@@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 740920737 SXKPKCSZUUYHKH-KRWDZBQOSA-N 409.502 2.029 10 20 HECD CCC[C@@H](O)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 740982567 NFHBCOIPAPMCCM-HLLBOEOZSA-N 410.486 2.150 10 20 HECD COCCN1CC[C@@H](NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 743626818 NREPGVWNEDEOPR-JKSUJKDBSA-N 412.481 2.277 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1ccccc1SCC(N)=O 746492265 HFSYOPAJOQRZAK-UHFFFAOYSA-N 400.504 2.168 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOCC34CCC4)cc2F)C[C@H](C)O1 749542943 JNRHOTZSDRNGDO-IRXDYDNUSA-N 405.514 2.310 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CNC3(C(=O)OC)CCC(CC)CC3)nc12 755989885 OZAUEMQHGWKZSP-UHFFFAOYSA-N 404.467 2.213 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 758715095 KXWMBTZQXNCEMK-GASCZTMLSA-N 415.531 2.015 10 20 HECD C[C@H](OC(=O)CCc1nc[nH]n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764011254 IDIXIHRSJRBBLV-LBPRGKRZSA-N 418.409 2.083 10 20 HECD O=C(Cn1ccc(-c2nccs2)n1)NCc1ccc(N2CCOCC2)c(F)c1 766117640 PPZSTIRXIRWFGZ-UHFFFAOYSA-N 401.467 2.299 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3c(C)noc3C3CC3)CC2)cc1F 768192916 NTGOBRDIWCZEHE-UHFFFAOYSA-N 402.426 2.295 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC(=O)N[C@@H]4CCCC[C@@H]43)cc2F)C[C@@H](C)O1 769033289 LQZALUJZEHEFKN-CWLMSFPYSA-N 418.513 2.392 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 769562513 DVGOQBAARSMGQQ-GOSISDBHSA-N 410.474 2.078 10 20 HECD CC(C)[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 770562235 SDPHGYKPPKWNGZ-PZPWOCDFSA-N 410.486 2.006 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)c1 770886361 VRSSCXJLBMPMSB-CQSZACIVSA-N 418.393 2.246 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](O)c3ccc(C)cc3)CC2)cc1 772726490 IHWVQYGXSOLHGO-SSSWZJSRSA-N 423.513 2.058 10 20 HECD N=C(NOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1 772877019 UHOWQYLMNWTIJH-UHFFFAOYSA-N 420.872 2.479 10 20 HECD CCOC(Cn1ncc(C(=O)NCc2ccc3c(c2)CCCN3C)c1N)OCC 773882920 XEYMRQCVZWCKHY-UHFFFAOYSA-N 401.511 2.177 10 20 HECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 779337023 VIFXZTIAOHQSBA-CMKODMSKSA-N 402.539 2.081 10 20 HECD CC[C@@H]1C(=O)N(CC)CCN1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 779558007 KYIAOYLNZOIVJU-LJQANCHMSA-N 419.545 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)cc1 785425846 SEIAFVSWXWRDGS-UHFFFAOYSA-N 422.529 2.311 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cn3ccsc3n2)cc1F 785573924 LTPKCAYJNKOOEM-UHFFFAOYSA-N 403.483 2.314 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(c4ccccc4)=NO3)cc2)CC1 786656539 NJQOCBLGKKVIAR-JOCHJYFZSA-N 406.486 2.165 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H](Nc2ccccc2)C1 788318975 JRASJORQYXMXHG-OAQYLSRUSA-N 422.529 2.243 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 788930587 CLOUIAANEMGEDX-OAQYLSRUSA-N 420.513 2.215 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCN(Cc4ccccc4)C3)ccc21 789667026 DARQMNDBKZNZQX-QFIPXVFZSA-N 420.557 2.466 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]2CCC[C@H]21 789848126 ZYGUZYKVBIHZME-VQIMIIECSA-N 403.498 2.194 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 793578573 TVPZFMQXKFXOMI-ZDUSSCGKSA-N 402.463 2.340 10 20 HECD C[C@H](O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 793642536 KLIHPYSFLZBXKM-JXFKEZNVSA-N 412.486 2.270 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1 804277506 DIDWVNQEODWFKV-HXUWFJFHSA-N 408.546 2.316 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)Cc3c(C)noc3C)CC2)cc1 804318929 VUXAXJFHCSNLLE-CQSZACIVSA-N 414.506 2.132 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1(C)CCOCC1 804650337 HAJJZPDPTCZXTA-UHFFFAOYSA-N 413.312 2.436 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCCN(C(=O)N2CCCC2)C1 804975379 MLTHTJWNJJBJKK-IBGZPJMESA-N 415.538 2.003 10 20 HECD CCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805026276 IKUMUQONFBKMQX-FQEVSTJZSA-N 400.567 2.339 10 20 HECD CC(=O)N1CCN(C(=O)C(=O)NCCCSc2nccs2)CC12CCCCC2 806282051 OVYSIOUXNGRSFA-UHFFFAOYSA-N 424.592 2.135 10 20 HECD CS(=O)(=O)CCn1ccc(NC(=O)NCc2cc(Cl)cc(Cl)c2O)n1 806308069 LGHCNOOJCWXFFF-UHFFFAOYSA-N 407.279 2.262 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(N(C)C)cc1 807674996 SKMAAQXBUMPBNZ-NVXWUHKLSA-N 405.564 2.491 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)Cc3ccccc3N(C)C)CC2)cc1 808785847 XCRAXZWYNLCFQA-QFIPXVFZSA-N 412.578 2.376 10 20 HECD CN(C)c1ccc(Cn2nccc2NS(=O)(=O)c2ccc(N(C)C)nc2)cc1 811824584 HCPNVENXMBTPPF-UHFFFAOYSA-N 400.508 2.259 10 20 HECD COC(=O)N1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 917172231 ARCBHKOMESKGRL-CQSZACIVSA-N 421.453 2.173 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(NC(=O)C(C)C)CC2)c1 917452071 UKSYAQFTSKTTMT-UHFFFAOYSA-N 417.550 2.164 10 20 HECD O=C(NCCNC(=O)c1cccs1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918209831 JHDCCSOELMXVSU-UHFFFAOYSA-N 420.510 2.078 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 1320180091 HFQMYPGOEHEEKI-XCVZWFEFSA-N 403.460 2.183 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)n([C@@H](C)C2CC2)n1 1320386644 OMQOMGKTWHHGGD-GUYCJALGSA-N 401.463 2.478 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2C[C@@H]2C2CC2)=NN1c1ccccc1 1847486003 FKZGQPQFUXBDNJ-JYBIWHBTSA-N 406.486 2.027 10 20 HECD CSc1nc(C)c(CCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(=O)[nH]1 109180090 DBUXWUYLWMPCEZ-CQSZACIVSA-N 416.547 2.447 10 20 HECD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N1CCOc2cc(N(C)C)ccc21 475938303 JPPGLDIRHDCFMI-LJQANCHMSA-N 410.453 2.396 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 731280135 IITWJVBBAVIIOF-UHFFFAOYSA-N 424.501 2.086 10 20 HECD CCS(=O)(=O)NCCOC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 731692347 SMULOAPCDBLCQK-UHFFFAOYSA-N 421.858 2.212 10 20 HECD COCCCN(C(=O)/C=C\c1cnc(C)s1)c1c(O)nc(=O)n(CC(C)C)c1N 732729947 OGIRGVVFXWJKCH-SREVYHEPSA-N 421.523 2.035 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(I)c[nH]1 734426589 PUZMOJIIJDFBEM-UHFFFAOYSA-N 411.243 2.386 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 741092985 MDFWIWLDROHSSN-VQIMIIECSA-N 409.552 2.273 10 20 HECD CN(C)CCOc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 747017484 MHOVIIYXOWDPIB-UHFFFAOYSA-N 410.518 2.264 10 20 HECD NC(=O)C1(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCC1 749052742 RADPYSBYIQJHPI-ZRDIBKRKSA-N 409.558 2.254 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H]1CC(=O)N(C2CC2)C1 750636169 ATYDOYJSIKPSHQ-CQSZACIVSA-N 408.449 2.319 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccc(OC)c(C(=O)N(C)C)c2)c1 751326255 NMTXBJDTBIRHAJ-GFCCVEGCSA-N 408.476 2.151 10 20 HECD C[C@@H](NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cc(F)cc(F)c1O 756478215 GUFXOSTWSRVUOV-SNVBAGLBSA-N 401.391 2.208 10 20 HECD Cn1cnc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 769122018 KFJAZYMNEULRJD-XYOKQWHBSA-N 407.546 2.174 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccccc1CN1CCNC1=O)c1ccc(N(C)C)cc1 773859961 XSAWTFNOPYLHEN-OAHLLOKOSA-N 409.490 2.094 10 20 HECD O=C(Nc1nnc2n1CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 780791171 LXBFMAYOFWLFOY-UHFFFAOYSA-N 419.488 2.435 10 20 HECD CC(C)c1nc([C@@H]2COCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)no1 780824325 VZVYCGXJNCYPPS-SFHVURJKSA-N 415.494 2.313 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 781476835 GSOVNYMUPHZTPR-UHFFFAOYSA-N 411.458 2.119 10 20 HECD NC(=O)[C@H]1CCCC[C@@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 782539511 KPZKDDUOJDMOTB-RDJZCZTQSA-N 405.454 2.034 10 20 HECD COCCOc1cc(C)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785297650 RBHAVCGFVOMFID-AWEZNQCLSA-N 402.447 2.117 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nn(CC(F)F)c3C)cc2)CC1 787321005 BTQHTEBFQDMKKI-UHFFFAOYSA-N 419.476 2.364 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1)c1ccc(N(C)C)cc1 787435607 ZMHXRRHJEVFTTM-QGZVFWFLSA-N 409.534 2.106 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)cc2F)C[C@@H](C)O1 789823025 XUIMEBFTVMUXCR-ASLJADJFSA-N 415.509 2.216 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(O[C@@H]2CCOC2)cc1 789912487 UCZCXKNQOLOCCX-HXUWFJFHSA-N 416.499 2.341 10 20 HECD Cc1cc2c(cc1S(=O)(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)OCO2 795113680 RMCGVHWBKBEBGS-UHFFFAOYSA-N 422.478 2.302 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H](S(C)(=O)=O)CC3)CC2)cc1 800704680 LJIFBMGMISQDIX-IBGZPJMESA-N 409.552 2.273 10 20 HECD O=C(OCCCCCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 803483356 MPSLWJHUGHSHAT-UHFFFAOYSA-N 424.431 2.421 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687996 JOQNDKOBDOPRFH-AVRDEDQJSA-N 420.557 2.322 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCC[C@H]3CCCCO3)CC2)cc1 804317140 SSQXNYJZACNJOW-HXUWFJFHSA-N 403.523 2.246 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N=c3ccnc4n(C)[nH]cc3-4)cc2F)C[C@@H](C)O1 806480483 NJBOECDTODECQQ-OKILXGFUSA-N 412.469 2.416 10 20 HECD Cc1ccnc(OC2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CC2)c1 807097893 PUGILLNRRQCMOO-UHFFFAOYSA-N 410.518 2.451 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 807102386 YOQGUQLDLVTQDE-SFHVURJKSA-N 418.538 2.145 10 20 HECD Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)ccc21 807511522 NRCYKACEMCOVIJ-UHFFFAOYSA-N 423.256 2.144 10 20 HECD CC1(C)[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@@H]2CCCO[C@H]21 807610873 MUTVVLKLJLKTSU-RAUXBKROSA-N 416.518 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](O)c3ccc(Cl)cc3)CC2)cc1 811282640 NWECFLNWPRLQER-FQEVSTJZSA-N 418.877 2.274 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1 915829281 XPQSSBRBUYOGML-CQSZACIVSA-N 400.410 2.469 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CN(c5ccccc5)C[C@H]4C3)nc12 917189242 BJXGETPXIXDTLO-HZPDHXFCSA-N 407.474 2.180 10 20 HECD COc1cc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cc(C(=O)O)c1OC 917760168 CKDFPOFMFAWUKA-UHFFFAOYSA-N 422.459 2.039 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)C2CC2)cc1 918055683 COANAPDWFMZNJF-UHFFFAOYSA-N 416.547 2.317 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cncn4)nc3)cc2F)C[C@@H](C)O1 918141041 RLTDXGAGORFATN-HUUCEWRRSA-N 410.453 2.345 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccc2c1COC2=O 918742523 LVXHVWYUMQVZJW-UHFFFAOYSA-N 402.472 2.014 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(-c2cccc(F)c2)n1 1321048906 OZLBZXAPNRLTAX-KRWDZBQOSA-N 413.405 2.327 10 20 HECD COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1337655551 ZUGNWJUWVDSVAQ-KRWDZBQOSA-N 424.906 2.160 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1783101586 QYNUIQWFPJHLRI-DMZRHTGOSA-N 406.866 2.327 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1783101587 QYNUIQWFPJHLRI-RCULGURQSA-N 406.866 2.327 10 20 HECD O=C(Cc1cccc(Cl)n1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796598741 CUIWWEBXLULWTL-QDMKHBRRSA-N 416.865 2.036 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1)CC2)c1cc(O)nc(O)c1 1816728795 VHXINTDFFZYPBY-PWSUYJOCSA-N 420.516 2.071 10 20 HECD CC(C)NC(=O)CN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 17306475 SBHLNDZTCHRUND-CQSZACIVSA-N 407.470 2.245 10 20 HECD Cc1c(CNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)n(C)c2ccccc12 472135480 ZIBOYJGELGTLKZ-FOIQADDNSA-N 405.520 2.022 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1-n1cnnn1 472779421 RRPKTNGSNBMXGY-UHFFFAOYSA-N 403.446 2.026 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)c(O)c1O 727006001 ZCTASIPZIYHEKF-CQSZACIVSA-N 402.422 2.439 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1O 727761208 NVSTUFYHDCWJCP-HNNXBMFYSA-N 422.478 2.257 10 20 HECD COC(=O)Nc1cccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 728518659 LBPPTCGDOUMYSR-UHFFFAOYSA-N 412.490 2.426 10 20 HECD CN(CC(F)F)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 728949868 WJVXVRABVMNTNA-UHFFFAOYSA-N 408.428 2.349 10 20 HECD COCCc1noc(CS(=O)(=O)CC(=O)c2cc(C)n(-c3ccccc3)c2C)n1 729030237 CHQBYAMVIBGHRE-UHFFFAOYSA-N 417.487 2.464 10 20 HECD COC(=O)c1cc(NC(=O)[C@H](C)N(C)Cc2ccccc2O)cc(C(=O)OC)c1 732203407 SPIQRVBMIKVTBP-ZDUSSCGKSA-N 400.431 2.424 10 20 HECD CCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H](C)CS(=O)(=O)CC 733345817 PGZUAXKXKNHWEM-DLBZAZTESA-N 411.568 2.439 10 20 HECD COc1ccc(N2CCC(NC(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 735750917 KWJHHCSVFHTLTJ-UHFFFAOYSA-N 418.519 2.442 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2ccc(=O)n(C)c2)NC(=O)OC(C)(C)C)cc1 742754915 RTNURTWOKZTCAV-SFHVURJKSA-N 414.506 2.447 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C(=O)c2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 742754967 SRKRREDUWLUTEV-KRWDZBQOSA-N 415.494 2.051 10 20 HECD C[C@@H](CN1CCOCC1)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743536429 KMLPPWCBQIFWMU-HOTGVXAUSA-N 412.481 2.277 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)NC[C@@]1(N2CCOCC2)CCSC1 743556487 LJOAQCNZGFMBMA-NRFANRHFSA-N 405.564 2.278 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 743903896 XCMKOSFPTSXTMM-UHFFFAOYSA-N 417.487 2.267 10 20 HECD CCc1ncc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 747482364 OSIWMIRYWDRMRQ-ZDUSSCGKSA-N 419.432 2.364 10 20 HECD CN(C)C(=O)Cn1cnc(NC(=O)N(Cc2ccccc2O)C2CCCCC2)n1 747544719 MEIFIWKRMOVGMP-UHFFFAOYSA-N 400.483 2.439 10 20 HECD CN1C(=O)N[C@]2(CCC[C@@H]2CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1=O 748098828 OQPKOICXFHEFOD-IERDGZPVSA-N 415.494 2.395 10 20 HECD O=S1(=O)CC[C@H](N2CCN(Cc3ccc(OCc4ccccc4)cc3O)CC2)C1 753534941 AXCZIZXRIXMVKT-FQEVSTJZSA-N 416.543 2.276 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccnc(C(=O)N(C)C)c3)CC2)cc1F 753884885 VLWLXOWHIHRSPJ-UHFFFAOYSA-N 401.442 2.285 10 20 HECD CCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 756080529 PDRIQZAXZQSALF-UHFFFAOYSA-N 402.520 2.169 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](c3cccs3)N(C)C)CC2)cc1 758188097 YHLAOQRTZMCJOH-PZJWPPBQSA-N 418.607 2.132 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CSc3nnc(NC4CC4)s3)CC2)cc1 758188455 DVNOLGPQSPKGDU-MRXNPFEDSA-N 421.592 2.396 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)[C@H](C)c3ccccc3)nc12 759553562 DVGYNXDTUUQSIQ-ASSNKEHSSA-N 413.430 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Oc3cccc4c3OCCO4)CC2)cc1 761011651 QFCARPUJDZOTJZ-KTKRTIGZSA-N 424.453 2.277 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 770251053 BKAYGQJYRMQMKS-UHFFFAOYSA-N 423.517 2.082 10 20 HECD CC(C)C[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 772899797 ZAUOJWIHZXVLAM-JOCHJYFZSA-N 419.497 2.090 10 20 HECD COCC[C@@]1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCOC1 773953401 FVQCTBFOMPYGSC-HSZRJFAPSA-N 408.454 2.186 10 20 HECD CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1 774357349 RTTVHMIIGCYTIY-UHFFFAOYSA-N 413.474 2.314 10 20 HECD CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774364226 VJTKJZLTHXJPSX-UHFFFAOYSA-N 411.380 2.480 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3ncn(C)c3=O)c2C)c1 781262883 HFXNKJQFKDXCDZ-UHFFFAOYSA-N 414.487 2.137 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C[C@@H](C)O)[C@@H](C)CO)c2C)cc1 785537519 QHZCUVMHLYHKKW-JKSUJKDBSA-N 402.491 2.127 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccnc(N2CCCC2)c1 786498639 WTKMWUYHLJOORX-UHFFFAOYSA-N 407.518 2.215 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCCn2cccn2)cc1 787052506 UGYNXUCVNYULSH-UHFFFAOYSA-N 409.490 2.277 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](C)O[C@@H](CO)C2)c(C)n1-c1ccc2c(c1)OCCO2 787315075 UHBIMCFIDCCPJO-CRAIPNDOSA-N 400.475 2.130 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3nc4c(s3)CCC4)CC2)cc1 789382870 RZBAUPAFIWCDOG-UHFFFAOYSA-N 400.504 2.318 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc2c(s1)CCCC2 789389355 RSCHTAUQYBYVLD-UHFFFAOYSA-N 400.504 2.113 10 20 HECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2sccc2C1 789725717 WCDYRUPYEGTQPZ-INIZCTEOSA-N 414.575 2.336 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)CCc3ccc4c(c3)CCO4)CC2)cc1 790039045 OOHASTFJHKUBTB-UHFFFAOYSA-N 402.516 2.325 10 20 HECD COc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(Cl)cc1C(N)=O 792959868 RVLBFISQNDZMEU-UHFFFAOYSA-N 418.881 2.111 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1c1ccc(Br)cc1 794701714 CMFSGQXITRUPGL-FUHWJXTLSA-N 419.275 2.254 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)NCCCSc2nccs2)ccc1F 801154492 HEBSRLWKHGGYGD-UHFFFAOYSA-N 403.526 2.445 10 20 HECD COC(=O)[C@H](C)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 802166496 GLIYDJYTEMKHKD-OCCSQVGLSA-N 410.467 2.490 10 20 HECD COc1cc(N2CCN(C(=O)c3occ4c3CCOC4)CC2)cc(OC)c1OC 803106098 VYCQHRIWBMZVQB-UHFFFAOYSA-N 402.447 2.341 10 20 HECD C[C@@H](NC(=O)C(=O)N1CC(C)(C)OC(C)(C)C1)c1ccc(N2CCOCC2)cc1 803305055 JEIUVDXAZRGSEW-MRXNPFEDSA-N 403.523 2.116 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2csc(N(C)C)n2)cc1 806663208 ULHZZNLEHISPFS-UHFFFAOYSA-N 403.552 2.330 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COCCN1CC(F)F 807107830 LZJYNBWWQPNDQR-HZPDHXFCSA-N 417.884 2.092 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)NC2(CCC(CC)CC2)C1=O 808095622 LPHIYXBVWTWCMH-UHFFFAOYSA-N 408.495 2.385 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OCCCO2 917918143 LSRNCTAANVZWQN-UHFFFAOYSA-N 422.478 2.302 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CC(=O)N(C)c2ccccc21 1116060323 HKBIYHYZRBEJDU-IBGZPJMESA-N 409.486 2.405 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(-c2ccccn2)c1CC 1320274932 UQISBIBWVBVCGT-INIZCTEOSA-N 424.457 2.145 10 20 HECD O=C(CNc1ccc(Cl)cc1C(=O)c1ccc(F)cc1)N[C@H]1CCS(=O)(=O)C1 1321192594 YWJJEKZATYHYQX-HNNXBMFYSA-N 424.881 2.425 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)CC2)cc1 1324045170 GNIRSYRWIPSSQK-GOSISDBHSA-N 421.538 2.398 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccn1)c1cc(O)c(O)c(Cl)c1 1795188961 WIKQQEPFUDOUQQ-CLLJXQQHSA-N 402.838 2.107 10 20 HECD O=C(Cc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817620302 GXHWOZVGWZROAZ-INIZCTEOSA-N 422.445 2.160 10 20 HECD C[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294896 VKZLNSKFPQNWJF-TVQRCGJNSA-N 408.842 2.161 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3csc(NC(C)=O)n3)cc2F)CC1 303250131 AQMQVOUUMFPNQZ-UHFFFAOYSA-N 405.499 2.313 10 20 HECD CCS(=O)(=O)NCc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437015444 GOHNZAMHGILBMK-UHFFFAOYSA-N 403.504 2.231 10 20 HECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C12CCOCC2 673314925 BPDNKUSESCRNBH-UXHICEINSA-N 413.518 2.193 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc(F)c3F)cc2)C1 725825388 LCCCZRFBMCOSMB-AWEZNQCLSA-N 409.458 2.145 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CCc3ccncc3)CC2)cc1 726702506 LODWTAIMWUFKEX-UHFFFAOYSA-N 411.550 2.486 10 20 HECD CC(C)C(=O)N1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 727940605 LWIHRALBBRMQPO-UHFFFAOYSA-N 420.529 2.187 10 20 HECD NC(=O)CN1C(=O)/C(=C\c2csc(-c3ccc4c(c3)OCO4)n2)SC1=S 728609902 BGFSCMOLTPSULZ-UUILKARUSA-N 405.482 2.225 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)COC4)cc2F)CC1 730269312 SMWQIDWWZBWCKG-UHFFFAOYSA-N 419.522 2.476 10 20 HECD Cc1nc2nc(N)nn2c(C)c1CC(=O)NCc1ccc(N2CCC(C)CC2)cc1 731053491 SIVZBLFDEULIJD-UHFFFAOYSA-N 407.522 2.419 10 20 HECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)N(C)Cc2ccccc2O)n1 731125700 MGDLHICDLPJPPP-UHFFFAOYSA-N 422.441 2.352 10 20 HECD COc1cc(N(C)CCOc2ccc(S(=O)(=O)N(C)C)cc2)cc(OC)c1OC 741798658 IWHZASOMSZUBOT-UHFFFAOYSA-N 424.519 2.478 10 20 HECD COc1cccc(CNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1O 745519349 RXSIJGATBQBWGE-UHFFFAOYSA-N 402.470 2.161 10 20 HECD O=C(Nc1cnn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 755191910 KXVNJMWJMOTESG-GOSISDBHSA-N 421.457 2.119 10 20 HECD C[C@@H](NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1cc([N+](=O)[O-])ccc1O 756459301 MNLQVWUDJXQUJJ-CYBMUJFWSA-N 408.455 2.030 10 20 HECD COC(=O)C[C@@H](C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759003430 DSDDFADQOLNIPS-GFCCVEGCSA-N 409.394 2.143 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1 759380853 OWZDXLKSEKWDGM-ZDUSSCGKSA-N 400.431 2.007 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCN(c2ccccc2F)CC1 759593011 IBGJULMLRXZBKC-VURMDHGXSA-N 400.406 2.142 10 20 HECD COC[C@H](O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 765902298 BXSZODRKIBUITB-XTCQQWIJSA-N 414.574 2.243 10 20 HECD COc1cc(O)c([C@H]2NC(=N)Nc3nc4cc5c(cc4n32)OCCCO5)cc1OC 768265909 HHXVBBBRWNFAOY-SFHVURJKSA-N 411.418 2.417 10 20 HECD CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 768498535 QZXJSYYZKRJGJF-GOSISDBHSA-N 405.543 2.103 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1F 768562305 OYHRCGPTCPGURB-NRFANRHFSA-N 404.486 2.399 10 20 HECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 771008887 MWDNMMGFINGKQU-HOCLYGCPSA-N 424.544 2.328 10 20 HECD CCc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)co1 772385191 FLMYXAVTTKLILX-ZIAGYGMSSA-N 419.453 2.463 10 20 HECD COc1cccc(/C=C(/C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n2nnnc2C)c1 773739256 CZPQMFWTIVAOCH-NCUBORBFSA-N 409.446 2.147 10 20 HECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1ccc(N2CC=CC2)cc1 775200258 FQAVVCWSYVZWFF-UHFFFAOYSA-N 400.504 2.018 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1 779481903 RPJYUAMWXLFTNA-WAPJZHGLSA-N 415.877 2.229 10 20 HECD COC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc2o1 785293241 FMYMAGJJYHBGPT-LLVKDONJSA-N 412.398 2.317 10 20 HECD Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 785711298 GVMBHQLHNFTKDZ-UHFFFAOYSA-N 403.429 2.042 10 20 HECD COc1cccc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1OC 787923505 DJKAMYXOOYUORY-UHFFFAOYSA-N 411.502 2.061 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)cc1 788965442 PWUHOXNORAUMJY-UHFFFAOYSA-N 418.538 2.132 10 20 HECD C[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)N1CCc2sccc2C1 789720593 AAFUDCRKADKXIV-ZDUSSCGKSA-N 424.617 2.366 10 20 HECD C[C@@H](COc1ccc(F)cc1F)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 793802653 WEIOLRJWCSOUKX-LBPRGKRZSA-N 409.408 2.370 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c(O)c1 797388262 VQCCCVVQPRLZNN-UHFFFAOYSA-N 414.643 2.467 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(c3cccs3)CC2)cc1F 803663233 ULHNWWPJXFJZML-UHFFFAOYSA-N 404.511 2.355 10 20 HECD CCc1ccc([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 806494637 SSFPTBHRRROPTC-IFMALSPDSA-N 424.545 2.484 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(OC2COC2)cc1 807385199 DXPQXJTWLLXTPO-UHFFFAOYSA-N 421.247 2.187 10 20 HECD CC(=O)C(=O)COC(=O)c1ccccc1SCC(=O)Nc1ccc2c(c1)OCO2 808484755 GVYOSGYHDGCNHM-UHFFFAOYSA-N 415.423 2.461 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)C2CC2)cc1 809495368 MIZXVPSKKYMDJG-VGOFRKELSA-N 417.575 2.415 10 20 HECD O=C(NC[C@H]1CCCCN1C1CC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809821884 ACMNRUQXGXVPJH-UXHICEINSA-N 415.534 2.033 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCC1([S@@](C)=O)CCC1 809897318 YMYQHKDRBXGRGT-MUUNZHRXSA-N 405.564 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3COc4ccccc43)CC2)cc1 813891940 POQDLHQRSCUKQC-LENZSSGSSA-N 421.497 2.192 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1CCN(C(=O)c2cccnc2)CC1 913210932 WZEAUKXHCKLZPI-UHFFFAOYSA-N 422.529 2.429 10 20 HECD CCN(CC)c1ccc(CNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)cc1 918111472 LRFXQNSTFGFUOE-UHFFFAOYSA-N 423.510 2.187 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](CO)Cc1ccccc1 918209172 SRRSZOORSAJCQH-IBGZPJMESA-N 401.482 2.313 10 20 HECD Cc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918463045 HHPHTJRUSOVEPE-MRXNPFEDSA-N 412.465 2.091 10 20 HECD NC(=O)[C@@H]1CCCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 920428307 LWZYGALSEGFEIM-HLVNSREUSA-N 423.585 2.453 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCCC[C@@H]3N(C)C)CC2)cc1 1318438364 AURWWOFIVJPSKV-VXKWHMMOSA-N 417.598 2.379 10 20 HECD O=C(O)CN1C(=O)/C(=C\c2cc(Br)c3c(c2)OCO3)SC1=S 7166777 ORPRTGLUAVYTPB-YCRREMRBSA-N 402.247 2.464 10 20 HECD Cc1cc(C(=O)NCCN2C(=O)CNC2=O)c(C)n1-c1cccc(Br)c1 97571136 WVKQCMDTPOWLFV-UHFFFAOYSA-N 419.279 2.138 10 20 HECD O=C(CN1CCC(C2OCCO2)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 110456038 GFSYRVOMMZCZPX-UHFFFAOYSA-N 420.465 2.485 10 20 HECD COc1cc(/C=C2/SC(=S)N(CCNS(C)(=O)=O)C2=O)ccc1SC 727177099 WKQRPQJTVOXSDE-UKTHLTGXSA-N 418.587 2.168 10 20 HECD CCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 727484124 WBRIMJUVMJETEC-GOSISDBHSA-N 409.527 2.105 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1 728313118 BUJRJYCHWKYRCJ-UHFFFAOYSA-N 419.547 2.076 10 20 HECD CN(CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)S(=O)(=O)c1ccccc1 731856998 WDISECTUWVHWDT-SFHVURJKSA-N 418.515 2.221 10 20 HECD Cc1cc(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1-c1ccc(Cl)cc1 739699776 VAPYUFLUCXYMPR-OAHLLOKOSA-N 424.954 2.393 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cn4cc(C)ccc4n3)CC2)cc1 742940026 PKHXXAYIOJDCIB-UHFFFAOYSA-N 422.533 2.273 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1 743255516 FEZBHTLKCIOZIB-UHFFFAOYSA-N 416.452 2.476 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594389 ULIAIDZEEBEBGN-KVSKMBFKSA-N 424.492 2.419 10 20 HECD O=C(NCc1nnnn1C1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743698730 YATOGWUNSGMQQJ-LBPRGKRZSA-N 407.425 2.078 10 20 HECD COC1(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCOCC1 746714935 PVTPKCGPFMMDHF-IYBDPMFKSA-N 409.502 2.434 10 20 HECD O=C(NCCNc1ccccn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748023861 HASQURFGVMPBQQ-UHFFFAOYSA-N 418.500 2.491 10 20 HECD C[C@@H](NCCS(=O)(=O)NCc1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765350887 OUNRUJCRGTWYDU-QGZVFWFLSA-N 421.538 2.433 10 20 HECD O=S1(=O)CC[C@@H](N(Cc2cc3c(cc2O)OC[C@@H]3O)Cc2ccccc2F)C1 768463472 JOMBKXJNCSOZSQ-BEFAXECRSA-N 407.463 2.146 10 20 HECD CCOC(=O)C1(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)CC1 770562574 ZDOXDZSHWRFVNV-UHFFFAOYSA-N 406.502 2.110 10 20 HECD O=S(=O)([C@H]1CCCN(Cc2ccc(N3CCCCC3)cc2)C1)N1CCOCC1 779607932 QYTYTGRIVBTMRW-NRFANRHFSA-N 407.580 2.303 10 20 HECD O=C(CS(=O)(=O)Cc1ccc(Cl)s1)OCC(=O)c1ccc(O)c(O)c1 782080940 NUOHWZPGWDYWAJ-UHFFFAOYSA-N 404.849 2.154 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 784029162 ANJBHXAOPRBPPP-UHFFFAOYSA-N 422.478 2.453 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)COC(=O)N4)cc2F)C[C@H](C)O1 784222133 LMYTYYVZIWWEGF-GJZGRUSLSA-N 420.485 2.223 10 20 HECD CC[C@@]1(CO)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 784389241 NPICQLAADMOEIB-JKSBSHDWSA-N 407.530 2.292 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785295294 SQJHBGLFIJFNEM-KBPBESRZSA-N 414.458 2.135 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](C2CC2)N(C)Cc2ccccc2)cc1 785424050 LCNXSDUAEGIIAR-QFIPXVFZSA-N 408.546 2.396 10 20 HECD Oc1cc2c(cc1CN1CCCN(c3nnc(C(F)(F)F)s3)CC1)[C@@H](O)CO2 786105364 HLXURSQXSSBKAR-ZDUSSCGKSA-N 416.425 2.401 10 20 HECD CC(C)C[C@@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 788745370 GFFAWMKSWREJHB-WMZHIEFXSA-N 416.566 2.471 10 20 HECD CCOC1CC(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789863461 HJFQCMFQSJLFHP-UHFFFAOYSA-N 405.564 2.177 10 20 HECD Cc1nccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 793764843 OJGUHQOGSMBJQW-UHFFFAOYSA-N 407.474 2.289 10 20 HECD COc1cc2c(cc1S(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OCC(=O)N2 797454785 XJVJEKSKERJVRR-LBPRGKRZSA-N 405.476 2.132 10 20 HECD Cc1oc(S(N)(=O)=O)cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 798321580 CPUDSWMWSVNXBC-QGZVFWFLSA-N 421.519 2.123 10 20 HECD C[C@@H](NC(=O)C(=O)NCC[C@@H](C)N1CCCCC1)c1ccc(N2CCOCC2)cc1 803309153 QDMVIIKCELLZOO-RTBURBONSA-N 416.566 2.081 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(-n2ccnc2)cc1 803346399 TTZAHOCFPWUBQN-UHFFFAOYSA-N 401.517 2.244 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)ccc21 803686039 TYNFQUNIALGOKD-NXHRZFHOSA-N 405.589 2.181 10 20 HECD C[S@@](=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 804975803 SXLAWBQGSBXKEY-MUUNZHRXSA-N 401.532 2.401 10 20 HECD O=C(NCCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)cc1 804976506 ZAIZZCVKNRYPNF-UHFFFAOYSA-N 422.485 2.009 10 20 HECD Cc1noc(C)c1[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806385570 ADWAMDKFBPQSEF-SUMWQHHRSA-N 401.463 2.382 10 20 HECD CS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1F 808114713 FUWRIAYXAOFHPW-UHFFFAOYSA-N 412.823 2.496 10 20 HECD CC(=O)N1C[C@H]2[C@@H](N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)CCC[C@H]2C1 809184391 GIAPCTKQSWGXLJ-XKQJLSEDSA-N 405.882 2.457 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 811567090 NCVNIBCCIBODNX-UHFFFAOYSA-N 418.431 2.126 10 20 HECD COc1ccc(Cl)cc1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339068 BCKITBYBXCWLMJ-UHFFFAOYSA-N 422.934 2.442 10 20 HECD CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 1317920951 KGACXDNYVQAPHR-FXAWDEMLSA-N 420.513 2.155 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(OCC(F)F)n1 1320148565 DFUDQEOHHXDBKU-ZDUSSCGKSA-N 410.373 2.041 10 20 HECD CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1806337490 KCSUDYLPTUUOTH-PHYPQJFDSA-N 411.458 2.328 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1nccs1 1816568989 WHFMAUMANJUNDK-LBPRGKRZSA-N 414.447 2.292 10 20 HECD CCn1nc(C)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1843247648 AZDAVJDBWLSRNX-UHFFFAOYSA-N 418.881 2.407 10 20 HECD O=C(Cc1ccc(Cl)s1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848109181 CCTNFSLNPOZABT-STQMWFEESA-N 407.879 2.266 10 20 HECD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NCc1ccc(N2CC=CC2)cc1 740902400 DIATWOUMYHMHQI-UHFFFAOYSA-N 414.531 2.313 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2ccn(C)c(=O)c2)NC(=O)OC(C)(C)C)cc1 742753572 KDSKCSNSKXEIRV-GOSISDBHSA-N 414.506 2.447 10 20 HECD CN1CC(=O)N(CCCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 742801353 PSLJYTGUNLQGDN-CQSZACIVSA-N 424.448 2.047 10 20 HECD COc1cccc(CNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1O 743332880 HXBBAQCSGMLHRJ-NSHDSACASA-N 402.476 2.092 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1Br 747226868 IUZFAKMFBDBBPN-QMMMGPOBSA-N 417.216 2.366 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 749637737 HYISLQXYAFFKFP-UHFFFAOYSA-N 405.476 2.189 10 20 HECD CN1CCN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2Cl)CC1 750360640 AMOIPJKNRRWWGN-UHFFFAOYSA-N 402.882 2.052 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCS(=O)(=O)C2(CCCCC2)C1 753856457 CWOJOOGJHRBYRR-UHFFFAOYSA-N 407.580 2.144 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@H](C)NS(=O)(=O)c1cccnc1Cl 760598336 YOZHYTIOINSLSN-AWEZNQCLSA-N 424.954 2.483 10 20 HECD C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C2=O 763283384 JMENLCYSBDYGES-SOHPYSCWSA-N 417.506 2.282 10 20 HECD CC[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1=O 767942563 LKOOMTFKZOQYEA-AYSMAOOMSA-N 419.497 2.231 10 20 HECD Cc1cccc(O[C@H](C)C(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c1 768444409 AXDCAWAAUDNZGX-IIBYNOLFSA-N 412.486 2.238 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCc2ccccc2)[C@@H]2CCOC2)c1 769966764 XHQCZIQQNMVSLK-QGZVFWFLSA-N 404.488 2.238 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(C(F)(F)F)c1 774799054 CHEJNXGQHOGRHZ-UHFFFAOYSA-N 421.419 2.475 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-n2ccnc2)nc1 777828203 JMYSWAMEOFBQGY-UHFFFAOYSA-N 400.822 2.442 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CC2(O)CCOCC2)c([N+](=O)[O-])c1Br 780633266 ZMSJEDKTEVPEER-UHFFFAOYSA-N 420.216 2.252 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 785296129 BSMAKJIOXQSPFV-CQSZACIVSA-N 411.458 2.020 10 20 HECD C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424566 PYBRBJLUOMDHEO-JMGYQRAPSA-N 401.532 2.326 10 20 HECD CSCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 786793769 RBZKUKZZVYIAJW-UHFFFAOYSA-N 419.469 2.028 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC3CCSCC3)cc2F)C[C@@H](C)O1 789816124 BVNUPZYJEWJQLI-HUUCEWRRSA-N 423.554 2.315 10 20 HECD CC(C)N(C)c1ccc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 790961430 BOAHIIMCMVPCRH-UHFFFAOYSA-N 402.564 2.451 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1 796788571 FQASXVVGIDDLPI-NSHDSACASA-N 417.393 2.312 10 20 HECD COC(=O)CSCc1cccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797390876 XQQBWKQBKFJJQK-UHFFFAOYSA-N 418.471 2.062 10 20 HECD COc1cc2c(cc1S(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1)OCC(=O)N2 797454784 XJVJEKSKERJVRR-GFCCVEGCSA-N 405.476 2.132 10 20 HECD C[C@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C)c1ccc(N(C)C)cc1 805309068 JUFAHEKPDXSFHL-SHFXZJCHSA-N 401.555 2.196 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288917 CQTJJHWLKAUULU-UHFFFAOYSA-N 414.531 2.119 10 20 HECD COc1cccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)c1 807678878 LSVSYZRYFUNKGL-KRWDZBQOSA-N 410.518 2.287 10 20 HECD CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NCc1cccc(Br)c1O 811459274 BQXNHENJOKNXSB-OAHLLOKOSA-N 423.311 2.268 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc2)CC1 811815326 MVUKAEFPBZKNOA-NRFANRHFSA-N 407.511 2.010 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccccc1S(=O)(=O)N1CCCCC1 917356437 RJPBYLVSIDKNNP-UHFFFAOYSA-N 404.488 2.245 10 20 HECD O=C(NCCCOC[C@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918197202 QOPCJBMZZRXMSY-GOSISDBHSA-N 409.502 2.172 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 918286196 FBEKPIPIUDGBJI-UHFFFAOYSA-N 416.453 2.099 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc4c3OCCO4)CC2)cc1 1319600906 BABYWSMOVJEGBX-UHFFFAOYSA-N 404.488 2.367 10 20 HECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)co1 1795135369 HSQISMMRJDHDLD-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CCOCC2)CC1 1826579172 HPBGXXXUBSVHOY-SFHVURJKSA-N 417.506 2.153 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1 513374824 AMOQGBXXIQHEMM-GOSISDBHSA-N 421.563 2.462 10 20 HECD O=C(NCCN1CCc2sccc2C1)NCc1ccc(N2CCOCC2)cc1 726236540 FKJUBPGYVUKIRL-UHFFFAOYSA-N 400.548 2.442 10 20 HECD Cc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CC2 727226014 WUMNTJNPCMVLPV-CKEIUWERSA-N 416.501 2.153 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(-n4cccn4)c3)CC2)cc1 735039318 NTUHBMVYEFKWAF-UHFFFAOYSA-N 405.502 2.433 10 20 HECD CC(=O)c1cc(Cl)cc(CN(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c1O 750045944 YULZUOBUUDSYMH-HZPDHXFCSA-N 401.912 2.416 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)oc1C 751145083 ASRDDLJGWZYJQP-UHFFFAOYSA-N 422.868 2.200 10 20 HECD COc1cccc(CNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1O 752130228 RSRDYELDVZAHQB-UHFFFAOYSA-N 407.224 2.326 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCCCSc2nccs2)cn1 753588585 NFRBRJGVZNBBED-RXBISOJRSA-N 413.594 2.357 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1F 753738773 UPXRJDFYBLRFIK-XIRDDKMYSA-N 417.481 2.047 10 20 HECD COc1ccc(N2CCN(CCN[C@H](C)CS(=O)(=O)c3ccccc3)CC2)cc1 756479932 PHGVQJMQENMLPO-LJQANCHMSA-N 417.575 2.269 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 758222035 DALBQBCMAKVQCU-SFHVURJKSA-N 401.463 2.474 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1 762313037 PZMVQXWTCHFRFY-UHFFFAOYSA-N 420.561 2.405 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773086624 FFUCTVPPNFEJJO-LBPRGKRZSA-N 415.512 2.303 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCNS(=O)(=O)c1ccc(F)cc1 773739382 GQOKZKLKYSSEHE-CYBMUJFWSA-N 410.467 2.043 10 20 HECD Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc12 773764036 UERKKASGVKYDKN-JQWIXIFHSA-N 416.503 2.220 10 20 HECD COc1c(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cccc1C(N)=O 782711667 MEJCPSHFNIDZRP-UHFFFAOYSA-N 402.426 2.092 10 20 HECD COC(=O)Nc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1F 785297736 RXCWMAODXORXCM-JTQLQIEISA-N 405.382 2.101 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C 785597294 DUTOCOSIQSACQQ-FQEVSTJZSA-N 405.502 2.317 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C 785597990 HXUQXQDHNWSZMZ-HXUWFJFHSA-N 423.492 2.489 10 20 HECD COc1cccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 787156118 IKDHCVNRFSLVCT-HXUWFJFHSA-N 412.486 2.267 10 20 HECD C[C@H](NC(=O)C(=O)NCCO[C@@H]1CCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 787991185 SYIDNIVFPLIOOH-BBTUJRGHSA-N 417.550 2.412 10 20 HECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC12CCC2 789836111 RWVSUMHMLJKZHM-MRXNPFEDSA-N 417.525 2.442 10 20 HECD O=C(NCCCOC1CCCC1)C(=O)NCc1ccc(N2CCSCC2)cc1 789855494 SLQSLPIWLNARSP-UHFFFAOYSA-N 405.564 2.322 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c(O)c1 797390269 SJTZXBLTUWNXIL-UHFFFAOYSA-N 416.384 2.334 10 20 HECD CCc1cnc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803298013 MKGJKEYMYVMRNH-OAHLLOKOSA-N 416.547 2.378 10 20 HECD Cc1cnc(CCN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803309795 COBJJJZLACQSKY-INIZCTEOSA-N 416.547 2.166 10 20 HECD COC[C@@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450461 HZBVKLHGWWNPLV-INIZCTEOSA-N 411.449 2.010 10 20 HECD C[C@H](CO[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676431 IGZPPICEKOYLEQ-DYESRHJHSA-N 417.550 2.382 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NC2COC(C)(C)OC2)cc1)C1CCCCC1 803676912 VTVWCLFYFGPPOM-UHFFFAOYSA-N 403.523 2.339 10 20 HECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@@H](C)O1 803677431 OZNYNZILBSLBBD-UTKZUKDTSA-N 417.550 2.334 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ccccc2F)C1=O 806216214 MXOBAHIJVLZPOX-KRWDZBQOSA-N 413.449 2.192 10 20 HECD O=C1COc2ccc(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)cc2N1 807513104 GGPSIZOIZIOTNO-UHFFFAOYSA-N 410.213 2.285 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(CCc2ccccc2)CC1)c1ccc(N(C)C)cc1 807678299 WDAPZMQHIPPFCB-LJQANCHMSA-N 408.546 2.317 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 915269079 RIEAFQMYDPBOLH-IBGZPJMESA-N 418.515 2.398 10 20 HECD C[C@H](CC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1327238124 KVRTXBVTTUCBJM-NVXWUHKLSA-N 418.538 2.308 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)c1 1338723640 KJPUHLQVOMUIKF-UHFFFAOYSA-N 407.448 2.058 10 20 HECD COCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806493405 FXZOPNFHTDFGCY-UGSOOPFHSA-N 419.865 2.112 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)CC(N)=O)C2)cc1 1841658479 RGIZWAJJCBKNNS-MRXNPFEDSA-N 422.529 2.423 10 20 HECD O=C(/C=C/c1ccoc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441201 RCTUYSOYJYGQDN-BQYQJAHWSA-N 418.453 2.289 10 20 HECD Cc1c(CNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)n(C)c2ccccc12 472135483 ZIBOYJGELGTLKZ-YWZLYKJASA-N 405.520 2.022 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1 729062737 DIEXHUAPQOKQOE-OAHLLOKOSA-N 421.453 2.427 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1 729063079 XMXGFKCVJFLPRS-ZDUSSCGKSA-N 417.437 2.192 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1O 737286341 VVDGIPPRFCOJDM-UHFFFAOYSA-N 411.317 2.165 10 20 HECD O=C(NCc1nnc2n1CCC2)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742712661 YIRWXZRYWCGTGB-CYBMUJFWSA-N 406.437 2.294 10 20 HECD COC(=O)C1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCC1 752020361 JMFKBFYTBUHQMK-UHFFFAOYSA-N 407.486 2.319 10 20 HECD CCOC(=O)CC[C@H]1CCCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 752050593 MJBZKUXIHWRRGA-LJQANCHMSA-N 417.550 2.399 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)c(F)c(O)c3F)cc2)C1 755098932 PJXOTRDOPFWMKO-LBPRGKRZSA-N 407.392 2.441 10 20 HECD O=C(CN1CC(=O)N[C@@H]2CCCC[C@@H]21)Nc1cccc2c1C(=O)c1ccccc1C2=O 758772930 QTICYUQAHIPAFW-MJGOQNOKSA-N 417.465 2.144 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3cccc(O)c3)CC2)cc1 760608346 WFZUOADCLBDQDA-SXSDINLZSA-N 409.486 2.483 10 20 HECD O=C1C[C@@H](Cc2ccc(C(=O)NCc3cccc(Br)c3O)cc2)C(=O)N1 765734977 AXNSGYRAVNYMMM-CQSZACIVSA-N 417.259 2.290 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](CO)OC[C@@H]3C)c2C)cc1 766945057 PCKXEMGLEKYBMH-KXBFYZLASA-N 400.475 2.145 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N(Cc1ccccc1)C1CC1 774357103 CBFBGPXLKVPSTD-UHFFFAOYSA-N 411.477 2.470 10 20 HECD CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 776118935 WVDOOYWZTRIOTM-WOJBJXKFSA-N 421.513 2.124 10 20 HECD COCCN(CC(C)C)C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778231447 FTCOUJYBQWTFBL-MDZDMXLPSA-N 403.523 2.031 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](C)Oc3ccccc3)CC2)cc1 778277146 AKPNKIIXHCYVCC-HSNDNRACSA-N 423.513 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](C)S[C@@H](C)C3)CC2)cc1 778287697 CRUZFUWHOUTNDC-AFYXXPPBSA-N 403.548 2.252 10 20 HECD CN(C)C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 783748974 AWSANYOIHUMWSD-UHFFFAOYSA-N 409.533 2.469 10 20 HECD C[C@H](NC(=O)N(C)Cc1ncnn1CC(F)F)c1ccc(N2CCOCC2)cc1 787062394 BTESOLNKLQOHSG-AWEZNQCLSA-N 408.453 2.282 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)c1 787485197 LJGYWULODOLFMZ-ZDUSSCGKSA-N 412.446 2.055 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C3CN(C(C)=O)C3)c2C)cc1 788156139 BWJDRBRINSOKOU-UHFFFAOYSA-N 412.442 2.085 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1 788817283 JLEVZPAQTSCATO-UHFFFAOYSA-N 405.502 2.238 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 789818732 KOJVMUCTOUJJEW-HLLBOEOZSA-N 421.513 2.129 10 20 HECD O=C(NCCc1cc(F)ccc1F)C(=O)NCc1ccc(N2CCSCC2)cc1 789855693 WLFMHGWPGQCSGN-UHFFFAOYSA-N 419.497 2.493 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)NC(=O)OC(C)(C)C 792038065 ITOPSLFXSKWOJP-CQSZACIVSA-N 410.490 2.375 10 20 HECD O=C(COC(=O)CCc1cnccn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 795917670 UBWQSLAAKQIKPX-UHFFFAOYSA-N 415.405 2.367 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@H]3C[C@H](C)O)CC2)cc1 796382866 JIJHIIFBRHRCET-BVSLBCMMSA-N 405.583 2.194 10 20 HECD Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)/C=C/c1ccc(O)c(O)c1 804743589 YLKAGPLDFMWBLB-XVNBXDOJSA-N 410.879 2.168 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](CN4CCCC4)C3)cc2)CC1 805023477 HPWRYMTUFXKGMN-NRFANRHFSA-N 412.578 2.483 10 20 HECD COCCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1OC 806855713 WIZJUKDYJZCFAY-UHFFFAOYSA-N 402.447 2.413 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)[C@H]1CCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807672291 XMIXOMGXUBEMBC-UZLBHIALSA-N 408.502 2.194 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O 808094902 JMMXWJXHNDCEAG-JOCHJYFZSA-N 416.474 2.270 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1C[C@H]2CCCC[C@H]2C1 808851302 BIIRBAUPDVBHKP-SZPZYZBQSA-N 424.589 2.483 10 20 HECD C[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808853909 KEGVNSVPSZTJLY-RTBURBONSA-N 412.578 2.482 10 20 HECD COc1ccc(CNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c(O)c1 811485234 YBCASAHGZUQVQL-UHFFFAOYSA-N 406.504 2.229 10 20 HECD COc1ccc(N2CCCN(C(=O)CCc3c(C)nc4nc(N)nn4c3C)CC2)cc1 917821689 PHIDRNKOPGEFJQ-UHFFFAOYSA-N 423.521 2.003 10 20 HECD CS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918162340 WLEQHGVUAGDQMF-UHFFFAOYSA-N 410.442 2.135 10 20 HECD CCC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337287 IOOUTIMMEVPLBE-UHFFFAOYSA-N 415.515 2.200 10 20 HECD O=C(Cc1ccccc1)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919791642 AYCLACABFBFIMS-UHFFFAOYSA-N 422.529 2.120 10 20 HECD C[C@H](NC(=O)CCNS(=O)(=O)c1cccs1)c1ccc(N2CCOCC2)cc1 920888248 MHRXOZRKJGRBJS-HNNXBMFYSA-N 423.560 2.131 10 20 HECD Cc1nccn1CC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1 1791109233 LPLSSSJFIPRNQU-UHFFFAOYSA-N 421.457 2.446 10 20 HECD Cc1nc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c(C)s1 1794466262 LQJWUTDTTOOCPA-QDMKHBRRSA-N 416.503 2.061 10 20 HECD CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813693146 JKHQOAMETHXYDD-IKSNEBHTSA-N 410.474 2.420 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1)CC2)c1cc(O)nc(O)c1 1816728797 VHXINTDFFZYPBY-ZYHUDNBSSA-N 420.516 2.071 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN(C)CCS(C)(=O)=O)c2C)cc1 728053948 AJLIBIFEQNCUEA-UHFFFAOYSA-N 406.504 2.040 10 20 HECD Cc1ccc(C(=O)NCCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(O)c1 728066096 YKOBGFXZWZTSQT-UHFFFAOYSA-N 411.502 2.316 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCS(=O)(=O)NCC2CCC2)cc1F 731685119 UQNVTLCRVGPRMV-UHFFFAOYSA-N 414.547 2.191 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCc2cc(OC)ccc2O)c1 734016557 SPNXMIYEFYGNMY-UHFFFAOYSA-N 422.503 2.370 10 20 HECD O=[N+]([O-])c1cc(CN[C@H]2CCN(CCN3CCOCC3)C2)ccc1N1CCCCC1 734509707 PEERPWXSEDWCSY-FQEVSTJZSA-N 417.554 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3[C@H](C)CC[C@H]3C)CC2)cc1 741018384 RIXRJUNDYGSFGL-KURKYZTESA-N 403.523 2.148 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(-n4cncn4)c(C)c3)CC2)cc1 742057133 JSSIFKOVEIHCEE-UHFFFAOYSA-N 420.517 2.136 10 20 HECD Cc1nnc2c(NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)nccn12 745971579 HKFVGGNWARWIFY-UHFFFAOYSA-N 419.468 2.301 10 20 HECD CCCN(CC(=O)N(C)C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 746777849 ZYHBHLGORMKOGC-UHFFFAOYSA-N 423.425 2.311 10 20 HECD CC[C@@H](C)[C@H](NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N)C(=O)OC 749821046 OEZUWVCTTUHCBE-PSLIRLAXSA-N 407.492 2.356 10 20 HECD COC(=O)c1c(F)cccc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751042143 BTQBSGFCMSKBHJ-AWEZNQCLSA-N 422.478 2.488 10 20 HECD CC(C)[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCOCC1 751930959 KOBKJIHNFZSLAA-GOSISDBHSA-N 403.504 2.356 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)s1 753643291 HMQWDCRHOUXIGP-SWLSCSKDSA-N 424.544 2.368 10 20 HECD COc1cccc(OC)c1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756916306 LBIKPUQQDWOGFJ-QGZVFWFLSA-N 411.502 2.264 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCc1nc[nH]n1 759218863 LTTQXWRVFTXTGT-FMIVXFBMSA-N 407.546 2.207 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(NC(C)=O)ccc2NS(C)(=O)=O)c1 761968997 XAXAWVPFORJGTB-LLVKDONJSA-N 421.475 2.222 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c(O)cc1C 768438001 NJUAEESPZAXGBV-UHFFFAOYSA-N 421.475 2.124 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2O)cc1OCC 769279884 GCJRYXQLOZKISI-UHFFFAOYSA-N 422.503 2.127 10 20 HECD CCOC1CC(O)(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 770261847 KVZGUDPBWAWTRH-HSHIJAPFSA-N 409.502 2.169 10 20 HECD CCOC(=O)c1c(C)oc2nc(COC(=O)/C=C\c3ccc(O)c(O)c3)nc(N)c12 772777990 ZAIVUOVBOARPTF-ALCCZGGFSA-N 413.386 2.458 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccc(N(C)C)cc1 773844966 FNLXXQMHUSKRTM-HNNXBMFYSA-N 422.485 2.218 10 20 HECD COCC(=O)N1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775649387 QKGYEQGNGSKALA-UHFFFAOYSA-N 422.117 2.208 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](OC)c3ccccc3)CC2)cc1 778228952 TWYUUQCMNNPCOM-MLUDITRGSA-N 423.513 2.404 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CC3(O)CCOCC3)cc2F)C[C@@H](C)O1 780311180 GIFQKRYXTYFUFO-IYBDPMFKSA-N 409.502 2.122 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@H](OCCO)C1 780506908 LMHBSCJWWBQCNQ-QAPCUYQASA-N 413.465 2.440 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1 782251160 IVLZHCSTKQIPQW-UHFFFAOYSA-N 416.452 2.175 10 20 HECD NC(=O)c1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)c1 787856595 QDVUJCRRDIMWGS-UHFFFAOYSA-N 409.486 2.469 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c1 790392789 AARZSPVMYOXZIW-TXBYWVTISA-N 418.534 2.195 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1 792306322 HLRMVTVHPZRZGY-OAHLLOKOSA-N 407.511 2.088 10 20 HECD Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 797531088 LKVSTKOWWGIQSQ-UHFFFAOYSA-N 410.518 2.495 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4cnn(CC)c4nc3C)nc12 799571674 JULNAVIFXPXEPD-UHFFFAOYSA-N 424.417 2.042 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 801549466 PECYYDXPXFLHQD-OAQYLSRUSA-N 417.550 2.234 10 20 HECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807101923 OEBOSJGJOPMGIL-MRXNPFEDSA-N 420.554 2.439 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1(C)C 809127612 RGPSOLIJIYKXHF-RADWXHQJSA-N 404.507 2.220 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)c1 810111802 BCFQEOYWXLSLNB-UHFFFAOYSA-N 415.515 2.084 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C 917991708 SEPXNDSRVMDGHN-UHFFFAOYSA-N 409.471 2.354 10 20 HECD CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 1317920953 KGACXDNYVQAPHR-XLIONFOSSA-N 420.513 2.155 10 20 HECD O=C(COC(=O)CCNc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 1330613553 GUEQWNQUPNASOY-UHFFFAOYSA-N 415.465 2.324 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2Cc2ccc(N3CCN(C)CC3)c(F)c2)cn1 1343627825 VOQKNXFFBZNFOG-LGGPFLRQSA-N 419.570 2.100 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1F 735512716 KCCRBUSXSBXONS-QGZVFWFLSA-N 402.474 2.010 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1 735824187 ZCFKZITVFJNZPC-FQEVSTJZSA-N 424.545 2.065 10 20 HECD CC(C)(C)c1cc(O)c(O)c(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)c1 743380781 QAGMCVRFPYFMAX-UHFFFAOYSA-N 409.508 2.031 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](O)Cc1ccccc1 747390637 UBTJJFPFIUFAIV-KKSFZXQISA-N 401.482 2.454 10 20 HECD CN(C)[C@]1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCSC1 748620742 ZSQJQCQTLNEVFL-FQEVSTJZSA-N 410.559 2.023 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CC2(CCCC2)c2c(F)cccc21 749151794 WARIMTDFJUHTIC-UHFFFAOYSA-N 401.463 2.482 10 20 HECD C[C@H](O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 749348805 XBXILAAHMLMIMK-OXJNMPFZSA-N 410.518 2.441 10 20 HECD CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 749555632 RNLAJHUCAPRTHF-QWFCFKBJSA-N 401.555 2.060 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(S(=O)(=O)CCOC(C)C)CC2)c1O 750057998 ORNJBLVEGBBNMH-UHFFFAOYSA-N 418.943 2.121 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2O)c(Br)o1 751309429 LWYBABWKOVGKAH-UHFFFAOYSA-N 420.237 2.021 10 20 HECD CCCCN(C)C[C@@H](C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 753017387 HKGIFWJLUHETRG-TZZQJPOUSA-N 416.566 2.137 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@H](OC)C3(C)C)CC2)cc1 753349070 IUOQYDHXOYSABC-PMACEKPBSA-N 404.555 2.320 10 20 HECD CNC(=O)c1cccc(CCNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753920125 ZPSVLQKIWXRTIQ-UHFFFAOYSA-N 414.481 2.268 10 20 HECD COC[C@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755218314 CUVYFHLRMOWPSM-MRXNPFEDSA-N 401.486 2.231 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H]3CSCCS3)CC2)cc1 759806183 XNJNMIUFUZNHCM-KRWDZBQOSA-N 410.561 2.126 10 20 HECD COc1cc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)cc(OC)c1OC 760124899 XKGGPBTYNXMPLS-HNNXBMFYSA-N 409.527 2.341 10 20 HECD COC(=O)c1cn([C@@H]2CCN(Cc3c(O)ccc(C(=O)c4ccccc4)c3O)C2)nn1 760529480 AYHQCJVLVZZPLD-OAHLLOKOSA-N 422.441 2.154 10 20 HECD CCc1noc2ncc(S(=O)(=O)N3CCN(c4ccc(OC)cc4)CC3)cc12 762520634 MFPWVIOFLALNIV-UHFFFAOYSA-N 402.476 2.305 10 20 HECD CN1CCN(c2ccc(CNCc3cccc(N4CCCS4(=O)=O)c3)cc2)CC1 764977628 PHZZAAOLARJKTE-UHFFFAOYSA-N 414.575 2.268 10 20 HECD COc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(OC)c1OCC(N)=O 773022683 ITZJONUCTZAYGL-ZDUSSCGKSA-N 401.463 2.125 10 20 HECD COCCOc1c(Cl)cccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785304621 QWQLIOAOZSQXCG-LBPRGKRZSA-N 422.865 2.462 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@]3(O)CCc4ccccc4C3)CC2)cc1 785723815 KPUFNTVRELBUPK-VWLOTQADSA-N 423.557 2.244 10 20 HECD CO[C@@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cs1 788933002 OFXZJPDLAQEGPN-AWEZNQCLSA-N 402.520 2.383 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1 792338302 ISVVTLHCLSSOSF-UHFFFAOYSA-N 422.485 2.359 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H]1c1cccn1C)c1ccc(N2CCOCC2)cc1 803303424 NAXLZTOOQVYEKZ-UTKZUKDTSA-N 410.518 2.403 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315143 FUBBHWFSXWTEBB-UHFFFAOYSA-N 414.506 2.209 10 20 HECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)CC2 807289650 CYQKPXLZUPUSHW-LJQANCHMSA-N 407.518 2.130 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387090 YNWUGZAQWFTSJU-UHFFFAOYSA-N 420.263 2.078 10 20 HECD Cn1c(=O)oc2c(NC(=O)C(=O)NCc3cc(Cl)cc(Cl)c3O)cccc21 807513127 GVNWPWKIFUFHNY-UHFFFAOYSA-N 410.213 2.399 10 20 HECD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)c1 808115418 BRCAQMMSQROKHJ-UHFFFAOYSA-N 408.860 2.236 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@H](N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)[C@H]2C1 809184387 GIAPCTKQSWGXLJ-JQFCIGGWSA-N 405.882 2.457 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H](O)c1ccccc1 812010215 NFBVERROQIHTOK-NBHGPNQESA-N 410.518 2.310 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)N(C)C3CCCCC3)CC2)cc1 913075233 POXFVDIFKJHOHX-UHFFFAOYSA-N 424.611 2.306 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc1 918308704 BVBMJXIFRRCFQO-UHFFFAOYSA-N 422.485 2.356 10 20 HECD COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918440498 RQJIYWUFWAQKBH-UHFFFAOYSA-N 401.438 2.050 10 20 HECD Cn1ccc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1=O 918848535 HXGYLJSSXBPIRA-UHFFFAOYSA-N 418.361 2.426 10 20 HECD COc1ccc(F)cc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918937333 SVZGTSJIEQJDRR-UHFFFAOYSA-N 420.412 2.283 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C(=O)c1cnn(C(C)(C)C)c1 919433627 WLSBVFJWXKPBOE-UHFFFAOYSA-N 400.479 2.089 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)cc1 1335807899 DVUGSYSHBOOYQY-MRXNPFEDSA-N 419.547 2.122 10 20 HECD O=C(Nc1c(Cl)ccc2nonc12)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 1342950581 HCEBNVGHCPNYFH-UHFFFAOYSA-N 418.818 2.435 10 20 HECD CCOCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809207870 XEEIJVFQCNCZOL-FNORWQNLSA-N 418.490 2.084 10 20 HECD Cc1n[nH]c(C)c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501594 FYZASPPFPOMSHW-UHFFFAOYSA-N 404.854 2.222 10 20 HECD Cc1cnc(F)c(C(=O)NC[C@H]2CC3(CCC3)CN2C(=O)c2cc(O)nc(O)c2)c1 2088596049 ZMQYXDBRCMCBLE-CQSZACIVSA-N 414.437 2.150 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1 9919412 ILMHQXPHGKOSLV-UHFFFAOYSA-N 413.478 2.128 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)cc1 46228199 QLJOZOCNQOBRKP-UHFFFAOYSA-N 408.502 2.001 10 20 HECD COc1ccc(N2CCC(NC(=O)NCC(=O)NCCc3ccccc3)CC2)cc1 726708849 FEDZPAYFLIICEB-UHFFFAOYSA-N 410.518 2.322 10 20 HECD COc1ccc(N2CCCN([C@H]3CC(=O)N([C@H](C)c4cccnc4)C3=O)CC2)cc1 731218802 JSVCBTQLRLWPIL-UTKZUKDTSA-N 408.502 2.491 10 20 HECD Cc1ncsc1CN(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 731281860 CMWSVZRZBBJZDI-MRXNPFEDSA-N 401.536 2.495 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731857476 CVCVYRMOXYIDCI-QGZVFWFLSA-N 404.488 2.122 10 20 HECD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(O)cs2)c(=O)n(-c2ccccc2)n1C 732355752 SZCNDISIAAILIY-LBPRGKRZSA-N 401.444 2.436 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CNc3ccccc3Cl)nc12 733500165 ZDRZHSKFEYPMGQ-UHFFFAOYSA-N 404.810 2.420 10 20 HECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)cc1S(=O)(=O)NC1CC1 734471650 SFOBIMLCMZGZMZ-UHFFFAOYSA-N 417.531 2.440 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(S(N)(=O)=O)c1 740902023 MSFIBSRZGBEDNF-OAHLLOKOSA-N 400.504 2.271 10 20 HECD CCOC(=O)N1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 748460889 MZXVKUVHHKCXTB-UHFFFAOYSA-N 408.474 2.036 10 20 HECD O=C(O)CCCOc1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1F 751189204 KIMUEODPXYCNJF-UHFFFAOYSA-N 413.379 2.274 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCC[C@]12NC(=O)N(C)C2=O 753020401 IOOJTSIMKQFAGJ-IERDGZPVSA-N 401.511 2.005 10 20 HECD CCc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc(O)n1 760086770 VIUGKARQWFSDEI-UHFFFAOYSA-N 401.463 2.338 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21 760491005 DYYZMAIRZMFIDB-PSLXWICFSA-N 412.486 2.220 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)NCc2cccc(Br)c2O)CC1 764790953 LBRPNQVBSZJPFJ-AWEZNQCLSA-N 413.360 2.228 10 20 HECD O=C(CCn1c(=O)nc(O)c2ccccc21)NCc1cccc(Br)c1O 765767880 FNQFFMLVTGGTBA-UHFFFAOYSA-N 418.247 2.277 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)c([N+](=O)[O-])cc1OC 766931221 LULMAVAAMNYZJN-UHFFFAOYSA-N 415.402 2.303 10 20 HECD COCCC(C)(C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 771084648 ZNTHJCWMYPUGTJ-UHFFFAOYSA-N 402.495 2.284 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1Cl 774364160 RANSFIQTBBPWQC-UHFFFAOYSA-N 419.865 2.188 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)c1 775370041 KGLRECNYGYMQCE-INIZCTEOSA-N 412.490 2.428 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 777564276 MCZRELDTCUYUKD-UHFFFAOYSA-N 412.469 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)cc1 778388670 JWDOSLCEYDXCLT-DXRVJIQQSA-N 423.513 2.353 10 20 HECD O=S(=O)(c1ccc(F)c(F)c1F)N1CCN(Cc2cc(F)ccc2O)CC1 778993385 QWLOAXSLBBBKDS-UHFFFAOYSA-N 404.385 2.455 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC3(C)CCN(C)CC3)cc2F)CC1 780828798 MVIUXKNZEYKOTP-UHFFFAOYSA-N 405.562 2.499 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OCC(=O)OC)cc1 784024432 ONJWEABUGXEEBW-UHFFFAOYSA-N 400.431 2.321 10 20 HECD CCOC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785295620 XNESIDBETTYOKI-CYBMUJFWSA-N 415.446 2.376 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(CN3CCCC3)c2)cc1F 787289425 HZNRXCVGIQJDBL-UHFFFAOYSA-N 412.509 2.420 10 20 HECD CC(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788309653 FVNKQOWVEHEXCL-UHFFFAOYSA-N 402.520 2.036 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 789389911 VRVLFZCHIYAPNQ-UHFFFAOYSA-N 403.866 2.440 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1ccc2ncccc2c1 789696791 OFEWUCDNDWEZHK-UHFFFAOYSA-N 422.460 2.143 10 20 HECD C[C@@H](c1ccco1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832700 COAWOEPPLGJMBO-AWEZNQCLSA-N 403.454 2.216 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C1CC1)C1CC1 789845314 WQHBMIDNNYSVLH-UHFFFAOYSA-N 403.498 2.050 10 20 HECD C[S@@](=O)c1ccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 797902269 VDNRUMWFAOFWKY-MUUNZHRXSA-N 404.507 2.383 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc1F 799790442 VZHIZFKMMVMZJZ-UHFFFAOYSA-N 421.494 2.047 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCN1C 806037517 YONOFKVEXAEREZ-PKOBYXMFSA-N 412.534 2.473 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CCO)C(C)(C)C3)cc2F)C[C@H](C)O1 806457563 OJDCVBSWGYBIFN-IRXDYDNUSA-N 422.545 2.037 10 20 HECD C[C@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 807013601 AQXPRCHRMNEKGP-GHTZIAJQSA-N 412.578 2.387 10 20 HECD CN(C)c1ccc(CN(C(=O)NCc2ccccc2S(N)(=O)=O)C2CC2)cc1 807605182 JSONSVBPKVWXEG-UHFFFAOYSA-N 402.520 2.274 10 20 HECD CCc1cnc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)s1 807675626 YZQBYAGRJSTICQ-OAHLLOKOSA-N 415.563 2.298 10 20 HECD CC(=O)C(=O)COC(=O)C1CCN(S(=O)(=O)c2c(C)c(C)cc(C)c2C)CC1 808484059 HMIBSVOQPISVED-UHFFFAOYSA-N 409.504 2.022 10 20 HECD COc1cccc(CNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1O 810328332 LWUMTUSXHPDPSZ-UHFFFAOYSA-N 419.286 2.302 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 811701480 XTRNAAGRAJBYLY-UHFFFAOYSA-N 404.444 2.219 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H]2CCCS(=O)(=O)C2)cc1 815153250 KHJJNUNIERPESM-QUCCMNQESA-N 408.564 2.475 10 20 HECD CS(=O)(=O)CC1CCC(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 815562565 ILDSJSRYDUEXEW-JLAWEPINSA-N 407.580 2.081 10 20 HECD Cn1cc(Br)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 815655082 HXQFNVRYIDFXFB-UHFFFAOYSA-N 407.312 2.321 10 20 HECD Cn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1C1CC1 917177538 STDOWIADHUNZCX-UHFFFAOYSA-N 405.499 2.077 10 20 HECD CSCC[C@@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 917355496 GKEMNWKARBPFEY-INIZCTEOSA-N 414.483 2.174 10 20 HECD CN(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918440955 VBFMOWOMPSAKJN-UHFFFAOYSA-N 414.481 2.108 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C1=NN(Cc2ccccc2)C(=O)CC1 919863785 XRHTWVJYYZVNRC-UHFFFAOYSA-N 406.486 2.318 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)C1Cc2ccccc2C1 1796603563 SHZMUJACSUVGMI-REPLKXPHSA-N 407.470 2.160 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797296162 HSWRXTRKXAPFLM-VGXVWSLXSA-N 422.909 2.391 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1ccnc1 1845500449 CSWBQLSYTOWLDE-LBPRGKRZSA-N 404.854 2.026 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1 141680427 LAPXIOSHFKHSIF-HNNXBMFYSA-N 411.458 2.110 10 20 HECD CCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 303253781 BMJHAFRMWHGXRH-HXUWFJFHSA-N 404.530 2.375 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)[C@H]1CCCN(C(=O)C2CCCC2)C1 513374825 AMOQGBXXIQHEMM-SFHVURJKSA-N 421.563 2.462 10 20 HECD C[C@@H](CN1CCOCC1)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726615001 ZFRGMYZLRBDPJZ-HNNXBMFYSA-N 412.481 2.277 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c1 739697037 VCSHFTNMRMAYJU-QGZVFWFLSA-N 404.536 2.048 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H](O)c1c(F)cccc1F 740908391 ZCOOYHUAGAAWGX-GOSISDBHSA-N 409.408 2.473 10 20 HECD COC[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 743769736 KCWQAWQTRRLAJC-JZUUQJBKSA-N 414.574 2.243 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 744357398 QMOFMIJHPZMRDF-CBFGRJNTSA-N 413.518 2.042 10 20 HECD COC(=O)C[C@@H]1CCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 749466892 XWTVFDCTUFCIQV-AWEZNQCLSA-N 406.438 2.428 10 20 HECD Cc1cc(CC(=O)N(C)C[C@@H](O)CN2CCOCC2)c(C)n1-c1ccc(Cl)cc1 751432407 WQVSOSAMEUFRQN-OAQYLSRUSA-N 419.953 2.442 10 20 HECD CC(C)N1CCc2nc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)sc2C1 752841710 UTTWHGGXQFJFOI-UHFFFAOYSA-N 410.521 2.239 10 20 HECD C[C@H](O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 753110487 YZQVNLZGOVVUJC-ZFWWWQNUSA-N 401.429 2.454 10 20 HECD C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)cc(F)c1O 756417258 MPMCHAZBPFGSSO-JTQLQIEISA-N 424.270 2.360 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1 759035639 OAUOIRIHWNECCE-UHFFFAOYSA-N 406.490 2.150 10 20 HECD COCC1(O)CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 759316294 VTOITIXJTRGIAD-OAHLLOKOSA-N 422.481 2.262 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3c(O)ccc4ccccc34)CC2)cn1C 765446081 QLPHFTFLYNUNCA-UHFFFAOYSA-N 400.504 2.094 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 769562514 DVGOQBAARSMGQQ-SFHVURJKSA-N 410.474 2.078 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc(O)c3)cc2F)C[C@@H](C)O1 769688212 IMXZBZAYBSVARV-GASCZTMLSA-N 415.465 2.191 10 20 HECD Cc1occc1C(=O)NCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771051910 DAHJEBLSIKPBOC-MRXNPFEDSA-N 405.882 2.458 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@@H]4CCCCO4)n3)CC2)cc1 771067046 MUNSNNWJAPHDQM-SFHVURJKSA-N 400.479 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(OC)nc4)n3)CC2)cc1 771082599 MIJZWENSZSYEGN-UHFFFAOYSA-N 409.446 2.040 10 20 HECD COc1cccc(OC)c1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 772348099 BDCXEWQPKRDVMX-UHFFFAOYSA-N 406.504 2.361 10 20 HECD COCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772930148 SUCYDLPKJOAFRU-UHFFFAOYSA-N 401.438 2.064 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H]1CC1(Cl)Cl)c1ccc(N2CCOCC2)cc1 775156752 AFFHTDOMBVHFOP-GXTWGEPZSA-N 400.306 2.010 10 20 HECD Cc1nc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)n[nH]1 776116614 ASRNDBYQUDYJET-MRXNPFEDSA-N 416.501 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3cscn3)CC2)cc1 778243863 FINOXDQCYNGCDH-BQYQJAHWSA-N 400.504 2.015 10 20 HECD CN1CC[C@H]2[C@H](CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 779331448 FYTXVRCLJJWXBT-XLIONFOSSA-N 404.530 2.413 10 20 HECD NC(=O)C1CCN(CCc2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)cc2)CC1 779512958 ZGOPRYRHFBOTKV-XBXARRHUSA-N 409.486 2.490 10 20 HECD COc1ccc(N2CCN(CN3C[C@@H](NC(=O)OC(C)(C)C)CC3=O)CC2)cc1F 782932250 ICQGAITWFFVHLH-HNNXBMFYSA-N 422.501 2.039 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCCN3C3CCCC3)CC2)cc1 786884435 PPXGVSAUGGJPGQ-OAQYLSRUSA-N 415.534 2.294 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccsc1 789842611 FDRFYXWEWCZVBN-CYBMUJFWSA-N 405.495 2.342 10 20 HECD COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 790302959 OCKBZVDKJKQFFG-IRXDYDNUSA-N 418.471 2.283 10 20 HECD CN1CCCc2cc(CNC(=O)Cc3ccc(S(=O)(=O)N(C)C)cc3)ccc21 793285282 SFJHQSUTRJSUAM-UHFFFAOYSA-N 401.532 2.178 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)c3cn(CC(=O)N(C)C)nn3)cc2Cl)C1 800048782 CBTTXBXIZLMFAM-AWEZNQCLSA-N 418.929 2.186 10 20 HECD CN(C)C(=O)CN1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 805138888 JBCYWXGYBCSXRW-UHFFFAOYSA-N 403.310 2.051 10 20 HECD CCN(CC)C(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807672699 GIMSQRXWYFGILE-INIZCTEOSA-N 402.539 2.037 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3C[C@@H](OC(C)C)C3(C)C)CC2)cc1 809438420 RIELFRAYBXBHOF-VQTJNVASSA-N 417.550 2.442 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2ccc3c(c2)CCCN3C)c1 810266447 MNTRRXTZHAIMCP-UHFFFAOYSA-N 401.532 2.281 10 20 HECD C[C@@H]1CN(C(C)(C)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H](C)O1 918199580 IJTONFNBIRCPQK-IAGOWNOFSA-N 422.545 2.349 10 20 HECD O=C(Nc1ccc(-n2nccn2)nc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 918294633 ILXIOEBICHPGFC-UHFFFAOYSA-N 418.413 2.128 10 20 HECD C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 919812054 AXAIFWBEQIYGAM-GFCCVEGCSA-N 406.460 2.244 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl 1254761587 QAIUKXRJWYFJBP-HNNXBMFYSA-N 422.821 2.493 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(OC)c(OC)c1 1261909219 MWIFWXFUYGLUOY-JCVNQNCUSA-N 415.442 2.419 10 20 HECD CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc1 1319715558 UBGUKGOZXOZCGS-CQSZACIVSA-N 402.520 2.395 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(F)cc2nc(S)[nH]c12 1320399549 QUORKHSZHUYTLE-ZDUSSCGKSA-N 419.434 2.306 10 20 HECD CCOc1ccc(N2CCN(C[C@@H](O)Cn3c(-c4ccccc4)noc3=O)CC2)cc1 1341377353 RMZPNVPGCYEMAB-HXUWFJFHSA-N 424.501 2.085 10 20 HECD C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CC1(F)F 1816729198 XYIBANWFWRTLGH-XLFHBGCDSA-N 424.429 2.220 10 20 HECD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)c[nH]1 1817754178 VRSJZIWRILRFKF-LBPRGKRZSA-N 413.459 2.125 10 20 HECD Cc1nc(N)sc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842968312 RWMPQLVVASSLMI-UHFFFAOYSA-N 422.894 2.229 10 20 HECD O=C(c1ncc(Cl)cc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248658 AZFCSBOJZAXRQA-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1 238079612 DYGLEFPTYBMGSB-UHFFFAOYSA-N 405.476 2.384 10 20 HECD CCc1nc(C[S@@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cs1 729871311 GTQQUFUMXBDXRI-HHHXNRCGSA-N 407.561 2.312 10 20 HECD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733972356 DVHPVYSACWKOHD-SFHVURJKSA-N 404.517 2.209 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(F)cccc3NC(C)=O)nc12 734195422 RZTJDLSFXOJBJE-UHFFFAOYSA-N 416.365 2.066 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c1O 737285124 ZPHJXCZCFPEDAU-GJZGRUSLSA-N 413.474 2.269 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](COCCOC)C3)cc2F)CC1 745810019 WWPSVBPWXMQPJX-IBGZPJMESA-N 422.545 2.162 10 20 HECD CC(C)OCCN1CCC(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 747579945 PSFPJYMTILLYSJ-UHFFFAOYSA-N 422.545 2.351 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3ccc(OC)c(O)c3)nc12 748881417 NBXUNDQGBQRPQX-UHFFFAOYSA-N 415.402 2.002 10 20 HECD CS(=O)(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 749563896 MUKMLJZGWQGFKD-UHFFFAOYSA-N 417.531 2.067 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)oc1C 751241090 VJGRQYBXHNRFJG-UHFFFAOYSA-N 422.503 2.062 10 20 HECD CC(C)n1cc([C@@H](C)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 754804902 FHAFAEZXLOGQND-MRXNPFEDSA-N 403.502 2.407 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cn3c(C)nc4ccccc43)CC2)cc1 754822884 DDUMVFKXWMWNMS-UHFFFAOYSA-N 422.485 2.245 10 20 HECD CS(=O)(=O)c1cccc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 756335872 KMXLVXIJIASVLS-SFHVURJKSA-N 418.515 2.415 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@@H]3CC(=O)c3ccccc3)nc12 757637508 DUCKVQKHLCQUJX-KRWDZBQOSA-N 424.457 2.085 10 20 HECD COc1cc(N2CCN(S(=O)(=O)CCc3ccccc3)CC2)cc(OC)c1OC 759099972 WRWQFQCVNAMILY-UHFFFAOYSA-N 420.531 2.407 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)nc12 763400786 GNDBJTUXCSWUQQ-NSHDSACASA-N 414.374 2.367 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 765777987 NZBSNINTZXLZMS-IAOVAPTHSA-N 410.465 2.471 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC(CO)(OC)CC2)c([N+](=O)[O-])c1Br 770192386 QJWOPJOJVIARDF-UHFFFAOYSA-N 420.216 2.252 10 20 HECD NC(=O)c1cc(OC2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)ccn1 772002170 GFFOMCZXQMQYTH-UHFFFAOYSA-N 421.501 2.310 10 20 HECD CC(=O)CCCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 772365421 LQTVFSAMNRDOMM-UHFFFAOYSA-N 420.487 2.227 10 20 HECD CCC(=O)[C@@H]1CCCCN1C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 773538903 QYFMOEOMLOVTEL-SGWGQVFISA-N 413.518 2.260 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)ccc21 775044130 PGXAHHIJAYZTND-OAQYLSRUSA-N 406.530 2.076 10 20 HECD Cc1cc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)ccc1S(N)(=O)=O 775227266 YXPKJMGZHRPLFW-UHFFFAOYSA-N 400.504 2.018 10 20 HECD COc1ccc(N2CCN(CCCN[C@H]3CCCC[C@@H]3S(C)(=O)=O)CC2)cc1 775365056 OLFXTXAEPYNGSX-SFTDATJTSA-N 409.596 2.153 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCSCc2ccnc(Cl)c2)c1 777450086 BAUNGQOGQKEOEE-UHFFFAOYSA-N 415.924 2.475 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CC(=O)NCC(F)(F)F)cc2F)C[C@@H](C)O1 779658350 WLNMFGCFOLVUBJ-VXGBXAGGSA-N 405.392 2.124 10 20 HECD O=C(COC(=O)c1cccc(O)n1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787545138 ONAJQLFTWKQZLX-UHFFFAOYSA-N 402.362 2.358 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)cc1 788977742 MHPULZCIHBZJIS-IUKKYPGJSA-N 417.550 2.334 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)ccc1C(N)=O 789435591 UXVYKBXAXPGEOD-UHFFFAOYSA-N 424.501 2.210 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@]3(CO)CC(C)C)CC2)cc1 789512699 BDFWFASRFXZUHY-FYYLOGMGSA-N 405.583 2.051 10 20 HECD O=[N+]([O-])c1cc(NS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)ccc1O 794597491 XYFSXISTYKIYSG-UHFFFAOYSA-N 408.360 2.098 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H](C)CC[C@@H]3C)cc2F)CC1 805007938 VNEZMCLHGBGJFW-IRXDYDNUSA-N 404.530 2.231 10 20 HECD O=C(N[C@H]1CCCOCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807562632 RAWMDOXLGTWWQB-LSDHHAIUSA-N 411.449 2.058 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 914830903 HGOYPWOKKCGOGR-UHFFFAOYSA-N 421.519 2.029 10 20 HECD CCN(CC)C(=O)CCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918210402 USHTXCFABJZUDT-UHFFFAOYSA-N 404.555 2.343 10 20 HECD O=C(O)c1ccc(Cl)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 919730627 JZJDQXBCPQDNCB-UHFFFAOYSA-N 410.879 2.353 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)CC2)cc1 1253441692 GLONBKORIMADNC-UHFFFAOYSA-N 417.531 2.312 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1CCCC1 1795026876 ITZNZONWMAWWIY-XOIINTDNSA-N 408.882 2.145 10 20 HECD COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1F 1796603785 WXVVVJOQBCOKEJ-BTTYYORXSA-N 415.421 2.206 10 20 HECD C[C@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1801780208 FTSCKERLERSCIP-LLLHUVSDSA-N 411.458 2.212 10 20 HECD O=C(c1ccnc(Cl)n1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501556 BKPKDVOMNGEZRW-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1nccn1[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502299 JKFWESVSCGQFFG-GFCCVEGCSA-N 418.881 2.334 10 20 HECD C[C@H]1NC(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)=NN(c2ccccc2)C1=O 109189894 FPWNULWKXAZSDN-IAGOWNOFSA-N 421.501 2.039 10 20 HECD CN(C)CCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729286023 ALQOAUCEYIBMBT-UHFFFAOYSA-N 414.529 2.290 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O 734470562 CXANUOKALNPSQW-UHFFFAOYSA-N 404.470 2.315 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n(C)n1 737111223 UGIRUZKDRAZAHC-GOSISDBHSA-N 414.506 2.471 10 20 HECD C[C@H](NC(=O)C(=O)Nc1nc(C(C)(C)C)ns1)c1ccc(N2CCOCC2)cc1 737156580 ANEFZSJSFGBBFV-ZDUSSCGKSA-N 417.535 2.488 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1O 737286194 SHAIEECKJPNWCG-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 745863112 RAIMKVRNNJGDRU-TZIWHRDSSA-N 418.582 2.356 10 20 HECD CN(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCS(=O)(=O)C1 745905821 NVPXZNZTZCBCKZ-HIFRSBDPSA-N 417.478 2.085 10 20 HECD CCN(CC)S(=O)(=O)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 746201146 UBSIOFYYKHFCCH-UHFFFAOYSA-N 419.494 2.045 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)o1 748640814 UHNTUITXYJDHBN-UHFFFAOYSA-N 402.450 2.019 10 20 HECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 749633153 NOWCHZRVCBRERB-UHFFFAOYSA-N 405.476 2.141 10 20 HECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCCCSc2nccs2)c1 749730941 HBFFCLGKQUBZMR-UHFFFAOYSA-N 406.533 2.438 10 20 HECD COc1nc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)ncc1Br 751137571 DFTDWKOPROUPGO-UHFFFAOYSA-N 423.267 2.004 10 20 HECD CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc(N3CCOCC3)cc2)C1 762557966 HYQPIUVTVIYUBL-UHFFFAOYSA-N 404.511 2.189 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)cc1 763819371 SBLUWPCVPJAKSN-UHFFFAOYSA-N 412.490 2.299 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cn(C)nc3C(C)(C)C)CC2)cc1 768954430 AGAJFRBNEIYUGF-UHFFFAOYSA-N 414.506 2.232 10 20 HECD Cc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769023776 LIVNZRDPMGEOFZ-UHFFFAOYSA-N 407.518 2.177 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCc3cnccn3)cc2F)C[C@@H](C)O1 771464771 QBSJUZLPINLVFR-CALCHBBNSA-N 415.513 2.020 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(OC(F)F)cn3)cc2)C1 772320584 TVFFQHUUGBJPFH-CQSZACIVSA-N 404.417 2.315 10 20 HECD Cc1c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nnn1-c1ccc2c(c1)OCCO2 773759933 APSRUZHLCRJMJB-LBPRGKRZSA-N 410.430 2.119 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H]3CCCC[C@H]3S(C)(=O)=O)CC2)cc1 775365053 OLFXTXAEPYNGSX-NHCUHLMSSA-N 409.596 2.153 10 20 HECD COc1c(S(=O)(=O)NC(=O)c2sccc2-n2c(C)ccc2C)c(C)nn1C 778834705 ABSMCFMGIHORHF-UHFFFAOYSA-N 408.505 2.325 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cn3cc(Cl)ccc3n2)cc1F 786500408 APYNMGIHGGNSEA-UHFFFAOYSA-N 403.845 2.125 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)O[C@H](C)C2 786627916 SXORVIMFBONVPQ-MRXNPFEDSA-N 421.497 2.327 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12 788933334 UPHDIEDTACWNTO-KURKYZTESA-N 405.589 2.399 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN2CCCC[C@@H]12 790277578 KEYCMEIJDPCDOR-CVEARBPZSA-N 424.339 2.246 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(N4CCC4=O)c3)CC2)cc1 790580450 RADXHTYPADVMDQ-UHFFFAOYSA-N 423.517 2.376 10 20 HECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N(C)C)cc1 793720346 ODWPLXVCZOOFJF-JOCHJYFZSA-N 406.530 2.407 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(Cc4cccc(F)c4)CC3)ccc21 803687347 KWRHINFOSLZYSP-UHFFFAOYSA-N 424.520 2.169 10 20 HECD CC[C@H](C)N(C)CCNC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 804221225 KAEFGIIBSDDYCT-ZDUSSCGKSA-N 414.344 2.350 10 20 HECD COc1ccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 806735508 KQCDZMBYRDPAQF-UHFFFAOYSA-N 411.502 2.115 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCc2c(ncn2-c2ccccc2)C1 807099587 ABUKGTOGQBEICM-UHFFFAOYSA-N 417.513 2.448 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cccc(C(=O)N(C)C)c1 807593416 LAADKZNZCKHMHN-UHFFFAOYSA-N 424.545 2.162 10 20 HECD CC[C@@H]1COCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768468 KKZUUJLOHYAQBB-HUUCEWRRSA-N 411.449 2.010 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 810172782 PRXNKFBYFYPIHK-UHFFFAOYSA-N 416.499 2.028 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn2ccnc12 815363574 YESLXMZCKUQYHJ-GOSISDBHSA-N 408.458 2.495 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)cc1 916197221 XONIQEFWTNVPSO-TZIWHRDSSA-N 415.582 2.133 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(N2CCNC2=O)cc1 919968808 KZWGZAUOHUEILI-UHFFFAOYSA-N 408.502 2.355 10 20 HECD Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)n1 1794173027 XOENLCJPTCEGPM-BCDXTJNWSA-N 410.474 2.081 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccn2c1)c1cc(O)nc(O)c1 1796576043 NSKCZGPGQOLULQ-QDMKHBRRSA-N 412.471 2.373 10 20 HECD Cc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)on1 1845500830 SWFXNGNIMTYOJH-UHFFFAOYSA-N 405.838 2.107 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)cc1 7095597 FJNNRIFPOYPBCB-XMMPIXPASA-N 420.513 2.325 10 20 HECD C[C@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 109181219 LPJPVMWHKWDBSZ-KRWDZBQOSA-N 417.531 2.021 10 20 HECD O=C(c1ccccc1SCc1cn2ccccc2n1)N1CCS(=O)(=O)CC1 111094550 ICBRMOSTTYCCIS-UHFFFAOYSA-N 401.513 2.497 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(c2cccc(O)c2)CC1 195564512 HBWLOAAGVYACDS-UHFFFAOYSA-N 414.481 2.400 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2cccc(OCC(=O)N(C)C)c2)c1 728945967 RTGNMJQWCMQCTR-CQSZACIVSA-N 401.463 2.428 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1 729065350 DGXVIVNHVQABGF-CQSZACIVSA-N 411.458 2.453 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1F 730540355 XUFCZEDWJTVGCQ-INIZCTEOSA-N 413.449 2.332 10 20 HECD CCOc1ccc(C(=O)NCC(=O)NCc2cc(OC)ccc2O)cc1OCC 734016457 STAHZRQOAUKENH-UHFFFAOYSA-N 402.447 2.244 10 20 HECD C[C@H]1[C@@H](C)N(C(=O)c2ccccc2SCC(=O)N2CCCC2)CCS1(=O)=O 736269775 GSGNDKZTZRBSPO-CABCVRRESA-N 410.561 2.049 10 20 HECD CCCS(=O)(=O)N1CCC(NC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740907745 OXOHXCQJRZCEQG-UHFFFAOYSA-N 406.552 2.066 10 20 HECD COc1ccc(COCC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742919443 IPLUMPJCOQIHHI-UHFFFAOYSA-N 413.518 2.159 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 745592477 IAYIWAMYBLJJRX-IBGZPJMESA-N 419.639 2.313 10 20 HECD O=C1C[C@H](Cc2ccc(NC(=O)NCc3ccc(N4CCOCC4)cc3)cc2)C(=O)N1 747554921 VTCUXOWLDSVUBO-SFHVURJKSA-N 422.485 2.050 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(-n3cnnn3)ccc2Cl)c(OC)c1 752124114 JBJAVXPHELUZHZ-UHFFFAOYSA-N 402.842 2.408 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(-n2cccc2)nc1 753294444 HWSCGBAAHQGAED-UHFFFAOYSA-N 410.499 2.037 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3nc(C)c(C)s3)CC2)cc1 755735881 CCRUNFOHOFKORK-UHFFFAOYSA-N 423.560 2.032 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCCc1cnn(-c2ccccc2)c1 759596151 NNWVGMGWZUQOPN-VQHVLOKHSA-N 407.426 2.199 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2cnc(C3CCC3)s2)SC1=S 760215518 JVUWCYQILSLCCQ-XFFZJAGNSA-N 403.576 2.161 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c(C)nn(CC(F)F)c3C)CC2)cc1 760633522 ZPJSEAQISILNJJ-UHFFFAOYSA-N 421.492 2.326 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1 762267761 QKWSAFGEOKULGP-OAHLLOKOSA-N 418.877 2.337 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCC(=O)[C@H]1CCOC1)c2[N+](=O)[O-] 762833699 YZNRZGISBZCKHN-NSHDSACASA-N 409.350 2.133 10 20 HECD O=C1CSc2ncc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2N1 765495664 RIRAPOOFRYORDS-UHFFFAOYSA-N 416.478 2.156 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@H]2C1 766268648 FJVRDLNYMFRCRR-HOCLYGCPSA-N 417.465 2.096 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3cc(Cl)cc(F)c3O)CC2)cs1 775678010 VLEZJDXRDVMIEE-UHFFFAOYSA-N 405.904 2.456 10 20 HECD CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(O)c3O)CC2)cc1 776318187 QJGSQVQALNRVAQ-UHFFFAOYSA-N 404.488 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@H](c4ncc[nH]4)C3)CC2)cc1 778258040 XGFDQWCBBIQUQW-GIFJBRJJSA-N 423.517 2.029 10 20 HECD Cc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1F 781689583 DDDKMWHRGLQEJZ-INIZCTEOSA-N 405.495 2.314 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](Oc4cccc(F)c4)C3)nc12 784483693 KLBXAJFMLURSOM-INIZCTEOSA-N 400.410 2.404 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 785424643 RXSIILKNKHSZIQ-YJBOKZPZSA-N 418.538 2.131 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)Cc3ccccc3Cl)cc2)CC1 787321411 FFSARMLOSKHULG-NRFANRHFSA-N 415.921 2.228 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCc2cn3c(n2)CCCC3)cc1 788844109 VOVVWAFMBQRXNX-UHFFFAOYSA-N 411.550 2.383 10 20 HECD COc1ccc(COCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788910919 HHJMJKDELNFXMZ-UHFFFAOYSA-N 411.502 2.245 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3)ccc21 789667025 DARQMNDBKZNZQX-JOCHJYFZSA-N 420.557 2.466 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCC(F)(F)CC3)cc2F)C[C@@H](C)O1 789818380 JOQQHEYFSJCDGJ-ZIAGYGMSSA-N 413.440 2.313 10 20 HECD C[C@@H](O)C[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855661 VOWVWXHKIXDYGY-APWZRJJASA-N 405.564 2.008 10 20 HECD Cc1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789864786 RLWNHKWTVUADDR-UHFFFAOYSA-N 404.561 2.246 10 20 HECD C[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1nnnn1C1CC1 792471005 XXRXHBNGKAGWJV-LBPRGKRZSA-N 416.441 2.073 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CCC(=O)c3cnn(C)c3)cc2F)C[C@@H](C)O1 793119432 XZXQFVYNGAFTCU-HUUCEWRRSA-N 402.470 2.452 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CC1 798254657 NMDJDZIGKSIIND-UHFFFAOYSA-N 418.563 2.369 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCCC(=O)N3)c2C)cc1 800245072 WMDWWUJTIGAHHV-GOSISDBHSA-N 412.442 2.275 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)cc2Cl)C1 800719785 NOTQJFALPGAVQU-GUYCJALGSA-N 419.913 2.022 10 20 HECD Cc1csc([C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 803304064 COKCJRDWPMJXEK-HOCLYGCPSA-N 416.547 2.385 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCCN2C2CC2)cc1F 804854719 JASFSQDAXYYPEL-SFHVURJKSA-N 404.530 2.421 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCC[C@@H]3CCCCO3)CC2)cc1 807994872 VNLSFYYOVZCORF-FQEVSTJZSA-N 403.523 2.199 10 20 HECD COC(=O)CN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(C)C 915865690 NPBKVPVAHOLVOF-UHFFFAOYSA-N 410.382 2.394 10 20 HECD CC(C)(C)OC(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224735 VQBBBILABKCBLI-UHFFFAOYSA-N 422.501 2.425 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cncs1 1816582574 OBLCSIVVMZYWRY-GFCCVEGCSA-N 414.447 2.292 10 20 HECD O=C(CC(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722854 ZPKCMLFLKYLULN-MRVPVSSYSA-N 416.381 2.128 10 20 HECD O=C(Cc1ccc(F)cn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501303 YWPZLDJNDSTUOE-UHFFFAOYSA-N 419.840 2.345 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1F 303378513 VEXRHJSDNBXAPG-IBGZPJMESA-N 406.502 2.205 10 20 HECD COc1cccc(CNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1O 727761270 RQMPHDATGZXFSW-LRTDBIEQSA-N 403.479 2.154 10 20 HECD COCCOCc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 729062772 DRFXPQBFVHWXSH-AWEZNQCLSA-N 402.447 2.380 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCN(C)C3CCCC3)CC2)cc1 729507260 YIZOMNIVNHRPQD-UHFFFAOYSA-N 417.598 2.381 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3ccccc3OC)CC2)cc1 729876420 YCVLUFVCBRHVNH-MUUNZHRXSA-N 402.516 2.301 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1 734016193 FZGQXVRYWQTLAY-HNNXBMFYSA-N 410.517 2.240 10 20 HECD CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 734215147 DDRUZIURWQQYER-IAGOWNOFSA-N 420.529 2.233 10 20 HECD O=C1CCC(=O)N(c2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)N1 735518316 INKOFSIEXPRUME-IBGZPJMESA-N 423.469 2.372 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](C3OCCO3)C2)c1 738148934 RMACPBAGHDPENK-KRWDZBQOSA-N 404.507 2.012 10 20 HECD C[C@H](OC(=O)c1ccnn1C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 743223925 LGXNXCXHSCINNG-LBPRGKRZSA-N 403.394 2.380 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CC2 745799852 LISDZZKRVLQDAQ-GJZGRUSLSA-N 420.464 2.471 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2nnc3c(=O)[nH]c4ccccc4n23)cc1 748851394 YAIAVIRAEXIEAJ-UHFFFAOYSA-N 408.487 2.045 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C3(S(C)(=O)=O)CCCC3)cc2F)C[C@@H](C)O1 749794473 NRNYBAMJAZKDFN-GASCZTMLSA-N 412.527 2.413 10 20 HECD CC(C)(C)N1C[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1=O 750639769 XOUTVQVKCBQBTF-SFHVURJKSA-N 402.539 2.094 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H](CO)C[C@@H](O)c3ccccc3)CC2)cc1 754642548 NVLNXBYZONOLPO-SIKLNZKXSA-N 413.518 2.448 10 20 HECD CC(=O)N1CC[C@H](CN(C)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 754843631 ZZPLEYMROOMFBF-GPMSIDNRSA-N 420.529 2.449 10 20 HECD NC(=O)NC1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 757197273 JAVWTHDWIUTQAK-UHFFFAOYSA-N 411.453 2.099 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 758222650 GQGQCMNLGJZYGW-GOSISDBHSA-N 417.462 2.174 10 20 HECD CCc1noc2ncc(S(=O)(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc12 762519671 GIXYIYQVRWEAHZ-UHFFFAOYSA-N 416.503 2.443 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2nnc(O)n2c1 763061325 ITZLHFSSQLQNBM-OAHLLOKOSA-N 401.854 2.188 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1cccc(Br)c1O)N1CCOCC1 764759615 APJRNEOMGSDIHT-OAHLLOKOSA-N 400.317 2.311 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(C)(=O)=O)ccc1F 771826939 PNKIJSIRGAIEET-UHFFFAOYSA-N 406.479 2.338 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc(N(C)C)cc1 773858150 OZPIPTXQFKRJQE-INIZCTEOSA-N 406.490 2.403 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 775148564 SGTUGXGIOCSXFH-UHFFFAOYSA-N 412.538 2.169 10 20 HECD CN(C(=O)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1)C1CCCCC1 779510926 CTDCLZQPOPIETO-CSKARUKUSA-N 401.507 2.046 10 20 HECD CSc1nnc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)s1 782654287 RRGQINLCGSBSLX-UHFFFAOYSA-N 407.565 2.468 10 20 HECD COC(=O)[C@@H](C)[C@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 802166670 HNQFMEMWNKSHCK-ZFWWWQNUSA-N 422.503 2.360 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)CCc1cccn1C)c1ccc(N2CCOCC2)cc1 803303570 PTZSSPGLEYNARF-MSOLQXFVSA-N 412.534 2.176 10 20 HECD CC[C@H]1C[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007083 MQTMMEHCZWZCEL-WMZOPIPTSA-N 404.530 2.231 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOc4cc(O)ccc4C3)cc2)C1 806496162 QDBAPDSPOGNYKT-SFHVURJKSA-N 424.501 2.198 10 20 HECD C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 807954033 GSJUUQDIBWVJCI-VXKZXEGRSA-N 413.971 2.076 10 20 HECD O=C(COC(=O)CCc1ncccn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 812606404 OQQKJKYYWYJVJC-UHFFFAOYSA-N 415.405 2.367 10 20 HECD CCNC(=O)[C@@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 814363040 GCJACEWEDYGXPN-DOXZYTNZSA-N 408.518 2.399 10 20 HECD Cc1nc(S(=O)(=O)N2CCN(Cc3cc(Cl)c(F)cc3O)CC2)cs1 816504438 NCGODBRYWYWEMT-UHFFFAOYSA-N 405.904 2.456 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](C)[S@@](=O)CC3)cc2F)C[C@@H](C)O1 821568969 RNQYUBVSJJLABH-QFCBSXDYSA-N 411.543 2.492 10 20 HECD CCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284479 HRRSSSYLLCMIJZ-UHFFFAOYSA-N 401.438 2.316 10 20 HECD Cc1nn(C(C)(C)C)c(C)c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338156 VVTKPEXCASJCAL-UHFFFAOYSA-N 418.563 2.420 10 20 HECD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N2CCOCC2)cc1 919863626 OHUSUEHJUJWCPP-NRFANRHFSA-N 424.480 2.057 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1 1324192704 PSPQMYAGKMLSNF-WOJBJXKFSA-N 420.575 2.475 10 20 HECD Cc1noc(N)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715738 ZGUZHCZKDNFNHO-ZSBIGDGJSA-N 420.853 2.195 10 20 HECD CC1(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1807992204 MAXNAGNLFOZPPR-DNVCBOLYSA-N 410.474 2.398 10 20 HECD Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)n1 1810543088 SRSDQKLONVMIFQ-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cccc(F)n2)C1 1844447075 VREVEFWALCXNQZ-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCC(=O)N1CCCC1)c2[N+](=O)[O-] 5787426 NEDHPUYAOOQVIK-UHFFFAOYSA-N 408.366 2.149 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(C(=O)NC4CC4)cc3)ccc21 60763565 UIALNUHBAZSPLQ-UHFFFAOYSA-N 406.486 2.216 10 20 HECD C[C@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 302963359 QPYHDNNIESDVSA-HNNXBMFYSA-N 401.532 2.392 10 20 HECD COCCNC(=O)c1cccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 501442746 UMEKOAJWVBFKHI-UHFFFAOYSA-N 422.485 2.118 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc(O)cc3)cc2F)C[C@H](C)O1 727484158 YCWVFJWDEHBPDD-GJZGRUSLSA-N 415.465 2.191 10 20 HECD COC(=O)NC(C)(C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 729736559 FUVYLWCNJCWSRR-UHFFFAOYSA-N 424.409 2.078 10 20 HECD COc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1OCCO 740176796 FYOXKVXEAZZILU-UHFFFAOYSA-N 413.474 2.020 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 740910446 QFEZZHMCTCEZDZ-KVSKMBFKSA-N 409.552 2.239 10 20 HECD CCCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 746363785 IQBLWQNFHIRURA-UHFFFAOYSA-N 401.536 2.491 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H](O)COCC3CC3)cc2F)C[C@@H](C)O1 749009294 KFTYTZKGXMYQHM-RKVPGOIHSA-N 409.502 2.026 10 20 HECD Cc1ccc(C(=O)NCCC(=O)N2CCN(c3ccc(F)cc3)CC2)c(O)c1O 751533430 NXAWRDCRNSSPGW-UHFFFAOYSA-N 401.438 2.014 10 20 HECD COC(=O)C[C@H]1C(=O)NCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 756186859 KVJGCZBARHTWFJ-SFHVURJKSA-N 417.893 2.180 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1 756455482 JTRBEGVBZPTUAD-XJKSGUPXSA-N 414.458 2.154 10 20 HECD C[C@@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)c(F)cc1O 756583481 ODNXFBHVWIUZAR-ZIAGYGMSSA-N 416.335 2.351 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@@H](Cc4ccccc4)N(C)C3=O)CC2)cc1 761186769 UJHUZOJDTSZVOE-JOCHJYFZSA-N 422.529 2.323 10 20 HECD CCOC(=O)C[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 761604023 WQTXAXNKZFCCGE-LLVKDONJSA-N 412.489 2.326 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3c(F)cccc3[N+](=O)[O-])CC2)cc1 767366363 FEEXXJREVDJPSP-INIZCTEOSA-N 405.426 2.304 10 20 HECD COc1cccc(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c1O 769506940 CVSCNKOICJVFEZ-UHFFFAOYSA-N 421.471 2.042 10 20 HECD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1Cc1ccccc1 770157032 MGWFJSWTOGJLNV-JKSUJKDBSA-N 417.531 2.499 10 20 HECD CN(C)S(=O)(=O)c1cccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 771804504 XCPBXQMQWZTWDD-UHFFFAOYSA-N 423.878 2.265 10 20 HECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 773020647 PWUWWGAOLPDYJR-WNSKOXEYSA-N 424.501 2.406 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773087284 JCENVEFXTSFYNP-ZDUSSCGKSA-N 420.487 2.365 10 20 HECD CC(C)[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 778241332 JTCGEEZJVMUPKA-FVJLSDCUSA-N 407.530 2.412 10 20 HECD NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779493261 LUAOCFNZICSAEV-PKKDWCJXSA-N 415.877 2.135 10 20 HECD CCC[C@@H]1C[C@@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 780156999 AVEBAIZTOOGYET-FXAWDEMLSA-N 404.507 2.482 10 20 HECD C[C@H](C[S@@](C)=O)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 784212584 HPWQKRWFUXHCAX-KHXSAUHESA-N 407.458 2.108 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CCCCCCC3)CC2)cc1 785527036 IYQPBINGHUTSIQ-UHFFFAOYSA-N 416.566 2.116 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ncn1 786115482 CNBWVQVGNJFCRW-HUUCEWRRSA-N 416.453 2.011 10 20 HECD COC(=O)[C@H]1C[C@@H](O)CN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 788604796 VVDSODHDXNIOME-CRAIPNDOSA-N 422.428 2.486 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788909978 JLMSVDABLVXTIY-INIZCTEOSA-N 418.538 2.275 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(SC)CCC3)CC2)cc1 790076214 DKRNIFLRZVYZSK-HJWRWDBZSA-N 403.548 2.302 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1C(N)=O 796865119 YHEXMUFVZRFFPZ-UHFFFAOYSA-N 422.485 2.204 10 20 HECD O=C1CC[C@H](OC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C(=O)N1 798590818 UWBQMELNNDEYOH-AWPPVZKDSA-N 424.525 2.078 10 20 HECD COc1cncc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)c1 799183545 SFUGKRFNJXIHRB-UHFFFAOYSA-N 408.461 2.244 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)C2CC2)cc1 799252608 CTIVVJMNNROSDW-UHFFFAOYSA-N 422.485 2.238 10 20 HECD CO[C@@H](C)CS(=O)(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2 800831006 OUMUXTMTUKGZDV-STQMWFEESA-N 416.565 2.312 10 20 HECD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665175 YDAYJFZWRGAOBG-HNNXBMFYSA-N 424.480 2.308 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1nnc2ccccn12)C(C)C 804101514 PQGLXLAGPZQRDQ-IBGZPJMESA-N 408.506 2.233 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1F 804854186 ZAYUQIRQXYNVQV-SJORKVTESA-N 420.529 2.051 10 20 HECD C[C@H](NC(=O)N1C[C@@H](N2CCOCC2)C[C@@H]1C)c1ccc(N2CCOCC2)cc1 804988331 ATZJNSDAUQVGJF-WFXMLNOXSA-N 402.539 2.089 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 806420772 GRPBUMRKQDFZLE-HXUWFJFHSA-N 408.502 2.023 10 20 HECD Cc1noc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 806493931 ITJCRXXUHLCHIQ-SJLPKXTDSA-N 412.494 2.126 10 20 HECD C[C@H]1COCCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768345 HKZCSHYKOQBGEX-GJZGRUSLSA-N 411.449 2.010 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC4(C3)OCCO4)cc2Cl)C1 807954133 JWHLQVOTUSGCMD-HNNXBMFYSA-N 421.925 2.168 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 808366852 BNFNGNHMXNNRJK-CQSZACIVSA-N 419.494 2.379 10 20 HECD CS[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 808758617 CRCPKCAJIJPRQR-SFHVURJKSA-N 407.580 2.376 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCOCC(F)(F)C1 811543730 AGJNMRARMJRFBJ-UHFFFAOYSA-N 418.443 2.362 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H](C)c3ccc(-n4cncn4)cc3)nc12 917055413 KMHHVUZBLPDXCA-CQSZACIVSA-N 421.461 2.385 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2c(C)nn(C)c2n1 917834563 KIYXEUINCOSHTD-QGZVFWFLSA-N 420.517 2.217 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c(c3)OCO4)cc2)C1 918006592 HZVBHXLOGOEGLD-SFHVURJKSA-N 424.501 2.159 10 20 HECD Cc1ccccc1NCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644751 IYGCRPZCCPNFMO-UHFFFAOYSA-N 401.532 2.348 10 20 HECD O=C([C@@H]1C[C@@]1(F)Cl)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502416 VCJXURMFRTWJBP-BTDLBPIBSA-N 403.237 2.493 10 20 HECD Cc1cnc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 11481068 NUIZHFZJAQNWNC-UHFFFAOYSA-N 401.378 2.356 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3ccccc3F)CC2)cc1 12069051 ZQDLSQRATGKYHM-UHFFFAOYSA-N 421.538 2.466 10 20 HECD C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 55341938 MWRMKWDZQMKRRV-YOEHRIQHSA-N 403.504 2.329 10 20 HECD CCN(CC)C(=O)N1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 139995995 TUDDMASFRDLYPH-GOSISDBHSA-N 417.554 2.373 10 20 HECD COC[C@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 140897613 MMMCDJRUJHPETG-MRXNPFEDSA-N 416.501 2.024 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc21 484982891 HHOWCJCEZKADQJ-UHFFFAOYSA-N 414.550 2.187 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C2CC2)cc1 728402741 CBYARNJDWNCBBM-UHFFFAOYSA-N 408.458 2.327 10 20 HECD CS(=O)(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)c1 730211285 OMFMKJMFGCBRGG-UHFFFAOYSA-N 419.572 2.470 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3ccc(N(C)C)cc3C)ccc21 735636984 SGRFORPJPMHHAC-UHFFFAOYSA-N 408.502 2.016 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccnn1Cc1ccccn1 746363370 WCYUOWJODXTKGJ-UHFFFAOYSA-N 406.490 2.380 10 20 HECD COc1ccc(N2CCCN(C(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 748032244 DXRUTPMTVUWKKY-QHCPKHFHSA-N 422.485 2.102 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(O[C@H]2CCOC2)CC1 748618677 PEAXDJNDBGMCNM-SFHVURJKSA-N 407.486 2.142 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1 751146501 UOLYEZXZIMGMQZ-UHFFFAOYSA-N 421.500 2.481 10 20 HECD COc1ccc(N2CCN(C(=O)NCCS(=O)(=O)c3ccccc3)CC2)cc1F 753885724 UBCIYSXAHOWDSI-UHFFFAOYSA-N 421.494 2.140 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccc(O)c(OC)c3)CC2)cc1 754027073 AYMNKPBSOXSNOV-HXUWFJFHSA-N 415.534 2.024 10 20 HECD COCCNC(=O)[C@H](CC(C)C)NC(=O)NC1CCN(c2ccc(OC)cc2)CC1 756691278 CFSOXQVTVQOZIU-FQEVSTJZSA-N 420.554 2.141 10 20 HECD CCOc1ccc(C(=O)NCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1OCC 763284886 XNATVICTZSKOAK-CQSZACIVSA-N 416.474 2.372 10 20 HECD C[C@H](NCCNS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765408216 JTNZMCOTCKCLNQ-INIZCTEOSA-N 407.511 2.291 10 20 HECD C[C@@H](NC(=O)NCCc1cn2c(n1)SCC2)c1ccc(N2CCOCC2)cc1 767312324 LFORTFWEMOKLMD-OAHLLOKOSA-N 401.536 2.428 10 20 HECD COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 771234383 JXQPZNPFHWIWAE-HSZRJFAPSA-N 424.501 2.153 10 20 HECD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773749986 SOGBJFIQOYLKOO-JTQLQIEISA-N 403.826 2.097 10 20 HECD C[S@@](=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1F 774104189 PEUONNMRWMDNHI-MUUNZHRXSA-N 403.479 2.418 10 20 HECD CCN(Cc1ccncc1)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778257210 TVMJXFPIIMCLLL-HJWRWDBZSA-N 408.502 2.344 10 20 HECD CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 779335479 DLTQYNASALQTBE-IRFCIJBXSA-N 413.566 2.014 10 20 HECD CN(C)C1CCN(C(=O)CC2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)CC1 779503927 XFPRENZPYVYCAQ-XQRVVYSFSA-N 415.534 2.292 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCCNC(=O)c1cccc(Br)c1 779507648 CMXIAEQWSPRVJD-ALCCZGGFSA-N 405.248 2.420 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1 785293723 AHAONSLEMVIVHN-GJZGRUSLSA-N 413.474 2.009 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(=O)(=O)CC)c(F)c1 790410072 ZQOXYGGBJBQTEX-UHFFFAOYSA-N 418.468 2.492 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC2(CCOCC2)O1 790667169 XDLMVPZECSVNDV-MRXNPFEDSA-N 421.513 2.266 10 20 HECD COc1cccc(CNC(=O)[C@@H](C)[C@H](C)C(=O)NCc2cccc(OC)c2O)c1O 790787390 DBVDKLYBQKOQGW-KBPBESRZSA-N 416.474 2.320 10 20 HECD O=S(=O)(c1ccc2c(c1)N(Cc1cc3c(cc1O)OCO3)CC2)N1CCCC1 792176552 GWSDTSQQCPEDID-UHFFFAOYSA-N 402.472 2.468 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](Cc1ccccc1)CN(C)C 793723943 OPUMWJUBJKUQOK-NRFANRHFSA-N 410.562 2.390 10 20 HECD CCOc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)ccc1[N+](=O)[O-] 794678947 KFFLSPHGQLGEHP-IBGZPJMESA-N 415.446 2.447 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCCN(C)Cc3ccco3)CC2)cc1 796674135 GEIMCZUEACMEKO-UHFFFAOYSA-N 414.550 2.391 10 20 HECD COC(=O)N1CCC(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 805832109 OLROGJJDDSXJEO-UHFFFAOYSA-N 422.501 2.064 10 20 HECD COCc1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 806844401 OVYQWDYLRANANW-OAHLLOKOSA-N 405.476 2.141 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@]2(CCO[C@H](C)C2)O1 807673335 QWROJJGATKYKHE-MPWIWIEXSA-N 403.523 2.115 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 807912987 TVVUOZZFSSNRJK-MRXNPFEDSA-N 400.454 2.060 10 20 HECD COc1ccc(CN2CC[C@H](NCc3cc4c(cc3O)OCO4)C2=O)c(OC)c1 808423950 LSIMTVWHKABXGB-INIZCTEOSA-N 400.431 2.029 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CO)CC3)cc2F)C[C@@H](C)O1 815277123 UJBRHTKDAWEXQI-KZNAEPCWSA-N 407.530 2.150 10 20 HECD Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cn2ccnc12 815363575 YESLXMZCKUQYHJ-SFHVURJKSA-N 408.458 2.495 10 20 HECD C[C@@H](NC(=O)c1cccs1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971091 NRPLBZSCQMCFRJ-CYBMUJFWSA-N 405.495 2.283 10 20 HECD Cc1cc(CC(=O)N[C@@H]2CCCN(CC(N)=O)C2)c(C)n1-c1ccc(Cl)cc1 1116049598 CMFCHSSAUUVAPR-GOSISDBHSA-N 402.926 2.356 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(CC(=O)N2CCOCC2)CCCC1 1320514643 XRFLKUMQBKIJPK-MRXNPFEDSA-N 404.507 2.344 10 20 HECD Cc1cc(CN2CCCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)no1 1322221594 HDEHFLHGYAGDFD-UHFFFAOYSA-N 413.522 2.237 10 20 HECD O=C(/C=C/c1cnc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719184 WNAXYOJRILBFPA-NLVNQHKVSA-N 416.865 2.440 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1C1CC1 1802985424 CENMGNWZYJLPHG-NWUWZPLHSA-N 422.485 2.254 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@@H](CNC(=O)C2(F)CCC2)[C@@H]1c1cccnc1 1813682782 NKZPCECQTBHCLW-KSSFIOAISA-N 414.437 2.100 10 20 HECD COC(=O)c1ccc(OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c([N+](=O)[O-])c1 7086827 POUJUNKTUIMGPL-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 727490443 QRWIDJJWQSFNRY-KRWDZBQOSA-N 412.414 2.256 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCC(=O)N3CCCCC3)cc2F)CC1 730118213 PHBNLAYYCXHOBO-UHFFFAOYSA-N 419.545 2.169 10 20 HECD COC(=O)CN(CC(=O)Nc1ccc2nc(O)[nH]c2c1)Cc1cc(Cl)ccc1O 732202914 IKODSDMAUMNQSJ-UHFFFAOYSA-N 418.837 2.241 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2OC)c1 734017348 FALZJCIRWCZCIK-GOSISDBHSA-N 414.458 2.339 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2c(F)cccc2Cl)c1 741288552 CJMRZPKIFPQKSO-AWEZNQCLSA-N 402.831 2.020 10 20 HECD C[C@H]1[C@@H](C)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@]1=O 744408331 WMRQLCYQEJTRAH-JFTGJMIGSA-N 410.495 2.242 10 20 HECD COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 747231281 XVDQEKABMLYVJX-UHFFFAOYSA-N 420.487 2.001 10 20 HECD Cc1cc(C(=O)[C@H](C)N2CCO[C@H](C(N)=O)C2)c(C)n1-c1ccc(OC(F)F)cc1 747835329 NQRBZAVRPHIHST-KSSFIOAISA-N 421.444 2.453 10 20 HECD CCOC(=O)N1CCC(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 749115741 BAIPKKQZIUYXSB-UHFFFAOYSA-N 405.495 2.123 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 751384360 CUBSHBPSLXKJDC-UHFFFAOYSA-N 414.462 2.164 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 752402979 BYDRXQJGXRQJOW-CQSZACIVSA-N 421.494 2.061 10 20 HECD CC[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)N1CCOCC1 753056538 HUNYEJQTOHWVJN-SFHVURJKSA-N 401.463 2.334 10 20 HECD C[C@H](O)[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 760877842 ZSNGRJUTKJIWDE-VXNCWWDNSA-N 407.530 2.148 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2nnc(O)n2c1 762702378 MBBAWJYAKGPNNO-ZDUSSCGKSA-N 403.389 2.435 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc1 765986134 OZEIGEWNWUGRFA-INIZCTEOSA-N 401.429 2.483 10 20 HECD COCCN(CCCc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769725373 AZNKPWSLTVYRMZ-UHFFFAOYSA-N 406.504 2.485 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)c2)CC1 771636984 MEESTBUBLRTORY-HSZRJFAPSA-N 421.501 2.135 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccc(N(C)C)cc1 773858583 RJCUZRNNQGISHK-HNNXBMFYSA-N 417.531 2.156 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCN2CCN(c3ccc(F)cc3)CC2)c1O 774963876 LQWQXFMIIBBJIS-UHFFFAOYSA-N 404.442 2.360 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@H](CC(=O)N(C)C)c3ccccc3)CC2)cc1 775217837 PHLDNAHVVVUZQX-JOCHJYFZSA-N 424.545 2.153 10 20 HECD C[C@@H](NC(=O)N1CCN(c2ncnc3c2cnn3C)CC1)c1ccc(N(C)C)cc1 776238388 NQDZWLCJBAXKON-OAHLLOKOSA-N 408.510 2.022 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(OCCOC)c3)cc2F)CC1 776900697 IEXIKMXERINNQO-UHFFFAOYSA-N 416.497 2.318 10 20 HECD Cc1cc(C(=O)CN(CC(C)(C)O)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778216849 RCJNGHMMHFYPFC-UHFFFAOYSA-N 419.547 2.160 10 20 HECD CC(C)N1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1=O 779982522 ZSEZCCIXSBPPDD-IYBDPMFKSA-N 406.502 2.202 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C3=CCN(C)CC3)CC2)cc1 781355871 HCPWBJCADFQRBF-LJQANCHMSA-N 415.582 2.157 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OC)cc1Cl 785295985 ABIYGBPQBJEZDD-SNVBAGLBSA-N 408.838 2.454 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCNC(=O)OC(C)(C)C)cc2)CC1 786701651 GBGCGLLWJBBKQT-UHFFFAOYSA-N 418.538 2.180 10 20 HECD CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 787491698 IGYQCRUACRSNDV-UHFFFAOYSA-N 400.435 2.106 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1CCN(c2ccccn2)CC1 788630015 DLOHVFWODDTLLP-UHFFFAOYSA-N 407.518 2.083 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](CC(=O)NC)c2ccccc2)cc1 788951394 JTLLEWLOTLNGHT-FQEVSTJZSA-N 410.518 2.143 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]1c1ccc[nH]1 789842198 BFULBPGVIAHWCR-FQEVSTJZSA-N 414.481 2.095 10 20 HECD COc1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1C 789855691 WJRRUVODARLBKU-UHFFFAOYSA-N 413.543 2.489 10 20 HECD O=C(c1cccc(O)c1O)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 790918478 KWYHOWDLHKHIPZ-HNNXBMFYSA-N 402.472 2.095 10 20 HECD O=C1NCCc2ccc(S(=O)(=O)NCc3cc(Cl)cc(Cl)c3O)cc21 805135667 PZLVXHJQNPLDEU-UHFFFAOYSA-N 401.271 2.463 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21 806275851 XTHSXRADIGUPHT-GRYCIOLGSA-N 403.620 2.237 10 20 HECD CNC(=O)c1ccc(CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C2CC2)cc1 807095062 JESBLBNAFPFHKY-UHFFFAOYSA-N 422.529 2.228 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCO1 807972070 HPTPMOBSCZEEGG-ZHALLVOQSA-N 404.507 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](n4cc(Cl)cn4)C3)CC2)cc1 810132074 VBDXMQZFQFDTKB-GOSISDBHSA-N 403.914 2.141 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(C)c2)c1C 915556335 CKRZZVQAAVSKBV-UHFFFAOYSA-N 421.515 2.498 10 20 HECD Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917709093 DEHQSQSPEWWDIC-STQMWFEESA-N 402.470 2.289 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cc(C(=O)O)ccc3OC)CC2)cc1 917759659 SCRDLVCTKFAYNK-UHFFFAOYSA-N 420.487 2.303 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(C(N)=O)cc3)cc2F)C[C@H](C)O1 917918846 UDYLHVCIEVPTEL-KBPBESRZSA-N 421.494 2.017 10 20 HECD C[C@@H](OC(=O)CO[C@H]1CCOC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1318976412 XFZKIVMQKFEWII-KGLIPLIRSA-N 423.421 2.138 10 20 HECD Cc1[nH]ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005665 UEMFRILIVODYLZ-HXUWFJFHSA-N 419.865 2.145 10 20 HECD CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826395916 AJGVKKMFCSRVHN-OAHLLOKOSA-N 411.593 2.267 10 20 HECD CCc1ccnc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847039067 PWMZVZSBSKKTCU-FNORWQNLSA-N 423.469 2.291 10 20 HECD C[C@H](NC(=O)CCNC(=O)OCC(F)(F)F)c1ccc(N2CCOCC2)cc1 145742324 QCQCMHCPZUMBJB-ZDUSSCGKSA-N 403.401 2.379 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(CC(=O)NC(C)C)CC3)cc2)CC1 731121351 SCFGAMMOIZKUAW-UHFFFAOYSA-N 415.582 2.275 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)c1 734068227 WXAPIBYBCWJOKT-UHFFFAOYSA-N 421.519 2.228 10 20 HECD CC1(C)Cc2cccc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)c2O1 738554521 CRNVFYIPFWTUNA-LCYFTJDESA-N 412.558 2.151 10 20 HECD COC(=O)c1csc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1 749153820 HQFSJCFDZSNJRT-UHFFFAOYSA-N 424.909 2.360 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOC4(CCCCC4)C3)CC2)cc1 754052197 XXEKYWQXUIWAJR-NRFANRHFSA-N 403.567 2.213 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1nccs1 754310879 YNILTIQIMNFYND-GDBMZVCRSA-N 401.536 2.448 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(NC(C)=O)c(F)c3)nc12 768995663 VTJUIBJAHKRPAK-UHFFFAOYSA-N 416.365 2.066 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CN(C)C(=O)[C@@H](C)n1cccn1 769289909 GFOXDKQPAMAJIR-CYBMUJFWSA-N 423.311 2.419 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(Br)n3)cc2)C1 770280945 OOANXJIVTBWWIY-CQSZACIVSA-N 417.307 2.476 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1noc2c1CCCCC2 780404523 GNBQGOMPOGSUBL-UHFFFAOYSA-N 403.504 2.108 10 20 HECD CC[C@@H]1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cccc(Cl)c2O1 784223131 NCZPPKABQZXWSG-GFCCVEGCSA-N 407.879 2.342 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1 785865146 HMOYVHVRAMKGAW-HDICACEKSA-N 418.582 2.153 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](OC)c3ccccc3)CC2)cc1 786658266 UASOCAFLUAJHSO-OAQYLSRUSA-N 411.502 2.238 10 20 HECD C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 787905640 YWOWIIRKGAJFIN-GOSISDBHSA-N 400.567 2.456 10 20 HECD Cc1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Cl 788323198 KFFSZLBAJRFQRS-UHFFFAOYSA-N 401.894 2.418 10 20 HECD CCOC(=O)C1CCC(NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)CC1 788967268 PXBPYRZGNYWQMW-UHFFFAOYSA-N 403.523 2.387 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CCC1 789950376 PNHLQHSXKUAMEI-ZDUSSCGKSA-N 413.440 2.463 10 20 HECD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c2ccccc21 803689130 LAROONFVABWQQU-HXUWFJFHSA-N 420.513 2.299 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(OC)cc3C)CC2)cc1 804318486 LIFIAZNBEPUDBN-UHFFFAOYSA-N 411.502 2.414 10 20 HECD CS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807511412 MJXIZZMHFDLXDP-UHFFFAOYSA-N 417.270 2.357 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1 807694778 OCZVPIYQPZWOGI-LJQANCHMSA-N 409.534 2.281 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)[C@@H]1CCCN(C(=O)OC)C1 808030554 ZKWJMAASYUTYKS-SJLPKXTDSA-N 418.538 2.084 10 20 HECD COc1ccc(N2CCN(CCCNCc3ccc4c(c3)oc(=O)n4C)CC2)cc1 816530792 UUNIKGFPCXKTOD-UHFFFAOYSA-N 410.518 2.442 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cc3cccc(NS(C)(=O)=O)c3)CC2)cc1 1341407348 UBCVCGHVBWMCFC-UHFFFAOYSA-N 417.531 2.348 10 20 HECD O=C(CCc1ccco1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441185 CIGYRAKWXIGMQD-UHFFFAOYSA-N 420.469 2.209 10 20 HECD CCOC(=O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502676 ZTGLQCUJTWOHQD-UHFFFAOYSA-N 424.881 2.158 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCc3c(C)nn(C)c3C)CC2)cc1 32764802 CFFPMPMZLWTQMU-UHFFFAOYSA-N 413.566 2.307 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1OCC(N)=O 54035305 ORHZBVDWVZEZNG-UHFFFAOYSA-N 415.515 2.043 10 20 HECD COc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1C 237441807 GAFOSHMLXPGCIG-UHFFFAOYSA-N 404.532 2.455 10 20 HECD COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(C3=S=CC=C3)o2)cc1 542113820 BYFQRWMNEOCBGM-CYBMUJFWSA-N 420.512 2.471 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 729598738 JTVYJKNDPNLPPU-PMACEKPBSA-N 415.582 2.308 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)c1cnn(-c2ccccc2)c1 733805191 GMWOBDLJAWUOJK-UHFFFAOYSA-N 422.460 2.472 10 20 HECD O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NCc1ccc(N2CCOCC2)cc1 740742055 FWXUULAVOFXVKB-QHCPKHFHSA-N 409.530 2.431 10 20 HECD CCCn1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 746354982 PWEDJPQOLOXKFG-GASCZTMLSA-N 417.485 2.301 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)cc1 746990917 VUUYBDFXRHZHJP-UHFFFAOYSA-N 417.531 2.332 10 20 HECD O=C1C[C@@H](N2CCN3C(=O)NC[C@H]3C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 751925745 SXMGBTKNCXGQIZ-RBUKOAKNSA-N 418.457 2.443 10 20 HECD Cc1noc(C)c1[C@@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 753962178 BIBWVUJZIOZEPV-AWEZNQCLSA-N 405.520 2.336 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cnn(-c3ccccn3)c2)C2CC2)cc1 754930569 VIKWRYKXDMGRHZ-UHFFFAOYSA-N 404.474 2.463 10 20 HECD CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 758966966 QUYUSBJOYNHBCE-UHFFFAOYSA-N 413.449 2.428 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3ccccc3F)CC2)cc(OC)c1OC 759099910 VJOGEVNTGRPWRJ-UHFFFAOYSA-N 410.467 2.362 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@@H](CCSC)C(=O)N(C)OC)CC2)cc1 765874196 WVKBAPGUNQHDBQ-SFHVURJKSA-N 424.567 2.105 10 20 HECD C[C@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1Cl 766021842 DUOLATKNRRPMKK-RBUKOAKNSA-N 423.001 2.234 10 20 HECD NC(=O)C1CCN(C(=O)C2CCN(Cc3cccc(Br)c3O)CC2)CC1 768335796 YNVDZEDXTYKIEB-UHFFFAOYSA-N 424.339 2.091 10 20 HECD C[C@H]1CN(Cc2cc(Br)ccc2O)CCN1c1nccn2cnnc12 770280808 MMSQHHSUTCDXTI-LBPRGKRZSA-N 403.284 2.303 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCO[C@H]3C)cc2F)C[C@@H](C)O1 771086725 MIGBRPAWQHETKW-QSJFSLAZSA-N 408.470 2.024 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3c(N)cccc3[N+](=O)[O-])cc2F)CC1 779512765 BFOYSHAYSGATNT-UHFFFAOYSA-N 401.442 2.388 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1 784560800 NRPATYLYAGBKCL-SFHVURJKSA-N 411.502 2.317 10 20 HECD O=C(NC1CCC2(CC1)OCCO2)C(=O)N(Cc1ccco1)Cc1ccccc1O 787408394 JWBMTECTKOSDDD-UHFFFAOYSA-N 414.458 2.316 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 797611425 QIPLNFWLIXYQAB-ZDUSSCGKSA-N 405.476 2.390 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)NCCOC)c[nH]1 801546589 VZBAPKDYVDBBTP-UHFFFAOYSA-N 409.508 2.088 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1c(F)cccc1F 918442069 BCPKKNCGNWCQPW-UHFFFAOYSA-N 403.429 2.428 10 20 HECD Cc1cc(C(=O)OCC(=O)NC2CCC3(CC2)OCCO3)c(C)n1-c1ccccn1 919076980 PQDDKMBLHNPNSC-UHFFFAOYSA-N 413.474 2.448 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccnc1N1CCOCC1 919777684 PYZCNRVTKAJFGM-UHFFFAOYSA-N 411.506 2.419 10 20 HECD CN1CCN(c2ncccc2CNC(=O)NCc2ccc(N3CCCC3)cc2)CC1 921200266 VTYCIXSEUUIDEY-UHFFFAOYSA-N 408.550 2.433 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1 1782022324 VTRFMHGOPXWLDL-QHCPKHFHSA-N 423.469 2.128 10 20 HECD CSCC(C)(C)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1841644164 OMGJFCLJUPREFZ-SOFGYWHQSA-N 420.531 2.409 10 20 HECD CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1F 1845500731 HWYAWBMRRRIFHI-UHFFFAOYSA-N 422.844 2.307 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)F 1848000260 REEXDPFGHKWGDT-UWVGGRQHSA-N 410.751 2.467 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)Nc3cccc(C)c3C)nc12 47280111 SUQHYSNIWPMGLI-UHFFFAOYSA-N 411.462 2.299 10 20 HECD Cc1nn(CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1[N+](=O)[O-] 726504375 WYJUMYKIFOGJFX-UHFFFAOYSA-N 405.430 2.090 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c(O)c1O 727004149 PJMHLIKBFGGHMX-UHFFFAOYSA-N 418.358 2.271 10 20 HECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 728209024 CZAZPSTXPIZIBA-HOTGVXAUSA-N 421.501 2.395 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCO4)cc2F)CC1 730268998 LYLDMDTYOVTOMJ-UHFFFAOYSA-N 419.522 2.381 10 20 HECD Cc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 732247237 COJPCHNPPCIEKG-UHFFFAOYSA-N 424.545 2.433 10 20 HECD Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 735633046 MNYITIYGMLVGIA-NRFANRHFSA-N 424.480 2.057 10 20 HECD Cc1c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cccc1[N+](=O)[O-] 738885035 NXPOAMPSSFCERD-UHFFFAOYSA-N 418.475 2.460 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](CN4CCCCC4)C3)CC2)cc1 743851220 AMDRCCSBEQKFDN-FQEVSTJZSA-N 400.567 2.152 10 20 HECD CNC(=O)[C@H](C)CN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 747967472 NKQBHIQKOKVUQG-ZIAGYGMSSA-N 407.470 2.103 10 20 HECD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NCc1ccccc1O 748482705 XTKULDBJSTZIAA-UHFFFAOYSA-N 409.364 2.248 10 20 HECD O=C(Cn1nc(-c2ccccc2)oc1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751294824 PTDDMVFWLVJYJT-GOSISDBHSA-N 409.442 2.417 10 20 HECD COCCN(C)S(=O)(=O)c1ccc(N(C)C(=O)/C=C/c2cncc(F)c2)cc1 753061939 IEEGCKNYVZLHAN-RUDMXATFSA-N 407.467 2.164 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c2C)cc1C 758489238 NZZNLPFTNFXHRT-OAHLLOKOSA-N 406.504 2.375 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC[C@@H]3CCCO3)cc2F)C[C@@H](C)O1 760535830 CSGWSNJVDPSREY-UXLLHSPISA-N 400.516 2.428 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N(C)C4(CCCC4)C3=O)CC2)cc1 760951598 ONRHKPMCHHMQAD-UHFFFAOYSA-N 400.523 2.414 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1F 762437749 CQQQAOCAXCTKIK-KRWDZBQOSA-N 417.485 2.302 10 20 HECD CCOC(=O)CN(CC)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 765009301 QGTDVGQRMJMLML-UHFFFAOYSA-N 412.489 2.280 10 20 HECD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCc1cccc(Br)c1O)C2=O 765752500 WZRKGRIWAYGDBF-BBATYDOGSA-N 424.295 2.272 10 20 HECD C[C@H](OC(=O)C[C@H]1COC(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767602531 RDBDLVIOOGVSGI-STQMWFEESA-N 421.405 2.285 10 20 HECD C[C@H](NC(=O)N1CCCC[C@H](S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 767780691 IRCDNDFSJLLECK-LPHOPBHVSA-N 409.552 2.193 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 771406234 HXFABWBIHDEIBA-UHFFFAOYSA-N 401.444 2.131 10 20 HECD COC(=O)CNC(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)cc1 775178522 UQPLKHIKUFQOAJ-UHFFFAOYSA-N 401.438 2.177 10 20 HECD CC(=O)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(F)c1 777361820 MDHANJCOZPXTFO-UHFFFAOYSA-N 404.463 2.193 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCn1ccnn1 782494940 VOMGIUVJVQLOAC-QBFSEMIESA-N 407.546 2.137 10 20 HECD O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NCc1c(O)ccc2c1CCCC2 787898324 DMJJIFURNFZRLE-UHFFFAOYSA-N 409.446 2.283 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCO[C@H]3CCCC[C@H]3C)CC2)cc1 787988394 NWUHWMNSXCMJMC-UTKZUKDTSA-N 417.550 2.492 10 20 HECD C[C@@H](NC(=O)C(=O)NCCSC(F)(F)F)c1ccc(N2CCOCC2)cc1 788543621 YBXXXEIKYSEZMH-GFCCVEGCSA-N 405.442 2.070 10 20 HECD COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)c1cccc(O)c1O)CC2 790670643 ZRRQLIYGYXLGLJ-UHFFFAOYSA-N 414.458 2.210 10 20 HECD COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 792295358 MKHORISWOLQUFW-SECBINFHSA-N 413.352 2.206 10 20 HECD Cc1c(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cnn1C 795867141 PAVPBFJHTIRLGD-UHFFFAOYSA-N 417.421 2.228 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC(C)C)cc2)cc1 797431854 ZTDQNPNTMTXKGG-UHFFFAOYSA-N 413.521 2.398 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)cc1F 803663017 RBYKIXCWDYRMSJ-UHFFFAOYSA-N 422.501 2.024 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(Cc2ccsc2)CC1 806276477 FHUPHXHQCKOBOK-UHFFFAOYSA-N 410.590 2.147 10 20 HECD CC1CCC(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)CC1 806281865 MVMSRCWTZAODKZ-UHFFFAOYSA-N 410.609 2.464 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COc4ccccc4C3)cc2)C1 918117373 DAJMOSBKDNTWAT-ICSRJNTNSA-N 422.529 2.439 10 20 HECD CC(C)(C)C(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918223014 CKRINPNHQHECDI-UHFFFAOYSA-N 406.502 2.062 10 20 HECD COC(=O)N(C)CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919286773 AOLNEOPJCOZJLV-GFCCVEGCSA-N 424.409 2.030 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3c[nH]c4cnccc34)CC2)cc1 1324173865 GBXRJNWRMPEEBP-UHFFFAOYSA-N 407.518 2.443 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1C1CCCC1 1328357197 QPRGYZVWYXWXLA-UHFFFAOYSA-N 416.547 2.471 10 20 HECD Cc1c[nH]cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005711 XBDFMRZVYOQCFY-HXUWFJFHSA-N 419.865 2.145 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C1(F)CCC1)CCO2 1782008093 VPAYABPBZKHOLA-SFHVURJKSA-N 412.845 2.087 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccnc1Cl)c1cc(O)nc(O)c1 1794220279 AOYHDIJVLYPIBA-QDMKHBRRSA-N 416.865 2.036 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccn2)[nH]n1)c1cc(O)nc(O)c1 1817843902 HEQWRPMFHHKLER-OAHLLOKOSA-N 408.418 2.231 10 20 HECD O=C([C@H]1CC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427039 CJFYZUPGXYSVLW-CABCVRRESA-N 409.433 2.381 10 20 HECD CCN(C)[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429695 PCIJYPUZZKDUDI-CRAIPNDOSA-N 418.538 2.066 10 20 HECD Cc1cnoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829553587 KHTSZHCNNFRGOL-MRXNPFEDSA-N 414.462 2.336 10 20 HECD CCn1nc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc1C 1844534058 XPFAOTKSXFQKGW-UHFFFAOYSA-N 418.881 2.407 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 148464038 CPXWMPPODNYJCX-MRXNPFEDSA-N 417.531 2.231 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCCCNC1=O 726869692 NBYGXWRIGMGPOO-GOSISDBHSA-N 405.454 2.001 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCS(=O)CC1 731007413 NXPQAKOJGCUTMI-QBFSEMIESA-N 414.599 2.320 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1 734015264 DPRPJBVYRIHXHL-FQEVSTJZSA-N 405.454 2.453 10 20 HECD CN1CC[C@@H](N(C)C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 737676891 CBEIIJRFKQTSDE-KECPUOCWSA-N 423.585 2.419 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc([N+](=O)[O-])ccc3OC)CC2)cc1 742927556 UTUGAZKTRNTSHJ-UHFFFAOYSA-N 414.462 2.164 10 20 HECD CCC1(O)CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 744410864 WNVZXUYBGHMZPT-UHFFFAOYSA-N 419.547 2.161 10 20 HECD CO[C@@H](C)c1noc(CN2CCCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n1 749989628 JTCGCPODZTVABM-INIZCTEOSA-N 416.526 2.261 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)C3CCCCC3)cc2)C1 751097137 HGPVRZPFTWYQOO-LJQANCHMSA-N 414.550 2.091 10 20 HECD CN(Cc1ccc(N(C)C)cc1)CN1C[C@@H]2CN(C(=O)OC(C)(C)C)CCN2C1=O 751594545 YEDNCHIOOCINTH-IBGZPJMESA-N 417.554 2.499 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1nccs1 754310881 YNILTIQIMNFYND-GOEBONIOSA-N 401.536 2.448 10 20 HECD CCCOc1ccc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)cc1N 754610594 XAIYUMYPYDAGCZ-UHFFFAOYSA-N 414.418 2.340 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c(C)o1 754748788 LRNZEZBCZBSRBL-UHFFFAOYSA-N 418.475 2.486 10 20 HECD Cc1cc(C(=O)CN(C)CCOCC2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 756049620 WLRVAQPZWYPEOF-UHFFFAOYSA-N 419.547 2.283 10 20 HECD NS(=O)(=O)c1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2O)c1 756326026 FRMQFVWLVXCDAT-UHFFFAOYSA-N 415.471 2.274 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnc1Cl 760091473 OPJWRQLHYDJHTD-UHFFFAOYSA-N 406.845 2.274 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1F 760096805 MYTPQSXNWATGIJ-HNNXBMFYSA-N 401.438 2.314 10 20 HECD Cc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768447801 PTQYVRKNVCHVMJ-UZLBHIALSA-N 412.486 2.238 10 20 HECD CC(=O)[C@@H](Cc1ccc(F)cc1F)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 768631823 OCUKUSJWLIEKAD-QGZVFWFLSA-N 413.398 2.399 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccccc1OCc1cscn1 774361754 ISTHIBAROMXSLK-UHFFFAOYSA-N 413.455 2.431 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccco2)N2CCCCC2)cc1F 774827936 SJYAKUUEMLYFMW-IBGZPJMESA-N 416.497 2.444 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1O 775024748 RHBBCLQODXXITE-HNNXBMFYSA-N 401.419 2.079 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NCc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 776959148 VBVALHCYQKAFDE-UHFFFAOYSA-N 405.904 2.494 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@@H](Cc4ccccc4)C3=O)cc2)C1 777610387 JSSBWSDVNFSOEG-QUCCMNQESA-N 406.486 2.051 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 779474977 HAMMQGFYNZSPOT-WMZJFQQLSA-N 411.502 2.448 10 20 HECD CCOc1ccccc1[C@H](CC(=O)OCC(=O)c1ccc(O)c(O)c1)NC(C)=O 783453906 ZSLNQPFMAPLNSR-INIZCTEOSA-N 401.415 2.490 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1C 786120298 LFHMOVNJXBABKD-UHFFFAOYSA-N 417.531 2.151 10 20 HECD O=C(NCCc1ccncc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786793245 PWIALLQLOUDYDF-MRXNPFEDSA-N 418.444 2.127 10 20 HECD CCN1CCCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1=O 787988123 VEIJMOHBFPWZPL-UHFFFAOYSA-N 421.409 2.065 10 20 HECD CCCN1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1=O 788280065 VELIKUPFZKPUBC-UHFFFAOYSA-N 419.481 2.345 10 20 HECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1cccnc1 788332431 MTCTXZMRNXQHSY-OAQYLSRUSA-N 410.518 2.090 10 20 HECD COCn1nc(C)c(S(=O)(=O)NCc2cccc(Br)c2O)c1C 788678652 ANTSRLXRLUUDLP-UHFFFAOYSA-N 404.286 2.050 10 20 HECD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)sc1C 789379035 VOVLPWFHMCOROO-UHFFFAOYSA-N 406.483 2.115 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccncc1 789864551 PQYZXHGYDSNNSA-UHFFFAOYSA-N 412.559 2.345 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2C)ccc1O 790404725 GUMFSFJJHLZCRB-UHFFFAOYSA-N 424.422 2.428 10 20 HECD COc1ccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)c(O)c1 794377331 RXVLCODYNPLCGK-UHFFFAOYSA-N 410.517 2.106 10 20 HECD NS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 798334066 LUTLZPWWMXOEGB-INIZCTEOSA-N 423.922 2.087 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCc3sc(C)nc3C)CC2)cc1 804317721 NKZYGUZOLCMXGL-UHFFFAOYSA-N 416.547 2.212 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 807290576 YYJOSRFJPOTZRF-ONTIZHBOSA-N 408.546 2.012 10 20 HECD COc1ccccc1CN1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 807674466 LESTUXQPNUSBOB-SFHVURJKSA-N 424.545 2.283 10 20 HECD CN(Cc1ccccc1O)c1nnc([C@H]2CCS(=O)(=O)C2)n1C[C@H]1CCCCO1 812439063 UHKZXUBKRUGLBB-DLBZAZTESA-N 420.535 2.091 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2c(I)cnn2C)c1 815835345 PYVPTRLLPJNHIU-MRVPVSSYSA-N 401.204 2.230 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)C4CC4)CC3)cc2F)C[C@H](C)O1 918219639 DCABKRXDKZBCIJ-HOTGVXAUSA-N 418.513 2.203 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1 918304779 ZBJYJYTUQKGURE-UHFFFAOYSA-N 402.882 2.492 10 20 HECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCN2CCS(=O)(=O)CC2)c1 1317904380 OIJBWALSHSMHQH-UHFFFAOYSA-N 409.939 2.208 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccc(N(C)C)cc1 1320385356 HWIZDVJYBLXCRL-SFHVURJKSA-N 400.475 2.387 10 20 HECD CCOC(=O)c1ncc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)s1 1321416422 BCCCDVYJIBWDQQ-UHFFFAOYSA-N 405.476 2.201 10 20 HECD C[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1822180359 UYFNNYWDNNKSJS-TVQRCGJNSA-N 408.842 2.161 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)CC2)cc1 248139641 PILKZQZTRSUOTG-UHFFFAOYSA-N 408.418 2.147 10 20 HECD Cc1cc(C)c(NC(=O)CNC(=O)COC(=O)c2ccc(C)c(O)c2O)c(C)c1 727004554 XHQHUZNSIYGVLW-UHFFFAOYSA-N 400.431 2.243 10 20 HECD CN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)ccc21 729787842 ZZZVCPOTRHXOEJ-UHFFFAOYSA-N 406.486 2.451 10 20 HECD CC[C@@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H](C)O1 732443562 HYBHMGYTJOTHMM-AZUAARDMSA-N 404.555 2.416 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CNC3(C(=O)OC(C)(C)C)CCCC3)nc12 735873418 NOIVZLDNINLACY-UHFFFAOYSA-N 404.467 2.356 10 20 HECD CS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739774461 OIDCOJFUSRZFQP-UHFFFAOYSA-N 401.488 2.044 10 20 HECD CN(CC(=O)Nc1cccc(S(N)(=O)=O)c1)Cc1ccc(N2CCCCC2)cc1 741711873 PGLDGFOOLGFTRW-UHFFFAOYSA-N 416.547 2.395 10 20 HECD CN(C)C1CCN(CCNC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 748962841 XCDWQGGHTMIGGH-UHFFFAOYSA-N 405.612 2.065 10 20 HECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)N(C)Cc2ccccc2O)c1 751235960 OSSAHTPYMVLUTQ-KTKRTIGZSA-N 421.471 2.416 10 20 HECD OCC1CCN(c2ccc(CNc3ncnc4c3cnn4-c3ncccn3)cc2)CC1 752631866 HHYFWFKOFRHZAQ-UHFFFAOYSA-N 416.489 2.426 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3C[C@H](C)O)CC2)cc1 752640132 FYGQXQJXWRAVML-ICSRJNTNSA-N 404.555 2.152 10 20 HECD COC(=O)c1cccc(NC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)c1 753859938 CARRIECPTOIGTA-UHFFFAOYSA-N 401.438 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(C)c(-n4cnnn4)c3)CC2)cc1F 753875487 AHODFXHQHZPKGG-UHFFFAOYSA-N 411.441 2.473 10 20 HECD CCS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 760317139 DJHNXAODNUWCQF-UHFFFAOYSA-N 412.518 2.138 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccn(C)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 764116023 BVKAZIKPAJMVPQ-UHFFFAOYSA-N 415.471 2.120 10 20 HECD CC[C@]1(C)CC(=O)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1=O 767942565 LKOOMTFKZOQYEA-DOQJBMMISA-N 419.497 2.231 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCc3nnnn3CC3CCOCC3)cs2)cc1 768857623 DWLDUOYBTFVNQO-UHFFFAOYSA-N 414.491 2.086 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCCc3ccc(O)c(O)c3)C2)s1 768900312 SSVCZSLRNBLRQS-HNNXBMFYSA-N 424.544 2.227 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@]3(C)CCCO)CC2)cc1 776123535 SUBSSBRKCJMLFZ-JOCHJYFZSA-N 404.555 2.154 10 20 HECD CCCCN(CCOC)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778267664 DJCHDPGQPIDRDR-KHPPLWFESA-N 403.523 2.175 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 785886810 IRSXKUHQGONRCU-UHFFFAOYSA-N 410.442 2.135 10 20 HECD C[C@H]1C[C@@H]1c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 787332250 ZNXBLWCYQJIMTB-YOEHRIQHSA-N 415.465 2.311 10 20 HECD Cn1ccc2ccc(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2c1=O 789683150 VUDURZGJLSYEJY-UHFFFAOYSA-N 424.476 2.243 10 20 HECD O=S(=O)(CCO)c1ccc(CNCc2cc(Br)ccc2O)cc1 791006248 FOXVYXYQGVIJHU-UHFFFAOYSA-N 400.294 2.211 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c(O)c1 797390092 NGGYRWRAVSZAAS-UHFFFAOYSA-N 419.865 2.146 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(O)c1 797390310 CUMMXWFOVAJBMK-UHFFFAOYSA-N 411.317 2.165 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1csc(N2CCCC2)n1)c1ccc(N(C)C)cc1 806334592 QGZMFHBYTWVPAN-OAHLLOKOSA-N 415.563 2.345 10 20 HECD O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)OCCO 913362062 SOOARLGAZNWNHD-YRNVUSSQSA-N 402.291 2.186 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cnn(C[C@H]2CCCO2)c1 918220468 JLXAREDFSVQDMW-QGZVFWFLSA-N 403.458 2.360 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O 920274280 NRXVEANLYZQWGF-UHFFFAOYSA-N 404.470 2.348 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCCn2c(O)nc3ccccc32)c1 920635120 CRUREZKERBCBTC-UHFFFAOYSA-N 405.432 2.066 10 20 HECD CN1CCN(c2ccc(CNC[C@@H](O)CN3CCc4ccccc4C3)cc2F)CC1 1324940163 OBZBUIOJQAXZEJ-JOCHJYFZSA-N 412.553 2.086 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 1336530893 FRPCUHWXPLVEMX-UHFFFAOYSA-N 417.531 2.298 10 20 HECD COC(=O)c1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)o1 1337828339 JAAVVIPIVDUQMF-UHFFFAOYSA-N 404.419 2.054 10 20 HECD CC(C)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781748667 BXZBTYJKQHPSAJ-IIBYNOLFSA-N 405.495 2.057 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)c3cncc(F)c3)C2)CC1 1808575763 MBKYSNHYKIQCTC-UHFFFAOYSA-N 414.437 2.186 10 20 HECD Cc1nocc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844372 YXJYZIQNYMQVFS-CQSZACIVSA-N 412.406 2.132 10 20 HECD Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)[nH]1 1827423811 IHWPGAILRGSMKR-QGZVFWFLSA-N 413.478 2.071 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C)c1ccc(N2CCOCC2)cc1 140126041 NKTZMJDYVORSQF-CQSZACIVSA-N 417.487 2.008 10 20 HECD CCOC(=O)C1=C(C)C(C(C)=O)=S=C1NC(=O)c1ccc(-c2nnc(C)o2)cc1 468679674 KMMISWHJYACDRB-UHFFFAOYSA-N 413.455 2.293 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)ccc2OC)cc1F 731346994 GLIFVIQUIODIMG-UHFFFAOYSA-N 409.483 2.258 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3cn4cccc(C)c4n3)CC2)cc1 731914685 OLROEIKCNQDOJF-UHFFFAOYSA-N 422.485 2.086 10 20 HECD CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 743806631 MYDYBDGJBZWYOD-QGZVFWFLSA-N 417.531 2.358 10 20 HECD CC(=O)NCCc1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)s1 746705439 OYFLARMBMOHUNF-UHFFFAOYSA-N 407.561 2.288 10 20 HECD C[C@](O)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccco1 751068496 WGCWGCNRXBQDMH-SFHVURJKSA-N 422.484 2.485 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cc(F)c(F)c(F)c3)c2)CC1 751213740 XKXPURDCQWGPLO-UHFFFAOYSA-N 420.434 2.140 10 20 HECD CC(C)CN1CC[C@H](CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 756988747 ZENKBTKBTFAXFM-WOJBJXKFSA-N 415.582 2.165 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CSc3ccc(O)cc3)CC2)cc1 757107568 NUIVAJCUIMZGDO-UHFFFAOYSA-N 416.499 2.385 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])cc3C)CC2)cc1 758222989 KDNQFYBDOJTYBW-LJQANCHMSA-N 401.463 2.474 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cnc(C(C)C)[nH]3)CC2)cc(OC)c1OC 759099602 KMTNDJPZERRYKI-UHFFFAOYSA-N 424.523 2.070 10 20 HECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cccc21 769255114 SWIUEPGJCYEAPY-UHFFFAOYSA-N 404.470 2.227 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC4(CCCC4)C3)CC2)cc1 778382454 QNBLDCCTQOXMJA-CMDGGOBGSA-N 413.518 2.072 10 20 HECD CCOC(=O)c1ccc(N2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)nc1 779504543 APTKVMAWRHXWQU-UITAMQMPSA-N 411.458 2.422 10 20 HECD COCCO[C@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 780311067 DITBVWQYVDJTDN-JZXOWHBKSA-N 409.502 2.386 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(CCCO)CC3)cc2)C1 782713826 YYUIPFMZJXKWAN-LJQANCHMSA-N 402.539 2.082 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4CCCO4)CC3)cc2)C1 784477909 IFUGHKSFBVFCAS-PZJWPPBQSA-N 414.550 2.489 10 20 HECD NS(=O)(=O)C[C@H]1CCCN1C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 784817020 CSOANXUIKWMGJY-QGZVFWFLSA-N 415.475 2.320 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(OCCN(C)C)c1 785295820 ZWHXRUOXMCTOCY-OAHLLOKOSA-N 415.490 2.033 10 20 HECD CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786071141 VFQNNVDLPFKXSK-UHFFFAOYSA-N 411.462 2.235 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCCCC3)nc2)cc1F 787198079 HCDSWHKSROIJFF-UHFFFAOYSA-N 413.497 2.210 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCOc3ccc(C=O)cc3)cc2)CC1 787325322 DRXQGFFADAVYQF-UHFFFAOYSA-N 409.486 2.253 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCN2CCc3sccc3C2)cc1 788966521 VOPVPEBRMYQALY-UHFFFAOYSA-N 414.575 2.385 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)cc1 788976889 IQRYCCMZVDCDKN-NRFANRHFSA-N 422.529 2.461 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccnc3F)cc2F)C[C@@H](C)O1 789007020 LDBCHITYQJRKMJ-OKILXGFUSA-N 419.428 2.447 10 20 HECD CCOC1CC(CCNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 789854528 COTOAEOJJLHJTG-HJWRWDBZSA-N 415.534 2.221 10 20 HECD CC(C)c1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)on1 789855021 NLWXQENXFYLPRN-UHFFFAOYSA-N 402.520 2.284 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@H]7[C@@H](C[C@H]64)[C@@H]3[C@@H]75)cc2)C1 793133899 YQIUOBXPAAYTSM-LSUCQFRVSA-N 405.542 2.399 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCc2nnc3n2CCCC3)cc1)C1CCCCC1 793585800 BDYZOWZKXZQXRM-UHFFFAOYSA-N 424.549 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](c4ccccn4)C3)CC2)cc1 799065049 AMIQNDWIXZLZCL-ZBTAVZRMSA-N 420.513 2.311 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ncc(-c3ccccc3)cn2)cc1F 803665210 YYGQZMJFYBBDHZ-UHFFFAOYSA-N 407.449 2.281 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc(N(C)C)cc1 804574534 NJEYRHZKRFYSBI-LSDHHAIUSA-N 408.502 2.326 10 20 HECD COC(=O)N1CCC(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 805832374 WHSOGBSNMUSKQG-UHFFFAOYSA-N 404.511 2.143 10 20 HECD O=C(NC1CC(N2CCCCC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807551763 FQVGLWLBRPAHLI-MHJFOBGBSA-N 415.534 2.033 10 20 HECD C[C@H](NC(=O)C(=O)NCc1nc(-c2cccc(F)c2)no1)c1ccc(N(C)C)cc1 807675268 VUSPEZYJIOLFCC-ZDUSSCGKSA-N 411.437 2.435 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](C)C1)c1ccc(N(C)C)cc1 807677987 UBMRFGFSTYAKDB-HZPDHXFCSA-N 418.538 2.398 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NCCc1ccc(O)c(O)c1 815833919 KNYYITKXPGOZMC-QHCPKHFHSA-N 423.469 2.146 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918439640 OGZADYUFMRHRRW-UHFFFAOYSA-N 419.428 2.189 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c[nH]c4ccccc4c3=O)cc2)C1 918670906 CNSXZIVIHSHTGE-INIZCTEOSA-N 404.470 2.160 10 20 HECD O=C(NN1CCCCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 920426898 GBLHZQKLVFVZSI-UHFFFAOYSA-N 420.447 2.232 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2cccs2)[nH]n1 1320396961 AFZJUFZFYNOXAD-AWEZNQCLSA-N 401.444 2.454 10 20 HECD CC(C)[C@@]1(CO)CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 1324148646 XFWMKIPGIHZOEM-IXFSTUDKSA-N 421.557 2.396 10 20 HECD CC1=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CCO1 1817694588 FWQOWOIKHMLGCG-OAHLLOKOSA-N 413.434 2.216 10 20 HECD O=C(Cc1cccs1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442070 UGKOBQRLFWVJND-UHFFFAOYSA-N 422.510 2.287 10 20 HECD C[C@H](OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)NC1CC1 5452755 MZARZOMPOUQEJR-JTQLQIEISA-N 408.366 2.194 10 20 HECD CNC(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1Cl 55892553 GZKUQZZWCBOKPZ-UHFFFAOYSA-N 416.909 2.469 10 20 HECD CS(=O)(=O)c1ccc(NCc2ccc(N3CC=CC3)cc2)c(S(C)(=O)=O)c1 301347342 KFXXXAQJDRCQKL-UHFFFAOYSA-N 406.529 2.482 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCN(c3ncccc3F)C2)n(C)c2ccccc12 583653836 MNYPYODWINXFIR-OAHLLOKOSA-N 409.465 2.032 10 20 HECD CCc1noc2ncc(C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)cc12 728101379 OLXIEQLXTPHFJO-UHFFFAOYSA-N 424.457 2.299 10 20 HECD CCO[C@H](C)c1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)s1 742560420 GGZJGPRRQQGAMS-CQSZACIVSA-N 423.560 2.405 10 20 HECD CCCN(C)C[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 745690319 ASPGZCWXAFGXIQ-WOJBJXKFSA-N 415.582 2.262 10 20 HECD Cc1csc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 746782872 GQBPZDORJABQMU-BETUJISGSA-N 406.483 2.459 10 20 HECD CC(=O)c1cc(F)cc(CN2C[C@H](C(=O)N3CCOCC3)Oc3ccccc32)c1O 750817058 IDOSNUHMOCHVET-HXUWFJFHSA-N 414.433 2.360 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3ccc(CNS(C)(=O)=O)o3)cc2)CC1 753604922 CORHLJWIKHTASX-UHFFFAOYSA-N 405.520 2.495 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(C)o1 754792210 IVIXWQGUIPFJSM-UHFFFAOYSA-N 408.476 2.284 10 20 HECD CN(C)CCN(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CCCC1 758714544 XUAOTXGHNIDZPV-IBGZPJMESA-N 415.582 2.404 10 20 HECD CC(C)CO[C@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 759566266 AQWGCNKHQPWANW-ICSRJNTNSA-N 402.539 2.345 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(C2CCCC2)n1 763279913 KDMLEZTXMIOQHV-UHFFFAOYSA-N 402.520 2.163 10 20 HECD CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 764400184 SBKCGVJBGLQCLA-UHFFFAOYSA-N 419.503 2.481 10 20 HECD COc1ccc(N2CCN(Cc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1F 766248683 MHXHHARMIGFYEY-UHFFFAOYSA-N 407.511 2.407 10 20 HECD COc1cccc(O)c1CN1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1 768160738 NPNICBOPFVUQJR-UHFFFAOYSA-N 416.421 2.325 10 20 HECD CS[C@H](CO)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769340490 KYAPEHMKDRCJLO-QMTHXVAHSA-N 416.546 2.097 10 20 HECD Cc1ccc(C(=O)N2CCC(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 785421831 FWCMHRKWAHMNOR-UHFFFAOYSA-N 422.529 2.098 10 20 HECD Cc1c(Cl)cccc1NC(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785422112 IPKQMYUCZQRJFH-UHFFFAOYSA-N 416.909 2.476 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1 785991625 PLNFZTPZEZNGSB-UHFFFAOYSA-N 411.458 2.104 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312509 HZBBPCDWKQJODC-UHFFFAOYSA-N 424.545 2.254 10 20 HECD C[C@@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 789818760 KUZDZNJSDQBHJN-JYJNAYRXSA-N 423.554 2.267 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@@H]3C[C@@H](C)O)CC2)cc1 790688012 WMZIVARLLOWSTI-UYAOXDASSA-N 404.555 2.152 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c(O)c1 794376401 FAEZAVCTWCSTKG-HNNXBMFYSA-N 410.517 2.240 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1 797651366 ZRNGRRFMVUKEMG-CYBMUJFWSA-N 411.466 2.023 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN2C2CCCCC2)cc1F 803661782 MYMSIXXFGMYPFJ-GOSISDBHSA-N 404.530 2.421 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1F 803664998 VRKYPQOCIYPWIB-OAHLLOKOSA-N 422.501 2.024 10 20 HECD COC(=O)[C@H](CNC(=O)c1cccc(O)c1O)Oc1ccc(Br)cc1 803766496 IEJYSUPAAZCQPS-AWEZNQCLSA-N 410.220 2.211 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C)c1OC 804275897 FTFJQVLFEZSRLB-UHFFFAOYSA-N 418.515 2.177 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(Cc3cccnc3)C3CC3)CC2)cc1 804314824 BCGWQALLCXSZSV-UHFFFAOYSA-N 408.502 2.366 10 20 HECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(C)c(O)c1O 804885207 MFHPMUSMWYTYAS-AWEZNQCLSA-N 408.451 2.031 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3(C)OCCO3)cc2Cl)C1 806377383 JXQAPJHOTGOUHD-OAHLLOKOSA-N 423.941 2.462 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C4CC4)c(C)cc3=O)cc2)CC1 807354673 FEMXZUXPWZCVFI-UHFFFAOYSA-N 408.502 2.090 10 20 HECD O=S(=O)(NC[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1)C1CC1 809784862 PCQXUWHAMVRUCL-LBPRGKRZSA-N 403.342 2.449 10 20 HECD Cn1nnc2c1C[C@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 810630193 GVWVGNMYJNUSAN-CJNGLKHVSA-N 403.914 2.060 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ncc(C(F)(F)F)s1 812960043 BIKMNCKPTLJAAO-UHFFFAOYSA-N 414.409 2.253 10 20 HECD COC(=O)c1cccc2c1OCCN2S(=O)(=O)c1ccc(Cl)c2nonc12 814388335 FNSSLFOQUKNAGV-UHFFFAOYSA-N 409.807 2.251 10 20 HECD CCN1CCN(CCCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 916504170 VQWULYSDVHHIBO-UHFFFAOYSA-N 417.598 2.082 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CCC4)cc2)C1 918464179 SLWMXCURHRBXFG-IBGZPJMESA-N 420.513 2.132 10 20 HECD COc1ncc(Cl)c(N2CC=C(CCNC(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)CC2)n1 1089874198 BQVRALKRJFAPCT-VUBIOHBQSA-N 404.898 2.205 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3sccc3S(=O)(=O)N(C)C)CC2)cc1 1336531565 MIRGIEFBTOPODH-UHFFFAOYSA-N 423.560 2.360 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CN)CCO3)cc1 1781753182 DTUMZCOUBPLDII-OSPHWJPCSA-N 424.545 2.132 10 20 HECD CC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)CCCCC1 1787295207 VEXPMVMKTAILEI-XIRDDKMYSA-N 417.506 2.057 10 20 HECD O=C(CCc1ccccn1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1807253655 XZHNHGXCJLNKJS-UHFFFAOYSA-N 424.501 2.365 10 20 HECD Cn1cccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816330855 WJHRUTPIWPNAOQ-CQSZACIVSA-N 410.434 2.174 10 20 HECD CO/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1828796450 SLSSJRXBJANILT-CLVCIHKQSA-N 403.479 2.276 10 20 HECD COc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250266 FGTNAWZRKYVJRI-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=C(c1ccc(O)cc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442348 CPLSMENDSXGKQO-UHFFFAOYSA-N 418.453 2.002 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnnn3C3CCCC3)CC2)cc1 29990901 KEVNJHAZTGXPKV-UHFFFAOYSA-N 402.524 2.238 10 20 HECD O=C1C[C@H](NCc2ccc(N3CCOCC3)c(F)c2)CN1CCOc1ccccc1 237864440 CEKUBDFHWKSQGN-IBGZPJMESA-N 413.493 2.432 10 20 HECD Cc1c(CNC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)n(C)c2ccccc12 472230088 LXIZBJUJMOZKSH-UHFFFAOYSA-N 411.550 2.326 10 20 HECD CNC(=O)CCOc1ccc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 472787780 NHPJYQCJZQCZLR-UHFFFAOYSA-N 422.485 2.257 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc3cc4c(cc3s2)OCCO4)c1 726979106 BOKRYPVVCZRCMT-UHFFFAOYSA-N 421.456 2.397 10 20 HECD CCCN(Cc1ccccc1O)Cc1nnnn1-c1ccc(S(C)(=O)=O)cc1 727830705 HYCSOWWEISUWSJ-UHFFFAOYSA-N 401.492 2.184 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)NCCCO)CC2)cc1F 731405131 UXLHOSRUHDSQSW-UHFFFAOYSA-N 408.518 2.092 10 20 HECD COC(=O)CN(CC(=O)NC[C@@H]1Cc2ccccc2O1)Cc1cc(Cl)ccc1O 732202797 DNQYALJNTKBPHE-KRWDZBQOSA-N 418.877 2.141 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCCN(c3ccccc3)C2=O)c1 734577630 GXTYWXSIOXIBEH-QGZVFWFLSA-N 404.444 2.116 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1C 749140757 BRZAJALIPQBJAX-UHFFFAOYSA-N 416.452 2.395 10 20 HECD C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NCCCSc1nccs1)C2=O 756991234 YZFNKSKSAWCFGL-IVWMJMPLSA-N 410.565 2.488 10 20 HECD Cc1ccc2c(c1)c(=O)n(C)c1nnc(COC(=O)/C=C\c3ccc(O)c(O)c3)n21 759595783 LZZIZMYQKAILEP-YVMONPNESA-N 406.398 2.057 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(N2CCCS2(=O)=O)cc1Cl 762261513 NXNURXQBGPREFE-UHFFFAOYSA-N 410.879 2.264 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(C4OCCO4)c3)cc2)C1 763962561 GRDZFJRPACOJLD-LJQANCHMSA-N 409.486 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1F 765504550 VFDZBJVNPBZTNC-SFHVURJKSA-N 423.485 2.119 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@]1(O)CCN(Cc2ccccc2)C1 765747939 RJWAZPIPENYNBI-IBGZPJMESA-N 405.292 2.408 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 770255020 FHWQJVCJYHYGMF-CYBMUJFWSA-N 417.487 2.187 10 20 HECD CCOC1CC(O)(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 770261846 KVZGUDPBWAWTRH-GWLAIFECSA-N 409.502 2.169 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1c(O)cccc1O 770402248 XEGZESMMXVDUOW-UHFFFAOYSA-N 423.448 2.284 10 20 HECD CCN1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 775057132 ZTQYUWNQMHIPJG-UHFFFAOYSA-N 412.534 2.475 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCC(CCCN3CCOCC3)CC2)cc1 780331288 SEIAOGAZJVWSOL-UHFFFAOYSA-N 402.583 2.193 10 20 HECD CNS(=O)(=O)CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 784705634 MCVLGTCIPPIZFW-UHFFFAOYSA-N 414.325 2.136 10 20 HECD COc1ncccc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766404 IEKBVVLQRZGIGJ-OAHLLOKOSA-N 418.881 2.169 10 20 HECD COC(=O)Nc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1F 785297739 RXCWMAODXORXCM-SNVBAGLBSA-N 405.382 2.101 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 789822458 WQYOXPIPCOTQPA-JZXOWHBKSA-N 421.513 2.131 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(OCCS(C)(=O)=O)c1 789835245 MKEBAULCCDOBFC-ZDUSSCGKSA-N 408.476 2.274 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@@H]3COCCN3C(=O)OC(C)(C)C)CC2)cc1 794763937 NMOPVGHPIOVFGN-GOSISDBHSA-N 419.522 2.370 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc2c1OCO2 800915719 RXUXIUFWPHXHIS-UHFFFAOYSA-N 404.488 2.103 10 20 HECD CCN(C)c1ccccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 804831056 PTPVNOYKAKMAKU-UHFFFAOYSA-N 424.545 2.254 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cc1F 804851845 QQDGJGKOUNTMTO-JKSUJKDBSA-N 420.529 2.194 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C[C@]2(CCOC2)O1 804853264 VIQWDXJNMUWETK-JTSKRJEESA-N 421.513 2.085 10 20 HECD CN(Cc1ccccc1)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806278493 SYHMGSLHJKBSIG-KRWDZBQOSA-N 418.588 2.474 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c(OC)n1 807513283 XVVLRFCMAGBXHD-UHFFFAOYSA-N 400.218 2.366 10 20 HECD CNS(=O)(=O)NC1CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 807973566 SCRWQFTXHYMYBU-UHFFFAOYSA-N 424.954 2.406 10 20 HECD C[C@@](O)(C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CCC1 812676942 PXWBYAUIRNOUKM-QHCPKHFHSA-N 407.422 2.495 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCCN(C(C)=O)CC2)c([N+](=O)[O-])c1Br 836204273 GHFPAULUZLFQFQ-UHFFFAOYSA-N 417.216 2.333 10 20 HECD Cc1ccc(O[C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918338445 UXSOLELLGJDKSU-QGZVFWFLSA-N 402.516 2.314 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1F)c1cc(O)nc(O)c1 1794537012 BFAGLNBUUIYCCE-ZSBIGDGJSA-N 420.828 2.246 10 20 HECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(F)c1 1796604807 OXNSXKOYRLLXIU-BTTYYORXSA-N 415.421 2.206 10 20 HECD Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1F 1847780626 RZBSWPCLNBYCTL-ROUUACIJSA-N 413.449 2.389 10 20 HECD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)o1 108804428 QVBPHHRACJPGQP-UHFFFAOYSA-N 421.519 2.123 10 20 HECD Cc1n[nH]c(C)c1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 728314729 PVARGHAZJVJGGD-UHFFFAOYSA-N 423.496 2.141 10 20 HECD CCCNC(=O)CCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 731686995 CZZKAABLHNKTAV-UHFFFAOYSA-N 401.429 2.465 10 20 HECD Cn1cnnc1CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 732763578 KWSJXOHDJRHUEG-RAXLEYEMSA-N 421.573 2.217 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@@H]3CCC[C@H](C)C3)CC2)cc1 733016257 AVCUGSVTQSVXRE-FXAWDEMLSA-N 404.507 2.482 10 20 HECD COC(=O)N(C)Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 735393763 GHXUNNOCXIDQKE-ZDUSSCGKSA-N 415.446 2.415 10 20 HECD CN(C)C(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 739699839 CKFHQSUHLCXQJJ-GOSISDBHSA-N 423.517 2.412 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CCS(=O)(=O)CC1 742807189 XUXPLBVTLSEXQY-AWEZNQCLSA-N 402.463 2.198 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 743193708 NSIHLDTUPNYNBN-UHFFFAOYSA-N 409.450 2.034 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1F 743599606 VBIYLMSWTGCBRD-KRWDZBQOSA-N 416.501 2.400 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC[C@@]1(O)CCSC1 747580615 UQEPZFCTNDIKAL-KRWDZBQOSA-N 419.469 2.209 10 20 HECD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3O)CC2)cc1 748354374 LCDTUJDYLITOIJ-UHFFFAOYSA-N 416.499 2.312 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(CN2CCOC2=O)c1 749731613 WPCCBOBVCZMPPK-UHFFFAOYSA-N 420.516 2.332 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CSCCS3)cc2)C1 752880378 ITHFEZJESBHPCV-RDJZCZTQSA-N 408.593 2.036 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(Br)ccc3=O)CC2)cc1F 753731495 OZAIPWZAFVCMTO-UHFFFAOYSA-N 424.270 2.107 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C2=NCC(C)(C)S2)CC1 754652451 YCWVTJUURLJWEO-UHFFFAOYSA-N 403.596 2.210 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(F)(F)c3ccc(OC)cc3)nc12 756334925 WPQVJJVFXLSGPE-UHFFFAOYSA-N 421.356 2.455 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(c2cccnn2)CC1 758418680 BSZUBGNKLNRAKB-UHFFFAOYSA-N 424.549 2.154 10 20 HECD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759225626 RRCRYOHZSDYBDT-HZPDHXFCSA-N 420.506 2.340 10 20 HECD O=C(Cc1ccnc(O)c1Br)NCc1ccc(N2CCOCC2)c(F)c1 772120395 FAZZGKVTIMWDQV-UHFFFAOYSA-N 424.270 2.384 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(CC(=O)NC2CCCCC2)c1 773750886 JPDFKVFHHGRABD-CQSZACIVSA-N 400.479 2.104 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCn3ccnc3)cc2Cl)C1 775099005 JUFVREWTQWJBDU-HNNXBMFYSA-N 403.914 2.205 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc([S@@](C)=O)cc3)nc12 775618975 KSJPWUSXEMNZSU-BODITIBLSA-N 402.476 2.200 10 20 HECD COC(=O)COc1ccc(N(C)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 784562313 WPVAVXRPCOYIDB-UHFFFAOYSA-N 408.476 2.252 10 20 HECD CCc1nc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788319521 LICINCLPYBHIRZ-CQSZACIVSA-N 402.520 2.036 10 20 HECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3ccc(OC)cc3O)ccc21 797390009 JREFBVDGUHKRHK-UHFFFAOYSA-N 411.458 2.345 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCCN1CCCCC1=O 804778849 HVBDGUZILXHSPI-UHFFFAOYSA-N 414.550 2.154 10 20 HECD CCOC(=O)C(C)(C)CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 805198131 KJIFPIUGGBRXDB-UHFFFAOYSA-N 408.495 2.340 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1OCCC(N)=O 916702320 YCKHKSZTIXSVBJ-UHFFFAOYSA-N 412.490 2.441 10 20 HECD CC(C)[C@H](CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1CCOCC1 918202753 XWZIKPIRYVZZBH-QFIPXVFZSA-N 418.582 2.051 10 20 HECD O=C(O[C@@H]1CCN(C2CC2)C1=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1322174287 LGBZVAISPDCYIH-OAHLLOKOSA-N 422.484 2.175 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3ncccn3)cc2)CCC1)c1cc(O)nc(O)c1 1787434375 JIOOAUADRAULAM-UHFFFAOYSA-N 405.414 2.344 10 20 HECD O=C(c1ccno1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426753 FMAZOCQFFUCWJI-HNNXBMFYSA-N 400.435 2.028 10 20 HECD C[C@@H](Cn1ccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846611740 PWXLNVBWAPFYJL-ZDUSSCGKSA-N 418.881 2.101 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)ccc3OC)CC2)cc1 23578421 XCKKQKJBXXKVAK-UHFFFAOYSA-N 402.422 2.349 10 20 HECD CCN(CC)c1ccc(CNCC(=O)Nc2cccc(S(=O)(=O)NC)c2)cc1 729687236 ZCENRJAVTLFBIY-UHFFFAOYSA-N 404.536 2.169 10 20 HECD CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 730118102 GYAMHQMZQVNQRZ-INIZCTEOSA-N 422.501 2.471 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(CCO)CC(C)(C)C)cc2F)C[C@@H](C)O1 730378675 SYUUZOZIMVIRKK-IAGOWNOFSA-N 409.546 2.396 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1 734073271 IZSYEKLCXJOKIS-UHFFFAOYSA-N 405.838 2.011 10 20 HECD COCCCOC1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 743555374 WYIWOYUEXORPGK-UHFFFAOYSA-N 409.502 2.389 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CCc3cccn3C)CC2)cc1 743568703 YCDSZOGKYCCKEA-IBGZPJMESA-N 413.566 2.476 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](COCc3ccccc3)C2)c1 743718695 QUDZYEFFCBDPEO-INIZCTEOSA-N 404.488 2.443 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccc(CN4C(=O)CNC4=O)cc3)ccc21 746706779 WRMCLXUDTTZGNC-UHFFFAOYSA-N 407.474 2.443 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C4CCOCC4)CC3)CC2)cc1 747584749 FLUXYXQGQDCTLC-UHFFFAOYSA-N 402.539 2.170 10 20 HECD CC(=O)c1cc(Cl)cc(CN2CCN(c3nccn4cnnc34)[C@H](C)C2)c1O 749450030 PHKSNWSZAOQYSS-GFCCVEGCSA-N 400.870 2.397 10 20 HECD COCCN(CCOC)S(=O)(=O)N(Cc1ccccc1O)C1CCCCC1 751137729 VYGQSVMRZNOLBG-UHFFFAOYSA-N 400.541 2.367 10 20 HECD Cc1nn(C)c(C)c1S(=O)(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751359938 MABGRZSYNFWOMQ-INIZCTEOSA-N 412.943 2.339 10 20 HECD CCO[C@@H]1C[C@H](N(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 754041585 CNUYCGHZYOLIPO-BAGYTPMASA-N 405.583 2.314 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC3(c4cccc(OC)c4)CC3)CC2)cc1 754162388 FNNURHOUKJPYKJ-NRFANRHFSA-N 411.546 2.466 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)[C@H]3CCCN(C4CCC4)C3)nc12 754465828 QBIKLOUJDSRLDF-GJZGRUSLSA-N 401.511 2.354 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(OCc2ncnn2C)cc1 766049157 ZOJNMCSPYMIIQN-UHFFFAOYSA-N 402.432 2.103 10 20 HECD CCC1(O)CCC(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 771954911 YEYDLDPIZVTKNI-UHFFFAOYSA-N 404.555 2.200 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cc3ccoc3)cc2F)C[C@H](C)O1 772575396 YUFRDYUROAASSL-GJZGRUSLSA-N 404.438 2.434 10 20 HECD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775403113 GMUOERPCBAATDK-CYBMUJFWSA-N 408.506 2.321 10 20 HECD COc1ccc(O)c(CN2CCN(c3ncc(Br)c(OC)n3)CC2)c1 775676593 VADSWUAYQWTXBG-UHFFFAOYSA-N 409.284 2.284 10 20 HECD COc1cc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)ccc1OCC(N)=O 776116104 CUNAZCMVUQHXCB-AWEZNQCLSA-N 400.479 2.186 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3sc(C)nc3C)CC2)cc1 778290770 XCRNIDKUHDKBGP-CMDGGOBGSA-N 414.531 2.290 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(C)nc3N(C)C)CC2)cc1 778392840 SZKCQFFKNJPXBI-VAWYXSNFSA-N 423.517 2.308 10 20 HECD CC(=O)N1CCCc2cc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)ccc21 785297402 OABJJHHKRDMFIT-ZDUSSCGKSA-N 411.458 2.083 10 20 HECD CC(C)NC(=O)Nc1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1 785422938 QNUPDOLWEZWBPH-UHFFFAOYSA-N 411.506 2.215 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1 785432327 ANAWOTNQHWBHQA-SJORKVTESA-N 418.538 2.321 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 785870476 NEZBIQOBZRCRSZ-ROUUACIJSA-N 418.582 2.105 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cscn3)cc2F)C[C@H](C)O1 789822976 BZPBPNZRIMYBJI-KBPBESRZSA-N 420.510 2.171 10 20 HECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789836600 TVQGGMQKIZCOLF-NVXWUHKLSA-N 405.514 2.488 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)[C@@H](COC(C)C)N(C)C3=O)cc2F)CC1 794771651 AYFYGDLKCQOETP-LJQANCHMSA-N 406.502 2.155 10 20 HECD C[C@@H](O)C[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 796386625 YBCJHRXYCWZGFM-MJGOQNOKSA-N 407.530 2.294 10 20 HECD CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(OC)cc2O)c1 797389519 LPIQZBYYRGZLSK-UHFFFAOYSA-N 400.435 2.106 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC3([S@@](C)=O)CCC3)cc2F)CC1 798104969 JQVXNSSQXVLUNN-MUUNZHRXSA-N 410.559 2.068 10 20 HECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 799915980 DXQUNCDAYVELBQ-RZQQEMMASA-N 413.497 2.372 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3CCOc4ccccc43)CC2)cc1 804082558 RDQHTHMOIYMWIC-SFHVURJKSA-N 423.513 2.416 10 20 HECD COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 804881162 OMMGNKGMCBFPCM-VIHMKRCTSA-N 420.462 2.122 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 807100601 LAGLDRBGKKZMDI-QFIPXVFZSA-N 408.546 2.410 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H](C)CCc3cccn3C)CC2)cc1 807649126 AEWKWZUIGAAUIZ-SFHVURJKSA-N 412.534 2.210 10 20 HECD NC(=O)C[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 809318229 NGPHGUYQKLTHHD-LQELWAHVSA-N 423.585 2.453 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1 810404033 BRKHUKFTCWOGQU-UHFFFAOYSA-N 406.504 2.229 10 20 HECD CCc1noc(C)c1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 817998746 MCURLVJKRWXWMU-KTKRTIGZSA-N 412.490 2.075 10 20 HECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1N1CCCC1=O 918304248 SWPXPIQEQJIYQO-UHFFFAOYSA-N 424.501 2.485 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2c(C)noc2n1 918340791 VGBKGBLLCUTYAM-UHFFFAOYSA-N 414.487 2.004 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2csnn2)cc1 920194610 BFSOWLHOLXVPIM-UHFFFAOYSA-N 423.498 2.297 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 920257252 IKTSBLCJJOHKQS-UHFFFAOYSA-N 404.492 2.167 10 20 HECD CCOc1ccc(N2CCN(C[C@@H](O)COc3ccc(C(=O)OC)cc3)CC2)cc1 1319611647 GQSMRMZSPVMOPU-HXUWFJFHSA-N 414.502 2.434 10 20 HECD CCOc1ccc(N2CCN(C[C@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1 1319613681 CDLYDYRJETUOQA-NRFANRHFSA-N 404.532 2.344 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2nccc2C)cc1 1342914653 HJKQOJNVAIRWGJ-SFHVURJKSA-N 409.442 2.496 10 20 HECD O=C(Cc1cnc[nH]1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788427888 BYJGLOSBRHLKKA-UHFFFAOYSA-N 407.430 2.206 10 20 HECD CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)CCCCC1 1791212557 CLIIOACBLNLTEO-XIRDDKMYSA-N 417.506 2.057 10 20 HECD O=C(Cc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816722671 UGSJUXSIGDEDRS-AWEZNQCLSA-N 424.482 2.418 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)C3CC3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1827464587 WDDJTPCAFXNLLX-ZDUSSCGKSA-N 423.498 2.258 10 20 HECD C[C@@]1(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1(F)F 1846990479 SGGUBSRHRTURHQ-JXTAAOLFSA-N 408.401 2.065 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037763 TUTPREMTMNATCW-RXQWTSATSA-N 400.475 2.456 10 20 HECD O=C(CCCc1ccccc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847547769 XGMKEGBRYNVFLI-ROUUACIJSA-N 413.449 2.470 10 20 HECD Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)o1 1847900875 FYDFMXUBELPFKQ-ROUUACIJSA-N 406.442 2.196 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CCOc2ccccc2)CC1 23294985 YBIXXAYWYXJTCP-UHFFFAOYSA-N 410.562 2.408 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1F 303398893 ZOBBJEADUIDYHL-UHFFFAOYSA-N 420.529 2.452 10 20 HECD O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=S=C(c2ccc3c(c2)OCCO3)C=C1 433102923 JWINBNPDTHCBPT-UHFFFAOYSA-N 405.439 2.273 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)n(C)c2ccccc12 472793479 XBMQTEWGQPVNKF-UHFFFAOYSA-N 420.391 2.466 10 20 HECD O=C(NCCn1c(=O)oc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 730118824 CPSJRNVUNSYDJC-UHFFFAOYSA-N 424.501 2.303 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1F 731373969 PLNHXYHEHMAIMU-UHFFFAOYSA-N 401.438 2.447 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)NC(=O)Cc2ccccc2)c1O 732829845 GGKHWIDKPYNWKQ-KRWDZBQOSA-N 402.516 2.498 10 20 HECD CC[C@H](C)[C@@](C)(O)CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 732883325 RBFXZDXLMNRIIP-AVRDEDQJSA-N 406.571 2.304 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(S(C)(=O)=O)o3)cc2F)C[C@@H](C)O1 733098222 XTTWDGMPYPKVJZ-CHWSQXEVSA-N 410.467 2.366 10 20 HECD COC[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 733198053 XBXAUVASVIEMFR-QGZVFWFLSA-N 419.547 2.283 10 20 HECD CCCS(=O)(=O)NC1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740919737 KTKRQNQGXWNQSM-UHFFFAOYSA-N 406.552 2.066 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(CCN(C)C)CC(C)C)CC2)cc1 743359886 YXGQZFRQVBIWRS-UHFFFAOYSA-N 405.587 2.046 10 20 HECD CCc1nncn1CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 743554682 KEDYOYJDTVIYMO-GJZGRUSLSA-N 404.490 2.093 10 20 HECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C1 743606049 RKFMTIRMFGLKER-MRXNPFEDSA-N 408.502 2.448 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(N(C)C)c(F)c3)CC2)cc1 743928829 ORUBNCVIQDYCEH-UHFFFAOYSA-N 400.498 2.452 10 20 HECD COc1cccc(CNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1O 745296136 BKHRSTCUONHSRU-MRXNPFEDSA-N 404.536 2.250 10 20 HECD CN1CCN(c2cc(CNC(=O)NCc3ccc(N(C)C)c(F)c3)ccn2)CC1 746722310 SOWVHKKDEOFMJU-UHFFFAOYSA-N 400.502 2.038 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1CCC(C)C 750227470 BCMCNUPZDOODKM-UHFFFAOYSA-N 418.563 2.402 10 20 HECD C[C@H](Sc1nnnn1C1CC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752150982 DBXQETFREAWXJT-XJKSGUPXSA-N 403.508 2.402 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)co1 756021457 VKHFGIFNICWWBQ-INIZCTEOSA-N 408.476 2.057 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c1 756710847 FOZRYIIZXSNKHL-SJORKVTESA-N 413.522 2.347 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)C[C@@H](O)c3ccco3)CC2)cc1 759575876 QJVLNWROOSIWMQ-YLJYHZDGSA-N 416.522 2.222 10 20 HECD COC(=O)[C@]1(C)CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 760151887 GLKCPDRVBHFCDL-GOSISDBHSA-N 424.500 2.280 10 20 HECD Cc1ccc(C)n1-c1ccc(-c2nc(CCN(C)S(=O)(=O)N(C)C)no2)cc1 763351784 KPZIGMDNEPFNTP-UHFFFAOYSA-N 403.508 2.425 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 764629924 QARPQXGJBYPRSI-IBGZPJMESA-N 419.522 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)OCC4CC4)n3)CC2)cc1 771055652 IGWCPZLGWOGZKY-HNNXBMFYSA-N 400.479 2.457 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)N(C)CC4)CC2)cc1 776039982 ZBAPPJTWFDVQGS-UHFFFAOYSA-N 408.502 2.365 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOc3ccccc3)CC2)cc1 778225754 OCQPJOUBZCMCFO-VAWYXSNFSA-N 409.486 2.095 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCOC3CCCC3)CC2)cc1 778252469 KVXZRKLKDPXVND-VAWYXSNFSA-N 415.534 2.366 10 20 HECD Cc1cc(O)cc(=O)n1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 783567268 WNAQTMSVTWXFJI-HOTGVXAUSA-N 417.481 2.322 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 787046008 ZFKJPTIAIBMXRY-UHFFFAOYSA-N 414.466 2.175 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(Cc2cccc(F)c2)CC1 788928790 CZIGZOMOQSJMNF-UHFFFAOYSA-N 424.520 2.387 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C 789779694 ZHJWOFBWJUBIQP-CXAGYDPISA-N 413.474 2.169 10 20 HECD CS[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834257 LHCCBSQQMYTKAM-RDJZCZTQSA-N 423.554 2.193 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nc1Br 793050680 FMNAHXKPDYCPGJ-JTQLQIEISA-N 408.252 2.250 10 20 HECD CCOC(=O)C1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 793678069 YUONTNRISXJFSO-UHFFFAOYSA-N 415.534 2.482 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCOCCc3ccccc3)ccc21 793720780 UKVRDRHBPYXIJQ-UHFFFAOYSA-N 409.530 2.451 10 20 HECD CS(=O)(=O)NC1CC(NC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 802593956 YRYREAWMQSSKSM-UHFFFAOYSA-N 415.475 2.237 10 20 HECD CCc1cnc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803301474 RJWVLPHFXCSDLP-HNNXBMFYSA-N 416.547 2.078 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nnc2ccccn12 803685503 CCUBUDWLNSPCKG-HXUWFJFHSA-N 420.517 2.241 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](CCN(C)C)C(C)(C)C)CC2)cc1 806389562 TYVPZVKTWWOAIR-HXUWFJFHSA-N 418.582 2.217 10 20 HECD CC(C)(C)OCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770978 QNFIKROANCMWNP-AWEZNQCLSA-N 413.465 2.304 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCO[C@H](CC(C)C)C3)CC2)cc1 808074173 PRXJBGVPGAONOT-GHTZIAJQSA-N 417.550 2.444 10 20 HECD C[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)N1C 815179471 RMGMGJRHGICJGA-XMTFNYHQSA-N 406.546 2.080 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cn(Cc2ccccc2)nn1 815351790 PANIHWMSZHDLMZ-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)cc2)cc1)N1CCOCC1 863986694 CIZFOGWIRFHLNF-UHFFFAOYSA-N 417.531 2.156 10 20 HECD O=C(CCn1ccccc1=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456564 KEFQZAKUKVPGLL-UHFFFAOYSA-N 409.408 2.410 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 918294582 HBFCQVPLPIVCDZ-IBGZPJMESA-N 411.458 2.497 10 20 HECD C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1ccc(N2CCSCC2)cc1 918616996 BTICBEXENLBSBD-ZDUSSCGKSA-N 404.565 2.358 10 20 HECD COc1cc(F)cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 1327642365 GFZRADQTNVHGLT-UHFFFAOYSA-N 407.467 2.391 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1C1CC1)CCO2 1782004480 WNLZHRVLHRHHAU-GXZWQRSESA-N 420.893 2.241 10 20 HECD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)cnn1C 1795267060 IFDBOIQYLNNEOQ-BTTYYORXSA-N 418.881 2.359 10 20 HECD Cc1cccnc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1841713201 DHDCMWXVNOSKMQ-SOFGYWHQSA-N 409.442 2.037 10 20 HECD COc1cc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-] 66024636 UUUSQIUVNIEOKS-UHFFFAOYSA-N 419.409 2.274 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)n1 472771259 CACDRWBOXMIFKW-UHFFFAOYSA-N 417.473 2.334 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c1O 727763012 XDXWQZFOLLGEQW-OAHLLOKOSA-N 424.544 2.488 10 20 HECD COC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729063290 YSIUPMPGCIJNGX-GFCCVEGCSA-N 401.419 2.419 10 20 HECD Cc1cc(C(=O)CN2CCCC[C@H]2[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730261360 IGXLDLGGISUFHS-UZLBHIALSA-N 419.547 2.160 10 20 HECD O=C(Nc1ccnc2ccnn12)/C(=C\C1=S=CC=C1)n1nnnc1-c1ccccc1 731169057 UEMWJFKCHHXTGB-DTQAZKPQSA-N 414.454 2.140 10 20 HECD C[C@H](NC(=O)N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(N2CCOCC2)cc1 732572715 XZSLDMFVVJPEKW-BBRMVZONSA-N 414.428 2.047 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1 734703645 SJUNWBQGLVQYIW-UHFFFAOYSA-N 424.545 2.191 10 20 HECD Cc1ccc([C@H]2COCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 735078382 KLEHWRCZUONIFT-HXUWFJFHSA-N 417.481 2.253 10 20 HECD CCc1cc(CNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)on1 741275775 QVYANNKFCWPJDP-UHFFFAOYSA-N 401.511 2.257 10 20 HECD CN(C1CCOCC1)S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742334545 PGLAZYAOPRPGLQ-AWEZNQCLSA-N 419.494 2.202 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)c2)n1C 746379390 LMSNLISDILCOCS-UHFFFAOYSA-N 418.501 2.428 10 20 HECD CCS(=O)(=O)N1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)CC1 748091210 FYYPETXRFQSIFZ-UHFFFAOYSA-N 407.511 2.383 10 20 HECD O=S(=O)(CC[C@H]1CCCO1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751373513 UIEYNWARVMZHCM-IAGOWNOFSA-N 402.944 2.499 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)CC(C)(C)C)cc2F)C[C@@H](C)O1 751767476 VJHQRMDLFKGIHK-CLCXKQKWSA-N 424.513 2.396 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc2c(cc1C(=O)OC)OCO2 753851559 COBHWAGTWOXBLC-UHFFFAOYSA-N 414.414 2.285 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](c4nccn4C)C3)cc2F)CC1 756695926 ZGANLZZOBIFUCK-SFHVURJKSA-N 414.529 2.400 10 20 HECD O=C(CN1CCO[C@H]([C@@H]2CCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 756898825 ZHJSLUGOUDHBKM-PMACEKPBSA-N 420.465 2.280 10 20 HECD CCc1cc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n[nH]1 759266127 GNASJVFWZLAQMQ-UHFFFAOYSA-N 403.483 2.030 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNc3ccccc3C(N)=O)cc2F)C[C@@H](C)O1 764384214 WEEPDONITMXFFQ-HUUCEWRRSA-N 414.481 2.267 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 764407977 GAZNBNVVLJOVRQ-CQSZACIVSA-N 418.454 2.380 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 768485115 SXNNCDBZOCGXBL-OAHLLOKOSA-N 420.510 2.048 10 20 HECD CN(C)c1ccc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1F 769450859 IFKCBYIEYYQAGO-UHFFFAOYSA-N 419.522 2.253 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOC2(CCOCC2)CC1 769493050 RTWQNWIAYVSSQG-UHFFFAOYSA-N 407.486 2.143 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCc2ccccc2CN2CCOCC2)c1 775365548 WHIGXWQRJFMJEL-KRWDZBQOSA-N 413.518 2.200 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(C)c1 783321499 QQNQIFIPFUUZBT-UHFFFAOYSA-N 410.518 2.461 10 20 HECD COCCCOc1cccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785293994 IPTXFDNMHCYBLT-AWEZNQCLSA-N 402.447 2.199 10 20 HECD O=C(OCC(=O)C1CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398132 MWISZYUYCBSONA-UHFFFAOYSA-N 420.399 2.237 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)cc1 788977741 MHPULZCIHBZJIS-IEGUWTFLSA-N 417.550 2.334 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCCN(C(C)=O)C3)cc2F)CC1 792993891 YQXSLKIZYPLYTC-IBGZPJMESA-N 419.545 2.025 10 20 HECD CC[C@@H](C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC(=O)OC 799169414 IXQRYUUGCKDANO-ZACQAIPSSA-N 423.529 2.329 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1cccc(OC)n1 803690709 SRTSWXAYFHMPRR-UHFFFAOYSA-N 422.279 2.223 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)cc2)CC1 805025099 IMYZYHUATQAILW-QGZVFWFLSA-N 416.566 2.301 10 20 HECD CCC1(CC)[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1OC 809438382 PZRFBKQRKAAWDH-WOJBJXKFSA-N 417.550 2.192 10 20 HECD CNC(=O)c1cc(S(=O)(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cn1C 914792176 DTGRGLVKFJNKJN-UHFFFAOYSA-N 414.531 2.313 10 20 HECD COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1ccc(N2CCSCC2)cc1 917083874 GFOFGCAECUOIIZ-UHFFFAOYSA-N 421.544 2.286 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3ccccc3F)cc2)C1 918116922 CIJQOLNOKNIFKR-UZLBHIALSA-N 414.481 2.060 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)cc1F)c1cc(O)nc(O)c1 1800375620 DGIORUUVNPQFAR-ZSBIGDGJSA-N 421.375 2.476 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1 10906877 GLUXJJFAKPOTGO-UHFFFAOYSA-N 417.531 2.046 10 20 HECD CCOc1ccc(S(=O)(=O)NCCC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 728980424 FPUWVGZPLMXFGW-AWEZNQCLSA-N 422.503 2.345 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)c1 729064502 SKPQSFYPUGJRCB-AWEZNQCLSA-N 411.458 2.339 10 20 HECD COCCN1C(=O)/C(=C/N[C@H](c2ccc(F)cc2)c2cccs2)C(=O)NC1=S 730971314 QERHGHODZDLBPU-WSYSLRRZSA-N 419.503 2.340 10 20 HECD CN(C[C@@H](O)COCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)cc1 732884232 HFCFFAYYSFMYKR-JOCHJYFZSA-N 413.518 2.242 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H]3OCCc4ccccc43)nc12 734606264 MQMPRSVDLCXCBD-QGZVFWFLSA-N 411.414 2.359 10 20 HECD COC(=O)CSCc1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 737278971 SICANOVMPSUXQW-UHFFFAOYSA-N 418.471 2.062 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c(C(N)=O)c2)NC(=O)OC(C)(C)C)cc1 742755028 UNSUPUJKVBMDOJ-QGZVFWFLSA-N 415.494 2.175 10 20 HECD CCOc1ccc(N(CC)CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1 748306617 XKCHIOMWIDDUSX-QGZVFWFLSA-N 420.535 2.415 10 20 HECD COC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2cccc3nonc23)c1 753922773 CYMZUEOUTYIDJF-UHFFFAOYSA-N 402.432 2.410 10 20 HECD COc1cc(C[C@@H](NCc2ccc(N3CCOCC3)c(F)c2)C(=O)O)cc(OC)c1 756367611 UYYDHSWTKSOXLL-HXUWFJFHSA-N 418.465 2.465 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3Cc4cccc(O)c4C3)cc2)C1 758434542 BQPIAWZZXXMKBZ-QZTJIDSGSA-N 408.502 2.061 10 20 HECD COC(=O)c1cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1C 759514391 VTLDTKPLGYNVAA-UHFFFAOYSA-N 400.479 2.342 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)cc2)C1 760902799 ACAPYGOSINMFNL-GSEOLPGOSA-N 400.523 2.145 10 20 HECD CCN1CCN(c2ccc(CN3C(=O)N[C@@H](CC(F)(F)F)C3=O)cc2F)CC1 761284315 UIBMVPIMPQMDJC-AWEZNQCLSA-N 402.392 2.340 10 20 HECD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC1(O)CCS(=O)(=O)CC1 767375752 PNZSIGQKXCNAGB-UHFFFAOYSA-N 424.563 2.404 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 772484553 HFSXVYGWFSSPNK-KFKAGJAMSA-N 410.536 2.235 10 20 HECD COc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nn1C 773194237 VFUBVFRVQHCLNQ-KRWDZBQOSA-N 417.510 2.491 10 20 HECD COc1cccc(CN2CCC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3=O)C2)c1O 777223309 TUNLTQQBIWKAJG-QGZVFWFLSA-N 419.522 2.445 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccn1 778543193 PVLVGUXYUYDKNN-UHFFFAOYSA-N 412.490 2.303 10 20 HECD CCCn1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 781607314 UCTGGOMPRLXOBY-UHFFFAOYSA-N 423.496 2.479 10 20 HECD C[C@H]1CCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 783917984 BMHSHTYGVUPNNJ-ZDUSSCGKSA-N 409.533 2.469 10 20 HECD O=C(OCCC1(O)CC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785397853 LMLLMHLWSSHDRH-UHFFFAOYSA-N 422.415 2.173 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)cc1 786686240 ZFAFMRWFJALBII-CQSZACIVSA-N 403.429 2.295 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCc2ccc3c(c2)CCCN3C)n1 786734859 MHVANVWQDHFBHO-UHFFFAOYSA-N 419.551 2.330 10 20 HECD CN(C)[C@]1(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)CCSC1 788242529 JMBHHZTWLYGAAT-NRFANRHFSA-N 417.531 2.068 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@]3(CO)CC(C)C)CC2)cc1 789512705 BDFWFASRFXZUHY-GMAHTHKFSA-N 405.583 2.051 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc2c(n1)CCCC2 789860584 MGZZREZPWUGWSC-UHFFFAOYSA-N 424.570 2.446 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4nccnc4cc3F)nc12 795871150 XNAAJELGWMYRBN-UHFFFAOYSA-N 411.349 2.051 10 20 HECD CS[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803306588 WJCGBEBOWNZKLS-SZVBFZGTSA-N 405.564 2.491 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC(c4nncn4C)CC3)cc2)CC1 805023917 CPNTWVQGNVWWFE-UHFFFAOYSA-N 424.549 2.074 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806254792 SUTIUHVKJNGMTB-VQTJNVASSA-N 417.550 2.281 10 20 HECD Cc1noc(C)c1CCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806477855 NLYNOZHDRHZTRF-SFHVURJKSA-N 415.490 2.254 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC4(CCOCC4)CC3)cc2)C1 806495653 JXFIQWZFLZVMIJ-IBGZPJMESA-N 414.550 2.491 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290482 WNXRDPRLKPVAKL-HXUWFJFHSA-N 418.541 2.412 10 20 HECD NC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 807513013 OVVADKTWCYIWNY-UHFFFAOYSA-N 400.193 2.192 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N(C)CC3(CO)CC3)cc2Cl)C1 807953145 ONEVCDREMQXDLS-OAHLLOKOSA-N 407.942 2.423 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNCc3ncc(C4OCCO4)s3)cc2)C1 809632449 PZIMPPZATDWXCC-HNNXBMFYSA-N 402.520 2.180 10 20 HECD Cc1cccc2c1OC[C@H](NC(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 812009524 IHHYUKKYMHLALX-VQTJNVASSA-N 422.529 2.500 10 20 HECD CCn1nncc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 815710762 UYBKATBPPAJRCL-INIZCTEOSA-N 402.499 2.360 10 20 HECD COc1ccc(N2CCCN(CN3C(=O)N[C@H](Cc4ccccc4)C3=O)CC2)cc1 917486934 APMBAUPXNVEDHC-OAQYLSRUSA-N 408.502 2.328 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1 917751597 ILZOGZLPSQZRBR-UHFFFAOYSA-N 423.516 2.141 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)OCCO4)cc2)C1 918001425 MUDFVMKMWFERQM-GOSISDBHSA-N 424.501 2.159 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)cc1)NCc1ccc(N2CCOCC2)c(F)c1 918975424 YWKULMMDNWAGHV-XBXARRHUSA-N 414.433 2.241 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)OCC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 1318955932 DYEXPOICFWLLJO-KRWDZBQOSA-N 418.515 2.171 10 20 HECD C[C@H](c1ccccc1)N(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 1319814774 XHPXCUBXSBUNGQ-APWZRJJASA-N 402.516 2.259 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 1320386945 PZHQFEFESQGJML-LPHOPBHVSA-N 416.405 2.021 10 20 HECD O=C(CCc1cccc(O)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602479 MHYFYVUTMPVDQD-BJWYYQGGSA-N 411.458 2.083 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1ccc(CO)o1 1800716660 RHGXWGLRCGTCPN-CLLJXQQHSA-N 420.849 2.402 10 20 HECD O=C(COc1cccnc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848125891 ULCQOPDKSKVHFV-HOTGVXAUSA-N 417.849 2.041 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccccn4)n3C)CC2)cc1 11137060 HAISHOVGZBWXLY-UHFFFAOYSA-N 424.530 2.327 10 20 HECD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3cccc([N+](=O)[O-])c3)C=C2)cc1 532069520 PTBRDSKDAYJPNK-UHFFFAOYSA-N 411.439 2.255 10 20 HECD CCOC(=O)c1c(NC(=O)COC(=O)c2ccc(C)c(O)c2O)oc(C)c1C(C)=O 727005917 XMILJKFZQMVZLM-UHFFFAOYSA-N 419.386 2.482 10 20 HECD C[C@H](NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2)C(=O)N(C)C 727142721 JYKWOJSXRUZKFZ-AWEZNQCLSA-N 403.504 2.119 10 20 HECD Cc1cc(CC(=O)N2CCO[C@@H](c3nn[nH]n3)C2)c(C)n1-c1ccc(Cl)cc1 732090003 FLIUKUQVLGGHST-QGZVFWFLSA-N 400.870 2.403 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCn3cnc4ccccc43)CC2)cc1 742927759 ZEHHPPRSZRKUFR-UHFFFAOYSA-N 407.518 2.373 10 20 HECD CN(CC[C@@H]1CCCCN1C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745691357 JJBUYLCBLLMLEP-UXHICEINSA-N 415.582 2.404 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cnn(Cc4ccccc4)c3)CC2)cc1 746700440 XQWNLBYYWPXEIW-UHFFFAOYSA-N 412.515 2.451 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)c1c(F)cccc1Cl 748396448 OMHKOMIITNIZFE-FVMDXXJSSA-N 416.858 2.408 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@H](O)c3ccc(Cl)cc3)nc12 750371536 IRONOVWFRALDHP-HNNXBMFYSA-N 419.821 2.432 10 20 HECD Cc1cc(C(=O)CN(C)CC2(O)CCCC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 752132391 ZIMRXKKYFAMURE-UHFFFAOYSA-N 419.547 2.161 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)N1CCCC1 753636315 MBSKDWXUYARUSR-GFCCVEGCSA-N 410.517 2.305 10 20 HECD Cc1nnc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 755137700 AVQFNDSSPSVEIN-MJBXVCDLSA-N 405.474 2.098 10 20 HECD Cn1ncc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1C(F)F 758963093 CBYIRRQYYSHQTC-ZDUSSCGKSA-N 408.405 2.210 10 20 HECD CCCC(=O)N1CCC[C@@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759240149 IFPZAPAISWORJN-QGZVFWFLSA-N 419.522 2.152 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccnc3OCC(F)F)CC2)cc1 760564024 OUFDHPJNVNUDEB-UHFFFAOYSA-N 420.460 2.286 10 20 HECD CN(C)S(=O)(=O)c1ccsc1C(=O)NCc1cccc(Br)c1O 765756210 LIFFAPSWUBGIMO-UHFFFAOYSA-N 419.322 2.397 10 20 HECD C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCc1cccc(Br)c1O 765765142 ODTDVYLNHUBDTI-SECBINFHSA-N 419.322 2.199 10 20 HECD Cc1cc(C)n(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(=O)n1 765981662 CQJZKPNAOIPQKW-UHFFFAOYSA-N 424.423 2.032 10 20 HECD Oc1cc2c(cc1CN1CCC[C@H](CN3CCN(c4ccccn4)CC3)C1)[C@H](O)CO2 768443505 FLKOGMYPDYSXPY-XMSQKQJNSA-N 424.545 2.247 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N(C)C)cc1 773083829 IHUYTKVUNJLPAJ-CQSZACIVSA-N 423.560 2.233 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1O 774876561 AQIQUVIGKLFCAB-RDJZCZTQSA-N 420.510 2.122 10 20 HECD C[C@H](NC(=O)N1CCN(CC(C)(C)O)C[C@H]1C)c1ccc(N2CCOCC2)cc1 780338125 JHUQEBGNSIYUQK-MSOLQXFVSA-N 404.555 2.071 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc4c(cc3C)OCO4)CC2)cc1 781484353 SXEDKQRJDNFNIJ-UHFFFAOYSA-N 411.458 2.456 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](O)Cc1cccc(OC)c1 785625505 QHRGWFXSUMKTGI-SFHVURJKSA-N 407.850 2.159 10 20 HECD COC(=O)[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[C@@H]1C 787325979 GWFUMAJCSYTLRI-ZIAGYGMSSA-N 406.438 2.284 10 20 HECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(CC)CC 788313048 OPSABPPGCOYFRM-UXHICEINSA-N 417.550 2.239 10 20 HECD Cn1cccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788335239 LCZFTBPCNJFSLI-CQSZACIVSA-N 406.433 2.028 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(Cc2ccsc2)CC1 788911115 OWOHBVCXWKVRHM-UHFFFAOYSA-N 412.559 2.309 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1 788975589 RDSJGWSWHLZLBV-UHFFFAOYSA-N 424.549 2.098 10 20 HECD C[C@H]1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789836762 WENADCOQZZHHBR-RDJZCZTQSA-N 405.514 2.346 10 20 HECD C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H](C)C1 789840611 KWFGUNIHWVIOAU-CLCXKQKWSA-N 405.514 2.344 10 20 HECD COc1cc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1O 789900042 HBJZZKOVNRRGLO-UHFFFAOYSA-N 404.438 2.244 10 20 HECD CN(C)c1ccc([C@@H](CNS(=O)(=O)c2ccnn2C)NC(=O)OC(C)(C)C)cc1 795248693 JNEIRJFXWLTMFS-MRXNPFEDSA-N 423.539 2.030 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Oc3ccc4c(c3)CC(=O)N4)CC2)cc1 797770457 ZALVBHRNSXGURC-CMDGGOBGSA-N 421.453 2.000 10 20 HECD Cn1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 803449017 LNKJKYPLGQVYRD-UHFFFAOYSA-N 406.433 2.028 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 803563353 YSOMCLROJPYJNY-AZUAARDMSA-N 417.550 2.136 10 20 HECD CN(C)CCN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803660884 HWVJMPQAUZRAKY-UHFFFAOYSA-N 418.488 2.237 10 20 HECD O=C(NCc1cscn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804021258 WZYBHPPSEYVPEY-GFCCVEGCSA-N 410.446 2.146 10 20 HECD C[C@H](OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1nncn1C 805337318 OEDKAIBIWISDOW-JTQLQIEISA-N 406.354 2.417 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 806164616 YIBDUHFNKNPDMP-NRFANRHFSA-N 405.502 2.431 10 20 HECD Cc1cccc(N2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)c1 806276156 JORGYLDJOBQXTN-UHFFFAOYSA-N 404.561 2.399 10 20 HECD NC(=O)c1ccccc1NCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 809727707 SNFCXSSAGSHOKU-MRXNPFEDSA-N 416.909 2.337 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC(=O)N(c2ccccc2F)C1 812877590 AUVWDFRCJQIZFZ-QGZVFWFLSA-N 412.465 2.267 10 20 HECD C[C@@H](CO)N(C[C@H](C)c1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 813672215 XIHLUSPGTTVDTB-GJZGRUSLSA-N 406.504 2.390 10 20 HECD O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(N2CCSCC2)cc1 917386325 UOAKJVUFPWPSSL-UHFFFAOYSA-N 416.547 2.111 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 919699639 UMGAIYOCVAQPRZ-UHFFFAOYSA-N 422.464 2.276 10 20 HECD COc1cc(N2CCN(C(=O)c3cc4c(cn3)OCCC4)CC2)cc(OC)c1OC 1254761098 JUSYOMQIAKIMIE-UHFFFAOYSA-N 413.474 2.395 10 20 HECD CN1CCC(N2CC[C@H](N(C)Cc3ccc(N4CCN(C)CC4)c(F)c3)C2)CC1 1261183174 JXCSUEDDSMVGMR-NRFANRHFSA-N 403.590 2.178 10 20 HECD C[C@@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C(=O)OC(C)(C)C 1321755977 KEOQTRGETLYBBA-LBPRGKRZSA-N 415.512 2.139 10 20 HECD O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4COC[C@H]43)CCC2)cc1)c1cc(O)nc(O)c1 1788429637 QAVROTZEINDWBS-MNZLEMJZSA-N 409.442 2.133 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848388 GXIRMCBKCBXBDM-XHDPSFHLSA-N 415.450 2.137 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843970701 XHHPRBCYFYAFKK-SBYGYFDASA-N 400.475 2.456 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1ccccn1 1847036754 AWPUGKJBFFIATE-HEWZJLJBSA-N 423.469 2.219 10 20 HECD CN(C)S(=O)(=O)c1ccc2oc(SCC(=O)c3ccc(O)c(O)c3)nc2c1 7254343 ZHADZACKOCSBFC-UHFFFAOYSA-N 408.457 2.464 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)c1C 542024082 KRFWTCXRIJDUEY-UHFFFAOYSA-N 404.492 2.400 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1O 727761362 WVVOHCYYJAFLIV-KRWDZBQOSA-N 404.488 2.260 10 20 HECD CCCN(CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1O 727831329 WCHXMNQACRHZAS-UHFFFAOYSA-N 405.520 2.493 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 733648021 ZMARWUUDMCRQBY-FQEVSTJZSA-N 417.598 2.381 10 20 HECD CCO[C@H]1C[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 740887207 QUHDUZXCFPRESF-PMACEKPBSA-N 407.530 2.414 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1O 745690771 DKBCPVGZDYRBKY-KRWDZBQOSA-N 412.490 2.102 10 20 HECD C[C@@H](NS(=O)(=O)c1cnn(C2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 749919737 LKRGFBVKNZPAIT-MRXNPFEDSA-N 420.535 2.111 10 20 HECD O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 751239435 JEEZJIOUFISCRC-UHFFFAOYSA-N 423.466 2.421 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1sccc1S(=O)(=O)N1CCCC1 753636318 MBSKDWXUYARUSR-LBPRGKRZSA-N 410.517 2.305 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cnc2N)cc1 754750820 YZJOANLKERTBPK-UHFFFAOYSA-N 404.901 2.270 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 756825634 ZWVQFMVMMUROQB-DEOSSOPVSA-N 423.513 2.187 10 20 HECD CO[C@@]1(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOC1 763640784 NJFMWGOENGXSMZ-GOSISDBHSA-N 417.428 2.147 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1O 768085123 BYYNOMYJAMPDEF-UHFFFAOYSA-N 406.442 2.330 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3cc(Cl)ccc3O)CC2)c1 768154933 CBYIODZKLYXODE-UHFFFAOYSA-N 411.867 2.460 10 20 HECD C[C@@]1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 770115681 ILDCRJHAOBCILY-GOSISDBHSA-N 421.431 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4csc5cncn45)n3)CC2)cc1 771059145 XVYCIOFDWYESSA-UHFFFAOYSA-N 424.486 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(N4CCOCC4)cn3)CC2)cc1F 772436637 NMXPCERQNJSZHQ-UHFFFAOYSA-N 415.469 2.420 10 20 HECD CC(C)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H](C)C1=O 777459322 NUTUDLXLXJRJBM-MRXNPFEDSA-N 406.502 2.061 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COC(C)(C)C)cc2F)C[C@H](C)O1 778153965 WQBARTSYMLMOFL-GJZGRUSLSA-N 410.486 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3Cc4ccccc4C3)CC2)cc1 778286172 VUQBBDAQOKHKIL-KHPPLWFESA-N 419.525 2.431 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(=O)NC4CC4)cc3)c2)CC1 781047449 PDDMKMSBCJVODU-UHFFFAOYSA-N 406.486 2.500 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccccc1Cn1cccn1 785641300 REQQFDJJLOTPEA-UHFFFAOYSA-N 417.513 2.464 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCCN3C(=O)C(C)C)cc2)CC1 786656628 PIKGNAXPDHLLEK-NRFANRHFSA-N 414.550 2.008 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(N(C)C)cc1 787741997 YRLFTAZHUSSLMD-UTKZUKDTSA-N 422.529 2.410 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1 788928659 MIRWBQNTHKTDIF-UHFFFAOYSA-N 422.529 2.134 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](C)N1CCc2sccc2C1 789720744 ARHYJJXWKTVMTH-INIZCTEOSA-N 414.575 2.302 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2COC(=O)N[C@@H]2CCOC2)cc1 796623546 LWVHFKMVZONMPM-MJGOQNOKSA-N 404.511 2.332 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)cc3cccnc23)cc1 797431223 JZZQIZSHLMLMEJ-UHFFFAOYSA-N 406.489 2.220 10 20 HECD O=C1CN(c2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2Cl)CCN1 799121972 UXUOQOPYJNWEQO-UHFFFAOYSA-N 423.907 2.082 10 20 HECD Cn1nnc2c(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccnc21 800903331 VVCLOMDLEAKMNV-GFCCVEGCSA-N 402.405 2.364 10 20 HECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 807100963 PACZNCMATSTGSM-OAQYLSRUSA-N 422.529 2.297 10 20 HECD CN(CCCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291060 DYJWAMORCZQXRV-UHFFFAOYSA-N 416.522 2.052 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807674756 QJDSDHWBXBKWBW-MRXNPFEDSA-N 418.538 2.399 10 20 HECD CN(C)c1cccnc1CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 811934115 SYRLKVNFMRPGMP-UHFFFAOYSA-N 401.486 2.247 10 20 HECD O=C1COc2cc(NC(=O)C(=O)N(Cc3ccco3)Cc3ccccc3O)ccc2N1 919663805 OOAWGYDENNQSJG-UHFFFAOYSA-N 421.409 2.484 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3nnn(Cc4ccncc4)c3C)CC2)cc1 1321904629 JIVQYLDHCYKBOK-UHFFFAOYSA-N 406.490 2.391 10 20 HECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1795008054 MDCJQFAMZQCSJK-VYMNDLDVSA-N 423.469 2.472 10 20 HECD C[C@H](Cc1ccncc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796604232 SRFQIYRVUPKWHC-NKGKWGDASA-N 410.474 2.018 10 20 HECD CCOc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1799567255 QBEPRTBDJWIWQS-MUJYYYPQSA-N 411.458 2.457 10 20 HECD Cc1cc(C)n(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845500860 XIAVGJGUIRITJO-UHFFFAOYSA-N 418.881 2.082 10 20 HECD Cc1ccnc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1 1847038817 JPSUNXUPORRWFQ-GQCTYLIASA-N 409.442 2.037 10 20 HECD C[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(N(C)C)cc1 302457467 UTRGFDUIYIKDHU-MRXNPFEDSA-N 403.552 2.257 10 20 HECD CCN(CC)CCO[C@@H]1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1 564363818 MKFNRBUHKCBYIC-GOSISDBHSA-N 414.550 2.062 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2Br)SC1=S 727177484 KMKNYZYKMOAILL-DHZHZOJOSA-N 421.363 2.200 10 20 HECD CCCCc1noc(C[S@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 729872898 SNRYAMFPWIMVLN-LJAQVGFWSA-N 420.535 2.018 10 20 HECD COC(=O)CN(CCN1C(=O)c2ccccc2C1=O)Cc1cc(Cl)ccc1O 732202809 FKQGBKCANLLVSV-UHFFFAOYSA-N 402.834 2.317 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(OC(F)F)c1 732478806 DXNZPSDHUYKRGS-UHFFFAOYSA-N 421.400 2.396 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cc(OC)ccc3O)CC2)cc1 734068581 ZBUQIQGOPJOZIJ-UHFFFAOYSA-N 414.506 2.031 10 20 HECD CC(=O)Nc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 736329563 KCRNDKNQLDHGPF-UHFFFAOYSA-N 421.494 2.408 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)cc1F 737166150 NGDADHMRPQXJRM-UHFFFAOYSA-N 418.494 2.114 10 20 HECD COc1ccc(NC(=O)NCc2cccc(OC)c2O)cc1S(=O)(=O)NC1CC1 740460357 RNTDPWCBUGBQBW-UHFFFAOYSA-N 421.475 2.172 10 20 HECD Cc1cc(C(=O)COC(=O)C2CC=CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741043070 OIKANZZMNZNLLL-UHFFFAOYSA-N 402.472 2.434 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1CCN(c2ccccn2)CC1 741144669 YWVWPBJLMQEUMH-UHFFFAOYSA-N 423.561 2.089 10 20 HECD Cc1cc(=O)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nn1-c1ccccc1[N+](=O)[O-] 753630316 AWZOMLYGJATHQE-GFCCVEGCSA-N 424.413 2.221 10 20 HECD CN1CCN(c2ccc(CNc3cccc4c3CCN4S(C)(=O)=O)cc2)CC1 757994639 VKILTBDGRSGLCJ-UHFFFAOYSA-N 400.548 2.373 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@H]4C[C@H](C)CCN4C3=O)CC2)cc1 760952884 WDQJLLOGCSVYQJ-YLJYHZDGSA-N 400.523 2.270 10 20 HECD O=C(CN1CC[C@@H](N2CCCC2=O)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 761121757 YWKRQDQAVMICQQ-OAHLLOKOSA-N 417.465 2.097 10 20 HECD CC(C)N1CC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 761126306 YGDGZVOPAAMLHI-UHFFFAOYSA-N 412.469 2.115 10 20 HECD CC1CCN(c2ccc(CNC(=O)Nc3nc(CS(C)(=O)=O)no3)cc2)CC1 765247405 QOWQOFRPRZQOCH-UHFFFAOYSA-N 407.496 2.172 10 20 HECD COc1ccc2c(c1)OC[C@H](NC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 768042052 XWKOLYIVXZQJHD-QGZVFWFLSA-N 415.465 2.474 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N3CCc4ccccc43)CC2)cc1OC 768439947 QMXHYGYBPHSVOM-UHFFFAOYSA-N 411.502 2.116 10 20 HECD Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773740640 SCGNBLPZXDYEIU-CYBMUJFWSA-N 408.458 2.232 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cn1C 774153877 DBWWLBTXBMKMLI-UHFFFAOYSA-N 412.490 2.398 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)cn1C 774229433 XQFICPFQBOQDLD-UHFFFAOYSA-N 418.469 2.442 10 20 HECD C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NCc1ccc(N2CCSCC2)cc1 780309968 ZPKDROIDZSCWJJ-KRWDZBQOSA-N 406.596 2.226 10 20 HECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)c(O)c1O 780848042 HWAZPVOVOUFKIE-UHFFFAOYSA-N 410.879 2.206 10 20 HECD COC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 781732268 WDGCZFNOEASPJU-GJZGRUSLSA-N 408.470 2.168 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c(OC)c1 782107602 LRUCGJWPRMSVCZ-NSHDSACASA-N 402.403 2.012 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1 785296274 CEJCBBNHHYVTCK-AWEZNQCLSA-N 411.458 2.020 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 785296666 OMZKSRVJWWSNPS-RDTXWAMCSA-N 414.458 2.342 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)N1C(=O)OC(C)(C)C 785440339 YKCRFATZNXRMST-IYBDPMFKSA-N 418.538 2.225 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)NCc2ccc(N(C)C)c(F)c2)n1 786731693 FTYDIMUKUMMPGK-UHFFFAOYSA-N 411.503 2.153 10 20 HECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1OC 787922441 BLLAJCPRLJNLDD-UHFFFAOYSA-N 409.486 2.055 10 20 HECD C[C@H]1CCC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842460 CQPZUOPYXWHXFB-HOTGVXAUSA-N 405.514 2.440 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@H](O)CCNC(=O)OC(C)(C)C)cc2)CC1 792986433 NIDGLRDWRKCEPR-GOSISDBHSA-N 407.511 2.010 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)CC3CCCC3)cc2)C1 798382986 FXQQHPHVIPXABP-PMACEKPBSA-N 416.566 2.376 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)NC(=O)OC(C)(C)C 804043088 KXEXOJIYCNLTQV-OAHLLOKOSA-N 418.538 2.273 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3CCOc4ccccc43)CC2)cc1 804082565 RJCXMVHJWKEUAV-KRWDZBQOSA-N 423.513 2.463 10 20 HECD COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 804083473 RDJWYIKHDUOQJF-SFHVURJKSA-N 424.545 2.329 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)c3nc(C)cs3)CC2)cc1 804317063 RVNCULQEEUBKCN-CQSZACIVSA-N 416.547 2.465 10 20 HECD CC[C@@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C[C@H](C)S1(=O)=O 805396657 PNLAOEPCHHXZER-JKSUJKDBSA-N 424.588 2.439 10 20 HECD CCCCCNC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807103319 ORWIZLPSNKEGMQ-UHFFFAOYSA-N 416.566 2.222 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 807287035 GPBDXPCENYWXIL-SFHVURJKSA-N 420.517 2.081 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807677428 OPYIHIVMUMRLMR-CQSZACIVSA-N 414.472 2.320 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)NC(C(C)C)C(C)C)CC2)cc(OC)c1OC 807679236 PBIVRKQIROQLRL-UHFFFAOYSA-N 421.538 2.158 10 20 HECD COC[C@@H]1CCCN1C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770501 LMBPOGLEABIGMZ-ZBFHGGJFSA-N 411.449 2.010 10 20 HECD CCC[C@H](C)N1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971244 NHHWKBBIDRFXRA-DOTOQJQBSA-N 405.514 2.440 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CC(=O)OC(C)(C)C)CC2)cc1 1318646829 NTZUOVSXAZOBDN-KRWDZBQOSA-N 420.554 2.237 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1nccs1 1796932720 WGQIYKYYODIHAA-RBVVOMGSSA-N 423.498 2.188 10 20 HECD Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808580268 LRWMFFORMSIQMF-YWZLYKJASA-N 421.457 2.158 10 20 HECD Cc1ncoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826064238 NZEKFZLSYFYPMF-MRXNPFEDSA-N 414.462 2.336 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CSc2nnnn2C2CC2)cc1 8545197 HCDYBERTNQQXPQ-GOSISDBHSA-N 416.551 2.374 10 20 HECD CC(C)CNC(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 64628822 ZCTSUVXACKRNMS-UHFFFAOYSA-N 416.444 2.113 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 108433476 UJILPEVNMUENSL-FQEVSTJZSA-N 423.579 2.328 10 20 HECD C[C@@]1(c2ccc(CNCc3cc(Br)ccc3O)cc2)NC(=O)NC1=O 726189821 MYIGTLOCFLBBQV-SFHVURJKSA-N 404.264 2.499 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c1O 727761256 QKWZQWLVPRPYOL-KRWDZBQOSA-N 404.488 2.179 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c1C 739697103 WKDFKJMREBPRFS-QGZVFWFLSA-N 404.536 2.048 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 742497810 KQSKPRDVVOXLCU-UKAVVXHISA-N 413.518 2.044 10 20 HECD CCOC(=O)CN(CC(N)=O)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 749585623 FLKCXQPBMMLMAU-UHFFFAOYSA-N 405.882 2.167 10 20 HECD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 753645513 UXVWOQUIQJMAII-CYBMUJFWSA-N 404.488 2.208 10 20 HECD NC(=O)c1ccc(N2CCCCC2)c(NS(=O)(=O)c2cccc3nonc23)c1 753924370 VZGQXLOZYVMFIV-UHFFFAOYSA-N 401.448 2.113 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)c(F)c(O)c3F)cc2)C1 755098930 PJXOTRDOPFWMKO-GFCCVEGCSA-N 407.392 2.441 10 20 HECD COCc1nc2n(n1)C[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)CC2 757786716 HOVACNAMGLPKBZ-INIZCTEOSA-N 411.462 2.450 10 20 HECD COC(=O)C12CCC(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)(CC1)C2 758118253 JNBBNHZFMJTNJE-YTZBPGPESA-N 413.518 2.128 10 20 HECD COC(=O)c1ccc(C)c(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 758222956 JPZRDARFMGZPAT-HXUWFJFHSA-N 414.502 2.352 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)CC2)cc1 759251431 FMLOLDSWBZTOTI-UHFFFAOYSA-N 413.499 2.438 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCCc3ccc(O)c(O)c3)C2)cc1 762273887 FCOUNQJWJKPOSL-KRWDZBQOSA-N 418.515 2.166 10 20 HECD O=S1(=O)CCCN1c1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1 763471227 TVRRCRDNUKPPKE-UHFFFAOYSA-N 401.532 2.353 10 20 HECD O=C(NCc1cccc(Br)c1O)Nc1ccn(CCN2CCOCC2)n1 765292192 AJOJXJZGGXKADR-UHFFFAOYSA-N 424.299 2.005 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC[C@@H]21 766880248 KYPIOZASHYSTEN-DYXWJJEUSA-N 413.566 2.014 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)cc1F 768853570 OUTUYSVTVHNCKB-UHFFFAOYSA-N 401.441 2.315 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1 769803178 QWLJBXBNCGPNQY-QGZVFWFLSA-N 418.471 2.112 10 20 HECD CC(C)N1C(=O)c2ccc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2S1(=O)=O 773739854 FOQKUVZFOLPRKA-GFCCVEGCSA-N 418.471 2.012 10 20 HECD COC(=O)[C@H]1COCCN1Cc1cc(Br)cc(Br)c1O 775694125 GNEIXWGGLYGTLS-LLVKDONJSA-N 409.074 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccccc3N(C)C)CC2)cc1 778252539 SJICRXKWOUPHJY-SEYXRHQNSA-N 422.529 2.282 10 20 HECD O=C(NCCCn1cnc2ccccc21)C(=O)NCc1ccc(N2CC=CC2)cc1 785412360 RVMXRXCKTLQRHP-UHFFFAOYSA-N 403.486 2.235 10 20 HECD CN1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc2C1=O 787401812 GEDRBEBQRTYYNW-IBGZPJMESA-N 411.477 2.272 10 20 HECD Cc1nc(Cn2nnc(C(=O)N(Cc3ccco3)Cc3ccccc3O)c2C)no1 787423680 HJADJRPUUZASCW-UHFFFAOYSA-N 408.418 2.467 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2ccc(F)cc2)CC1 788320935 SBEZFUPIKDZSPP-UHFFFAOYSA-N 411.477 2.127 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(OC(F)F)cn1 788935804 GDQQZUAWQSBZSP-UHFFFAOYSA-N 404.417 2.216 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCSC3)cc2F)C[C@@H](C)O1 789825429 LRYQFNPRZVPXMV-IIAWOOMASA-N 409.527 2.019 10 20 HECD C[C@@H]1OCC[C@]12CN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C[C@@H](C)O2 790503015 ZBJMPSLHSAHZFD-XFQAVAEZSA-N 407.486 2.140 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(N4CCC4=O)c3)cc2)C1 790576649 NJQGPSJFEZTIME-QGZVFWFLSA-N 421.501 2.447 10 20 HECD CC(C)(C)CCCCNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793725742 RVEPGDAFMBIZSF-GOSISDBHSA-N 416.566 2.337 10 20 HECD CCCN1CCC(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 793822231 AWFOEEHZXJYKIE-HXUWFJFHSA-N 417.550 2.138 10 20 HECD COc1ccc(N2CCN(C(=O)c3nnn(Cc4cc(C)no4)c3C)CC2)cc1F 794372656 FCKATWFVJGWFGQ-UHFFFAOYSA-N 414.441 2.041 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c(O)c1 794380678 GRWXQYVPDZIKJE-YEJXKQKISA-N 403.479 2.154 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1 795776437 TUOSIRCNLWXMNA-QGZVFWFLSA-N 420.554 2.094 10 20 HECD CO[C@H]1CCC[C@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 796052052 FXUOXQGLHLRVIV-WMZOPIPTSA-N 422.497 2.417 10 20 HECD O=C(OCc1nnn(CC(F)(F)F)n1)c1cccc2c1C(=O)c1ccccc1C2=O 799453980 FGQPZHBIBZAIIS-UHFFFAOYSA-N 416.315 2.368 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nnc2n1CCCCC2 803686701 GTOHNEWYCYCBRN-SFHVURJKSA-N 424.549 2.271 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCN(C)Cc1ccc(F)cc1 807099569 ZQYUBIZCHWGICG-UHFFFAOYSA-N 400.498 2.065 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807102098 CVAXNTUTFQLMBL-QGZVFWFLSA-N 403.523 2.115 10 20 HECD Cc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807587486 HGBSTVHSGRZAFM-OXQOHEQNSA-N 408.502 2.160 10 20 HECD O=C(N[C@H]1CCOC2(CCC2)C1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 809458815 XZDRLSMCTVEABH-ZWKOTPCHSA-N 402.491 2.118 10 20 HECD Cc1noc(C2CCC(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)CC2)n1 813860316 HYROSTKVCURTAA-UHFFFAOYSA-N 404.536 2.429 10 20 HECD CCNC(=O)[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 815132977 PDKNJLNBTJDJNH-FQEVSTJZSA-N 407.470 2.151 10 20 HECD C[C@@H](Oc1ccc(F)cc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335044 LBOLSYXAOUKITK-OAHLLOKOSA-N 406.479 2.144 10 20 HECD CC(=O)Nc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C 918337245 HPDQBRXOVINFLN-UHFFFAOYSA-N 415.515 2.118 10 20 HECD CCN(CC(=O)NCc1ccc(S(C)(=O)=O)cc1)c1ccc(OC)c(OC)c1 921061772 LDWKGNKQHHJTJV-UHFFFAOYSA-N 406.504 2.250 10 20 HECD C[C@H]1CN(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 921231725 KSMSQBDTHOQJEY-JQVVWYNYSA-N 402.583 2.285 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 1116421879 ZULPCTXOCPXRLB-IBGZPJMESA-N 419.522 2.370 10 20 HECD Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1F 1843248908 GKURYZSDJWQKAT-UHFFFAOYSA-N 413.449 2.390 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(CS(C)(=O)=O)cc1 10906730 ZBRPMYNVVDYWEK-UHFFFAOYSA-N 402.516 2.340 10 20 HECD C[C@@H](NC(=O)NC[C@H](O)COc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 65698144 YYLMKGYLQSWPDS-UZLBHIALSA-N 417.481 2.462 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 726247595 NGMLHEIASLDTAK-UHFFFAOYSA-N 413.478 2.225 10 20 HECD CNC(=O)[C@H]1CCCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729470118 BFOWURPSFVORFX-GOSISDBHSA-N 405.454 2.001 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@@H]1CCSC1 743556817 MCRGHSKSFOREEG-MRXNPFEDSA-N 416.526 2.247 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cc1 743879994 NSKBZGXYTLBBBM-UHFFFAOYSA-N 409.895 2.064 10 20 HECD O=C(NC[C@@H](O)COCC1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903004 AUEJYSGGPGAUJN-DOTOQJQBSA-N 413.465 2.344 10 20 HECD Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NCCCSc1nccs1 746020049 IUHOVKKBYLPUNR-UHFFFAOYSA-N 422.576 2.358 10 20 HECD CCOc1ccc(N(CC)Cc2nnnn2-c2ccc(S(C)(=O)=O)cc2)cc1 746157965 ZRAHPMUCEITZJC-UHFFFAOYSA-N 401.492 2.491 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCCS3)CC2)cc1 752797100 LSTYUOAKUCEBPW-JBVUFVISSA-N 403.548 2.302 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3c3c(C)n[nH]c3C)CC2)cc1 754080209 CBUROGZDYKINRB-UNMCSNQZSA-N 413.566 2.355 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](C)CN3CCCC3)CC2)cc(OC)c1OC 759277316 HLYNIFXBWDMKFM-KRWDZBQOSA-N 420.554 2.276 10 20 HECD CCN1CCC(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 759282370 VOXPEPDXMMAVKF-UHFFFAOYSA-N 406.527 2.028 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2c(F)cccc21 763373749 NKRQBWCZXNVQJB-UHFFFAOYSA-N 401.413 2.007 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cccc2c1OCCC2=O 765902811 DTUMRYPDELUYCY-UHFFFAOYSA-N 419.231 2.375 10 20 HECD Cc1cc(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n([C@H]2CCS(=O)(=O)C2)n1 775467748 RBZACRKYWYIJBI-PBHICJAKSA-N 405.524 2.500 10 20 HECD Cc1ccc(OCC(=O)N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)cc1 775669416 YWSKDYDKTZOZKS-UHFFFAOYSA-N 422.573 2.470 10 20 HECD CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 775868907 FNKRTLZHHPVAGN-CTNGQTDRSA-N 407.530 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3Cc4ccccc43)CC2)cc1 778242753 XLRSOEUBDJHQSR-GNISGLHKSA-N 405.498 2.356 10 20 HECD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(NCc2ccc(N(C)C)c(F)c2)CC1 779341730 PQTQTVOBGYLKHX-UHFFFAOYSA-N 409.531 2.175 10 20 HECD COC(=O)[C@H]1CCN(Cc2cc(Br)cc(C)c2O)[C@H](C(=O)OC)C1 780784028 NUUCVCXIZMOQJZ-FZMZJTMJSA-N 400.269 2.390 10 20 HECD CCN(CC)c1ccc(CN(C)[C@@H](C)C(=O)N(CC)[C@H]2CCS(=O)(=O)C2)cc1 781624358 KMSFEVVVWAUWER-PXNSSMCTSA-N 409.596 2.389 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccccc3-n3ccnn3)CC2)cc1 783789653 CCMYJTWXQKJUNE-UHFFFAOYSA-N 420.517 2.218 10 20 HECD COc1ccc(CNC(=O)[C@@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c(O)c1 794378987 LMXRPIJVIIBLKS-CYBMUJFWSA-N 423.447 2.070 10 20 HECD COC[C@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 804319843 TWPJZFTXXYDWKU-IBGZPJMESA-N 415.490 2.186 10 20 HECD Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)/C=C\c1ccc(O)c(O)c1 804743588 YLKAGPLDFMWBLB-CLTKARDFSA-N 410.879 2.168 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](N3CCCC3)C2)cc1F 804853453 YGKXXLNRINHORU-GOSISDBHSA-N 404.530 2.375 10 20 HECD CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 807100094 JLWCNQWXNVMNHU-UHFFFAOYSA-N 421.501 2.375 10 20 HECD COC[C@H]1CCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770499 LMBPOGLEABIGMZ-GOEBONIOSA-N 411.449 2.010 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(c2ncccc2F)C1 807912986 TVVUOZZFSSNRJK-INIZCTEOSA-N 400.454 2.060 10 20 HECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2ccc(N3CCN(C)CC3)cc2)CC1 809785777 BPOYBZXGRJIASH-LJQANCHMSA-N 422.639 2.320 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cn(C4CCOCC4)nn3)cc2F)C[C@H](C)O1 810167843 QOVVVSVGPWFERM-GJZGRUSLSA-N 417.485 2.312 10 20 HECD O=C1CCCCC[C@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 811382775 PZXGNNAWCCTUGC-KRWDZBQOSA-N 420.481 2.361 10 20 HECD O=S(=O)(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCCCC1 917912094 MZQKHMINEDZZJT-UHFFFAOYSA-N 407.458 2.362 10 20 HECD Cc1cc(C(=O)NCCNS(C)(=O)=O)c(C)n1-c1ccccc1Br 918012007 OIWIZOMLGLBRAV-UHFFFAOYSA-N 414.325 2.136 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(Cc2cccnc2)CC1 918225011 ZPZQEAFACOFINW-UHFFFAOYSA-N 413.497 2.085 10 20 HECD Cc1cc(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1-c1cccc(Cl)c1 919978291 MCNDJRBHAGHCRR-UHFFFAOYSA-N 424.954 2.312 10 20 HECD CC(C)(C)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715303 HMHSEHJXJPINMB-BTTYYORXSA-N 409.914 2.391 10 20 HECD O=C(CCc1ncc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718809 HQZCAXMHIQZVFA-BTTYYORXSA-N 418.881 2.359 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@]1(F)Cl 1802496524 FWGRTCNHBDEEQJ-MGAJALESSA-N 424.856 2.379 10 20 HECD O=C(CC1CC1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898630 TWPSGIAPVMRLTL-MRXNPFEDSA-N 423.604 2.267 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)C(F)(F)C(F)F)C1 1841812069 FEDZFKILKIIBAX-UHFFFAOYSA-N 410.751 2.469 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccncc2C(F)(F)F)C1 1843531351 DWPMIRMTXJWTPN-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCOCC1 8170889 WFACNKJKGSIRSP-UHFFFAOYSA-N 417.531 2.012 10 20 HECD Cc1cc(NC(=O)CSCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 16134799 MSZGDZSLGRJEPV-UHFFFAOYSA-N 418.519 2.150 10 20 HECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 60763679 IADFYILMLBSZQB-UHFFFAOYSA-N 410.474 2.291 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1 446361340 BFEQRXXZZDLZLK-UHFFFAOYSA-N 422.493 2.356 10 20 HECD COc1ccc(N2CCC(NC(=O)CCNC(=O)OCC(F)(F)F)CC2)cc1 726563232 WNSDMVCJDNXRQK-UHFFFAOYSA-N 403.401 2.459 10 20 HECD C[C@H](O)[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 730260536 BBIBXVDAXNXTKI-PDOICOKGSA-N 407.530 2.291 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)CC2)cc1 731896638 MXDBRNCRQOTPMI-UHFFFAOYSA-N 419.485 2.332 10 20 HECD Cc1cccc(N)c1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 735149791 JMKAPGVVKSDFQX-UHFFFAOYSA-N 401.438 2.026 10 20 HECD O=C1C[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CN1Cc1ccccn1 735517872 GBXJOTSJLSHGNV-QUCCMNQESA-N 409.486 2.344 10 20 HECD COc1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 737108872 ZUOSEXOJOXIMNF-UHFFFAOYSA-N 401.438 2.234 10 20 HECD Cn1ccnc1[C@@](O)(CCNC(=O)NCc1ccc(N2CC=CC2)cc1)C(F)(F)F 740909894 SGJMFEWHGFORGB-IBGZPJMESA-N 423.439 2.436 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccco1 744280643 SNGZWEBNFOOATH-OAHLLOKOSA-N 402.520 2.337 10 20 HECD CN1C(=O)N[C@@]2(CCC[C@H]2CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1=O 748098826 OQPKOICXFHEFOD-HRAATJIYSA-N 415.494 2.395 10 20 HECD O=C(NCc1ccccc1O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 748349944 MPTDNFYKWGNXAU-UHFFFAOYSA-N 420.395 2.382 10 20 HECD COCCN(CC(=O)Nc1ccc2nc(O)[nH]c2c1)c1ccc(OC)c(OC)c1 751474957 HKPWINBBWMJJIN-UHFFFAOYSA-N 400.435 2.377 10 20 HECD Cc1nc2n(n1)CCN(C(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)C2 752895905 SODAIVZQSZTKGE-ZIAGYGMSSA-N 402.474 2.065 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1F 754039966 GYJBHOHYPRAVCE-UHFFFAOYSA-N 409.439 2.395 10 20 HECD O=C(COC(=O)c1cccc(O)c1O)Nc1cccc(C(=O)N2CCSCC2)c1 758571528 GEUSFASGUDEUAA-UHFFFAOYSA-N 416.455 2.082 10 20 HECD CC(=O)[C@@H]1C[C@H](CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1(C)C 759541744 SUWAIXHFLZGIEY-MJGOQNOKSA-N 406.548 2.179 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@H](c4cccc(O)c4)C3=O)CC2)cc1 760951610 OQXFHHIZUQVKGD-OAQYLSRUSA-N 424.501 2.206 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)Cc2cccc(Br)c2O)C1 769304683 BGHRLINYVSWBJS-CQSZACIVSA-N 413.312 2.388 10 20 HECD NC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Cl 772908547 ZYUCVUABMUBZEB-UHFFFAOYSA-N 420.872 2.143 10 20 HECD C[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 775411634 RLMBUMWKUMXIIB-BEFAXECRSA-N 412.490 2.100 10 20 HECD C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(N2CCN(C)CC2)cc1 775644699 ROEGUTHSZPVVJH-KRWDZBQOSA-N 402.564 2.279 10 20 HECD C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 777237212 ZNUZTKJYNNXPQN-CQSZACIVSA-N 408.518 2.231 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](OCC4CC4)C3)cc2)C1 779536193 KRZFPZHFNMVTCQ-FPOVZHCZSA-N 414.550 2.489 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CC(C)(C)O)[C@H](C)C3)CC2)cc1 780387042 GPLLECIXQCUARO-QGZVFWFLSA-N 404.555 2.151 10 20 HECD Cc1ccc(C(=O)N2CCN(CC(=O)N3CCCc4ccccc43)CC2)c(O)c1O 780935511 USRCGXYSILCPGO-UHFFFAOYSA-N 409.486 2.143 10 20 HECD CN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(N2CCOCC2)cc1 784123202 BOVYWFAWGFQPLE-UHFFFAOYSA-N 419.503 2.337 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1 785295505 INRAMPGTBLFTIP-CQSZACIVSA-N 411.458 2.301 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(-c4ncn(C)n4)c3)CC2)cc1 788825138 BKTPBFGVZJTGPD-HXUWFJFHSA-N 423.517 2.053 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4nc(C)n(C)c4c3)CC2)cc1 793246474 IREISJVWPHMVAV-UHFFFAOYSA-N 407.518 2.442 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]3C)nc12 795122045 NHECYVSJAYTBDT-KBPBESRZSA-N 417.510 2.079 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nnn1Cc1ccncc1 796815267 WYGXBHRCJUPXCW-UHFFFAOYSA-N 424.480 2.060 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 797444902 KQTJUCLPYVTRAX-HXUWFJFHSA-N 410.465 2.424 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)nc12 797530497 UXSLTGKFAOSIHW-HNNXBMFYSA-N 423.473 2.097 10 20 HECD C[C@@H]1CN(CCOC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCO1 800087194 XLFLSVLFVGJVBC-CYBMUJFWSA-N 424.409 2.248 10 20 HECD C[C@H]1CN(CCOC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCO1 800087196 XLFLSVLFVGJVBC-ZDUSSCGKSA-N 424.409 2.248 10 20 HECD Cc1cnc([C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803302934 FZKYWIYDFBZNGI-ZBFHGGJFSA-N 416.547 2.385 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1F 803664997 VRKYPQOCIYPWIB-HNNXBMFYSA-N 422.501 2.024 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCC[C@H]1N1CCOCC1 806088472 WIHVFNIXZQSRDG-WOJBJXKFSA-N 417.550 2.281 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1 806887037 WSCTWENGURDNDQ-VIFPVBQESA-N 419.821 2.201 10 20 HECD CN(C)S(=O)(=O)c1cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)n(C)c1 807838412 QPELWBSGLNKZME-UHFFFAOYSA-N 406.291 2.218 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC(C)(C)[C@H]1CCCCO1 809423574 OPHHMTOJCJPGMN-HXUWFJFHSA-N 417.550 2.193 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(CCC(F)(F)F)CC3)cc2)CC1 812832746 CHTWUSZHKCAXOR-UHFFFAOYSA-N 419.513 2.428 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1 815729882 NDEXSIDQRROHMA-UHFFFAOYSA-N 401.438 2.289 10 20 HECD CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 917908089 KNWGTWWBGKAOQP-UHFFFAOYSA-N 421.494 2.095 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1 920257413 UIHYBDSZPNTNOU-UHFFFAOYSA-N 417.560 2.264 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](C)OCC3CC3)cc2F)C[C@@H](C)O1 920779107 PNHSKFUFCRQWNH-OWCLPIDISA-N 422.497 2.414 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(F)(C1)C2 1793657802 RJQDPUACPXMIDR-GOEWXDGDSA-N 416.449 2.347 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3nccs3)CC2)C1 1810543114 XCIPBUKRKIWZQB-UHFFFAOYSA-N 402.476 2.108 10 20 HECD CC[C@H](C)[C@@H](N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426104 LEUXZXVLUJQGOP-GZRFBZBPSA-N 418.538 2.100 10 20 HECD O=S(=O)(c1ccc(NC(=S)NNc2cccc(F)c2)cc1)N1CCOCC1 139134176 UEPMTGSFEGNYQO-UHFFFAOYSA-N 410.496 2.160 10 20 HECD Cc1ccc(C(=O)NCCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 303459890 LEAXISFKXRSYEW-UHFFFAOYSA-N 414.481 2.200 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCN3Cc4ccccc4C3)CC2)cc1 726248603 OOEZJHFFXAGLMO-UHFFFAOYSA-N 423.561 2.132 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCc1ccc(OCC(N)=O)c(OC)c1 731280854 FKNHFCRQIXQAFD-UHFFFAOYSA-N 401.463 2.387 10 20 HECD Cc1nc(CN2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)oc1C 734269363 IGWRTNMNZQAQHK-UHFFFAOYSA-N 413.522 2.155 10 20 HECD NS(=O)(=O)c1ccc(F)c(CNC(=O)NCc2ccc(N3CCCC3)cc2)c1 734524389 AULNWGKCMJWKMC-UHFFFAOYSA-N 406.483 2.073 10 20 HECD O=C1N[C@H](C(F)(F)F)CC[C@@H]1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520109 WCBKDTMRCFMOQP-DZKIICNBSA-N 400.397 2.357 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc([S@](C)=O)c3)CC2)cc1 737137959 FQWIEAMWMOOOMJ-LJAQVGFWSA-N 415.515 2.110 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCN(C(=O)C(C)C)CC2)c1 738086333 HDJYQOGUONSDOT-UHFFFAOYSA-N 417.550 2.117 10 20 HECD CCN(CC(=O)NCC(=O)NC(C)(C)C)Cc1cc(Br)ccc1O 744427078 XTYACNRSKXUOIO-UHFFFAOYSA-N 400.317 2.008 10 20 HECD CCCN(C)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 746172877 NWNRUWFIBUBHAO-MHWRWJLKSA-N 421.544 2.075 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCS3)cc2F)C[C@@H](C)O1 750900751 IAFFNVIWNVCIMB-HBUWYVDXSA-N 410.511 2.494 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3nnc(-c4ccco4)o3)CC2)cc1F 757999770 JNYIDYFWAOPHLY-UHFFFAOYSA-N 401.398 2.238 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)NCc3cccc(OC)c3O)cccc12 766816916 GASXYLOSNAFUHM-UHFFFAOYSA-N 402.428 2.214 10 20 HECD CCOC(=O)CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 769733517 ZHNXISAPJQXAIL-UHFFFAOYSA-N 424.500 2.422 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)N(C)C)c1 774958578 QEARRLLZSNRIBD-OAQYLSRUSA-N 412.534 2.105 10 20 HECD CCn1nccc1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 775021481 FMDWHIOPLOGXJB-UHFFFAOYSA-N 403.394 2.474 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCC2CCN(CC(=O)NC(C)(C)C)CC2)c1O 775029067 JYCTYMYSUAAPFA-UHFFFAOYSA-N 408.499 2.025 10 20 HECD CC[C@@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 776040960 GUGDXNQMIUVRNP-CQSZACIVSA-N 417.485 2.393 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnc4c(c3)COCC4)CC2)cc1 777738732 ZVIPFUFSEOHFQG-UHFFFAOYSA-N 411.506 2.107 10 20 HECD CN(CCn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(OCc2ccccc2)cc1 781960130 DUBQRPGBELIJIC-UHFFFAOYSA-N 419.485 2.149 10 20 HECD Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)cnn1CCO[C@@H]1CCCCO1 784402272 UFCYLKOJIUDHKC-LJQANCHMSA-N 404.419 2.186 10 20 HECD Cc1ccccc1C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798983 KUTANJCKSBQWHY-KRWDZBQOSA-N 413.493 2.334 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCOC(C)(C)C)cc2F)C[C@@H](C)O1 789816660 DUIZMUKHFCYJTJ-IYBDPMFKSA-N 423.529 2.329 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]1C1CCC1 789840636 LSIRVEVFWAQTEK-IBGZPJMESA-N 403.498 2.194 10 20 HECD COC(=O)Cc1cccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 792409702 IRXHVOJORSXNOA-UHFFFAOYSA-N 402.426 2.095 10 20 HECD CC(C)n1cc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 803310351 JCDVOKMCDBACAJ-SJORKVTESA-N 413.522 2.355 10 20 HECD Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)c2cc(O)cs2)c1 807761095 HDEFPVSKIUROLX-UHFFFAOYSA-N 419.322 2.233 10 20 HECD CCOC(=O)C1(S(C)(=O)=O)CCN(Cc2cccc(Br)c2O)CC1 809711603 FUEKHCCWXBZSKP-UHFFFAOYSA-N 420.325 2.097 10 20 HECD CS(=O)(=O)CC1CCC(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 815562566 ILDSJSRYDUEXEW-XBMUEBEBSA-N 407.580 2.081 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CCCc2nn[nH]c21 816889738 KCUHNVCNVOVURU-AWEZNQCLSA-N 409.412 2.396 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnc(C)c(C(=O)OC)c3)CC2)cc1 1343748172 JAVXAQQCYPJZTD-UHFFFAOYSA-N 419.503 2.086 10 20 HECD COc1cscc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1797160766 RANPAWPQGINOKZ-CLLJXQQHSA-N 403.460 2.129 10 20 HECD COc1cc(C)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1803582985 LEMBQTHLRGCWLN-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2ccco2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992358 XBLMQRRXQBTUJV-IFXJQAMLSA-N 408.414 2.114 10 20 HECD Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817847652 QHNJXQXBCWMZNH-OAHLLOKOSA-N 424.461 2.483 10 20 HECD O=C(CNC(=O)c1cc(-c2ccccc2)on1)NCc1ccc(N2CCOCC2)cc1 109921614 NVLHLSXUTFBOTA-UHFFFAOYSA-N 420.469 2.224 10 20 HECD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1cn(Cc2cccnc2)nn1 542187759 BWTBJSMEDUDLNS-RIYZIHGNSA-N 401.386 2.284 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2nc3ccccn3c2=O)cc1 728837051 KWUKJWHJOLSIKV-UHFFFAOYSA-N 407.396 2.153 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 730172878 ABMSIGDHNVLPFL-MRXNPFEDSA-N 415.440 2.471 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)oc2C)cc1 746055630 XYOWDAAJSKXDOM-UHFFFAOYSA-N 402.450 2.239 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(C)(C)S(C)(=O)=O)cc2F)C[C@@H](C)O1 748961336 RLJSSLLGVPRMOJ-OKILXGFUSA-N 415.531 2.062 10 20 HECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cccc(Br)c2O)C1 754153406 HHIFNHDCPNELSS-CQSZACIVSA-N 421.357 2.027 10 20 HECD O=C(N[C@H]1CCCS(=O)(=O)C1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 758662662 MDOIEMPJFCHWHS-KGLIPLIRSA-N 417.478 2.133 10 20 HECD CN1C(=O)CCc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc21 758676532 QAYWNNWPETVKNQ-UHFFFAOYSA-N 413.499 2.083 10 20 HECD CCC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1CCOC 766775023 GAAKKOMJHGIQIB-NRFANRHFSA-N 404.555 2.166 10 20 HECD O=C(Nc1ccc2c(c1)OCO2)C1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440780 DPRSBLPKTOBYNP-SFHVURJKSA-N 412.442 2.397 10 20 HECD C[C@@H](C(=O)NCc1ccccc1O)N1C(=O)c2ccc(Br)cc2C1=O 769358741 QPLUTVPPMLVYDQ-JTQLQIEISA-N 403.232 2.456 10 20 HECD C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770157025 MGWFJSWTOGJLNV-CVEARBPZSA-N 417.531 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3(OC)CCCCC3)CC2)cc1 774783264 QDYMPGFNAOQIOR-KHPPLWFESA-N 415.534 2.366 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCO[C@H](C(C)C)C3)CC2)cc1 779329990 HYFBXOMGXWRHKL-NRFANRHFSA-N 404.555 2.274 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 782105023 PCAAFXYZMGPTCC-UHFFFAOYSA-N 405.401 2.065 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C(=O)OC(C)(C)C 785432407 BRKYUZPYTJMCJK-NVXWUHKLSA-N 418.538 2.273 10 20 HECD C[C@@H]1CCCN(CCCCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 787909231 LDGJDGQFMLYYHU-GOSISDBHSA-N 400.567 2.314 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864829 SGMLGEAAEGNBOP-UHFFFAOYSA-N 416.547 2.285 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c(O)c1 793067174 JACHLQMGFPXCIY-UHFFFAOYSA-N 424.207 2.326 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Br)cn1 794174291 VGLVITRPTNHSHB-SECBINFHSA-N 414.281 2.412 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C1CCN(c2ccc3nnnn3n2)CC1 801548163 AXLWPUPDBBYOPP-UHFFFAOYSA-N 409.494 2.270 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccccc1OCCN(C)C)c1ccc(N(C)C)cc1 803213674 GYFGPBFEYHLDPH-KRWDZBQOSA-N 412.534 2.187 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ccncc3)CC2)cc1F 804853745 UCJDWBCDZSKJBW-UHFFFAOYSA-N 413.497 2.032 10 20 HECD CC(C)(C)[S@@](=O)CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 806197544 FGSKUKWILVRXOH-NDEPHWFRSA-N 406.504 2.177 10 20 HECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)NCCCSc1nccs1)CC2 806278806 YEOYQJBRZCJRAR-AWEZNQCLSA-N 407.565 2.193 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1 806683372 HKGZXAAYEWPITQ-QGZVFWFLSA-N 400.523 2.318 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 807099483 WSZJMHGZSZMJNZ-LJQANCHMSA-N 403.523 2.259 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2ncnn2-c2ccccc2)C2CC2)cc1 809867953 VYWRZSVMAQVXCY-UHFFFAOYSA-N 418.501 2.141 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 811924824 KKDPLJYNQGQIMI-UHFFFAOYSA-N 417.531 2.012 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)CC[C@H]3CCOC3)cc2F)C[C@@H](C)O1 814994691 WGLCZEMLGJEYKW-OWCLPIDISA-N 400.516 2.285 10 20 HECD O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1c(-c2ccccn2)nc2ccccn12 820005759 BMQDNNOFJURAKN-CYBMUJFWSA-N 402.501 2.255 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccccc1NS(C)(=O)=O 849194715 BFWRVLVLKBUOLB-UHFFFAOYSA-N 403.504 2.167 10 20 HECD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1c2ccccc2C[C@H]1C 920637580 KIBFCTISAFGNHG-OLZOCXBDSA-N 418.471 2.287 10 20 HECD C[C@H](NC(=O)NC[C@H](CO)CC1CCOCC1)c1ccc(N2CCOCC2)cc1 1343834263 CIBRLFIZPQCTOS-PKOBYXMFSA-N 405.539 2.309 10 20 HECD CN(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1 1796604802 OOFBAIVLBDGCCN-VBUUOAMHSA-N 410.474 2.124 10 20 HECD COCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708647 LMFGPBDKENTVRO-VIFPVBQESA-N 411.867 2.080 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])o2)C1 1840966710 GTENATVINCDOLX-UHFFFAOYSA-N 421.793 2.383 10 20 HECD COc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843251348 VZTSLKDHAZOEBZ-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=S(=O)(c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)nc1)N1CCCC1 301099983 QGQDXKJWANXZPE-UHFFFAOYSA-N 420.510 2.454 10 20 HECD CC(=O)c1ccc(S(=O)(=O)CC(=O)N2CCOc3cc(N(C)C)ccc32)cc1F 437021841 TWRJGIRYNTUDMA-UHFFFAOYSA-N 420.462 2.294 10 20 HECD CC(C)CS(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 725827618 VNIVBWRJVQHNJB-UHFFFAOYSA-N 407.515 2.018 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnc4onc(C)c4c3)CC2)cc1 726794858 CFEIRHCJPFTXIV-UHFFFAOYSA-N 402.476 2.487 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1 729064511 SLYPYCFUMIUVNJ-NSHDSACASA-N 401.419 2.184 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1nc(-c2ccc(F)cc2)n[nH]1 729878590 YDPLIRHCOSKSPN-UHFFFAOYSA-N 410.453 2.447 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCN4CCCC[C@@H]34)cc2F)CC1 730118789 MIEJGKXINSJPLS-CTNGQTDRSA-N 403.546 2.394 10 20 HECD O=C(CN1CCN(Cc2cc3c(cc2O)OCO3)CC1)N1CCCc2ccccc21 731350764 AHLCNGISCUUNCV-UHFFFAOYSA-N 409.486 2.218 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@@H]3CCN(c4ccccc4)C3=O)nc12 731847389 HWTWEIMOVGHUEK-GOSISDBHSA-N 423.473 2.239 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1 731979066 FLFHAGOYHZAHDH-KBPBESRZSA-N 408.499 2.355 10 20 HECD C=CC(=O)NCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 732102045 PFTXAMDUMDCOHN-QBFSEMIESA-N 409.558 2.148 10 20 HECD COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2cc(O)cs2)cc(C(=O)OC)c1 732354139 FFCIQFYJPZBBGK-VIFPVBQESA-N 407.400 2.211 10 20 HECD C[C@H]1CCC[C@H](OCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 733020787 HQAQQBJFVLEYKC-WMZOPIPTSA-N 422.497 2.417 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)CCO4)c2)CC1 740609449 LWONQPNNJLMGLW-UHFFFAOYSA-N 401.488 2.124 10 20 HECD CN1CCCC[C@H]1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 741145284 QVINNCLFCYTXQF-IBGZPJMESA-N 406.438 2.428 10 20 HECD O=C(COC(=O)c1cccnc1C1CC1)NCc1ccc(N2CCOCC2)c(F)c1 751774412 UUNXRBHRYZMMTQ-UHFFFAOYSA-N 413.449 2.408 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCOCC2(CCOCC2)C1 753108018 HZIGQHNHMMSHPZ-UHFFFAOYSA-N 421.513 2.125 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C[C@H]3CCOC3)cc2F)C[C@H](C)O1 753624847 LUDLLTWTEAVAJL-YQQAZPJKSA-N 408.470 2.025 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 753637637 WQBNRLBFJGGWBS-NSHDSACASA-N 412.895 2.363 10 20 HECD C[C@@H](Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1)c1cc(F)cc(F)c1O 757621400 OTSKMJHPTNDWNO-GFCCVEGCSA-N 412.462 2.320 10 20 HECD C[C@@H](OC(=O)CC1(CO)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759941576 QWYWUVXITPETFD-CYBMUJFWSA-N 407.422 2.495 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)c1 760105304 RDCLOGCLNSFAAT-HIFRSBDPSA-N 400.431 2.384 10 20 HECD Cc1ccnc(-n2nccc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 760202102 BUTJXCDWCXIXIE-UHFFFAOYSA-N 404.474 2.431 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(Cl)n1 761702082 AKWBOCANWQRDBL-UHFFFAOYSA-N 424.910 2.300 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)NCc3cccc(Br)c3O)ccc2N1 765925180 FHQUPGLUGIZRGZ-UHFFFAOYSA-N 418.247 2.294 10 20 HECD Cc1cccc(NC(=O)CN2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c1C 768441427 HVKHDYDPBKEVPH-OAQYLSRUSA-N 411.502 2.191 10 20 HECD C[C@@H](NS(=O)(=O)c1cccs1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 771008885 MWDNMMGFINGKQU-GDBMZVCRSA-N 424.544 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCO[C@H](C(C)C)C3)CC2)cc1 771953560 QQWZUWRAVKPVGC-NQIIRXRSSA-N 404.555 2.320 10 20 HECD Cc1cc(C(=O)Nc2cnn(CC(=O)NCCO)c2)c(C)n1-c1cccc(Cl)c1 777829625 XVSUSFKOSHAHQM-UHFFFAOYSA-N 415.881 2.305 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@H](C)[C@@H](OC)C3(C)C)CC2)cc1 778420580 XQJPASOJXRHWBG-OOBHPXJCSA-N 415.534 2.076 10 20 HECD Cc1cccnc1C(F)(F)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 782724645 FBBBTPCLKKFLNX-INIZCTEOSA-N 402.445 2.500 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)C3CCCCC3)cc2)CC1 786263206 UOWQWRISVSPWPG-KRWDZBQOSA-N 414.550 2.056 10 20 HECD COC(=O)CCc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 786312007 NVEBTMLABIJSBH-ZDUSSCGKSA-N 400.431 2.322 10 20 HECD CCOc1ncccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 787284453 NZVAISAPPRPSDB-SFHVURJKSA-N 413.474 2.010 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCN(C)C3CCCCC3)ccc21 787692419 XKCXJDAGVKJUTN-UHFFFAOYSA-N 400.567 2.456 10 20 HECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788937938 PLWWWIOKEKURDN-SFHVURJKSA-N 406.530 2.470 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]2CCCC[C@@H]12 789836745 VXOINFAJYWBKBM-MOXGXCLJSA-N 417.525 2.440 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@H]3C[C@@H](C)O)CC2)cc1 790688009 WMZIVARLLOWSTI-QUCCMNQESA-N 404.555 2.152 10 20 HECD CCN(CC)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249182 PQJTVJBVUSJPRZ-QGZVFWFLSA-N 414.572 2.495 10 20 HECD CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797388928 GRXKUAICIOXTNL-UHFFFAOYSA-N 406.460 2.456 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 797639470 AGWFEFGAUXAZNE-LLVKDONJSA-N 423.466 2.430 10 20 HECD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 799428867 RFFGWHGPKUUCHL-DEQOLOFCSA-N 423.585 2.370 10 20 HECD C[C@H](NC(=O)C(=O)N(C)C1Cc2ccccc2C1)c1ccc(N2CCOCC2)cc1 803298209 RFXDGEJUELSEHC-KRWDZBQOSA-N 407.514 2.326 10 20 HECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)NC(=O)OC(C)(C)C 803658829 FAZPCCHBDNRVEM-INIZCTEOSA-N 424.517 2.173 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(OC(C)C)CC3)CC2)cc1 804315728 MDRCNVVYAOVIKR-UHFFFAOYSA-N 403.523 2.196 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccn1 806844537 ZJSYGGQBSDBILS-ZIAGYGMSSA-N 416.453 2.098 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 807749547 VJDDHTBKFQXPPS-NQIIRXRSSA-N 408.546 2.490 10 20 HECD O=C(COC(=O)C[C@@H]1CCCC(=O)N1)Nc1cccc2c1C(=O)c1ccccc1C2=O 808685964 TWVNDRZXSKGMKH-ZDUSSCGKSA-N 420.421 2.003 10 20 HECD CCOc1ccc(CN(CCN)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(O)c1 809728447 XNNUIJDZVRQQEW-UHFFFAOYSA-N 409.464 2.068 10 20 HECD CSCc1cccnc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 810172165 AOJZPXPCKOGXFE-UHFFFAOYSA-N 405.545 2.109 10 20 HECD Cc1ccc(C(=O)N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c(O)c1O 813838795 OTQIXUGCXQTROK-OAHLLOKOSA-N 405.495 2.173 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c(F)cc1C 814975005 NRFGQGFBIBSDGS-UHFFFAOYSA-N 422.478 2.440 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2CCCS(=O)(=O)C2)cc1 815153249 KHJJNUNIERPESM-ICSRJNTNSA-N 408.564 2.475 10 20 HECD COC(=O)N1CCN(c2ccc(NCc3cc(OC)c(OC)cc3O)cn2)CC1 816659284 IBALWZDWTFYZBC-UHFFFAOYSA-N 402.451 2.305 10 20 HECD C/C(=C\c1cccnc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802947744 RXGWPUXIVHTTFT-CXWYDIKBSA-N 408.458 2.243 10 20 HECD O=C(CC1CC1)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817035481 FXUOZNVPNFLSLI-CYBMUJFWSA-N 421.548 2.062 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2[C@H]3c4ccccc4S[C@H]32)C1 1844271665 JWBAGNGVVZXKMK-CEXWTWQISA-N 423.494 2.198 10 20 HECD Cc1ccc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)c1 1848057471 FDQVJSOZNBOVFA-IRXDYDNUSA-N 411.458 2.004 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)NCc3ccc(C)cc3)nnc2n1 5146141 YLEHUFIGDSBLMB-UHFFFAOYSA-N 400.512 2.100 10 20 HECD COCCn1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1=O 726566795 FPDCLLBBZBHXJY-UHFFFAOYSA-N 421.444 2.495 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c(O)c1O 727004266 QNXIFOHCNMMONB-UHFFFAOYSA-N 413.835 2.259 10 20 HECD Cn1c(=O)oc2cc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 728393813 QBYVZXIBGDDDST-HNNXBMFYSA-N 423.473 2.155 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](n4ccnc4)C3)cc2)C1 728747467 NYVIXDWWWWJVQL-QUCCMNQESA-N 410.522 2.132 10 20 HECD CN1CCCc2cc(CNC(=O)NCCOc3ccc(S(C)(=O)=O)cc3)ccc21 730067438 ULKIOZDBUKCDCM-UHFFFAOYSA-N 417.531 2.351 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1 734074016 GMXVCQFBLBRFDO-UHFFFAOYSA-N 421.457 2.251 10 20 HECD C[C@H](NC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1)c1ccc(N2CCOCC2)cc1 734271865 MWCJNGGOBOTNKX-ICSRJNTNSA-N 415.582 2.052 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cccc4cccnc34)cc2)C1 734743500 VBVMJDBOGDUXJP-GOSISDBHSA-N 424.526 2.415 10 20 HECD O=C(c1ccc(CN2C(=O)CNC2=O)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 735517612 LGTKOXDKDUKBKK-LJQANCHMSA-N 423.469 2.265 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1O 737286009 PRJZXHIPPGXWTE-UHFFFAOYSA-N 411.458 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(CC(=O)N(C)C)cc3)CC2)cc1 738297152 OMXJJMCKKKBWSP-UHFFFAOYSA-N 410.518 2.087 10 20 HECD O=C1C[C@@H](Cc2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)C(=O)N1 741145868 QNPZAYSSWAKKHS-LJQANCHMSA-N 423.538 2.375 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@H](CN2CCCC2)C1 746414356 CONJHLSNVPLBRJ-GOSISDBHSA-N 404.530 2.414 10 20 HECD C[C@H]1CC[C@H](C)N1CCN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 748988579 CWOVMUIJDBKQCV-SFTDATJTSA-N 415.626 2.201 10 20 HECD CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749407657 WFFLNYGIZLOTBU-GOSISDBHSA-N 423.554 2.351 10 20 HECD Cn1c(=O)nc(O)c2cc(C(=O)N(Cc3ccco3)Cc3ccccc3O)cnc21 752088479 KQCUYQKYKGRRNK-UHFFFAOYSA-N 406.398 2.175 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSCc1cc(=O)n2ccsc2n1 753640277 NKCSDJCDGQGWFU-LLVKDONJSA-N 405.501 2.148 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O 753640460 QOUPHKOGSLCUJZ-CYBMUJFWSA-N 404.488 2.171 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCCNS(=O)(=O)c2cccc(Cl)c2)c1 756480592 SOHIPIJHFUTPAO-GFCCVEGCSA-N 412.895 2.461 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](C)N3CCCCC3)CC2)cc(OC)c1OC 759277367 HZDKZIYFUKIPQK-QGZVFWFLSA-N 420.554 2.418 10 20 HECD CCC1(CO)CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 764369184 OLXIBINOKPZQKR-UHFFFAOYSA-N 404.555 2.011 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCc3nc(C)cs3)CC2)cc1 769509435 NNXSRJGLVFOFNO-UHFFFAOYSA-N 403.504 2.285 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4c(C)n[nH]c4C)n3)CC2)cc1 771058311 UNRCKSVYYCISCW-UHFFFAOYSA-N 424.505 2.095 10 20 HECD CN(CCNC(=O)NCCCSc1nccs1)S(=O)(=O)c1cccs1 772624421 PZYURUMTWNNGIS-UHFFFAOYSA-N 420.607 2.307 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)N(C)C)c1 774949996 TYPGHHFTXVLSLZ-OAQYLSRUSA-N 412.534 2.139 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@H](CNC(=O)OC(C)(C)C)C1 776150701 SEXNKTHLVSRPPA-GOSISDBHSA-N 406.527 2.496 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1C 776492775 SUTDWWCYRFRHLM-UHFFFAOYSA-N 401.488 2.480 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(C)(C)c3ccncc3)CC2)cc1 778423447 SVSQIWWJIGYQFM-CMDGGOBGSA-N 422.529 2.389 10 20 HECD O=C(CNc1cccc2c1OCCC2=O)NCc1ccc(N2CCOCC2)c(F)c1 779746581 ZZTBSGQQAWMLDV-UHFFFAOYSA-N 413.449 2.356 10 20 HECD COCCc1ccccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 786369424 NXMUEEYUKGCEFL-UHFFFAOYSA-N 415.465 2.311 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(F)cc3F)CC2)cc1 786978223 BTHRIXAXQJAJIY-UHFFFAOYSA-N 403.429 2.375 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910851 DQZNTGSCAYGFNU-MRXNPFEDSA-N 418.538 2.180 10 20 HECD C[C@H]1CCCN(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789861721 RLBBJRFDPBDMML-ZWKOTPCHSA-N 418.607 2.093 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c(O)c1 794389993 VUPCGCAZXDWVAK-SFHVURJKSA-N 404.488 2.179 10 20 HECD C[C@@H](OC(=O)[C@H]1CCCC(=O)N1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 800242876 LAXRYGQJPSEACP-KZULUSFZSA-N 420.421 2.001 10 20 HECD COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 803664317 KJIJIIGVGAMWCL-CQSZACIVSA-N 403.454 2.100 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3nccn3C)C2)cc1F 804851668 KRDRCHXGDXBGJS-KRWDZBQOSA-N 415.513 2.428 10 20 HECD CN(C)c1ccc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 805011036 PVIJNNCSDKUEDE-INIZCTEOSA-N 424.954 2.450 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 806512844 VMRMKJPGMKZIKW-NVXWUHKLSA-N 401.429 2.226 10 20 HECD CO[C@@H](C)c1nc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cs1 807288185 RJYROUPGBBHMSF-AWEZNQCLSA-N 400.504 2.159 10 20 HECD Cc1cc(CCNC(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1 914542591 BISFLGKOMMLVAP-UHFFFAOYSA-N 418.563 2.360 10 20 HECD CC(C)[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCOCC1 916254152 IWHOPKKDZWGTRT-VQTJNVASSA-N 405.539 2.440 10 20 HECD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 917364423 GMZWFMHNKAYGHB-RCCFBDPRSA-N 400.475 2.075 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3cccc(S(N)(=O)=O)c3)CC2)cc1 918000883 VAXSNJDYASCCRN-UHFFFAOYSA-N 404.492 2.087 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 918438802 IFWQYFHBALZSFI-UHFFFAOYSA-N 400.460 2.403 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4ccccc4oc3=O)nc12 918875464 GBBRDYDWWMWUMM-UHFFFAOYSA-N 409.354 2.075 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCc4ccccc4C3)CC2)cc1 920250293 DMRXENJRPNUTMP-ZHACJKMWSA-N 405.498 2.485 10 20 HECD CN(C)Cc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 920939863 OWSKUHFQKUFAJB-UHFFFAOYSA-N 416.547 2.305 10 20 HECD Cc1cc(S(=O)(=O)N2CCN(Cc3cc4c(cc3O)OCO4)CC2)c(C)s1 921058522 XHQBUTWOLCVSOV-UHFFFAOYSA-N 410.517 2.306 10 20 HECD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)co1 1795133030 GRKDBCSBEDMXAA-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@@H]1CCc2ccoc2C1 1796600964 LQSYRXWZWUBSFL-MXASKKJJSA-N 411.458 2.143 10 20 HECD Cc1cncc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1 1810542920 FJNBWOBCEOLLLO-UHFFFAOYSA-N 410.474 2.355 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCOc3ccccc3F)CC2)cc1 29140940 VYNNRPFRUKOEDD-UHFFFAOYSA-N 401.482 2.494 10 20 HECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)N1CCOc3cc(N(C)C)ccc31)C2=O 536043858 OQISIJOVKBWOJJ-GJZGRUSLSA-N 414.506 2.225 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1 728950548 SFZXUCXPAWWAPW-OAHLLOKOSA-N 413.474 2.434 10 20 HECD C[C@H](CN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1)NC(=O)/C=C\c1cnn(C)c1 733955236 CVMIUZJANSBYLK-DDUXPQFESA-N 418.501 2.418 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(O)c(F)c3)cc2)C1 738987883 ZQWQASACGXNTNF-MRXNPFEDSA-N 400.454 2.232 10 20 HECD CCN1CCC(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 740874522 MBLAGOHTVLATLS-ROUUACIJSA-N 420.573 2.472 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cnn(CC(=O)NCCN(C)C)c2)cc1 741608952 ZSITVXMKQRBHBG-UHFFFAOYSA-N 408.506 2.221 10 20 HECD COC(=O)c1c(F)ccc(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1F 749176948 HXUZAUGZIARXKD-UHFFFAOYSA-N 402.394 2.435 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN3C3CCCC3)CC2)cc1 749241469 NOCIXKMAJQAEOI-QFIPXVFZSA-N 400.567 2.340 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)CC2)cc1 749640963 DILXGBUQJVAKMD-UHFFFAOYSA-N 422.485 2.304 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)N(C)C1CCOCC1 751466631 OHKHYQBCDFECJV-UHFFFAOYSA-N 407.330 2.332 10 20 HECD COCCOc1ncccc1CNC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753855860 JIZAKPBBLATUNW-UHFFFAOYSA-N 418.469 2.286 10 20 HECD COc1ccc(N2CCN(Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)CC2)cc1 755255681 LVLXJLSLXMMSLV-UHFFFAOYSA-N 411.418 2.200 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc4ccc(=O)oc4c3)CC2)cc1 758223622 NZIIYPLHXMSAQB-IBGZPJMESA-N 410.470 2.364 10 20 HECD COc1cc(Cl)cc(CN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)c1O 761190543 CNHIPKXECPZHKU-UHFFFAOYSA-N 411.911 2.024 10 20 HECD CNS(=O)(=O)c1cc(C(=O)NCc2cccc(Br)c2O)ccc1F 765726021 CIMPLGBENYCRNB-UHFFFAOYSA-N 417.256 2.132 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@@H]2C1 766268646 FJVRDLNYMFRCRR-GDBMZVCRSA-N 417.465 2.096 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(N4NC(=O)CCC4=O)cc3)c2)CC1 770149505 YZPOQYRTUZZDPI-UHFFFAOYSA-N 421.501 2.239 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773756791 NSNFAMGTODEWHS-CQSZACIVSA-N 418.515 2.314 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCc2ccccc2C1 775122267 RGWJBNNMNBIVSA-NRFANRHFSA-N 407.514 2.155 10 20 HECD CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775255443 QMJPFTBPZUPOBF-MBSDFSHPSA-N 409.530 2.490 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl 775286774 NRWYXOQVWVHRFB-UHFFFAOYSA-N 419.864 2.037 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(OCC(F)(F)F)nc1 775288539 UWOJXXWFUHVCBG-UHFFFAOYSA-N 406.338 2.316 10 20 HECD CC[C@@H](C)n1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 778245487 HAWYLDHBVLBGJA-OAHLLOKOSA-N 404.536 2.327 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc4c(c3)CCO4)CC2)cc1 778255892 ZKNSHEMHKTVSFB-HJWRWDBZSA-N 421.497 2.151 10 20 HECD CC[C@H](CSC)N(C)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778420198 RXQGQHUIQHYLBM-QXPKXGMISA-N 405.564 2.500 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc2c1OCCC2=O)c1ccc(N2CCOCC2)cc1 780046684 MKWZPCLXMHMYHT-OAHLLOKOSA-N 423.469 2.304 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1 785428772 QXLOKLDBPYVDST-UHFFFAOYSA-N 410.396 2.021 10 20 HECD C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785439958 XULHRAMRTJEIQU-JKSUJKDBSA-N 418.538 2.225 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)c1nnc2n1CCC2 786441089 IESSDJGILVLTFH-HNNXBMFYSA-N 411.506 2.469 10 20 HECD C[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N(C)c1ccccc1 787636958 JIROCQBAMVLVQE-IBGZPJMESA-N 424.545 2.123 10 20 HECD C[C@H](NC(=O)C(=O)NCCO[C@@H]1CCCC[C@H]1C)c1ccc(N2CCOCC2)cc1 787991189 SYIDNIVFPLIOOH-LVCYWYKZSA-N 417.550 2.412 10 20 HECD COc1cc(Cl)ccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317920 BAGMTYXOJBTCTI-UHFFFAOYSA-N 417.893 2.118 10 20 HECD C[C@H](c1ccncc1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789837291 YKPHWZTYTNMRAB-OAHLLOKOSA-N 414.481 2.018 10 20 HECD COCC[C@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccco1 789860901 NQXHRXTYWSHHGH-SFHVURJKSA-N 417.531 2.343 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1 790411737 PUNFYTDOJNNTCZ-UHFFFAOYSA-N 404.441 2.102 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)COc3ccccc3)CC2)cc1 793683216 BJRWYICHOQUHBQ-KRWDZBQOSA-N 411.502 2.364 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccc(Br)cc1 793902314 LUKYESVBOQQXSI-AWEZNQCLSA-N 419.279 2.217 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1 793913795 KJHKDSGSDBAZNL-UHFFFAOYSA-N 419.507 2.383 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 796556995 SWRAMMTZBKTZNE-IZHWHUGBSA-N 420.465 2.280 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 797618997 SUTGTXNPVKQJMR-CQSZACIVSA-N 419.503 2.085 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1 797675308 MVUXMBJOWIYMFZ-CYBMUJFWSA-N 420.491 2.030 10 20 HECD O=S(=O)(Nc1cc(-n2nnnc2C2CC2)ccc1F)c1cccc2nsnc12 799122659 DPJMMAXGWMCHRR-UHFFFAOYSA-N 417.451 2.484 10 20 HECD Cc1cc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)on1 803309503 YOIJCSXJEQYEMC-VQIMIIECSA-N 412.490 2.361 10 20 HECD CC(C)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 803677137 GTFNVNSTUUYNGO-FQEVSTJZSA-N 414.550 2.197 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@H]3C[C@@H](O)c3ccco3)ccc21 803688826 CEKRBZVGQBGUIX-AZUAARDMSA-N 411.502 2.393 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 804007216 CZPITJLZLMMXLX-LJQANCHMSA-N 409.486 2.048 10 20 HECD COC(=O)N1CCC(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989556 OPZLWJZRJQCNOL-INIZCTEOSA-N 404.511 2.362 10 20 HECD Cc1cc(CCNC(=O)C(=O)N=c2ccnc3n(C)[nH]cc2-3)c(C)n1-c1ccccc1 806833885 OKJPGVILAYNKCK-UHFFFAOYSA-N 416.485 2.047 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(N(C)C)cc1 807671691 SCUIUBMWZNPIPS-WMLDXEAASA-N 410.522 2.332 10 20 HECD CCCN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851367 CODHYSYLQZSZIG-UHFFFAOYSA-N 412.578 2.483 10 20 HECD O=C(Nc1ccc2c(c1)C(=O)OC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 808920109 VTXQPWKCLULAIU-QGZVFWFLSA-N 410.426 2.209 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1 809494909 DGGCLWODDUOLNE-DYESRHJHSA-N 405.564 2.272 10 20 HECD O=C(NCCCOC[C@@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)c(F)c1 918197203 QOPCJBMZZRXMSY-SFHVURJKSA-N 409.502 2.172 10 20 HECD CN1CCN(c2ccc(CN(C)CCN3C(=O)c4ccccc4C3=O)cc2F)CC1 1319828849 NRLKSRSOUAJFGJ-UHFFFAOYSA-N 410.493 2.306 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N3CCN(c4ccc(OCC)cc4)CC3)ccnc12 1320511826 QSXFKYPRBUJIKU-UHFFFAOYSA-N 423.473 2.267 10 20 HECD CC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)CC1 1783606262 ITCLSJWNMCQLOT-WCJKSRRJSA-N 417.506 2.153 10 20 HECD Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600973 MYSQXLBLBFKMOE-BJWYYQGGSA-N 412.490 2.322 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1)n1cccc1 1843442452 NYKCHHKSMMSDCO-KRWDZBQOSA-N 419.485 2.045 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1(S(=O)(=O)c2ccccc2)CC1 731340700 XXHVAXCIGVMHGX-UHFFFAOYSA-N 418.490 2.285 10 20 HECD CCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H](C)CS(=O)(=O)CC 733345821 PGZUAXKXKNHWEM-IRXDYDNUSA-N 411.568 2.439 10 20 HECD CNC(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 742799435 AQZLSVQJNYPRKD-CQSZACIVSA-N 404.417 2.441 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)CN1CCOCC1 745500285 DJXYUHCTWSJGBH-CYBMUJFWSA-N 400.317 2.407 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC[C@H]3CN3CCOCC3)CC2)cc1 745796699 TVOLZZQHVZTIMP-FQEVSTJZSA-N 402.539 2.170 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(N2CCOC2=O)cc1 749730843 GMURZCYYDMHFLD-UHFFFAOYSA-N 406.489 2.337 10 20 HECD C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@@H]1C(=O)N(C)Cc1ccccc1O 753834609 MBGOHHIHJYEPBK-WXYCVUISSA-N 410.392 2.336 10 20 HECD C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nc(C(C)(C)C)no1 755060769 GCNDOFZHCIXLDB-AWEZNQCLSA-N 419.501 2.310 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 763283920 MBDFZYPUGOIRKA-RDJZCZTQSA-N 418.515 2.246 10 20 HECD COC(=O)CN(Cc1cc(OC)cc(OC)c1)Cc1cc2c(cc1O)OC[C@H]2O 768442744 NNSZKMPKUDIBDB-LJQANCHMSA-N 403.431 2.010 10 20 HECD C[C@H](NS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(N(C)C)cc1 773089677 UCBYPWFKMAFUAT-AWEZNQCLSA-N 423.560 2.233 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 776269511 LDCCNYQLNPAIEX-CQSZACIVSA-N 403.504 2.111 10 20 HECD CC(=O)Nc1ccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786260366 WGMAXLSNZOANPC-UHFFFAOYSA-N 408.502 2.172 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc4c(s3)CCCC4)CC2)cc1F 789624156 PTFMAPDZSUQBQZ-UHFFFAOYSA-N 418.494 2.457 10 20 HECD CC(C)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)CN1CCCC1 790235916 CITDUQWPRHNFJZ-IBGZPJMESA-N 415.582 2.310 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1 790409039 LFEXWPWDQBSZHR-LBPRGKRZSA-N 420.443 2.029 10 20 HECD CN1CCCC(C)(C)[C@@H]1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790536891 AHZZKMAEHBAKFV-QUCCMNQESA-N 415.582 2.308 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 793860568 BPJDYRMWMXFAHL-QGZVFWFLSA-N 412.509 2.459 10 20 HECD C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 793910204 ITJAOIILXIWDER-KURKYZTESA-N 400.567 2.168 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c(O)c1 797388823 AXFOJRXLWQTNLX-UHFFFAOYSA-N 411.458 2.200 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(O)(c3ccccc3)CC2)cc1F 803665101 TUYQZHXLYSEDGL-UHFFFAOYSA-N 413.493 2.455 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCCCC3(C)C)CC2)cc1 803749850 IRKDUZPJWQZWDS-HXUWFJFHSA-N 416.566 2.018 10 20 HECD Cc1nc(C)c(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 805261611 HQBZMLULDRGMHW-QGZVFWFLSA-N 417.531 2.332 10 20 HECD COc1ccc2c(c1)OCC[C@@H]2NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 806793936 VOQBBQQENDCURK-FQEVSTJZSA-N 407.470 2.328 10 20 HECD CN(CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)Cc1ccc(F)cc1 807289132 JZEJQLIPMUIZAB-UHFFFAOYSA-N 410.493 2.066 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccn3)cc2)C1 810182229 AERYGKDTCPPTGJ-MRXNPFEDSA-N 404.474 2.103 10 20 HECD Cc1cc(CCNC(=O)NCCCN(C)S(C)(=O)=O)c(C)n1-c1ccccc1 916221309 WKMXFBGBESTFPF-UHFFFAOYSA-N 406.552 2.217 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccccc1-n1cccn1 918309596 BRRIYQRHANEMNK-UHFFFAOYSA-N 419.485 2.306 10 20 HECD CCC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783135748 KQQNADAINRAGQX-IMAOXBOFSA-N 418.490 2.083 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccoc2C(F)(F)F)C1 1843488665 GSPGSZLEKXXNAH-UHFFFAOYSA-N 411.336 2.235 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)[nH]n2)C1 1844777299 QDLKMXAKLVMVNH-UHFFFAOYSA-N 419.441 2.014 10 20 HECD C[C@H](NC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 145444987 NTBAMTXDJKMQNO-INIZCTEOSA-N 417.531 2.265 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccc(OCCN(C)C)cc2)n(C)c2ccccc12 670883989 NSXWNSVLKMOZPS-UHFFFAOYSA-N 422.529 2.360 10 20 HECD CS(=O)(=O)N1CCC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 726242589 TUOYNCHSNYLEBS-MRXNPFEDSA-N 407.492 2.121 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 728941051 MFAJUNDQNDARQN-CYBMUJFWSA-N 407.492 2.010 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NCc1nnnn1-c1ccccc1 730579763 HUYPAIYZZGSDND-UHFFFAOYSA-N 409.519 2.215 10 20 HECD CC1CCN(c2ccc(CNC(=O)c3cc(S(=O)(=O)N(C)C)c[nH]3)cc2)CC1 731016621 NYOFJYGWWWOVAB-UHFFFAOYSA-N 404.536 2.431 10 20 HECD O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 732589889 GHCUQMLJJOMLPZ-LSDHHAIUSA-N 415.412 2.246 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 734214746 AVXYCDNPTIFYRW-PMACEKPBSA-N 416.566 2.342 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1cc(I)cn1 738022727 MTJIDFIPRVEBQH-UHFFFAOYSA-N 412.275 2.414 10 20 HECD CCO[C@@H]1C[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 740887211 QUHDUZXCFPRESF-WOJBJXKFSA-N 407.530 2.414 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 742928295 KXICUWUTXCBGIH-UHFFFAOYSA-N 411.550 2.383 10 20 HECD CC(=O)NCCc1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1 743046372 DJLIIIAKQIREML-UHFFFAOYSA-N 405.505 2.023 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(CN2CCOC2=O)cc1 743955585 LBXVQDGSRLSVRE-UHFFFAOYSA-N 423.469 2.478 10 20 HECD COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 753786628 WNIWUMNWRYDNAJ-MRXNPFEDSA-N 418.943 2.121 10 20 HECD Cc1cc(C(=O)Cn2nnc3c(cnn3C)c2=O)c(C)n1-c1ccc2c(c1)CCC2 753795248 FIJSADRKAGFICG-UHFFFAOYSA-N 402.458 2.304 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCOC[C@H]2C[C@@H](O)c2cccs2)cc1 753855859 JIWLZYYDOGNBCG-RTBURBONSA-N 403.548 2.255 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 756326318 GHXZJZMQMZBPAX-IBGZPJMESA-N 404.507 2.175 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 756925080 BIDUFYMPHRCCRW-IBGZPJMESA-N 424.501 2.137 10 20 HECD O=C(CN[C@@H](CCO)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 760862921 DKNRVRMOWSQRRT-FQEVSTJZSA-N 407.530 2.199 10 20 HECD CCC(=O)N1CC[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 762082965 NOXFSLHBPNTXBJ-ZOBUZTSGSA-N 406.502 2.249 10 20 HECD O=C(c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1Cl)N1CCOCC1 765053916 MCDJIADTCSCUBU-UHFFFAOYSA-N 422.850 2.149 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CCCC4(C3)OCCO4)cc2F)CC1 768331273 WWIKBKRVRCDKTK-GOSISDBHSA-N 420.529 2.453 10 20 HECD COCCCNC(=O)[C@@H](C)N1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 769328812 SPCHAVLZXYAWQC-CYBMUJFWSA-N 404.338 2.358 10 20 HECD CCOC(=O)CNC(=O)C1CCN(C(=O)NCc2ccc(N(CC)CC)cc2)CC1 771963405 OYYWVDZDANRKJI-UHFFFAOYSA-N 418.538 2.134 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccc(N(C)C)cc2)c1 772960219 OPMBYMTUERGLJL-CABCVRRESA-N 404.536 2.339 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(F)c(S(C)(=O)=O)c1 785756664 YDGFUQYPMJVEJZ-UHFFFAOYSA-N 406.479 2.338 10 20 HECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789845247 UJRYUHBYUBEAFM-VQIMIIECSA-N 405.514 2.488 10 20 HECD C[C@H]1c2nncn2CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 790204719 ROKJQFQOQAMFTL-ZDUSSCGKSA-N 424.427 2.420 10 20 HECD CC(C)(C)[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 790666429 PXPYGMMFCKTNSD-IEBWSBKVSA-N 402.539 2.345 10 20 HECD COCc1ncsc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 790953445 ZZJAXKSLGJWEDR-UHFFFAOYSA-N 407.492 2.278 10 20 HECD CC(C)[C@H](NCc1ccc(N(C)C)c(F)c1)C(=O)N(C)Cc1nnc2n1CCC2 793247748 SJLXBMIXNOVXSI-FQEVSTJZSA-N 402.518 2.202 10 20 HECD Cc1nn(CCS(C)(=O)=O)c(C)c1CN(C)Cc1ccc(N2CCOCC2)cc1 797944308 CDBKXGPHHHHFKP-UHFFFAOYSA-N 420.579 2.013 10 20 HECD CCNS(=O)(=O)CCNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799925742 UPCFFAQWBRSZRY-AWEZNQCLSA-N 416.975 2.315 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(CC(F)F)CC1 803650194 APEKHZDHAQDRHA-UHFFFAOYSA-N 410.509 2.335 10 20 HECD O=C(NCCCSc1nccs1)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1 806959076 QBJWQAAJWKTRJX-CYBMUJFWSA-N 418.610 2.129 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnc(C4CCCC4)nc3N)cc2)CC1 807354720 HKVCUXYZQPNYEG-UHFFFAOYSA-N 422.533 2.315 10 20 HECD CC(C)Cc1ncc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cn1 807387379 IJLYVWLQZXYQGF-UHFFFAOYSA-N 407.268 2.398 10 20 HECD O=C(N[C@H]1CCCC12CCOCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 814181482 AVRGMIVFPIENTH-QUCCMNQESA-N 416.518 2.365 10 20 HECD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)c1 817957524 CMBLLMCQESUTGR-UHFFFAOYSA-N 423.497 2.151 10 20 HECD CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)Nc2ccc(O)cc2)c1 919954967 ZBAPVYOQPSIKHF-UHFFFAOYSA-N 406.279 2.359 10 20 HECD CCOC(=O)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 920088676 HQMIMBPJDABTPX-HZPDHXFCSA-N 421.513 2.083 10 20 HECD COCCN1C(=O)/C(=C\Nc2ccc3nc(SC)sc3c2)C(=O)NC1=S 920977812 ONNAJFNNNGHXKT-NTMALXAHSA-N 408.530 2.204 10 20 HECD CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1806337492 KCSUDYLPTUUOTH-XUYSBGGMSA-N 411.458 2.328 10 20 HECD O=C(NC[C@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001921 RLPKBYHRRQHRMV-IERDGZPVSA-N 410.474 2.398 10 20 HECD C[C@H](CN)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1817228288 OWMKKDVUFPGSRI-YGRLFVJLSA-N 421.885 2.375 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1)c1cc(O)nc(O)c1 1827286731 YYDQQBMTYYFSGY-ZYHUDNBSSA-N 420.516 2.071 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424130 PXQQQJWWTHVSSC-QGZVFWFLSA-N 417.506 2.341 10 20 HECD COc1cccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c12 1845649344 KWRATLIYXOOCLW-UHFFFAOYSA-N 422.441 2.114 10 20 HECD COc1ccc(CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1F 302758131 MZJQKLBQNJWIKK-UHFFFAOYSA-N 414.525 2.334 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 302761049 JKJODSUEJVEKLA-UHFFFAOYSA-N 422.445 2.284 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CN(C)C(=O)c3cccs3)cc2F)CC1 303325854 SFOLJVSTUWIGDQ-UHFFFAOYSA-N 418.538 2.418 10 20 HECD Cc1c(CNC(=O)N2CCN(c3nccn4cnnc34)[C@H](C)C2)n(C)c2ccccc12 472228522 DTFDHLNYWLDUAF-OAHLLOKOSA-N 418.505 2.345 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c(O)c1O 727004955 ABSCZXPWIOHNHZ-LLVKDONJSA-N 416.386 2.071 10 20 HECD COc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1O 727763009 WMSGTAABXSGRET-UHFFFAOYSA-N 418.515 2.426 10 20 HECD C[C@@H](NC(=O)c1sccc1S(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 731979441 FOOWWQDSSYQQQP-CQSZACIVSA-N 423.560 2.326 10 20 HECD C[C@@H](c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1)N1CCOCC1 732288341 QEHLPEMFFYPCMD-AWEZNQCLSA-N 419.503 2.409 10 20 HECD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NCc2ccc(N(C)C)cc2C)c1 734468237 RSDIBAZJUZOGPZ-UHFFFAOYSA-N 418.519 2.321 10 20 HECD CC(=O)c1ccc(S(=O)(=O)CC(=O)NCc2ccc(N(C)C)c(F)c2)cc1F 734812015 MBISHADEZBKAMD-UHFFFAOYSA-N 410.442 2.324 10 20 HECD CN(C)CCNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)c1 740911661 QLQZNYVZTLYOET-UHFFFAOYSA-N 421.545 2.354 10 20 HECD COC(=O)[C@@H]1CCC[C@H](C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 742241682 TVFSPSZNBAMESZ-RBUKOAKNSA-N 417.550 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1F 746765108 BWRRJILIFZMMCZ-UHFFFAOYSA-N 420.510 2.448 10 20 HECD COC(=O)c1ccc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)[C@@H](C)C2)cc1 749915034 UDLWIOFDTBEMRB-SFHVURJKSA-N 424.545 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(Br)c[nH]3)CC2)cc1 750508922 LBGSUBKDNXQAGG-UHFFFAOYSA-N 422.279 2.291 10 20 HECD CCN(C(=O)CN(Cc1ccco1)Cc1ccccc1O)[C@@H]1CCS(=O)(=O)C1 756327983 YBJQVYJOQMHSKI-QGZVFWFLSA-N 406.504 2.023 10 20 HECD CC1(C)OCC(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CO1 758363269 FXSXDCKQIZURQD-UHFFFAOYSA-N 417.428 2.493 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C1 763281676 WOXWOQTZFWBOPT-KBXCAEBGSA-N 411.458 2.343 10 20 HECD CC[C@H](C)NS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765102856 STWNHYIRGIPRNO-NSHDSACASA-N 410.477 2.100 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@@H](O)C(F)(F)F 766248819 PRDYNNIQLYDVQZ-DOTOQJQBSA-N 420.451 2.469 10 20 HECD COc1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1[N+](=O)[O-] 766936786 FVYAFZXUJRGXTQ-UHFFFAOYSA-N 412.446 2.202 10 20 HECD COc1cccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1O 769506739 AOKXOCLTAQDESR-UHFFFAOYSA-N 418.515 2.434 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)Nc3ccc(O)cc3C(=O)O)cccc12 776433256 PEBVODNOFXXLPL-UHFFFAOYSA-N 402.384 2.226 10 20 HECD CCOC(=O)NCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785670951 YFACAWOSHUSHSE-LBPRGKRZSA-N 424.409 2.078 10 20 HECD O=C(COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc(O)c(O)c1 785766223 LWIPSYCPBDJQIG-SFHVURJKSA-N 420.421 2.260 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3c(C)nn(C(F)F)c3C)cc2)CC1 786258698 GEJXSNDFQDKCQY-UHFFFAOYSA-N 419.476 2.422 10 20 HECD CCCCCN(CCO)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789822433 AUULPHIQJSBWRY-IRXDYDNUSA-N 423.529 2.067 10 20 HECD O=C(NCCCC(=O)N1CCN(c2ccccc2)CC1)c1c(F)ccc(O)c1O 789977751 ZXOOUFLFMYAEML-UHFFFAOYSA-N 401.438 2.096 10 20 HECD C[C@@H](CN1CCCC1=O)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803118708 ZYCBNEOROXMUEM-KRWDZBQOSA-N 414.550 2.199 10 20 HECD CC(C)[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCS1 803299795 NWBXOYFURGJKHA-APWZRJJASA-N 405.564 2.300 10 20 HECD COC1(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCC(C)CC1 803317588 TVMHWAKBWUNOAD-FRIYVGAWSA-N 417.550 2.412 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccc(NC(C)=O)cc1 803556405 GXYJHXBTYRHJPT-UHFFFAOYSA-N 410.518 2.418 10 20 HECD CCc1nc(CCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cs1 804035245 HHDHDHWHCKTDRR-UHFFFAOYSA-N 416.547 2.112 10 20 HECD O=C(NC[C@H]1CN2CCC[C@H]2CO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 804060153 MUYODYRLNPYAJN-PMACEKPBSA-N 415.534 2.033 10 20 HECD Cc1cc(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 918064999 KNUAANTZQWEMOT-UHFFFAOYSA-N 424.954 2.312 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1onc2ccccc12 1796604237 TYUNXAPSDWAEKX-BTTYYORXSA-N 408.414 2.200 10 20 HECD C[C@@H](CN)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809652664 AUQUZEPHRUFDMT-ZDUSSCGKSA-N 409.914 2.191 10 20 HECD O=C([C@@H]1[C@H]2Sc3ccccc3[C@@H]21)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250187 SSXKCNWLKYPZPE-QYZOEREBSA-N 423.494 2.198 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc2c1OCCO2)c1ccc(N2CCOCC2)cc1 725828617 INWCETKKTDCUHS-OAHLLOKOSA-N 404.488 2.334 10 20 HECD O=C(Nc1ccc(-n2ccnn2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 727037564 ORIPWJLZRHNGLX-LJQANCHMSA-N 421.457 2.119 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(CN(C)C)ccc2OC)c1 729065798 FRZJWROJXOXDOJ-CYBMUJFWSA-N 401.463 2.287 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(OCC(N)=O)cc3)cc2)CC1 731131332 KLESBDLRFKWDGP-UHFFFAOYSA-N 424.501 2.042 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)NCc1cccs1 731844899 QOOIXFAOYQWDSN-MRXNPFEDSA-N 403.504 2.461 10 20 HECD Cc1cc(C(=O)CN(CCCCO)C2CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 741250979 LGJMGPQAUWVFJN-UHFFFAOYSA-N 419.547 2.161 10 20 HECD CC(C)CS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742804947 CXOAJCNMORZVLP-CQSZACIVSA-N 404.479 2.444 10 20 HECD CC(C)Cn1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 743223691 URBGNBXZUGWWOF-UHFFFAOYSA-N 405.524 2.096 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1ccccc1CN1CCCC1=O 746497556 PHEUJALSGYYBAG-UHFFFAOYSA-N 422.529 2.390 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)cs2)cc1C 749155662 ZKFOOMNDNBYKID-UHFFFAOYSA-N 418.518 2.406 10 20 HECD CCn1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 751068270 LHQSEIPQECEOMK-UHFFFAOYSA-N 406.489 2.401 10 20 HECD COc1ccc(N(C)CC(=O)NCc2c(OC)cc(OC)cc2OC)c(OC)c1 752123529 DPJPQOVJIHTJQI-UHFFFAOYSA-N 404.463 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)CC2)cc1F 753732614 VJCOAKKOIDAJJY-UHFFFAOYSA-N 413.409 2.441 10 20 HECD COc1ccc(N2CCN(CC(=O)NC(=O)N[C@H]3CCCC[C@H]3C)CC2)cc1F 753856648 DNSPFEOXAKNXKP-QAPCUYQASA-N 406.502 2.361 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)cc1F 753933427 WEPTWNPZPJRLBZ-HOTGVXAUSA-N 406.502 2.313 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cn(C(C)C)cn3)cc2F)CC1 754005507 DOGPTKFIQUYIBL-UHFFFAOYSA-N 409.531 2.224 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](c3ccccc3)N(C)C)CC2)cc1 758184617 FEJVIYFSJLYUFW-UPVQGACJSA-N 412.578 2.071 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 759369053 OGEDDRWKXATSQF-UHFFFAOYSA-N 419.494 2.333 10 20 HECD COC(=O)Nc1ccc(CNC(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)cc1 759596094 MGXYQOPEKIUOCH-UITAMQMPSA-N 400.387 2.149 10 20 HECD C[C@H](OC(=O)CC1(CO)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759941578 QWYWUVXITPETFD-ZDUSSCGKSA-N 407.422 2.495 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccncc3Br)cc2)C1 763279615 FPYVADTWONWJLO-CQSZACIVSA-N 417.307 2.476 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1 765756881 NUOBSNULSAFSAT-LSDHHAIUSA-N 423.307 2.212 10 20 HECD Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768447793 PTQYVRKNVCHVMJ-JXFKEZNVSA-N 412.486 2.238 10 20 HECD CCOC(=O)c1[nH]c(C)c(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1C 771131851 BATYITLOWTUZBN-UHFFFAOYSA-N 409.493 2.466 10 20 HECD COC(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 772908633 CWTARXZVIZDMMI-UHFFFAOYSA-N 415.465 2.486 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3c(C)cccc3OC)CC2)cc1F 773381394 HDCNEOIKWMAGMQ-UHFFFAOYSA-N 401.438 2.439 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC3(N(C)C)CCCCC3)CC2)cc1 774815533 MUINWWSNXNQFSO-UHFFFAOYSA-N 416.566 2.115 10 20 HECD C[C@@H](NS(=O)(=O)c1cnn(CC(F)F)c1)c1ccc(N2CCOCC2)cc1 777908061 CQCCESSWTCYSEV-CYBMUJFWSA-N 400.451 2.024 10 20 HECD C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785421489 CWKKMVMGLVJTJF-MAUKXSAKSA-N 418.538 2.131 10 20 HECD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427698 GOXDFQXOVQWVII-INIZCTEOSA-N 406.490 2.169 10 20 HECD Cc1nc2ccccc2n1CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 785494892 CGSTVHYWFWWILD-UHFFFAOYSA-N 403.486 2.154 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C2 786674930 SBQHUVSMCZOPHL-SFHVURJKSA-N 407.518 2.016 10 20 HECD COc1ccc(F)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1OC 788499565 XVDVUZDSIKBUHT-UHFFFAOYSA-N 422.478 2.008 10 20 HECD CCO[C@@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1(C)C 788744713 ZNOUIMVCQHOERN-KNQAVFIVSA-N 423.529 2.152 10 20 HECD CN(C)Cc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 789734338 IZUBQUBIVNLZRB-UHFFFAOYSA-N 416.547 2.251 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1CCC(NC(=O)C2CC2)CC1 795959564 JNWWCRVYZYMGSY-UHFFFAOYSA-N 415.534 2.339 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N(C)Cc1ccccc1 803664270 IWBDNXGPLHBPQL-MRXNPFEDSA-N 400.498 2.145 10 20 HECD COCCN(Cc1cccs1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685899 OJEWNLMNOMKFSE-UHFFFAOYSA-N 401.532 2.422 10 20 HECD COCCc1ccnc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 804388072 NCGDHDQYFNVMOD-FPLPWBNLSA-N 424.501 2.123 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCCN3C)C2)cc1F 804853285 WDSFZBLCEGBTPF-IEBWSBKVSA-N 404.530 2.231 10 20 HECD CC(C)Oc1ncccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 806525932 PHGHJEVTFKCONL-UHFFFAOYSA-N 403.504 2.034 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc2c(c1)C(=O)OC2 808920838 HQLRTPYIXOTNKW-UHFFFAOYSA-N 411.483 2.165 10 20 HECD CCOCC1(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CC1 809464578 HPEABGCPQSXRIH-UHFFFAOYSA-N 400.479 2.038 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc1 813609258 CFVLUYZXXAUBCL-YDHSSHFGSA-N 416.566 2.058 10 20 HECD CC(C)N(C)C(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224998 ZCMYHRKQBYTFLM-UHFFFAOYSA-N 420.529 2.451 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1S(C)(=O)=O 918306690 CZMXCKBSVRVLBQ-UHFFFAOYSA-N 403.504 2.143 10 20 HECD Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807993778 LPBXAMGNLZNSAL-FOIQADDNSA-N 421.457 2.158 10 20 HECD CCO/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832049343 TXQWHFFYTJEZOH-FWVUHSSSSA-N 403.479 2.276 10 20 HECD CSc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843251035 PGIRDGWMIPKWEK-UHFFFAOYSA-N 413.499 2.274 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2CCCSC2)C1 1847022370 YCVIAEPIUYYAMR-ZKKXHLJNSA-N 418.515 2.163 10 20 HECD CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)NCc2ccc(N(C)C)cc2)C1=O 7099153 PPQPRQOAZSCGBG-HSZRJFAPSA-N 424.501 2.235 10 20 HECD COC(=O)CNC(=O)COC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 11486834 VXWDTPBFHSWGGP-UHFFFAOYSA-N 423.263 2.303 10 20 HECD C[C@@H](NC(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(N2CCOCC2)cc1 145482875 NCKZWPYPJHGCCP-MRXNPFEDSA-N 407.470 2.387 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1 733045407 LRZBGOAZZMGPFG-UHFFFAOYSA-N 418.510 2.158 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cn(CCC(C)C)nn3)CC2)cc1 740646197 RXQOEYZAQSSDEL-UHFFFAOYSA-N 414.554 2.275 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740919165 DZCUUYVETYXBIY-UHFFFAOYSA-N 406.552 2.018 10 20 HECD CNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)s1 740919653 FVRQANLQCGOUDR-UHFFFAOYSA-N 406.533 2.032 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(Cn4cccn4)cc3)CC2)cc1 742921200 PZPQPPUXRXRSDM-UHFFFAOYSA-N 419.529 2.492 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CC3(CS(C)(=O)=O)CC3)cc2F)C[C@@H](C)O1 746831463 DHMIEQCEIJRJDM-GASCZTMLSA-N 412.527 2.270 10 20 HECD CCOC(=O)[C@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 752816295 SCDWBLHWQRWKLM-LLVKDONJSA-N 412.489 2.184 10 20 HECD CCC(CC)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(=O)OC 754906997 VCXKIDBPJHWCKV-HOTGVXAUSA-N 423.529 2.377 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@H]1CCCS(=O)(=O)C1 758662654 MDOIEMPJFCHWHS-KBPBESRZSA-N 417.478 2.133 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N1CCN(c2ccccc2O)CC1 759579631 NGIHCIOMPTZHJR-HEWZJLJBSA-N 412.442 2.097 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)CC2)cc(OC)c1OC 760084064 JBAWBABUQXUGQC-UHFFFAOYSA-N 416.434 2.165 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2COC(=O)C2)NC(=O)OC(C)(C)C)cc1 765684581 PGBKDEGRKDZLSZ-YOEHRIQHSA-N 405.495 2.388 10 20 HECD CN(C)Cc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765902684 BOZODKAIEUIMTP-UHFFFAOYSA-N 406.280 2.471 10 20 HECD Cc1cc2ncc([C@@H](C)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c(C)n2n1 772456015 PTJXPALYOBOPRN-MRXNPFEDSA-N 413.547 2.432 10 20 HECD C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 775411635 RLMBUMWKUMXIIB-KXBFYZLASA-N 412.490 2.100 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc4c3OCCC4=O)CC2)cc1 780050732 QRRHWBZMXZTROH-UHFFFAOYSA-N 423.469 2.384 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCCN(C(=O)C2CC2)CC1 780308508 NARRZYGBFDENII-UHFFFAOYSA-N 402.564 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(C)(c4nc(C)no4)CC3)CC2)cc1 781350069 KSMWVCXVIHAPMJ-UHFFFAOYSA-N 413.522 2.089 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cnc(N(C)C)nc2)cc1 782424945 JNWYRCYVEXSKAL-UHFFFAOYSA-N 422.489 2.369 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1 785432793 IPPBLUDSWMMWFP-UHFFFAOYSA-N 423.439 2.448 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCOCC(F)F)c2[N+](=O)[O-] 788472122 ZJIRKJDJWCCRFQ-UHFFFAOYSA-N 404.325 2.382 10 20 HECD Cc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 789798374 GJTVDUREOUBXQD-HNNXBMFYSA-N 417.481 2.317 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 789840184 GRDSGMDKIWJWIA-OKZBNKHCSA-N 417.525 2.488 10 20 HECD COC(=O)[C@H](NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(OC)c(O)c1 792181898 VWXRRXFXHBZRKT-HXUWFJFHSA-N 404.438 2.380 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCN(C)Cc3ccccc3)CC2)cc1 793841223 WMMNOFAWBNJPBC-UHFFFAOYSA-N 424.545 2.028 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCOC[C@H]2CCOC2)cc1)C1CCCCC1 803677217 JRFWEFQVTPCHKB-IBGZPJMESA-N 417.550 2.241 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@H](C)N1CCOCC1 804774042 ALNGGEHCZVDJFM-ROUUACIJSA-N 417.550 2.279 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](CN3CCCC3)C2)cc1F 804853608 SOLMNGUUGMXKEI-GOSISDBHSA-N 404.530 2.232 10 20 HECD COc1ccc(N2CCCN([C@@H]3CC(=O)N(c4ccc(C(=O)O)cc4)C3=O)CC2)cc1 917638418 KJSQZVMBNIKGET-HXUWFJFHSA-N 423.469 2.238 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccnc3N3CCCC3)cc2)C1 917832487 BMQUUBZXBOKAMD-SFHVURJKSA-N 407.518 2.314 10 20 HECD CCOC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 918220404 DZCNXUIMWQIXRD-MRXNPFEDSA-N 422.501 2.207 10 20 HECD O=C(Nc1ccc(-n2ccnc2)nc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918297306 QFPVSSZGUSLZGA-GOSISDBHSA-N 421.457 2.119 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1F 918437798 BBAZUHAFWXLZBU-UHFFFAOYSA-N 403.429 2.489 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(CN3CCN(C)CC3)c2)c1O 1116811725 MHAMDTFXJDMZCY-UHFFFAOYSA-N 400.479 2.346 10 20 HECD CCc1nsc(N2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)n1 1319713172 UBJCTGOMGKTXEV-UHFFFAOYSA-N 404.559 2.314 10 20 HECD CC1(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1802424367 WLNCHTDKBDWZML-DNVCBOLYSA-N 410.474 2.398 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnoc2)CC1 1827750189 GIWOUOVECAAKDM-INIZCTEOSA-N 400.435 2.028 10 20 HECD O=C(/C=C/c1ccco1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441414 UHHYZRPVGHVSDH-MDZDMXLPSA-N 418.453 2.289 10 20 HECD C[C@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843963995 KBWSFOSLXULLNI-FUHWJXTLSA-N 408.502 2.419 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3Sc4ccccc4[C@H]32)C1 1844271667 JWBAGNGVVZXKMK-GBESFXJTSA-N 423.494 2.198 10 20 HECD COc1ccc(-c2nnc(SCC(=O)NCc3ccc(N(C)C)cc3)n2N)cc1 7327605 OOGYFVQMSUQHBL-UHFFFAOYSA-N 412.519 2.142 10 20 HECD Cc1cccc2c(=O)n(CC(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cnc12 65561195 LOIKCEVKRMYKOP-KRWDZBQOSA-N 406.486 2.419 10 20 HECD C[C@@H](NC(=O)c1ccc(NS(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 148467527 FFRGVVIRAZHVKF-OAHLLOKOSA-N 403.504 2.386 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O 303689654 LQOAVHAMIOQCKP-FQEVSTJZSA-N 410.522 2.357 10 20 HECD CCCn1c(=O)nc(O)c2cc(C(=O)N3CCOc4cc(N(C)C)ccc43)cnc21 437012252 KPYONFXHTOCUGQ-UHFFFAOYSA-N 409.446 2.012 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(C[C@H]4CCCO4)CC3)CC2)cc1 726714926 BKXDIFMEEYWEKL-OAQYLSRUSA-N 402.539 2.170 10 20 HECD CCn1nc(C)c(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1C 727601288 SHJQSLRZMHROEX-GOSISDBHSA-N 412.538 2.221 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCOc3ccc(C=O)cc3)cc2)C1 731612235 HZMJZNLGOWAGOC-IBGZPJMESA-N 409.486 2.286 10 20 HECD C[C@@H](CS(C)(=O)=O)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 732700613 JQUNXTCAFZPEGG-ZDUSSCGKSA-N 419.494 2.331 10 20 HECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCCCSc1nccs1 733972380 QLJUAEQUZPKOCS-SGMGOOAPSA-N 400.595 2.467 10 20 HECD COc1cc(CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1O 734215511 GNIBBKDLOWJNEN-UHFFFAOYSA-N 403.454 2.418 10 20 HECD CNC(=O)c1cccc(CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 740920237 IWLBHECMSXNXOY-UHFFFAOYSA-N 414.481 2.064 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CCO)c3ccccc3)cc2)C1 741080536 CHORHKQCNWYYFN-SFTDATJTSA-N 424.545 2.354 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H](c1ccccc1F)N1CCOCC1 742246917 HTNJUILFUKFALC-QFIPXVFZSA-N 413.493 2.352 10 20 HECD C[C@H](CN1CCOCC1)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743536430 KMLPPWCBQIFWMU-HZPDHXFCSA-N 412.481 2.277 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3c(C)nn(C)c3C)CC2)cc1 745351592 ROHIBGMOMIGRAC-UHFFFAOYSA-N 414.554 2.057 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CC3(CS(C)(=O)=O)CC3)cc2F)C[C@H](C)O1 746831464 DHMIEQCEIJRJDM-GJZGRUSLSA-N 412.527 2.270 10 20 HECD CN1CCC[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 748582248 QXEOWEJLPPGRBR-UQRISPGASA-N 423.585 2.467 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@]3(C)CCCC[C@H]3O)CC2)cc1 748617261 XVVOHGSIWQQOLS-FYYLOGMGSA-N 418.582 2.448 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4ccccc43)cc2)C1 748626354 LMBOSTYLSBJZMW-LPHOPBHVSA-N 406.486 2.131 10 20 HECD CC(C)(C)OC(=O)N1CCC(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1 749133266 YKEFTSQGAPUVEQ-UHFFFAOYSA-N 423.579 2.411 10 20 HECD Cc1c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cnn1-c1ccc(O)nn1 752151890 NBEDAEXKJYOLSL-MRXNPFEDSA-N 409.446 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1F 753739695 YAKPFMBZRXSEMT-IAGOWNOFSA-N 417.481 2.048 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 759590901 BKHHKGCVYUSOLP-UHVJXZQCSA-N 401.390 2.393 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)cc1 760212363 JKZISXDZYDGLGQ-UHFFFAOYSA-N 421.505 2.380 10 20 HECD O=C(O)c1cc(NS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)ccc1O 767468375 DMEPPNWMLWQLMD-NSHDSACASA-N 411.407 2.446 10 20 HECD CCCNC(=O)Cc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 771166148 PHXVOAPEUYJQGY-UHFFFAOYSA-N 422.488 2.373 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773614226 SKPCTLOMAGJXMF-MRXNPFEDSA-N 418.538 2.257 10 20 HECD CCCCC[C@@H](C)NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 774641363 ZGBWUZICCHXOIC-MRXNPFEDSA-N 421.538 2.446 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 775258098 QHMJHGJBISXRFV-QWFCFKBJSA-N 417.550 2.364 10 20 HECD CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NCCc1ccc(O)c(O)c1 778914981 QVBHZIYMCAPSOT-UHFFFAOYSA-N 408.401 2.016 10 20 HECD COc1ccc2ccc(O)c(CN3CCC[C@@H](S(=O)(=O)N4CCOCC4)C3)c2c1 779869812 MIWMUABFENAYEC-GOSISDBHSA-N 420.531 2.180 10 20 HECD COc1cc(F)c([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785432674 GRYUFCZEZIUJSM-ZDUSSCGKSA-N 403.454 2.403 10 20 HECD Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 786112537 UTTXYHFUDBIDTQ-LJQANCHMSA-N 401.482 2.374 10 20 HECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788401992 OJQUMEXLYXAMRZ-QGZVFWFLSA-N 411.502 2.495 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCc4c3cnn4C)cc2)CC1 789591362 NPVYMRKCBLDPGO-HXUWFJFHSA-N 409.534 2.466 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc(Cl)c1F 792230374 HLHCSPIILFPQDI-UHFFFAOYSA-N 410.785 2.235 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@H]3CC(C)(C)OC3=O)cc2F)C[C@@H](C)O1 795649782 FJKSEVGYMXGDSP-CLCXKQKWSA-N 421.513 2.081 10 20 HECD CO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C(=O)O)C1 797709671 GIUCZZBNFQEYHP-QHHYFVSCSA-N 423.485 2.213 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)N1CCC(S(=O)(=O)N2CCCC2)CC1 799884944 WJODJSMJAWRFSI-UHFFFAOYSA-N 420.579 2.386 10 20 HECD CCN(CCOCCO)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 800705441 WTAAFBRUUPKYDX-UHFFFAOYSA-N 401.454 2.297 10 20 HECD C[C@H](CCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCN(C)CC2)cc1 801734459 BYVWFFPMFMLRPC-LJQANCHMSA-N 416.591 2.285 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ncc(-c4ccccc4)cn3)ccc21 803688398 PZVVCFRQWXPCFP-UHFFFAOYSA-N 415.497 2.459 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC(C)(C)OC(C)(C)C3)CC2)cc1 804317334 ZZKSMDPESPACSR-UHFFFAOYSA-N 403.523 2.196 10 20 HECD O=C(N[C@H]1CCc2c(O)cccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804399653 AYORWTIQPJMRKQ-LPHOPBHVSA-N 410.470 2.409 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(CC)Cc3ccoc3)cc2F)CC1 805009794 OELIJZCPXYBAIZ-UHFFFAOYSA-N 416.497 2.226 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@]3(CCc4ccccc4O3)C2)c1 811608442 VUWZBAYVMXMUSM-HXUWFJFHSA-N 402.472 2.374 10 20 HECD CN(C)C(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918201006 ALJHXLUGRIHZHI-UHFFFAOYSA-N 414.481 2.364 10 20 HECD COCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918441357 ZAHZODXQBNUWBU-UHFFFAOYSA-N 415.465 2.188 10 20 HECD CCN(CC)[C@@H](CN/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O)c1ccccc1 920980657 UXOIBKYVVAUADN-FSEPTYSPSA-N 402.564 2.442 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1csc([C@H]2CCCO2)n1 1116591587 DBTAJAXCWHOECN-BLLLJJGKSA-N 406.460 2.310 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1OCC(C)C 1320148434 BLMKUPXQHQFHFX-INIZCTEOSA-N 402.447 2.432 10 20 HECD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)n1cncn1 1788429654 RLYPJVISKAOMJW-ZDUSSCGKSA-N 422.445 2.093 10 20 HECD C[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1822180358 UYFNNYWDNNKSJS-RNCFNFMXSA-N 408.842 2.161 10 20 HECD Cc1cc(S(N)(=O)=O)cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)c1C 542952833 CJOAUKRNFPTCST-UHFFFAOYSA-N 404.492 2.448 10 20 HECD CCOCCN1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 732451478 WKYLTZVBIHUODU-QZTJIDSGSA-N 422.545 2.303 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](CO)c3ccccc3C)CC2)cc1 746756083 VYSYJPTXWASMTF-QFIPXVFZSA-N 412.534 2.158 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSCc3cscn3)CC2)cc1 746839937 TVGKGWANOBWHQN-UHFFFAOYSA-N 406.577 2.323 10 20 HECD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)c(F)c2)c1 746890771 YODZNXOZHKERGR-UHFFFAOYSA-N 421.494 2.079 10 20 HECD C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NCc3ccccc3O)cc2)C[C@@H](C)O1 748354837 NXKRYODXPFEEGB-HUUCEWRRSA-N 404.488 2.120 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-c3nnnn3CC)c2)cc1 749633994 WOTYZUKLIJIGTI-UHFFFAOYSA-N 421.505 2.461 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc12 751137666 UCMCLTSAVQNFCV-MRXNPFEDSA-N 416.503 2.352 10 20 HECD Cc1nc(Cl)ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 751783162 RUNGJJXAJRSGKO-UHFFFAOYSA-N 421.856 2.492 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@H]3CCO[C@H](C)C3)CC2)cc1 753150608 PMQVYMVALMNHAD-YZBXUTEPSA-N 415.534 2.221 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1C 754040573 RGKPIUVDNVPZJT-UHFFFAOYSA-N 422.478 2.440 10 20 HECD CCS(=O)(=O)N1CCC(CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 758746755 ZWAOKEDJPQLUJE-UHFFFAOYSA-N 409.552 2.132 10 20 HECD Cn1ccc(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 760654176 CSHYWUPCVIVHDA-UHFFFAOYSA-N 411.428 2.317 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCSC3)cc2F)C[C@@H](C)O1 762036451 OAYKFTKQSYAEGL-IIAWOOMASA-N 410.511 2.352 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3nc(C)sc3C)CC2)cc1 767555344 LSVPLRICRVPNTH-UHFFFAOYSA-N 403.504 2.203 10 20 HECD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NCc1ccc(O)c(O)c1 768914726 YOVHDHRQUSVWKW-UHFFFAOYSA-N 410.517 2.193 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)CC2)cc1F 769157514 WHXJCECJFDWBOW-VQTJNVASSA-N 420.529 2.044 10 20 HECD CN(Cc1ncc(Cl)n1C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 779336308 KFFZCTXHPOAWRS-HNNXBMFYSA-N 418.929 2.117 10 20 HECD C[C@@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785428067 JQORLHUGPCISFT-INIZCTEOSA-N 400.548 2.336 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CSCC(F)(F)F)CC2)cc1 786452042 OCPRNRWHVKBEEY-UHFFFAOYSA-N 406.426 2.183 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21 788933338 UPHDIEDTACWNTO-SQNIBIBYSA-N 405.589 2.399 10 20 HECD CCOC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 789816245 CKKGABFFJHSPDJ-FCEWJHQRSA-N 423.529 2.233 10 20 HECD CCOC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 789866387 NHKGXUOWSWBHGB-CTDFXDFQSA-N 403.523 2.077 10 20 HECD O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 789965331 FLFXIPHQEJKTTC-MRXNPFEDSA-N 414.481 2.306 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccccc3-n3cccn3)CC2)cc1 794753224 CMCVHWBJEICQLU-HXUWFJFHSA-N 408.502 2.443 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)Oc3ccc(C=O)cc3)CC2)cc1 795775225 MCVKGJUAVWAHLS-GOSISDBHSA-N 411.502 2.213 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(N2CCOCC2)cc1 803298425 ARXFBGDATDQLJW-GOSISDBHSA-N 424.545 2.425 10 20 HECD COC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCO1 807951926 CTBABFNYMSZALV-DOTOQJQBSA-N 423.941 2.066 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn2ccnc12 815371225 NVGMXNJGYBTPGK-UHFFFAOYSA-N 407.474 2.076 10 20 HECD CN1C(=O)c2ccc(NC(=O)C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)cc2C1=O 918457190 ZDZLWOKTFLJCGQ-UHFFFAOYSA-N 420.469 2.108 10 20 HECD COc1ccc(CNC[C@@H]2CN(C(=O)[C@@H]3OC[C@@H]4COCC[C@@H]43)C[C@H]2C)cc1C 1093936782 YKQJPKZYIPKWFV-BCLZFNBHSA-N 402.535 2.239 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCCC[C@H]3N(C)C)CC2)cc(OC)c1OC 1116594737 NAMBYDVAXDRVCA-QZTJIDSGSA-N 420.554 2.417 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)NC(=O)CC1CCCCC1 1342435483 VMSKBCCTARQKCE-YOEHRIQHSA-N 420.506 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(OC)ccc3OC)CC2)cc1 5082327 NJIJWADFZVQOLL-UHFFFAOYSA-N 414.458 2.218 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H](C)Sc3nnnn3C3CC3)CC2)cc1 726562562 LVOJUXQQHUNIDY-CYBMUJFWSA-N 402.524 2.282 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3nccn3C(F)F)CC2)cc1 726701892 ACXYJRAFGTZBAY-UHFFFAOYSA-N 422.480 2.298 10 20 HECD CCN(CC)C(=O)CN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 727239937 ILJKQIQFFWLICX-UHFFFAOYSA-N 407.470 2.201 10 20 HECD CCNC(=O)CCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 729522241 FQWNWQQEQVVQJY-UHFFFAOYSA-N 401.429 2.465 10 20 HECD Cn1cnnc1CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 732763577 KWSJXOHDJRHUEG-JLHYYAGUSA-N 421.573 2.217 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(CNC(C)=O)cc3)CC2)cc1 733664332 BYMBQYSZKJBVNS-UHFFFAOYSA-N 424.501 2.009 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CNS(=O)(=O)c1ccc(Cl)s1 734468201 PZZPEJQQYUOWOL-UHFFFAOYSA-N 401.941 2.371 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1nc2c(s1)COCC2 735584054 DORQGMBBUBWIEG-UHFFFAOYSA-N 418.544 2.024 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(CC(F)(F)F)c3)cc2)C1 741071565 FHSFWICQMCJNET-AWEZNQCLSA-N 424.427 2.469 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 741100330 ZSDFIDPBELETMV-NRFANRHFSA-N 407.470 2.485 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(CN2CCOC2=O)c1 743955077 HHMGBGNRUIABNP-UHFFFAOYSA-N 423.469 2.478 10 20 HECD CC[C@]1(C)NC(=O)N(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 744373406 XZUWUQKYFLRTNS-RBZFPXEDSA-N 424.448 2.094 10 20 HECD O=C(COc1ccccc1CNC(=O)NCc1ccccc1O)NC[C@H]1CCCO1 748459632 HRHCBWQZANRZIT-GOSISDBHSA-N 413.474 2.066 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 753641099 ZCVQEOBNUXHDAY-AWEZNQCLSA-N 406.504 2.488 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753857134 LMMVZODEQQOGQI-GOSISDBHSA-N 418.465 2.183 10 20 HECD CCc1ccc([C@H](COC)NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 754346767 GMSDVJNIRCZJAR-FQEVSTJZSA-N 401.507 2.477 10 20 HECD C[C@H](NC1CCN(S(=O)(=O)C2CCOCC2)CC1)c1cc(F)cc(F)c1O 756734584 XUZPJRHATOMAQQ-LBPRGKRZSA-N 404.479 2.294 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccn(CC(F)(F)F)c1=O 757246055 DSYXAASIEMRAEO-UHFFFAOYSA-N 422.407 2.266 10 20 HECD COC(=O)c1cc(F)ccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 758300789 RGSSCQICDRGAJB-CQSZACIVSA-N 422.478 2.488 10 20 HECD CCN1CCC(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 759285283 XSURVOQQXAFXAX-UHFFFAOYSA-N 420.554 2.276 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(-c4cccnc4)c3)CC2)cc1 759286234 XBMLCKZOPJUGID-UHFFFAOYSA-N 420.517 2.218 10 20 HECD CCOC1CC(CNC(=O)NCc2ccc(N3CCCC3)cc2)(N2CCOCC2)C1 767777955 FOWXCYBIPCOQRJ-UHFFFAOYSA-N 416.566 2.356 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN(C)C(=O)c1ccc(Br)o1 773740912 QVTJVJFLMKUWOP-SNVBAGLBSA-N 411.252 2.273 10 20 HECD COc1c([N+](=O)[O-])ccc(CNC[C@H](c2cccs2)N2CCN(C)CC2)c1O 774942859 QFDCKESODMLHMY-MRXNPFEDSA-N 406.508 2.449 10 20 HECD CCOCCOC1CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 777720121 FEDPZZUGVOPKEH-HZPDHXFCSA-N 409.502 2.386 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3csc(C)n3)CC2)cc1 778223166 JFMWZRFXJWIPSO-BQYQJAHWSA-N 414.531 2.024 10 20 HECD CCOc1ncccc1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778240077 ZWKIPUXPOJXWIL-KHPPLWFESA-N 424.501 2.010 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(O)c(O)c3)cc(C3CC3)nc21 778917066 UPIWVVMMKKUUMM-UHFFFAOYSA-N 410.430 2.126 10 20 HECD COc1ccc(C(=O)N2CCC(NC(=O)c3ccc(C)c(O)c3O)CC2)cc1OC 780945351 JSWJFJABAWGMIQ-UHFFFAOYSA-N 414.458 2.458 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCCNc2ccc(C(F)(F)F)cn2)cc1 785426387 XLUHPELIGHBFBY-UHFFFAOYSA-N 423.439 2.401 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1 785435383 YLWIUZVPWGDFCU-INIZCTEOSA-N 423.439 2.448 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1ccc(OC)nc1 785841786 GBQRVZMVTQIKOC-UHFFFAOYSA-N 422.279 2.223 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)c1nnc2n1CCCCC2 786053103 AANSABJDBXOKJR-MRXNPFEDSA-N 412.538 2.296 10 20 HECD CCNC(=O)c1ccc(CNC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)cc1 787182529 DAZWLUBEDFQOBZ-UHFFFAOYSA-N 410.518 2.215 10 20 HECD COC(=O)[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H]1C 787505989 XALAJANNYSWJEV-WCQYABFASA-N 424.500 2.278 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]2CCCC[C@H]12 789798979 HAAFWNQCVGINSW-SUMDDJOVSA-N 403.498 2.316 10 20 HECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 792709084 DJLGIFBUIUNSLR-KRWDZBQOSA-N 414.568 2.268 10 20 HECD Cc1ccc([C@H](CNC(=O)C(=O)NCCCSc2nccs2)N(C)C)cc1 793723404 WQOZUYFWOVCRRF-INIZCTEOSA-N 406.577 2.469 10 20 HECD C[C@H](NC(=O)C(=O)N1CCc2cc(F)ccc2C1)c1ccc(N2CCOCC2)cc1 803305660 LQPDOGODEBBHSF-INIZCTEOSA-N 411.477 2.424 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nc(C(F)(F)F)cs2)cc1F 803660826 GHZZFFVKDWHVCW-UHFFFAOYSA-N 404.389 2.300 10 20 HECD Cc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)o1 803660909 IWFAEKPHFXJPIA-LJQANCHMSA-N 416.497 2.363 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCSc3nccs3)ccc21 803686120 WRMRBEITFBJDQB-UHFFFAOYSA-N 404.561 2.440 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 804118497 RZTNEPOQDGZDOX-SFHVURJKSA-N 410.518 2.081 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCn1cc(Br)cn1 805838171 NHJCBOHUFPGLCA-UHFFFAOYSA-N 422.327 2.324 10 20 HECD CCCN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 806496605 ZYQWKHGWCGNXMW-QUCCMNQESA-N 401.555 2.062 10 20 HECD COc1ccc(O)c(CNC[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1 816550444 RDPFJFQZOXLOCC-HNNXBMFYSA-N 407.511 2.254 10 20 HECD Cc1nc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2o1 918284589 KKOATNKCVYGOJU-UHFFFAOYSA-N 412.421 2.367 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1 919815831 FNUPXXIIUYLACQ-UHFFFAOYSA-N 413.455 2.226 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c[nH]c4cnccc34)CC2)cc1 1261234880 ZDSVMKRNOQFRAN-UHFFFAOYSA-N 408.458 2.006 10 20 HECD COc1cc(/C=C2\N=C(C3=S=C(C)C=C3)OC2=O)c([N+](=O)[O-])cc1OC(C)=O 1317745727 VQONMEJZWWGUBO-SDQBBNPISA-N 402.384 2.493 10 20 HECD CN(C)[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1321731000 URGKHFONZXDHOV-DFQSSKMNSA-N 401.555 2.060 10 20 HECD O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(F)(F)Cl)C3)=NN1c1ccccc1 1796934713 HCSRCZIROLWOOH-UBSAEIQESA-N 424.835 2.249 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807764071 SPGKSGDBRSMFEN-LSXYAIFWSA-N 410.474 2.254 10 20 HECD CC/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838032193 GICJIUBLXMFFJA-SYZQJQIISA-N 417.506 2.461 10 20 HECD Cc1oc2cc(O)ccc2c1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843741469 QVBHRHAIFSDYDQ-UHFFFAOYSA-N 423.425 2.384 10 20 HECD Cc1n[nH]c(C)c1CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501806 FQEFDPXWPFOSMG-UHFFFAOYSA-N 418.881 2.151 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 7201572 FXHXSKSSHZRXOA-DLBZAZTESA-N 418.515 2.251 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 57372395 PCBHMJAPTMHOJG-GASCZTMLSA-N 410.453 2.345 10 20 HECD Cc1cc(NC(=O)CSCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)no1 148448335 REBUIKJUGDPSOJ-HNNXBMFYSA-N 418.519 2.369 10 20 HECD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 303010609 JZPLOGIHFIAVIS-UHFFFAOYSA-N 401.467 2.015 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)ccc1-n1cnnn1 527170604 DKCJKHZSSQMSIT-UHFFFAOYSA-N 403.446 2.026 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@H]3CCCc4ccccc43)nc12 733895132 RSHJYAPGPCLADO-IBGZPJMESA-N 410.474 2.484 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)c2)CC1 739767568 CZRXXNNJSNOCRC-UHFFFAOYSA-N 412.402 2.278 10 20 HECD CN1CCN(Cc2cccc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2)CC1 742247065 NMPLKKMDUVZPJY-UHFFFAOYSA-N 408.546 2.201 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)Cc3cnc(C)s3)CC2)cc1 742939974 NROWGODKTRLHTL-UHFFFAOYSA-N 403.552 2.424 10 20 HECD O=C1OCc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc21 751136704 KVEMSTAEWAQPTM-MRXNPFEDSA-N 403.456 2.433 10 20 HECD CN(C)c1ccc(CNC(=O)c2c3c(cc([N+](=O)[O-])c2[N+](=O)[O-])OCCO3)cc1 751219087 GTTOHGBFZILFDI-UHFFFAOYSA-N 402.363 2.270 10 20 HECD COc1ccc(N(C)CC(=O)NCc2cc(OC)c(OC)cc2OC)c(OC)c1 752123492 CULKAIHNIXQSBV-UHFFFAOYSA-N 404.463 2.482 10 20 HECD CC(C)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C 754731173 MOPPYMCMPPPFIH-FQEVSTJZSA-N 423.529 2.234 10 20 HECD COc1ccc(COC[C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 755304515 QLPJDMYEAUHVHJ-NRFANRHFSA-N 414.502 2.320 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCc1ccccc1Cn1cccn1 759590649 DBYUEONGWSAJMX-CLFYSBASSA-N 407.426 2.215 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc([C@H]2CCCO2)s1 760383147 ULDOODTYVSWAGA-MRXNPFEDSA-N 421.544 2.159 10 20 HECD COCCOc1ccc(Cc2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 762335052 MMVRGLMYURBSBL-UHFFFAOYSA-N 419.459 2.430 10 20 HECD COc1ccc(N2CCC(NCCCN3CCN(c4ncccn4)CC3)CC2)cc1 764847186 PAGRNSSQXBSKQQ-UHFFFAOYSA-N 410.566 2.256 10 20 HECD NC(=O)COc1ccccc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913187 WBHVPMRUPDXAGO-MRXNPFEDSA-N 417.893 2.304 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCCN2CCCC2=O)cc1)C1CCCCC1 774461100 JEXNZWLHQIYDAF-UHFFFAOYSA-N 414.550 2.200 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N(C)C)c1 774947630 OMKXQPXKEAQGQS-QFIPXVFZSA-N 422.529 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3COc4ccc(C)cc43)CC2)cc1 778375975 OAKAPOGAWGFBRF-GLCJEOIMSA-N 421.497 2.458 10 20 HECD COc1cccc(-n2c(C)nnc2SCC(=O)NCc2ccc(O)c(O)c2)c1 778919917 PMDDSAJLAHOMFB-UHFFFAOYSA-N 400.460 2.404 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)N3CCc4ccccc43)nc12 788137596 CRUTYZXTDGXWCB-ZDUSSCGKSA-N 410.430 2.106 10 20 HECD Cc1csc([C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)n1 788322050 FQMOGWJYHDSOQY-SFHVURJKSA-N 414.531 2.172 10 20 HECD COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 788401991 OJQUMEXLYXAMRZ-KRWDZBQOSA-N 411.502 2.495 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)C[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 789812150 JFLZPHGJVWSFSW-JFIYKMOQSA-N 421.513 2.083 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)c3c(F)ccc(O)c3O)CC2)cc1 789947006 VDROLOGRNWFOPW-UHFFFAOYSA-N 408.451 2.128 10 20 HECD COc1ccc(CNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c(O)c1 794372628 BLXRJJCBXBMKLO-UHFFFAOYSA-N 412.414 2.050 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C4CC4)c3)cc2)C1 795397522 QVEAHURHRNFFSF-SFHVURJKSA-N 421.501 2.062 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)NCC(=O)N3CCOCC3)cc2Cl)C1 799966639 LTLWDHDAWGVFMM-HNNXBMFYSA-N 408.930 2.234 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc(N2CCOCC2)cc1 803298426 ARXFBGDATDQLJW-SFHVURJKSA-N 424.545 2.425 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCOc2ccccc21 804082394 NYKBKVKZCGRDSE-LJQANCHMSA-N 423.513 2.164 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCCCSc2nccs2)C1 806276745 TVHNRHVZTCTCDG-SFHVURJKSA-N 413.565 2.179 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 806457401 LIULXKZNCQOZRA-CABCVRRESA-N 419.419 2.365 10 20 HECD COc1cccc2c1OCC[C@@H]2NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290208 DZBNINYHRXGQEL-IBGZPJMESA-N 407.470 2.328 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 809378475 IGYHEPKYTRMMAI-UHFFFAOYSA-N 414.506 2.163 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)c1 810448191 XOBZJFGVYBPEMZ-UHFFFAOYSA-N 402.516 2.483 10 20 HECD O=C(CNS(=O)(=O)c1ccccc1F)NCc1cc(Cl)cc(Cl)c1O 811528802 IORDKTPXHBHEMF-UHFFFAOYSA-N 407.250 2.433 10 20 HECD O=S1(=O)CCN(c2ccc(CN[C@@H](c3nc[nH]n3)C3CCCCC3)cc2)CC1 813860827 LUOYTFQUDACVDW-LJQANCHMSA-N 403.552 2.451 10 20 HECD CN(CC(=O)NC1CC1)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 914436927 FODSHVDLISQJDL-GXDHUFHOSA-N 423.585 2.467 10 20 HECD COC(=O)N1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 917172313 SHPMNOFHDOIDLL-CQSZACIVSA-N 421.453 2.173 10 20 HECD O=C(NCc1ccc(-n2ccnc2)nc1)NCc1ccc(N2CCOCC2)c(F)c1 918199558 HIAKFDONQANLRU-UHFFFAOYSA-N 410.453 2.242 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918308920 RYTYINNSHHKYBQ-UHFFFAOYSA-N 410.474 2.079 10 20 HECD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCc1ccc(N(C)C)cc1 919808083 QWCPUHHBAZDXJU-HNNXBMFYSA-N 420.491 2.422 10 20 HECD Cn1[nH]c(C2CCN(C(=O)OC(C)(C)C)CC2)nc1=NC(=O)c1cc(O)cs1 1120819946 SDBAGXVUSFFNHO-UHFFFAOYSA-N 407.496 2.371 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1C1CC1)C2)c1cc(O)c(O)c(Cl)c1 1799767071 OWWKTVYAGALHGF-KQVLKZGSSA-N 420.893 2.001 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccno2)CC1 1825915695 HUYFVPAJQNSKMO-HNNXBMFYSA-N 400.435 2.028 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2C2CC2)C1 1841270370 DJTGZQGQRCIWCX-MSOLQXFVSA-N 406.486 2.029 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3cccnc23)C1 1843638285 PSPFNXLHZCAWQC-UHFFFAOYSA-N 404.426 2.172 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c1 728610701 LISQHDGAYKWWRI-QGZVFWFLSA-N 417.531 2.058 10 20 HECD CC(C)(C)CN(CCCO)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 730121136 HWRUPQZYRPXWOA-GOSISDBHSA-N 404.555 2.328 10 20 HECD COC(=O)NCCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 733543927 DTHSCROGNSCVLS-UHFFFAOYSA-N 416.430 2.337 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NC(=O)c2ccc([N+](=O)[O-])o2)c1 734015492 OBYSZUNOTCPUQQ-ZDUSSCGKSA-N 423.447 2.070 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)NCc2cc(OC)ccc2O)cc1 734016811 IVSTXTNWAHYORD-UHFFFAOYSA-N 400.460 2.273 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1 734072487 CDZDICQTAJVKCS-SFHVURJKSA-N 400.431 2.214 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1 734178004 RKTRZMDGGWPITR-QGZVFWFLSA-N 403.504 2.158 10 20 HECD CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734703336 NAKNRSRNMNMCLA-OAHLLOKOSA-N 412.490 2.289 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(nc1O)CCCC2=O 736196292 QTFLIVQKTWYITM-UHFFFAOYSA-N 409.486 2.445 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1 737100740 SYMFDQDPLSCBKF-UHFFFAOYSA-N 408.437 2.262 10 20 HECD COCCNC(=O)Cn1cc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cn1 741735885 FZCZZZHYLQCHJP-UHFFFAOYSA-N 413.453 2.445 10 20 HECD CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NCc1cc(OC)ccc1O 743910233 ODYXNAUBISPVSL-UHFFFAOYSA-N 406.460 2.456 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCCN3C)cc2F)C[C@@H](C)O1 745080945 YSTCWYPNPJHMTQ-YRNRMSPPSA-N 421.513 2.083 10 20 HECD COC(=O)c1cc(Cl)ccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 753829608 KQWILLUMEJVICG-UHFFFAOYSA-N 424.906 2.442 10 20 HECD COc1cc(N2CCN(c3ccc([N+](=O)[O-])c4nonc34)CC2)cc(OC)c1OC 758941867 RTQNBMRSZPMDPB-UHFFFAOYSA-N 415.406 2.483 10 20 HECD COc1cc(N2CCN(C(=O)NCCN3CCC(C)CC3)CC2)cc(OC)c1OC 759220137 HYYQFMIXOPDKIM-UHFFFAOYSA-N 420.554 2.276 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@@H](Cc4ccncc4)C3=O)cc2F)C[C@@H](C)O1 761097523 JCMMCGFBWPRIJM-KHYOSLBOSA-N 412.465 2.497 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCn1c(=O)oc2ccccc21 761285009 WPSZZASIKWQXBS-UHFFFAOYSA-N 401.806 2.418 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)c3ccccc3)CC2)cc1 761622255 FMXIPLHHHIIMJD-QFIPXVFZSA-N 412.534 2.240 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3cc(N4CCCC[C@H]4CO)ncn3)cc2)CC1 764916088 DYPUDNHYISWJGJ-NRFANRHFSA-N 424.549 2.108 10 20 HECD CC(C)NC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 767296792 BBUWZEJPNORHMD-HXUWFJFHSA-N 422.529 2.457 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@H](C)O[C@H](C)C3)CC2)cc1 767316916 FSCUMHMHAPCZFU-REPLKXPHSA-N 404.555 2.463 10 20 HECD COc1cc(O)c(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1OC 768447023 QIWKEOUNZOYESQ-UHFFFAOYSA-N 401.419 2.276 10 20 HECD CC1(C)CCCN(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 770299788 MCBRKCYJQVCYRE-LJQANCHMSA-N 415.582 2.310 10 20 HECD O=C(Cc1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1)NC1CC1 771011996 LQMJZWMDFHCONB-UHFFFAOYSA-N 420.472 2.126 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 772477718 RMLVMHUBMIFGOO-LJQANCHMSA-N 419.485 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3c(=O)ncn3-c3cc(C)ccc3C)CC2)cc1 772568461 DOOMMAPOIKYCJK-UHFFFAOYSA-N 421.501 2.008 10 20 HECD COCCC1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 773034115 BUHVHIKNVBWBNJ-UHFFFAOYSA-N 413.497 2.375 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCOC(C)C 774767935 NAVOVQHAFPEQQM-UHFFFAOYSA-N 401.301 2.435 10 20 HECD O=C(Cn1cnnn1)N1CCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 775416528 ITBIUSXEBMULMK-UHFFFAOYSA-N 419.449 2.465 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)/C=C/c1ccc(O)c(O)c1 779520068 OFRMBZMAKOLZJU-UXBLZVDNSA-N 406.460 2.399 10 20 HECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 780700640 OJSJQQWEQUDWPQ-UHFFFAOYSA-N 423.560 2.016 10 20 HECD COC(=O)COc1ccc(N(C)CCOc2ccc(S(=O)(=O)N(C)C)cc2)cc1 784553233 DEKUCJONWLITIH-UHFFFAOYSA-N 422.503 2.004 10 20 HECD COc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)cc(OC)c1OC 785482580 LNAXDEFEYJJCNQ-UHFFFAOYSA-N 415.490 2.019 10 20 HECD C[C@H](O)CN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](C)CO 785871086 XPXUQCNUOCCVAN-ILXRZTDVSA-N 401.454 2.030 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](C)N1CCc2sccc2C1 789720745 ARHYJJXWKTVMTH-MRXNPFEDSA-N 414.575 2.302 10 20 HECD CC(C)[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)N(C)Cc1nnc2n1CCC2 793247949 WJKKHRLAQBCSEX-GOSISDBHSA-N 409.893 2.495 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@@H](N3CCCC3)C[C@@H]2C)c1 795707137 YABCXUXRWPQKOG-JTSKRJEESA-N 401.551 2.486 10 20 HECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 799915983 DXQUNCDAYVELBQ-YRNRMSPPSA-N 413.497 2.372 10 20 HECD CS[C@H]1CCCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803300446 SAQHGKQEBKIUJU-APWZRJJASA-N 405.564 2.445 10 20 HECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](C)S1(=O)=O 804968916 JTGPNHUBORBWJB-QAPCUYQASA-N 411.593 2.347 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)[C@H]1c1ccccc1 806276335 NBBIYRSXKDJTST-JKSUJKDBSA-N 404.561 2.303 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 806853966 YATSWQAEYGMZCT-IBGZPJMESA-N 418.488 2.408 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O 807654007 JSYGYFOVAIXWCB-LAUBAEHRSA-N 422.529 2.411 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](c1cccc(F)c1)N(C)C)c1ccc(N(C)C)cc1 807670202 BSTJHTDFKFUVHG-MGPUTAFESA-N 400.498 2.488 10 20 HECD CNC(=O)[C@H]1CCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 809240318 VIKKPKAJLOHILS-ZWKOTPCHSA-N 401.507 2.084 10 20 HECD COc1cccc(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1O 813489282 UTBVLWYMZFKVRD-UHFFFAOYSA-N 405.472 2.040 10 20 HECD CC(C)[C@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCOCC1 916254150 IWHOPKKDZWGTRT-PMACEKPBSA-N 405.539 2.440 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)cc1 917752066 QNFPXCBYVHCIDA-UHFFFAOYSA-N 424.500 2.436 10 20 HECD CCOc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 918436776 CLVILGHGLAELKZ-UHFFFAOYSA-N 400.504 2.288 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1C 918462061 PLVZIDFESQHBCW-UHFFFAOYSA-N 424.501 2.041 10 20 HECD CCN1CCOC[C@@H]1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1337093405 HIMMKBAVUFFMMS-RBUKOAKNSA-N 420.554 2.155 10 20 HECD COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1514747685 JFRPFISOPGAYMR-IBGZPJMESA-N 418.515 2.123 10 20 HECD C[C@@H]1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778900730 FAYVXCKUBYUCHP-XCMNSTNTSA-N 417.506 2.057 10 20 HECD CC(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826299481 QLSRUGHGKYYNAL-JKNJVXJCSA-N 416.474 2.025 10 20 HECD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C1(O)CCC1 1841048716 NLNWALXBYRIPAD-GFCCVEGCSA-N 408.882 2.119 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)cc1 302601439 MSNHAURZOQUVFO-FQEVSTJZSA-N 401.532 2.039 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CC[S@](=O)c1ccc2c(c1)OCCO2 470530472 PTSGOYIMANEVAQ-LJAQVGFWSA-N 416.499 2.447 10 20 HECD CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCS(=O)(=O)[C@H]2C)C1 485895793 FQQWNXOOHCYBRA-YJBOKZPZSA-N 403.548 2.100 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3[C@@H](C)O)cc2F)C[C@@H](C)O1 730260538 BBIBXVDAXNXTKI-WOCWXWTJSA-N 407.530 2.291 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1 732256506 FHZLSUPJBRGVGT-CYBMUJFWSA-N 407.492 2.357 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(n2cncn2)C1 732760207 GCKZPRJKQVRRAZ-AUWJEWJLSA-N 419.557 2.405 10 20 HECD CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NCc3cc(OC)ccc3O)c2)n1 734072484 BZOODTZWHDZJPR-UHFFFAOYSA-N 422.441 2.381 10 20 HECD Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746674519 TXYXXSYYGPIJOU-QGZVFWFLSA-N 409.490 2.117 10 20 HECD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 750554497 SHTBEOWLJKDMOC-UHFFFAOYSA-N 403.350 2.171 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(SC)nc3)CC2)cc1F 754214120 YXBJQTSJLRPGCX-UHFFFAOYSA-N 404.467 2.239 10 20 HECD CCN1C(=O)[C@@H]2CN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CCN2C1=O 757689512 QBECTAYUBPVBHM-IBGZPJMESA-N 413.522 2.101 10 20 HECD COc1cc(N2CCN(C(=O)C3(NC(C)=O)CCCCC3)CC2)cc(OC)c1OC 759220074 CIIKLRWVTKXRHS-UHFFFAOYSA-N 419.522 2.200 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN4CCCC[C@@H]34)CC2)cc(OC)c1OC 759254499 PUSQKCKZKLYVFF-MSOLQXFVSA-N 418.538 2.171 10 20 HECD COc1cc(N2CCN(Cc3nc(N)c4ccccc4n3)CC2)c([N+](=O)[O-])cc1OC 766925250 IFWMNVFBJUPAPL-UHFFFAOYSA-N 424.461 2.460 10 20 HECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)c1ccc(NS(C)(=O)=O)cc1 772774095 GSYCHYLYSIURTB-JOTVYFQTSA-N 405.428 2.297 10 20 HECD O=C(CN1CCc2cc([N+](=O)[O-])ccc21)NCc1ccc(N2CCOCC2)c(F)c1 772902482 TZXKZNZNHFKYJF-UHFFFAOYSA-N 414.437 2.249 10 20 HECD CC(C)OCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774766824 IFCBXQZMSJHQAS-HNNXBMFYSA-N 413.465 2.304 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCC2(N3CCOCC3)CCCCC2)c1 775370548 HMGZNYLIEBJOGH-KRWDZBQOSA-N 405.539 2.203 10 20 HECD CCOc1ccnc(N2CCCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)n1 775737483 IIHLCQWEHPKPDZ-UHFFFAOYSA-N 410.566 2.339 10 20 HECD COCC1=CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 775827399 QYUZVIHGSHXKNE-IRXDYDNUSA-N 405.514 2.334 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)N(C)CC4)CC2)cc1 776040055 GCPAIKVOWGWAGM-UHFFFAOYSA-N 408.502 2.411 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 776040762 DLCSUEDVMFXGTQ-YLJYHZDGSA-N 409.552 2.068 10 20 HECD CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1(C(N)=O)CCCC1 778394616 MFXDKGZRBWAMEO-UHFFFAOYSA-N 423.516 2.125 10 20 HECD CNC(=O)CCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 781230714 VAERGEUVRZIREG-ZDUSSCGKSA-N 422.437 2.249 10 20 HECD Cn1cc(-c2ncccc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 786271759 YKPJZHUKPAJHTI-UHFFFAOYSA-N 404.474 2.337 10 20 HECD C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 787369384 ZIBTUXKNSSDLJR-CQSZACIVSA-N 415.465 2.374 10 20 HECD COc1ccc(N2CCCN(C(=O)c3nnn(Cc4ccncc4)c3C)CC2)cc1 795398665 PIHUVUNAQKKSGB-UHFFFAOYSA-N 406.490 2.391 10 20 HECD CCCc1[nH]nc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c1[N+](=O)[O-] 796261133 XYVMLMAKVFYXRM-UHFFFAOYSA-N 403.439 2.152 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCCCC3(C)C)CC2)cc1 803749849 IRKDUZPJWQZWDS-FQEVSTJZSA-N 416.566 2.018 10 20 HECD CC1CCC2(CC1)OC[C@H](CNC(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)O2 806708890 AMVPGNOIBNBYAM-GTPZEUEISA-N 413.518 2.117 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807287961 QFLOYOBPLBGSSE-QHCPKHFHSA-N 413.518 2.117 10 20 HECD NC(=O)[C@H]1CC(C(=O)NCc2cc(Cl)cc(Cl)c2O)=NN1c1ccccc1 807838845 SGLLUTFPZAPKLA-OAHLLOKOSA-N 407.257 2.435 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 808079151 QKHDQJNOAYWGSZ-YLJYHZDGSA-N 417.550 2.444 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1 809328146 AJMWQMRMYGRWHL-UHFFFAOYSA-N 410.518 2.053 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)Sc3nncn3C)cc2F)C[C@@H](C)O1 917709583 PLJIJCMUAOEUOE-MJBXVCDLSA-N 407.515 2.365 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)c1ccc(Cl)cc1 1324541486 LAUGKVPIMRZFEB-YWZLYKJASA-N 407.850 2.249 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CC(C)C)N1CCCCC1=O 1325382358 LNGNBCVJXCJXOB-DLBZAZTESA-N 420.506 2.115 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H]3CCN(C)C[C@@H]3c3cnn(C)c3)CC2)cc1 1355457610 OSFDBNBCEPPDHZ-FGZHOGPDSA-N 411.550 2.203 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3F)CCC2)cc1 1792315054 YZKHIVVIGPRBBE-UONOGXRCSA-N 421.519 2.339 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccnc(Cl)c1 1796599200 DSSGHYSENSNJNG-BTTYYORXSA-N 402.838 2.107 10 20 HECD Cc1onc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)c1C 1810546437 BCNMVNSESHUPIB-UHFFFAOYSA-N 414.462 2.256 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)C(F)F 1816839695 AVYUWVNEHUXLMK-PZBABLGHSA-N 422.388 2.497 10 20 HECD COC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424225 UTSCIMPKNDPZTP-YOEHRIQHSA-N 405.495 2.009 10 20 HECD CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898650 UQTMNHMDCJCTRN-OAHLLOKOSA-N 411.593 2.267 10 20 HECD COC(=O)c1cc(NS(=O)(=O)c2cccc3nsnc23)cc(C(=O)OC)c1 14256924 VMWSOAYTUHGAQZ-UHFFFAOYSA-N 407.429 2.065 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)Nc3nnc(NS(C)(=O)=O)s3)ccc21 486976271 KZIRSZPOOURJEZ-UHFFFAOYSA-N 423.520 2.380 10 20 HECD CN(C)c1ncc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 727469631 YYNBSMJGZGRING-UHFFFAOYSA-N 422.512 2.088 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1 729064064 OFGUFHFSXDBVHV-AWEZNQCLSA-N 411.458 2.339 10 20 HECD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NCc1ccc(N(CC)CC)cc1 729523580 QQSHCMIGXSLFKF-FQEVSTJZSA-N 407.522 2.437 10 20 HECD Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741099844 JWMZSORJKPFCJY-UHFFFAOYSA-N 420.513 2.463 10 20 HECD NC(=O)CCOc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 743150028 LHMYMMJUXDDXLN-UHFFFAOYSA-N 416.453 2.238 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3nc(C)c(C)s3)CC2)cc1 743568701 YAOQDIXBLFIMAH-UHFFFAOYSA-N 403.552 2.390 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](c3ccccc3)n3cccn3)cc2)C1 747644470 BWMDYGCXTSJJER-IRLDBZIGSA-N 417.513 2.491 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCN(CC2CC2)CC1 748023820 KGYYLGRGCFDLGV-UHFFFAOYSA-N 421.544 2.422 10 20 HECD O=C1CCc2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2N1 749627095 XEDNELWAACMWAF-SFHVURJKSA-N 423.469 2.423 10 20 HECD C[C@@H]1C(=O)N(C)S(=O)(=O)N1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 752889568 ZIBXYIVPUMFWGQ-CYBMUJFWSA-N 401.448 2.448 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1cnn(CC(F)(F)F)c1 765904303 QLEMRIIRZSFCRH-UHFFFAOYSA-N 421.173 2.168 10 20 HECD Cc1cc2c(cc1NC(=O)C(=O)NCc1cccc(Br)c1O)OCO2 765928396 YREJJYGVAKPAGJ-UHFFFAOYSA-N 407.220 2.447 10 20 HECD COc1cc(OC)c(OC)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 766490732 VPBCYLRXNCDWPQ-UHFFFAOYSA-N 411.458 2.344 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3coc(C4CCOCC4)n3)cc2)C1 767692661 JIQAQBFXYOYMSI-KRWDZBQOSA-N 412.490 2.200 10 20 HECD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NCc1ccc(O)c(O)c1 768914750 ZFWSWHRTVSBKKI-UHFFFAOYSA-N 419.503 2.146 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1 769803177 QWLJBXBNCGPNQY-KRWDZBQOSA-N 418.471 2.112 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C(C)(C)C3CCC(O)CC3)CC2)cc1 773490447 KCCQDWJAGAIDJM-UHFFFAOYSA-N 418.534 2.464 10 20 HECD O=C(CN1CCC[C@H](C[C@@H]2CCOC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 773703731 VIVYXRFOWMRNTO-UXHICEINSA-N 419.541 2.417 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 774872034 QVIINOIGOCRIBJ-AWEZNQCLSA-N 408.549 2.288 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCCN2CCCCCC2=O)C2CC2)cc1 775095196 GOVOUUVKUBBIJE-UHFFFAOYSA-N 414.550 2.153 10 20 HECD C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424567 PYBRBJLUOMDHEO-OHZJNBGDSA-N 401.532 2.326 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(-n2ccnn2)cc1 788908881 CKXXOYLTJFVNEY-QGZVFWFLSA-N 418.501 2.361 10 20 HECD Cc1cccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789827399 SHFUOLFCEBYWMO-HZPDHXFCSA-N 414.481 2.075 10 20 HECD C[C@H](c1ccco1)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832702 COAWOEPPLGJMBO-CQSZACIVSA-N 403.454 2.216 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)NC2CCCCC2)cc1F 793758538 AGJHCGQXVQHCSS-UHFFFAOYSA-N 420.529 2.243 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)N(C)CC(F)(F)F)CC2)cc(OC)c1OC 793815096 LXLXNZBDCHDZMO-CYBMUJFWSA-N 419.444 2.244 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(F)c1 795079576 FMFNLILCTXQBKE-AWEZNQCLSA-N 422.478 2.488 10 20 HECD COc1ccccc1CCNC(=O)CNC(=O)NCc1ccc(N2CCCC2)cc1 798056992 HANMYNJSVHSKDY-UHFFFAOYSA-N 410.518 2.454 10 20 HECD COCCN(C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CC[C@@H](C)C1 803303261 JTLDSSOLRUHRFN-OPYAIIAOSA-N 417.550 2.364 10 20 HECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 804881161 OMMGNKGMCBFPCM-SOIVGHGOSA-N 420.462 2.122 10 20 HECD COC(=O)c1cn(CCNC(=O)N(Cc2ccccc2O)C2CCCCC2)nn1 807250662 JNEQUUCMMQSSHE-UHFFFAOYSA-N 401.467 2.315 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2ccc(OC)c(S(N)(=O)=O)c2)cc1 808237555 WHPHXNWXZOAPDN-UHFFFAOYSA-N 420.535 2.188 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NS(=O)(=O)c3cn(C)nc3C)c2C)cc1 809030020 BEMZXIYPSURWBU-UHFFFAOYSA-N 402.476 2.263 10 20 HECD COC(=O)c1csc(SCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 814789785 BWPFDWKHNWOSNI-UHFFFAOYSA-N 407.517 2.379 10 20 HECD C[C@H]1[C@H](N(C)C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816767492 ZVJMAHOMDIMHOQ-SWLSCSKDSA-N 409.533 2.419 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccc(-n2nccn2)nc1 916684078 BEHIRSZVXSPZAD-UHFFFAOYSA-N 411.441 2.084 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCCC4=O)c3)cc2)C1 917832848 HZXIADRJPAHHBY-LJQANCHMSA-N 420.513 2.445 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918369653 PXFTVKDBNYSXSU-UHFFFAOYSA-N 417.531 2.346 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1 918444301 QDRLTLZGAQTJRR-UHFFFAOYSA-N 403.866 2.479 10 20 HECD CCO[C@H](CC)C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 920672281 FQYMMTYTMHLSLC-LJQANCHMSA-N 422.503 2.283 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCNC(=O)OCC(F)(F)F)CC2)cc1 1319496569 OKAVDSVMCVAPAF-UHFFFAOYSA-N 403.401 2.413 10 20 HECD Cc1ccoc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005533 LZZMXLUSYJCIRL-HXUWFJFHSA-N 420.849 2.410 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2(F)CCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997612 BMHORNCNMCJSRG-KSSFIOAISA-N 414.437 2.100 10 20 HECD Cc1ccc(CN2C[C@H](C(=O)NCc3ccc(N4CCOCC4)cc3)CC2=O)cc1 108805600 VYRUDMJVLHMQJL-OAQYLSRUSA-N 407.514 2.497 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)n(C)c2ccccc12 673315433 CWULAHBGTFVTEZ-QVKFZJNVSA-N 401.532 2.274 10 20 HECD CCN1C(=O)[C@@H]2CN(C(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)CCN2C1=O 674452269 JPEJKCOUYNYYEC-IBGZPJMESA-N 412.490 2.013 10 20 HECD COc1cccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2)c1O 727761386 ZMZORYTZGYFXOE-MRXNPFEDSA-N 424.544 2.117 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3ccccc3OC)CC2)cc1 729876421 YCVLUFVCBRHVNH-NDEPHWFRSA-N 402.516 2.301 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 734066047 NEUPGNXZLAFFFX-FDDCHVKYSA-N 410.518 2.095 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)O)c2)cc1 740812105 RRFWPQVDWGEHFD-UHFFFAOYSA-N 401.466 2.056 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC(C)(C)c3cnn(C)c3)cc2F)CC1 745807570 FBPBLGGVNUGVQD-UHFFFAOYSA-N 402.518 2.436 10 20 HECD Cc1cc(CCNC(=O)CNS(=O)(=O)CCOC(C)C)c(C)n1-c1ccccc1 747906890 WAKTVTLFNLOUMJ-UHFFFAOYSA-N 421.563 2.097 10 20 HECD CN(C)[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 751063093 KKEYYYLEOPTRON-OAHLLOKOSA-N 409.533 2.325 10 20 HECD CC(C)[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCOCC1 751930961 KOBKJIHNFZSLAA-SFHVURJKSA-N 403.504 2.356 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1csc([C@@H]2CCCO2)n1 755586325 KEQSQBAFGCYXFW-KRWDZBQOSA-N 421.544 2.159 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3c(C(C)(C)O)nc4ccccc43)CC2)cc1 758210779 RSAUIRBIZCGZQJ-LJQANCHMSA-N 424.545 2.455 10 20 HECD COc1cc(F)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 759022238 JMOWXQMMQLWKBV-UHFFFAOYSA-N 423.391 2.204 10 20 HECD C[C@H](Sc1n[nH]c(CO)n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767081735 OXSLBUIVEJZIKP-JTQLQIEISA-N 408.439 2.192 10 20 HECD CCOc1ccc(CN2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c(O)c1 768214940 IXHYTSAHXSVICA-UHFFFAOYSA-N 400.504 2.178 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1O 769506963 DBZAKDZGZJVJTI-JYJNAYRXSA-N 420.531 2.314 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@]4(C3)OCc3ccccc34)CC2)cc1 770687304 DYAWPULIRWLTFV-RCZVLFRGSA-N 423.557 2.310 10 20 HECD C[C@H](NC(=O)N1CCN(c2nccn3cnnc23)[C@@H](C)C1)c1ccc(N(C)C)cc1 773613418 QSGKMXVHFZWCGK-HOTGVXAUSA-N 408.510 2.172 10 20 HECD COc1ccc(N2CCN(CCNCc3ccc([N+](=O)[O-])c(OC)c3O)CC2)cc1 774984900 WLFVRRKVVHNFIN-UHFFFAOYSA-N 416.478 2.229 10 20 HECD C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)Nc1sccc1C(N)=O 775258477 BPMTXWPMTOWTQB-ZIAGYGMSSA-N 402.520 2.361 10 20 HECD O=[N+]([O-])c1cc(CN[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)ccc1N1CCCCC1 776498176 IRJLHHIJYJVWKK-YLJYHZDGSA-N 423.535 2.411 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)Cc1cccc(F)c1 777828527 KUBLWJVGIQGFJX-UHFFFAOYSA-N 422.840 2.045 10 20 HECD O=C(O)CN(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CC1 780444045 PPHNIYSJYOTMSW-UHFFFAOYSA-N 401.385 2.301 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)C3CCCCC3)CC2)cc1 785527148 AVXHVCIQNHQNNV-UHFFFAOYSA-N 416.566 2.115 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N(Cc1ccccn1)C1CC1 789856741 XRRFJOFRNDKCPU-UHFFFAOYSA-N 410.543 2.442 10 20 HECD CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 792626427 WMIPSWJJUWDIGA-GFCCVEGCSA-N 415.512 2.139 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 796559899 FZVSVMAZPQWMDP-IZHWHUGBSA-N 420.465 2.280 10 20 HECD C[C@@H](CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCCCC1 803309152 QDMVIIKCELLZOO-RBUKOAKNSA-N 416.566 2.081 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@H](Cc4ccncc4)C3)CC2)cc1 804316580 DLTKTYGWSOJQLE-IBGZPJMESA-N 422.529 2.266 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCC(=O)N2C)NC(=O)OC(C)(C)C)cc1 806945829 OVPRYUQLINZSGA-IAGOWNOFSA-N 404.511 2.055 10 20 HECD C[C@H](NC(=O)C(=O)N1CCNC(=O)C[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 807678776 JPLXBIULLYAZRV-JXFKEZNVSA-N 408.502 2.020 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 809234545 NCRFGOSUQPEUJB-WCZIJOHHSA-N 407.580 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc5cncn5c4)n3)CC2)cc1 809465854 ZUPJPTKKIOLSCI-UHFFFAOYSA-N 418.457 2.284 10 20 HECD O=C1COc2c(cccc2NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)N1 810257405 QBGVTSXQQOCARK-UHFFFAOYSA-N 414.437 2.439 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccnc(-n2cccn2)c1 914827972 KSQOWNUROSFJBX-UHFFFAOYSA-N 406.490 2.446 10 20 HECD CN(C)CCN1CCC(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 916382552 IZQZYIRRWIZLTR-HXUWFJFHSA-N 404.555 2.109 10 20 HECD Cc1cc(CCNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1 920240170 KTVIISPYKIITCL-LJQANCHMSA-N 418.563 2.360 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cc(O)no3)cc2)CCC1)c1cc(O)nc(O)c1 1789834801 LAJRTGNIFKFMLU-UHFFFAOYSA-N 410.386 2.248 10 20 HECD CC(C)(C)n1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)n1 1796599311 LDGIBLHOQPFNHR-QDMKHBRRSA-N 413.478 2.010 10 20 HECD CCCOc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843250300 IGJLWHSSDOYFRH-UHFFFAOYSA-N 411.458 2.412 10 20 HECD Cc1cc(NC(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)n(C)n1 10254447 VAXDQQGWQYBVQJ-UHFFFAOYSA-N 403.394 2.299 10 20 HECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)cn1 727245019 SCPUMVLJGVKSGW-UHFFFAOYSA-N 412.518 2.231 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)NC3CCCCC3)CC2)cc1 728593756 GBGOORWFZWHNLV-UHFFFAOYSA-N 401.555 2.029 10 20 HECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 731911099 YZJSUPCIWNVTOT-ZETCQYMHSA-N 402.350 2.171 10 20 HECD NC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 732432738 PWECKKIKWWBKFQ-UHFFFAOYSA-N 400.454 2.455 10 20 HECD CCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H](C)CS(=O)(=O)CC 733345823 PGZUAXKXKNHWEM-SJORKVTESA-N 411.568 2.439 10 20 HECD CCn1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1Cl 745361308 XESOPXGTTPDXTJ-UHFFFAOYSA-N 420.897 2.379 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)c1ccc(Cl)s1 749838900 RFUJXFLHUJLANB-UHFFFAOYSA-N 401.941 2.404 10 20 HECD COc1ccc(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 759217847 XMIXUCSEPHTUKR-UHFFFAOYSA-N 416.478 2.148 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@H](C4CCOCC4)C3=O)cc2F)C[C@@H](C)O1 761090009 HQIUNFYCMPVDOY-BIENJYKASA-N 405.470 2.286 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c1 761972005 DZXRVJUSLJDYMC-SNVBAGLBSA-N 410.430 2.117 10 20 HECD Cc1cccc(F)c1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 763381313 LYHHGCUGTHLRIM-MRXNPFEDSA-N 412.465 2.091 10 20 HECD COc1cccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)c1O 769504454 ZEUMRHIKAKFPMA-UHFFFAOYSA-N 410.517 2.106 10 20 HECD COc1cc(NC(=O)CN(C)Cc2ccc([N+](=O)[O-])c(OC)c2O)cc(OC)c1 774915109 UNWSKHJRZKSPNH-UHFFFAOYSA-N 405.407 2.397 10 20 HECD COC(=O)CN1CCC(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 775622663 YRTRMABGTAEODM-UHFFFAOYSA-N 415.456 2.269 10 20 HECD COC(=O)c1scc(C)c1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 782105411 AJJMFGMOOJYJRR-UHFFFAOYSA-N 401.488 2.480 10 20 HECD CCS[C@@H](C)c1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785444681 UJZWDXWEBMIKRI-ZDUSSCGKSA-N 405.524 2.225 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3cccc(F)c3)cc2)CC1 786122262 PIZAXQHYLYVQKU-UHFFFAOYSA-N 405.495 2.114 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)c1nnc2n1CCC2 786441092 IESSDJGILVLTFH-OAHLLOKOSA-N 411.506 2.469 10 20 HECD O=C(NCc1cc(F)ccc1F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787041617 SYOBHJOISNLBEC-QGZVFWFLSA-N 404.413 2.494 10 20 HECD Cn1ccc2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c21 788327421 KVBGIIVAKHPAME-UHFFFAOYSA-N 410.449 2.409 10 20 HECD CN(C)S(=O)(=O)C[C@@H](NCc1cccc(Br)c1O)C(F)(F)F 796452989 AGQIGRNTDHALFW-SNVBAGLBSA-N 405.236 2.067 10 20 HECD CNC(=O)CNC(=O)c1cccc(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 800595066 ORFSDASEQZTWPQ-UHFFFAOYSA-N 423.517 2.425 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC([C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 803308494 GFNAXBCIZOGLCP-LAUBAEHRSA-N 415.534 2.118 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@H](N(C)C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807676022 BYKRNNYXCOZJGZ-YJBOKZPZSA-N 418.538 2.398 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)c3c(C)noc3C)CC2)cc1 809526192 NPEIYNAIKUHWGF-OAHLLOKOSA-N 414.506 2.259 10 20 HECD CNS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c1 812362319 VMFXYKJNBDPUIA-UHFFFAOYSA-N 400.460 2.355 10 20 HECD Cc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 917917819 IGNAFBZEHWCYAX-UHFFFAOYSA-N 408.451 2.147 10 20 HECD COc1ccc(S(=O)(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1C(N)=O 917926930 UGGJFGQBOQBHOI-UHFFFAOYSA-N 403.504 2.213 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cccc4c3COC4=O)CC2)cc1 1116410136 VCEGZQANDHLMLF-UHFFFAOYSA-N 402.472 2.267 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)nn(CC(F)F)c1C 1255149304 UXZSCGRBAUKSMV-ZDUSSCGKSA-N 411.405 2.080 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1317929412 KZMHJCCAZQOVOW-QZTJIDSGSA-N 420.573 2.472 10 20 HECD CCCCC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787295028 LTOSIJHFYDGMDX-LAQRGFTBSA-N 419.522 2.303 10 20 HECD Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805611988 PBBVWGNHJLNDNH-FOIQADDNSA-N 422.441 2.423 10 20 HECD CCO/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848298 CGMYPWKCMWOVTQ-OWNNVSBGSA-N 401.423 2.072 10 20 HECD Cc1cc(C(=O)COC(=O)c2cc(S(N)(=O)=O)cn2C)c(C)n1-c1ccccc1 26264834 WIZSWDWQLDNPGR-UHFFFAOYSA-N 415.471 2.120 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC[S@](=O)C(C)(C)C)CC2)cc1 303698952 WVXVOGUHQRDHBR-LJAQVGFWSA-N 424.611 2.054 10 20 HECD CCOC(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 726978940 RQTAYJMIMDXQER-UHFFFAOYSA-N 422.501 2.425 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1 729065804 GAPTZOLJFSAJQR-HNNXBMFYSA-N 413.474 2.362 10 20 HECD COCC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 732811255 PTTPEMOLLUIOEN-CALCHBBNSA-N 407.530 2.414 10 20 HECD O=C(CCc1nc(-c2ncccn2)no1)N(Cc1ccccc1O)C[C@H]1CCCO1 735517801 CXQZBFCCIOFLHH-MRXNPFEDSA-N 409.446 2.373 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 742563117 FLPDAOICKJEYFA-UKAVVXHISA-N 413.518 2.042 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)Cn2ccccc2=O)NC(=O)OC(C)(C)C)cc1 742751088 RJTTZSTYXBKIDD-SFHVURJKSA-N 414.506 2.297 10 20 HECD Cc1ccc(N2CCC[C@@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cc1 743718439 PAUGJYYVLFMLGD-MRXNPFEDSA-N 403.504 2.471 10 20 HECD CCn1nccc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 746422027 LUIRZLVDMSXROA-CYBMUJFWSA-N 407.421 2.228 10 20 HECD COCCN(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(OC)c(OC)c1 746475018 QTWOTUIRQWNKCL-UHFFFAOYSA-N 415.490 2.497 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CC4)C3)cc2F)C[C@@H](C)O1 750637047 JHYJGPPHGLYMCZ-FMKPAKJESA-N 404.486 2.002 10 20 HECD CC[C@@H](C)OCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 751875970 RVYPZDVLSRJRKE-OAGGEKHMSA-N 410.486 2.414 10 20 HECD Cc1noc([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 754690003 SNWGONRDHZVXJC-MCIONIFRSA-N 405.474 2.098 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccccc1CN1CCNC1=O 755190823 BVAGFXSVXYAATG-UHFFFAOYSA-N 421.501 2.067 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 756415120 KPTPPAWGNXGRJJ-MRXNPFEDSA-N 411.502 2.417 10 20 HECD C[C@@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1cc([N+](=O)[O-])ccc1O 756454133 AVYCNSHDUHOMGX-DOMZBBRYSA-N 401.419 2.276 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)CC2)cc(OC)c1OC 759293941 OYWUYHFHPLVECL-HZPDHXFCSA-N 418.538 2.169 10 20 HECD COc1cc(N2CCN(CC(=O)N(C)Cc3ccco3)CC2)cc(OC)c1OC 759876983 DHAHHCPXYMOWLX-UHFFFAOYSA-N 403.479 2.086 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CN[C@H](Cc3ccc(Cl)cc3)C(N)=O)cc2)C1 760576623 OZHFPRQTERPWSI-FXAWDEMLSA-N 414.937 2.228 10 20 HECD CSc1nsc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 762951559 GDPDOFKYPXGCQZ-GFCCVEGCSA-N 406.537 2.283 10 20 HECD CCc1ccccc1NC(=O)CN1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440721 CILYZXXWTLCBEX-OAQYLSRUSA-N 411.502 2.137 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCc4nccs4)n3)CC2)cc1 771064601 DNUDTIANAZKICG-UHFFFAOYSA-N 413.503 2.211 10 20 HECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1cnn(CC(F)(F)F)c1 772448782 YXVYZQOTHDJPML-UHFFFAOYSA-N 420.482 2.477 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(-c2ccccc2Cl)c1 774356773 MSEQAGUVSGNOKP-UHFFFAOYSA-N 400.822 2.234 10 20 HECD C[C@@H](NC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1)c1ccc(N(C)C)cc1 776127996 HLNVWXPNPANNRA-JLCFBVMHSA-N 409.490 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 778249677 APBHIWVVSAUEOB-KTKRTIGZSA-N 424.457 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3CCSCC3)CC2)cc1 778276830 WXCOOLPLSKHBHY-VOTSOKGWSA-N 403.548 2.159 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)cc1 785438641 CNZCODVZVLNMLB-UHFFFAOYSA-N 423.517 2.182 10 20 HECD O=C(NCCc1cscn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786623731 HUMHXTWDAKSEEE-ZDUSSCGKSA-N 424.473 2.188 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NC[C@]1(N(C)C)CCSC1 788257012 ZNBQNYSOGFJSFV-JOCHJYFZSA-N 418.607 2.189 10 20 HECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933326 PIXZUMIDUCFXJY-MRXNPFEDSA-N 418.538 2.323 10 20 HECD CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788933800 YFRKBBSTIABVHA-QGZVFWFLSA-N 416.522 2.029 10 20 HECD O=C(CN1CCCC[C@@H]1c1cc[nH]n1)NCc1ccc(N2CCOCC2)c(F)c1 796193142 ILVNMGXCCNUOAU-HXUWFJFHSA-N 401.486 2.229 10 20 HECD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 797639533 FADNPUAFBCNCFD-ABAIWWIYSA-N 422.507 2.023 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(CC3CCOCC3)OC)CC2)cc1 801967284 DJAYMERMOAFVFW-UHFFFAOYSA-N 420.554 2.207 10 20 HECD CC(C)[C@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCS1 803299799 NWBXOYFURGJKHA-QFBILLFUSA-N 405.564 2.300 10 20 HECD CC(C)[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 803662551 CYJMLFLIOTWLBO-SFHVURJKSA-N 412.469 2.064 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)c3c(C)noc3C)CC2)cc1 804317304 ZFYNXIJLGLQHPU-CYBMUJFWSA-N 400.479 2.262 10 20 HECD CCS(=O)(=O)N1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 804902777 SBYHUBLQKMUKOC-UHFFFAOYSA-N 410.323 2.312 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccc(C(C)(C)O)c3)CC2)cc1F 806934375 FGVQDDOABSOWPD-UHFFFAOYSA-N 415.465 2.349 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1 807754282 CLLPQNSUSKMGTM-UHFFFAOYSA-N 414.472 2.102 10 20 HECD CCCC(=O)N1CCCC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918169045 BWGNDMOSXVFPMY-ICSRJNTNSA-N 414.550 2.186 10 20 HECD C[C@H](NS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1ccc(N2CCOCC2)cc1 920865863 POIDJABCFNBSMV-AWEZNQCLSA-N 402.472 2.233 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c1 921078546 OVFRCIFLUFBYBN-OAHLLOKOSA-N 418.393 2.246 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)CN(C)CCNS(C)(=O)=O)c2C)c1 1319423737 LBOZFVLZVDIHKH-UHFFFAOYSA-N 409.577 2.480 10 20 HECD Cc1noc(C)c1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810542960 GSMCRKUJHPJTBW-UHFFFAOYSA-N 414.462 2.256 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824374434 IGZWKLAQFIFWQL-QGZVFWFLSA-N 417.506 2.341 10 20 HECD O=C(c1csc2c1CCCO2)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249990 YIBKRKNRBSXLIY-UHFFFAOYSA-N 415.471 2.010 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F 45717027 KHZPMTLWIBJCKW-SFHVURJKSA-N 413.444 2.468 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CC(=O)OC(C)(C)C)cc2F)C[C@@H](C)O1 725800736 QDIFFHZKHFERQP-IYBDPMFKSA-N 423.529 2.329 10 20 HECD CN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 725886684 JYDJEZOAUTTYLE-UHFFFAOYSA-N 424.906 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2ccccc2)cc1F 731364965 VWQDCWZSPFRBNF-UHFFFAOYSA-N 422.526 2.450 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1 739080173 KOKWZEDXTJFKIY-GJZGRUSLSA-N 413.474 2.442 10 20 HECD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741099777 HWLQIIWMWQVYRP-UHFFFAOYSA-N 408.502 2.258 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 745784568 XXCPYXOBISZWEV-UGKGYDQZSA-N 404.555 2.320 10 20 HECD COC(=O)c1ccsc1N1CC[C@H](NC(=O)NCc2ccc(N(C)C)cc2)C1=O 746739848 DWTDZFJZURDELX-INIZCTEOSA-N 416.503 2.205 10 20 HECD COC[C@@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 754347555 MSEOLWBDCPMXQK-TZIWHRDSSA-N 403.523 2.057 10 20 HECD O=S1(=O)CCN(c2ccc(CNCc3ccc(N4CCCC4)nc3)cc2)CC1 758480564 CYTZWWWXNBTIDX-UHFFFAOYSA-N 400.548 2.206 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)cc(OC)c1OC 759240888 CTPCHBITEQYFFL-HXUWFJFHSA-N 414.458 2.201 10 20 HECD COc1cc(N2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc(OC)c1OC 760083647 GLXSBNJLBCLNCH-UHFFFAOYSA-N 416.434 2.165 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCS(=O)(=O)Cc1ccccc1 761158003 VWLPHRWZAYUFDQ-UHFFFAOYSA-N 422.890 2.425 10 20 HECD CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NCCc2ccc(O)c(O)c2)cc1 769607582 OJTHYVLHMKYWHJ-UHFFFAOYSA-N 408.401 2.016 10 20 HECD COC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)C 769654588 XGCYQVMONSNTRZ-HNNXBMFYSA-N 412.489 2.182 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 772829063 GKOXWZVXKMYTFF-QAPCUYQASA-N 414.499 2.018 10 20 HECD CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1CCCCN1C(=O)c1cc(O)cs1 776269563 GOAWNDUQOVGTDX-ZDUSSCGKSA-N 411.524 2.479 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1Cl 785296136 BVTDTLYSKPINPP-JTQLQIEISA-N 405.838 2.396 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cs1 785670933 PNOACMXIGLGUPT-CHWSQXEVSA-N 420.510 2.137 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCC=CO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 787038980 WUKDKXCFXDSXNW-LJQANCHMSA-N 418.471 2.160 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C 787639349 OMLMZKLBOOVZCE-FQEVSTJZSA-N 400.498 2.235 10 20 HECD COc1cnccc1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789860166 IPPHYGJDCFKSBM-OAHLLOKOSA-N 414.531 2.137 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC(CS(N)(=O)=O)CC3)cc2)CC1 799923939 YXAJPAMMXCOLBZ-UHFFFAOYSA-N 408.568 2.133 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCN(c4ccccn4)C3)cc2)CC1 805023659 ZGGVFQJKGNJTGM-HXUWFJFHSA-N 421.545 2.329 10 20 HECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCCCSc1nccs1 806929532 JQVVVABOMFYLQI-UHFFFAOYSA-N 407.443 2.441 10 20 HECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807100886 NWDPBKXAHAVTAT-MRXNPFEDSA-N 418.538 2.050 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1 807838331 PDFJHCAHZYEABD-UHFFFAOYSA-N 404.275 2.274 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H](CNC(=O)C(F)(F)F)C1 810067636 XJXHIAJFCWHIJY-INIZCTEOSA-N 414.472 2.102 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NCc1cccc(OC)c1O 815834534 MVLQBCUWJUCHOM-QHCPKHFHSA-N 423.469 2.406 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@]1(c2ccccc2)CCC(=O)NC1 816825472 DTVVKFYEEKATSE-XMMPIXPASA-N 407.514 2.330 10 20 HECD CCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918463006 GHUCKYMLSMEVJF-KRWDZBQOSA-N 424.501 2.042 10 20 HECD COc1cc(OC)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1OC 919879387 ATBRXMSOUXRPTC-UHFFFAOYSA-N 420.487 2.200 10 20 HECD C[C@H](NC(=O)CCn1c(=O)nc(O)c2ccccc21)c1ccc(N2CCOCC2)cc1 920888639 URFBLVNDPASQTB-INIZCTEOSA-N 422.485 2.206 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OC)c(OC)c1C 1341814397 FNRLHFFEPFYMRC-HNNXBMFYSA-N 403.431 2.328 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCn2c(nnc2C2CCCC2)C1 1346390200 GXQKZTYNMAQFHU-UHFFFAOYSA-N 410.522 2.498 10 20 HECD CC1(C)CC(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)C1 1846418291 PZSPOIGKAWHOJH-UHFFFAOYSA-N 408.502 2.419 10 20 HECD CC(=O)NC1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 50992397 JJHUQTUVARBHSR-UHFFFAOYSA-N 405.454 2.001 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@H](C(C)C)N3CCN(C)CC3)CC2)cc1 726704634 WNFZATKMGPHQEX-JOCHJYFZSA-N 417.598 2.235 10 20 HECD CCS(=O)(=O)NC1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728194648 DFXXFPRMKHZGNW-UHFFFAOYSA-N 418.515 2.233 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-n4cccc4)cc3O)nc12 728362597 RSKBKXIICKFGBB-UHFFFAOYSA-N 422.397 2.465 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)NCc1ccccc1 731281132 VBUJBYDQEJXRAU-UHFFFAOYSA-N 405.520 2.433 10 20 HECD COc1ccc(O)c(CNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1 734017347 DZHQGYOXEUYZQU-UHFFFAOYSA-N 404.488 2.091 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1 749140849 CXTMVLHWNHESFP-UHFFFAOYSA-N 416.452 2.476 10 20 HECD CC1(C)NC(=O)N(CCCC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 751306539 WQIJDAQHFRRCKO-UHFFFAOYSA-N 406.446 2.445 10 20 HECD Cc1oc(-c2cnn(C)c2)nc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 752603649 UXCFQISIESOSEI-UHFFFAOYSA-N 411.462 2.265 10 20 HECD COc1ccc(CCNC(=O)[C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 759580341 QTGYTEZTWBQFIU-VIIAAUOXSA-N 415.442 2.419 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC(C)(C)[C@@H]3C)CC2)cc1 764352925 YMADRBPPUGGTES-SFHVURJKSA-N 404.555 2.416 10 20 HECD CCOC(=O)C(C)(C)n1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cn1 766163994 SFPVVPBHLMRIAW-UHFFFAOYSA-N 415.494 2.340 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c1 769255053 RZTKEUPRQIIAJD-UHFFFAOYSA-N 412.421 2.348 10 20 HECD CCN1CCN(c2cccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)c2)CC1 770711072 LBIMZGMNQGKCTG-UHFFFAOYSA-N 409.534 2.149 10 20 HECD CC[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)N1CCO[C@H](CC)C1 773979988 RDGDWVXNDQAQHV-YADHBBJMSA-N 403.567 2.401 10 20 HECD C[C@H](NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N(C)C)cc1 773995149 RRLSPXCAULPNRN-INIZCTEOSA-N 417.531 2.265 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 774543710 OMNHSJOIMBZKPQ-UHFFFAOYSA-N 413.543 2.224 10 20 HECD C[C@H](NC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)c1ccc(N(C)C)cc1 775404485 MZXGHPIMERAXAL-KRWDZBQOSA-N 415.559 2.474 10 20 HECD CCOC(=O)c1ccc(N2CCN(Cc3ccc(N4CCN(C)CC4)cc3)CC2)nc1 775649053 KEIAMGGYAKESCA-UHFFFAOYSA-N 423.561 2.332 10 20 HECD O=S(=O)(c1c[nH]c2ncccc12)N1CCN(Cc2cccc(Cl)c2O)CC1 775660110 BAFFKCIOJNAFEQ-UHFFFAOYSA-N 406.895 2.428 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOCC4(CCCC4)C3)cc2)C1 776124322 QUGCMNJUOMQJEN-LJQANCHMSA-N 414.550 2.491 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc2c1OCCO2 781046630 IPKKSXCKTJILDN-UHFFFAOYSA-N 411.458 2.387 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(-n2cncn2)cc1 785402038 ZHPSEFBHOYWLDS-INIZCTEOSA-N 418.501 2.143 10 20 HECD COc1c([N+](=O)[O-])cc(N2C[C@@H](C(N)=O)CC[C@H]2C)c([N+](=O)[O-])c1Br 785753871 OAJXJSFLMCUVKG-SFYZADRCSA-N 417.216 2.364 10 20 HECD CCc1nc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)sc1C 789624470 RSMKEPJUEMXNOX-UHFFFAOYSA-N 406.483 2.449 10 20 HECD CCSCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789836712 VPUUOGGEEWQRCQ-HUUCEWRRSA-N 411.543 2.315 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@]2(CCO[C@@H]2C)O1 790666799 VEBWVBHFUBFFSY-XCGNWRKASA-N 421.513 2.265 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnc(CC2CC2)nc1 792965975 KFOXPXUYJRPPFN-UHFFFAOYSA-N 411.531 2.237 10 20 HECD CN(C)S(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCCC3)cc2)cc1 793043612 RZRCQJLXQPACDO-UHFFFAOYSA-N 401.532 2.396 10 20 HECD Cc1ccn2cc(CNC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)nc2c1 793750078 OYLYUTGBMQOLDE-LJQANCHMSA-N 422.485 2.172 10 20 HECD CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NCc1ccc(N(C)C)cc1 796276461 MWTSYYIBECGZSP-UHFFFAOYSA-N 423.605 2.118 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(C)(C)N1CCC(OC)CC1 805156954 LNIYQNFFQIIUCS-UHFFFAOYSA-N 418.582 2.107 10 20 HECD Cc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)sc1C 807333532 LUCRGGIACSJEMJ-KRWDZBQOSA-N 417.531 2.332 10 20 HECD COC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@H]1CCCO1 809451995 DKWWMHPWUDADCX-UYAOXDASSA-N 404.507 2.364 10 20 HECD Cc1ccc(-c2csc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)n2)cc1[N+](=O)[O-] 913077933 SKWVUGWHDVVVKQ-UHFFFAOYSA-N 421.460 2.265 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc4nccnc34)cc2)C1 917837207 VIDMVHCNQZRCFM-HNNXBMFYSA-N 407.449 2.401 10 20 HECD C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918118599 UQUNJFBEHIDJBF-UYAOXDASSA-N 415.582 2.452 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)c1ccccc1 918371572 HFYJLGKUTNEKAM-YLJYHZDGSA-N 422.529 2.213 10 20 HECD CCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918464106 QIIADGWIJWQDTB-SFHVURJKSA-N 408.502 2.206 10 20 HECD CCOC(=O)[C@@H](Cc1ccccc1)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920638389 YMQFLCHLAFIJLM-QGZVFWFLSA-N 407.444 2.095 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cc(C(C)=O)ccc1OC 1254762051 XOHPUKLEXQTUKD-KRWDZBQOSA-N 415.442 2.142 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)CC2)cc1 1320395318 URVWATMAXMPADD-GOSISDBHSA-N 408.502 2.178 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)c1ccco1)C2 1796603992 BIQRENJWIUPXGQ-CLLJXQQHSA-N 407.373 2.130 10 20 HECD C[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)O1 1827427685 PLABWMMHNQYVES-FHLIZLRMSA-N 417.506 2.294 10 20 HECD CC[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)CC1 1847055127 GPKPHPVFRMDEAO-SHTZXODSSA-N 423.604 2.267 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 7228478 HJWXNTMLNFALNI-HSZRJFAPSA-N 406.486 2.105 10 20 HECD C[C@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ncccn1 14076807 VZAJYGQCCJYCAO-LBPRGKRZSA-N 401.378 2.436 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1sccc1S(=O)(=O)N1CCOCC1 28494750 RTPDSYAOMXTSGX-UHFFFAOYSA-N 423.560 2.107 10 20 HECD COCCNC(=O)CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 71996563 JDSKDDQMVOSFRT-UHFFFAOYSA-N 408.296 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@H]3CN3CCCCC3)CC2)cc1 110729779 NFQCVBUZJDJWOY-NRFANRHFSA-N 400.567 2.294 10 20 HECD COC(=O)CNC(=O)c1ccc(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 541065497 JOWZTUOTSICJIU-UHFFFAOYSA-N 412.446 2.086 10 20 HECD CCN(CC)Cc1ccccc1CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 730994340 NXVIQIVUQJRZQG-LDADJPATSA-N 402.564 2.401 10 20 HECD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NC1CCC2(CC1)OCCO2 731844561 JYJVTMKJTKPATM-IBGZPJMESA-N 404.507 2.175 10 20 HECD Cc1ccc2c(c1)N(C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)CC2 746991049 ZMXZKEXXVRPIRZ-UHFFFAOYSA-N 411.477 2.301 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@@H](O)COCC3CC3)cc2F)C[C@@H](C)O1 749009293 KFTYTZKGXMYQHM-IIDMSEBBSA-N 409.502 2.026 10 20 HECD Cc1cc(=O)n2nc(COC(=O)c3csc(Cc4ccc(N)cc4)n3)sc2n1 751936612 LJKFBYFXUKSFQC-UHFFFAOYSA-N 413.484 2.446 10 20 HECD C[C@@H]1NC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NN(c2ccccc2)C1=O 752149431 MHBOHCPTWBQWNA-QFBILLFUSA-N 422.485 2.238 10 20 HECD CCc1nnc(O)c(CNC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1CC 754652920 HUYVGZBGGDZEIE-UHFFFAOYSA-N 417.485 2.487 10 20 HECD CN(C)Cc1ccsc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756095438 CXHSCEFYRLDLQZ-KRWDZBQOSA-N 400.548 2.441 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccn(Cc2ccccn2)n1 759033355 VIKMEJNGGCVUMC-UHFFFAOYSA-N 405.458 2.166 10 20 HECD CC[C@@H]1C(=O)N(CCCN2CCN(c3ccc(OC)cc3)CC2)C(=O)N1C1CC1 760951658 PGQPXDOZYFEHGG-HXUWFJFHSA-N 400.523 2.413 10 20 HECD CN(CCc1ccccn1)C(=O)CNC(=O)NCc1cccc(Br)c1O 764767594 DDOXVMSSFXHJRK-UHFFFAOYSA-N 421.295 2.050 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c1 770035275 VIMROTMDANNWKK-UHFFFAOYSA-N 414.277 2.497 10 20 HECD Cc1ccc(C(=O)N2CCN(Cc3noc(-c4cccs4)n3)CC2)c(O)c1O 770488696 OUFHTHGIJYTKCU-UHFFFAOYSA-N 400.460 2.476 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccnc(S(N)(=O)=O)c2)c(C)n1-c1ccccc1 772426643 ZQKOLJFNWYXPQP-UHFFFAOYSA-N 413.455 2.176 10 20 HECD C[C@H](NC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 773995341 UCYGWRIPURIDBZ-AWEZNQCLSA-N 420.491 2.207 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 775045045 RZIGIAOBFZUVIH-INIZCTEOSA-N 404.561 2.132 10 20 HECD CC(C)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(O)n1 775524081 PYLIUMMQHNZEKC-UHFFFAOYSA-N 403.504 2.075 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1Br 778920158 YDRHZGFAWHLBKZ-UHFFFAOYSA-N 400.250 2.194 10 20 HECD COCCN1CCN(Cc2cc(Br)cc(Br)c2O)CC1=O 779603800 BWVHTLFQNCDLHZ-UHFFFAOYSA-N 422.117 2.208 10 20 HECD C[C@@H](NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccc(N2CCOCC2)cc1 780339819 SOINAXBQGBHDCU-QZTJIDSGSA-N 404.555 2.071 10 20 HECD CCS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781047531 QUSUOZNQAHKGFX-UHFFFAOYSA-N 415.515 2.401 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(OC)cc3O)CC2)cc1 785689837 YACFQCYUQHFXGN-KTKRTIGZSA-N 411.458 2.253 10 20 HECD Cc1nc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cs1 788324046 QRHQXARTJUDESD-LJQANCHMSA-N 414.531 2.268 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](Oc4ccncc4)C3)cc2)C1 788894644 RVACBQWRBRXWGF-GHTZIAJQSA-N 423.517 2.146 10 20 HECD Cc1ccc2c(c1)[C@@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 789802362 XGMZGZUGBWFFRY-FQEVSTJZSA-N 411.477 2.391 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789825467 LWIYZYUBEYKURW-IIDMSEBBSA-N 403.498 2.314 10 20 HECD COc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc(N2CCN(C)CC2)cc1 796400947 AOKYLOWQBOGBFR-UHFFFAOYSA-N 418.563 2.309 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c(O)c1 797389380 DTGYNHLOHOZCHV-UHFFFAOYSA-N 413.474 2.350 10 20 HECD C[S@@](=O)C1(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 799404109 SIYYDGNCCMPMKH-PFUSGODGSA-N 401.479 2.467 10 20 HECD CC(C)N(CCOCCO)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 801994333 ZYOBBLFGFMYXJT-UHFFFAOYSA-N 410.470 2.120 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccn(-c3ccccc3)n2)cc1F 803662036 FEWXPLCFOKVXBM-UHFFFAOYSA-N 409.465 2.053 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCCCN3CCCCC3)ccc21 803686084 VIKNARAOFKTMSY-UHFFFAOYSA-N 400.567 2.458 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687999 JOQNDKOBDOPRFH-XMSQKQJNSA-N 420.557 2.322 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1 808341732 KXJGVAUPXIFSMC-TZIWHRDSSA-N 417.550 2.015 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@](C)(OC)C3CC3)CC2)cc(OC)c1OC 812924792 QAHYYOVTGFAVCK-OAQYLSRUSA-N 407.511 2.359 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H](n4cccn4)C3)CC2)cc1 813032079 LKMIMSUTIYJSKK-FQEVSTJZSA-N 412.538 2.060 10 20 HECD COc1cc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cc2c1OCO2 814285175 FLOYYGIUOXETMS-WJDWOHSUSA-N 422.528 2.347 10 20 HECD CN(C/C=C\C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC(F)(F)F 815730255 BMZNLCNGBYKCIN-IHWYPQMZSA-N 403.420 2.453 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc4nc(O)oc4c3)CC2)cc1 917759261 KVAHOXUVNXYGLP-UHFFFAOYSA-N 403.460 2.443 10 20 HECD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)cnn1C 1800715852 SNHMTQYGYVKYKP-BTTYYORXSA-N 418.881 2.359 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990902 KSECUKQMXFYCHY-OXQOHEQNSA-N 410.474 2.398 10 20 HECD C[C@@H](CN)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821293731 NZNNSWWXAPXSAP-HZMBPMFUSA-N 421.885 2.375 10 20 HECD CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1827435179 CYESHSFLBJEYNW-UXONFWTHSA-N 402.476 2.387 10 20 HECD Cc1csc(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843249144 BBGIZVYZGMQMSY-UHFFFAOYSA-N 401.488 2.313 10 20 HECD COC(=O)c1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cc1 28836150 QIHQTSMBHIBBSR-SSZFMOIBSA-N 406.529 2.397 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)O)c2)cc1Cl 391739626 UEARZIWTQRWHQH-UHFFFAOYSA-N 410.882 2.272 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c1 729062329 QGOHOCKAHJXSSK-OAHLLOKOSA-N 413.474 2.049 10 20 HECD COc1ccc(N2CCCN(C(=O)Cc3c(C)nc4cc(O)nn4c3C)CC2)cc1 729523374 BCIFFMHQXISQBT-UHFFFAOYSA-N 409.490 2.342 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN4CCC[C@H]4C3)cc2F)CC1 730117447 YJZBKZQNGQKWMG-OALUTQOASA-N 403.546 2.394 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)C1 731456727 DRQGBNRSZJRKRX-AWEZNQCLSA-N 400.410 2.366 10 20 HECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NCc1ccc2c(c1)CCCN2C 731623320 ULVNESRIPFBKGU-UHFFFAOYSA-N 413.430 2.494 10 20 HECD COC(=O)c1sc(NC(=O)CN(C)Cc2ccccc2O)c(C(=O)OC)c1C 731842775 BFYZLSCCBWQOQU-UHFFFAOYSA-N 406.460 2.406 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(OCCN(C)C)CC3)CC2)cc1 734276960 VQCBDMRUCYAVRM-UHFFFAOYSA-N 404.555 2.416 10 20 HECD O=C1NCCc2ccc(S(=O)(=O)NCc3ccc(N4CCSCC4)cc3)cc21 734842421 NJKMWGNPZLRBTK-UHFFFAOYSA-N 417.556 2.004 10 20 HECD COc1ccc(S(=O)(=O)N2CCC(NCc3ccccc3O)CC2)cc1OC 735508870 PHWVOPNGMCVGGL-UHFFFAOYSA-N 406.504 2.352 10 20 HECD CC(C)Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n(C)n1 737130656 GMRLNXSZGJXTQQ-UHFFFAOYSA-N 415.563 2.427 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3F)cc2F)C[C@@H](C)O1 741380780 VUZQGSGVEKJXED-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD COCCNC(=O)Cn1cc(NC(=O)c2sccc2-n2c(C)ccc2C)cn1 741738015 QAGOPJAKIGHNQJ-UHFFFAOYSA-N 401.492 2.367 10 20 HECD COc1ccccc1-n1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cn1 743251399 PENVDKYDDMKWBO-UHFFFAOYSA-N 422.488 2.053 10 20 HECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc21 746040408 WOSKYDBHIXXDGX-UHFFFAOYSA-N 409.490 2.100 10 20 HECD CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 749623006 MWOBDNRRKLOPCP-UHFFFAOYSA-N 418.519 2.159 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](c3ccsc3)N(C)C)CC2)cc1 758211383 UUFLUEMZGGWSDF-RBBKRZOGSA-N 418.607 2.132 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(C)c3[N+](=O)[O-])CC2)cc1 758226623 YSBVGUUIJIHJEC-SFHVURJKSA-N 401.463 2.474 10 20 HECD O=C(NCCCSc1nccs1)NCCCN1C(=O)NC2(CCCC2)C1=O 759540152 RFFIHCWCYJJHPR-UHFFFAOYSA-N 411.553 2.179 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1 761839746 WROZEWHVFIVOCE-UHFFFAOYSA-N 407.474 2.261 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCOC4(CCC4)C3)cc2)C1 769037944 PINOQPVSXHSYBV-QZTJIDSGSA-N 400.523 2.289 10 20 HECD CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)c2ccccc2C1=O 771266524 QNYOXRXMYGWUAQ-UHFFFAOYSA-N 407.470 2.214 10 20 HECD COC(=O)c1cccc(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)n1 773843218 AFSQYFOOAUYAKN-UHFFFAOYSA-N 401.463 2.216 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c(OC)c1 779499273 NKAKQWNWFPDDLA-YWEYNIOJSA-N 412.442 2.113 10 20 HECD Cc1cc(N2CCC(NC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)CC2)n[nH]1 784124979 JTRMYPCYHHJHQL-UHFFFAOYSA-N 412.538 2.365 10 20 HECD O=C(NCc1ccccc1O)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 788941929 TUGZTIKZRQJAKE-SFHVURJKSA-N 415.465 2.048 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@@]3(CCCOC3)C2)c1 794890332 OABPFMQXKCMFKK-SBUREZEXSA-N 418.534 2.197 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@H]7[C@@H](C[C@H]64)[C@@H]3[C@@H]75)nc12 796322716 LRWMPCGDSBUDSE-UNXNJRRQSA-N 409.442 2.049 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1 796864661 XNUKVXKACDTHSX-UHFFFAOYSA-N 424.432 2.413 10 20 HECD COc1cc(C)cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803301677 WFCXGGSZCUWUBO-QGZVFWFLSA-N 411.502 2.334 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCc2ccccc2C1)c1ccc(N(C)C)cc1 803885334 LNRYIZXCNFITGU-MSOLQXFVSA-N 408.546 2.493 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)N(CC)Cc2ccc(N(C)C)cc2)cn1C 804944622 ZULKMZWXNDWIPZ-UHFFFAOYSA-N 421.519 2.048 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 807097998 RDBJXRAALWZSMN-SFHVURJKSA-N 423.561 2.414 10 20 HECD CCOC(=O)c1cc(COC)cc(S(=O)(=O)NCc2cccc(OC)c2O)c1 813672414 HCVPPASPQDPIAM-UHFFFAOYSA-N 409.460 2.202 10 20 HECD N=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCSCC1 849064385 USKMSBZRFCZYQV-UHFFFAOYSA-N 415.542 2.015 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1 914848958 ANLYISWIZLGRDF-UHFFFAOYSA-N 412.515 2.468 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 917821381 DPLOJUFFRXGVAV-AHRSYUTCSA-N 413.518 2.298 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(Cn4cccn4)o3)cc2)C1 917834930 UQUFHMBZUPVSPZ-KRWDZBQOSA-N 407.474 2.156 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)on1 1795148685 FMWVLDJPNJKRIL-PLCSWTFUSA-N 413.430 2.065 10 20 HECD Cc1occc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767405 MOORVEXOQKFERD-FVCICTRLSA-N 420.849 2.170 10 20 HECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1827427513 BNIBQMXJJVBTEF-KRWDZBQOSA-N 413.478 2.071 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)NC=O)C3)cc1 1845399122 SWRWOIVUGDTWAX-GOSISDBHSA-N 408.502 2.046 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cncn3-c3ccccc3)CC2)cc1 45361168 URCJMJIACOMUGQ-UHFFFAOYSA-N 420.469 2.387 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccccc3OC)cc2F)CC1 303307992 OFGRGRXMVHZDBE-UHFFFAOYSA-N 407.511 2.455 10 20 HECD Cc1c(CNC(=O)C(=O)NCCN2CCc3ccccc3C2)n(C)c2ccccc12 550659214 MRCBZJVEMDOFIA-UHFFFAOYSA-N 404.514 2.277 10 20 HECD O=C(NC[C@H](O)COCC1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726718174 AFLGWEDFDBYQSQ-KRWDZBQOSA-N 413.465 2.344 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1F 729853577 BHCKUSIISXGPCP-MRXNPFEDSA-N 405.495 2.314 10 20 HECD COCCOC(=O)c1sc2[nH]c(CN(C)Cc3ccccc3O)nc(=O)c2c1C 731843425 FGXFBNSBZBSAFD-UHFFFAOYSA-N 417.487 2.434 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](O)CC(C)(C)C)CC2)cc1 735377801 LSOWNRMUYRPARP-IBGZPJMESA-N 406.571 2.304 10 20 HECD O=C(NCc1ccc(N2CCCCC2)cc1)C1CCN(c2ccc3nnnn3n2)CC1 742475871 CAPHFFKYOOXTKP-UHFFFAOYSA-N 420.521 2.042 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n(C)n1 743975441 RODOZFLAOMAEDH-CQSZACIVSA-N 421.448 2.308 10 20 HECD CC(C)C[C@H](CCO)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745699948 ZHRKROIEGOEOKB-OALUTQOASA-N 404.555 2.232 10 20 HECD COc1ccc(N2CCN(CCC(=O)Nc3ccc(C(N)=O)cc3)CC2)cc1F 753862324 XSXFAMDRCLUSRP-UHFFFAOYSA-N 400.454 2.084 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccccc3[N+](=O)[O-])CC2)cc1 753993790 JBSWBUCUONGMNH-HXUWFJFHSA-N 414.506 2.218 10 20 HECD CCS(=O)(=O)N1CCC(CNC(=O)NCc2ccc(N3CCCC3)cc2)CC1 754159424 MUECMVAGIMFKHH-UHFFFAOYSA-N 408.568 2.148 10 20 HECD Cc1cc(O)ccc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 758517428 QSJMVUDGPVISGX-UHFFFAOYSA-N 402.422 2.150 10 20 HECD CSc1ccccc1NC(=O)CN(C)C(=O)COC(=O)c1cccc(O)c1O 758582477 TVGTXSOWEJZXFK-UHFFFAOYSA-N 404.444 2.074 10 20 HECD O=C(CNC(=O)NCc1ccco1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912622 PXPOBWCGIMEXKH-MRXNPFEDSA-N 420.897 2.219 10 20 HECD CC(=O)N1CCc2c(NC(=O)C(=O)NCc3c(O)ccc4c3CCCC4)cccc21 769251342 DDJBZLLGXNTKLP-UHFFFAOYSA-N 407.470 2.435 10 20 HECD Cc1nc(C)c(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)n1 771054590 AHAVPYKXTNSMKV-MRXNPFEDSA-N 404.898 2.481 10 20 HECD CSC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 773741140 SCGSUWFXMRYBPD-DMRZNYOFSA-N 420.531 2.052 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1O 775023938 OFNHWVOWZXBIOH-ZWKOTPCHSA-N 401.463 2.282 10 20 HECD COc1cccc(C[C@H](O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 785597640 JWRGMQTVIKLXIM-NRFANRHFSA-N 402.466 2.015 10 20 HECD COC1(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCOCC1 785883008 QVMZNKBXAPQRKO-UHFFFAOYSA-N 402.413 2.354 10 20 HECD COc1cc2c(cc1CNC(=O)C(=O)NCCCSc1nccs1)O[C@H](C)C2 786629825 NHGUXEIJJFUHMZ-GFCCVEGCSA-N 421.544 2.390 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCc3nc(C)ncc3C2)cc1 786669497 AXOWHYYPZGNLOJ-IBGZPJMESA-N 409.534 2.263 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1 790412192 ZXRKBTPWTXIVBX-UHFFFAOYSA-N 412.489 2.132 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2F)C[C@@H](C)O1 791204253 GVTIGRMCZAVLIK-VXGBXAGGSA-N 403.414 2.255 10 20 HECD CN1CC[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 793929743 MJSMELPGETVLKX-SEVUAYLXSA-N 423.585 2.467 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1CC(C)(C)OC1=O 795675982 JUGOVGXKGGEWIQ-GOSISDBHSA-N 406.438 2.426 10 20 HECD CC(C)(C)n1ncnc1CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 800037552 UBXRLBMJJILZSN-UHFFFAOYSA-N 404.490 2.133 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)CCNS(=O)(=O)c2ccccc2)c1O 802660090 AWDWLFXQYINEHL-CYBMUJFWSA-N 409.464 2.156 10 20 HECD Cc1nc(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)sc1C 803311729 YLURHGDOTINAAI-HNNXBMFYSA-N 416.547 2.133 10 20 HECD O=C(NC[C@@H]1CCCS1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450233 FKLUSADKYTULOX-INIZCTEOSA-N 413.490 2.385 10 20 HECD CCN(CCNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 804258215 PKDDGOAHIBDESI-OAHLLOKOSA-N 406.527 2.303 10 20 HECD COCc1cnc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 804304783 SAQXGNAYAHBUHX-FPLPWBNLSA-N 416.503 2.142 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)cc1F 804851397 AVKGZJNQPITYOR-KRWDZBQOSA-N 421.513 2.480 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 805736724 CYWVQJRXQZJFBZ-CABCVRRESA-N 406.527 2.207 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN([C@@H](C)c2nccs2)CC1 807103713 VNACWNKGCFIYQD-INIZCTEOSA-N 415.563 2.039 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 807841461 BJBCYTDSTZDIPN-GOSISDBHSA-N 401.507 2.038 10 20 HECD COC(=O)C1(CS(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCCC1 809809957 GHZJJMOYXPNTOW-MRXNPFEDSA-N 410.536 2.237 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CO)CC3)cc2F)C[C@@H](C)O1 815277121 UJBRHTKDAWEXQI-KSZLIROESA-N 407.530 2.150 10 20 HECD Cc1ccnc2nc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)nn12 916458279 YQICBDMUVAHRRC-UHFFFAOYSA-N 420.395 2.218 10 20 HECD CN(C)[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1321731001 URGKHFONZXDHOV-MISYRCLQSA-N 401.555 2.060 10 20 HECD CNC(=O)c1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1324542761 NBAVEBKJHUVIHX-HNNXBMFYSA-N 402.882 2.195 10 20 HECD O=C(CCc1ccc2c(c1)CCO2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1329348733 BWQJEIOFZKCXCU-UHFFFAOYSA-N 414.527 2.105 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCn3c(=O)n(C)c4ccccc43)CC2)cc1 1341406446 GGVSRBDUBYHXKM-UHFFFAOYSA-N 408.502 2.478 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799945552 HYCVTDNQDUCWGO-HURGMSJPSA-N 408.502 2.464 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@H]1C1CC1 1802985423 CENMGNWZYJLPHG-DZKDUJFISA-N 422.485 2.254 10 20 HECD CC(C)[C@@H](CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCOCC1 65698526 VVIAWRYXHPRKIW-WIYYLYMNSA-N 404.555 2.240 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)n(C)c2ccccc12 472782522 CDXFAOOTXBKIGD-UHFFFAOYSA-N 421.501 2.242 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CSCC(=O)N1CCCCC1 728301429 BGYOMUIIDIWOMG-UHFFFAOYSA-N 405.564 2.227 10 20 HECD CCS(=O)(=O)C[C@H](C)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 733649075 YOFLRPMQZIVPMF-ZDUSSCGKSA-N 419.494 2.379 10 20 HECD O=C(NCCCSc1nccs1)c1ccc(S(=O)(=O)N2CCCC2)o1 733974015 DBYGZWFVNLBMBX-UHFFFAOYSA-N 401.535 2.433 10 20 HECD COc1ccc(O)c(CNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 734071079 QHWLTCGZHPPQIG-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4[nH]ccc34)cc2)C1 737139835 UCJJVSOYPBIVPP-INIZCTEOSA-N 419.485 2.125 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccc(CN2CCOC2=O)cc1 741099767 HQMYGVHYRZUUAA-UHFFFAOYSA-N 420.469 2.270 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCC(C)(C)NS(C)(=O)=O 745812441 QFUGSQYSLGUGHB-UHFFFAOYSA-N 422.345 2.014 10 20 HECD CN1CCC(=O)Nc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 746133885 MESAHEYFXAANMG-UHFFFAOYSA-N 412.465 2.371 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(O[C@@H]3CCOC3)CC2)c1 748267807 QHVIMXYINIYFPN-JOCHJYFZSA-N 418.534 2.197 10 20 HECD COc1ccc(N2CCN(CC(=O)NC(=O)NCc3cccs3)CC2)cc1F 753858466 SKFZOSXFVYZPCJ-UHFFFAOYSA-N 406.483 2.044 10 20 HECD C[C@@H]1CN(c2ccc(CN3C(=O)N[C@H]([C@H]4CCCOC4)C3=O)cc2F)C[C@@H](C)O1 761097476 IYTGGXSRDMZVAO-GTACMHHNSA-N 405.470 2.286 10 20 HECD O=C(NCc1cccc(Br)c1O)c1cccc(CN2C(=O)CNC2=O)c1 765733224 VMBBWQVZANICCY-UHFFFAOYSA-N 418.247 2.137 10 20 HECD CCNC(=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765925172 FEQRQQZIBBRGCD-UHFFFAOYSA-N 420.263 2.159 10 20 HECD CCOCCCN1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H](C)C1 765976823 AZHXAQWUGADPQX-SIKLNZKXSA-N 423.623 2.148 10 20 HECD COc1ccc(Cn2nccc2NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 769766712 XAYXEDVITHGYTO-UHFFFAOYSA-N 416.459 2.269 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(C4CC4)cc3)CC2)cc1 772219597 OSEHTEIXAIEUGF-UHFFFAOYSA-N 422.529 2.450 10 20 HECD C[C@@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(Cl)c(Cl)cc1O 774250054 BAYIZCOWPYHAQM-OLZOCXBDSA-N 402.322 2.283 10 20 HECD O=C1OCCN1c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 777587758 MCQYRBFMDZMSMC-UHFFFAOYSA-N 407.360 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCc3nccs3)CC2)cc1 778393823 MQVWDYMFXASYQG-BQYQJAHWSA-N 414.531 2.058 10 20 HECD COc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CC1 779521674 UGLQRQZRHOQEEY-OQFOIZHKSA-N 404.444 2.199 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(Br)c3)cc2)CC1 786656715 QJINYJFWJCALKW-UHFFFAOYSA-N 417.307 2.443 10 20 HECD COc1cccc(O)c1CNC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 788528957 KSWBIFJCYMIDAG-QGZVFWFLSA-N 402.466 2.347 10 20 HECD Cc1cccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 789839808 ALNGHZXYZILWCQ-UHFFFAOYSA-N 413.493 2.370 10 20 HECD C[C@@H](C1CC1)N(C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CC1 789839823 ATTXTUMFOOVFKA-AWEZNQCLSA-N 403.498 2.193 10 20 HECD CN1CCN(c2ccc(CNc3cccc(NC(=O)NCCC(N)=O)c3)cc2)CC1 797893640 SVPCYJNBROOMQU-UHFFFAOYSA-N 410.522 2.047 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCCO[C@H]2CCOC2)cc1)C1CCCCC1 803680167 ZHVHQFZUAYOKPX-NRFANRHFSA-N 417.550 2.384 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](C)CC2(C)OCCO2)cc1F 804852885 PUNOCRKKVZXIFO-OAHLLOKOSA-N 409.502 2.194 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1F 804853468 QFFGFPDSKCRXEV-LRDDRELGSA-N 419.419 2.466 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291513 XOSKFNNTBGHKCF-INIZCTEOSA-N 416.522 2.051 10 20 HECD Cc1cc(CC(=O)OCc2cc(=O)n(C)c(=O)n2C)c(C)n1-c1ccc(Cl)cc1 808931573 XCFWNTAAWMCLFX-UHFFFAOYSA-N 415.877 2.431 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H]4[C@H]5CC[C@@H](C5)[C@H]4C3)CC2)cc1 818440030 RAHMQENWXGQIBY-SEXYSYKVSA-N 409.530 2.405 10 20 HECD CS(=O)(=O)N1CCc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc21 918374549 LCMLXTXXGBKMIM-UHFFFAOYSA-N 401.488 2.098 10 20 HECD COCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442827 QASITTREWLVHSI-UHFFFAOYSA-N 411.502 2.297 10 20 HECD CCc1c(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)[nH]c(C)c1C(C)=O 920638248 VMNYDHHSBCFRMO-UHFFFAOYSA-N 422.459 2.205 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 920868936 FVJJEUHBCDGJPN-MRXNPFEDSA-N 417.531 2.199 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1[S@@](=O)CC 1320436705 MTVYEZSQEMVNFP-HBIPHATFSA-N 405.472 2.130 10 20 HECD Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995386 YQXJWZUSZFLLNW-FOIQADDNSA-N 421.457 2.158 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1822641656 FSQUHYSMXDBOPA-OKAXRFMISA-N 402.476 2.221 10 20 HECD O=C([C@@H]1C[C@H]1C1CC1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441196 RBAGMIMXOLMXJD-ZWKOTPCHSA-N 406.486 2.029 10 20 HECD O=C(/C=C/c1ccoc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033760 BVRWLSZLARRWNQ-DDEVBNQJSA-N 410.426 2.326 10 20 HECD COc1ccc(N2CCN(C(=O)COc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 6290679 WCRIBRSJBZKVNY-UHFFFAOYSA-N 401.419 2.340 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3Cc4ccccc4C(=O)O3)cc2F)CC1 303273104 GQLSDQRQAVUUSN-OAQYLSRUSA-N 411.477 2.366 10 20 HECD Cn1c(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1-c1ccccc1 728164562 AJFXFNNUNXGOMG-UHFFFAOYSA-N 409.465 2.317 10 20 HECD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NCc1ccc(N(C)C)c(F)c1 731622707 QODOZVWBZYZLPB-UHFFFAOYSA-N 405.382 2.316 10 20 HECD CNc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc(Cl)n1 732274667 LJQINKNQDBEADL-CQSZACIVSA-N 401.898 2.408 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H](N2CCCCC2=O)C1 732823384 RMASLDACZPMTLR-SFHVURJKSA-N 418.513 2.349 10 20 HECD COc1cc(C)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 737131600 QXEKBWWAYPYXFV-UHFFFAOYSA-N 411.502 2.467 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 741097685 VABQMKVNORTAPR-UHFFFAOYSA-N 406.486 2.458 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H](CCO)C3)CC2)cc1 745349428 HUPFTXQINJVTOW-IBGZPJMESA-N 404.555 2.011 10 20 HECD COc1ccc(N2CCC(NC(=O)N(CCN(C)C)C[C@@H]3CCCO3)CC2)cc1 745799503 IPMYJQVZHQLCFH-NRFANRHFSA-N 404.555 2.416 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccccc4C)CC3)CC2)cc1 753995679 RQDVMLMTOARYQL-QHCPKHFHSA-N 424.589 2.309 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cccnc3OC(C)C)CC2)cc1F 754211059 DGFIJNIRWKCZQO-UHFFFAOYSA-N 416.453 2.304 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1ccc(S(=O)(=O)N(C)C)cc1 766240204 WMKZKWRQUIOYLB-UHFFFAOYSA-N 403.548 2.406 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(OC)c(OC)cc2OC)c1 766430822 HDOQSQWJLVBJGP-NSHDSACASA-N 404.419 2.243 10 20 HECD CCCn1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1 767027827 DEYYVXBJKRFBGC-UHFFFAOYSA-N 418.409 2.259 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c(O)cc1C 768438607 VRHHICRZOMJSIW-UHFFFAOYSA-N 421.475 2.124 10 20 HECD COCCc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)n(C)n1 768713510 LHTOJOUJNXLKRE-UHFFFAOYSA-N 413.522 2.196 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C 771577795 ICROCYLMCHKRKE-CQSZACIVSA-N 421.357 2.467 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773860210 WSIPRILROWFGGH-HNNXBMFYSA-N 411.506 2.109 10 20 HECD C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 775836542 NADVBDYDWKNGAN-JYJNAYRXSA-N 418.563 2.317 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)Cc3ccncc3)CC2)cc1 778305515 ARHFRZQGBLURSO-JTHGQSKGSA-N 408.502 2.042 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cc(OC)c(OC)c(OC)c1 785481763 IXJKFDGGEVKGHX-UHFFFAOYSA-N 416.474 2.473 10 20 HECD O=C(NCc1ccc(O)cc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 786628250 UVGSDHHNPCJZKG-HNNXBMFYSA-N 419.428 2.395 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H]3CCC[C@H](S(C)(=O)=O)C3)CC2)cc1 788505818 KSFWBPKSHRABJI-NQIIRXRSSA-N 409.596 2.153 10 20 HECD CC(C)[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1nnc2ccccn12 788909221 DTJKIXJTQWIXMJ-HXUWFJFHSA-N 420.517 2.459 10 20 HECD CS[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799034 MAPWASMRSVHUNE-CVEARBPZSA-N 409.527 2.069 10 20 HECD O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)c1c(F)ccc(O)c1O 789966814 KRUOFYIJUYRUIF-UHFFFAOYSA-N 408.451 2.342 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2OC(C)C)cc1C 794595073 NXJBCPXOAVHXMF-UHFFFAOYSA-N 414.505 2.197 10 20 HECD CCOC[C@@H](C(=O)O)N(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 797710488 ZRYWOMCONRNRKW-IYOUNJFTSA-N 411.474 2.070 10 20 HECD COc1ccc(N2CCN(C(=O)C3=C(C)N(C)c4ncnn4[C@H]3C)CC2)cc1F 798974888 VUGWBGFKYCVGHX-AWEZNQCLSA-N 400.458 2.059 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCc3ccccc3[C@H]2CO)cc1F 804852673 DJZDHUYEORHPNN-OAQYLSRUSA-N 413.493 2.406 10 20 HECD NC(=O)c1cc(OC2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)ccn1 809752778 WNHIHHCKXPSTTA-UHFFFAOYSA-N 414.481 2.200 10 20 HECD C[C@H](OC(=O)c1cn(C)cn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 811227498 JONRXWHQPDVRNR-LBPRGKRZSA-N 403.394 2.380 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cn(C)nc1C(F)(F)F 814981177 YNVUACAGIQDPMV-UHFFFAOYSA-N 418.441 2.096 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@@](=O)CCOc3ccccc3F)CC2)cc1 912940392 VZFCXWSULVJPJE-LJAQVGFWSA-N 420.506 2.311 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(cnn4-c4ccccc4)C3)nc12 917112532 LIPVVTRJNJYZLD-UHFFFAOYSA-N 418.457 2.356 10 20 HECD COc1ccc(N2CCCN([C@@H]3CC(=O)N(c4cccc(C(=O)O)c4)C3=O)CC2)cc1 917639633 RDLDEHVUMKWRPH-HXUWFJFHSA-N 423.469 2.238 10 20 HECD Cc1nccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 919464853 DVJYYAJRYBNVQF-OKILXGFUSA-N 416.453 2.011 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(S(C)(=O)=O)C3)c2C)cc1 920294626 YVIFVPBBSUMGDQ-INIZCTEOSA-N 405.520 2.257 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCOCC1)c1cc(O)c(O)c(Cl)c1 1795754582 CYULEDDEKCFWIP-QDMKHBRRSA-N 408.882 2.430 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1 1823819142 UWNBGWXGDPHSQV-QZTJIDSGSA-N 417.506 2.295 10 20 HECD CC(C)N(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429286 RJVXUQULOLMAFW-GOSISDBHSA-N 418.538 2.066 10 20 HECD O=C(c1ccc(OC(F)F)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250546 KKGJZYOTFCMHOM-UHFFFAOYSA-N 419.384 2.225 10 20 HECD O=C(/C=C/c1cccnc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033912 NXLBARJWXNHDDO-HNJDCKIISA-N 421.453 2.128 10 20 HECD C[C@H](NC(=O)NCCS(=O)(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 65433797 YTBOCIQGYPMIMF-KRWDZBQOSA-N 417.531 2.357 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 116046449 CJKFBAJCIZRXIJ-BETUJISGSA-N 405.430 2.169 10 20 HECD C[C@H](NC(=O)N1CCC(CN2CCOCC2)CC1)c1ccc(N2CCOCC2)cc1 139992012 WBBWNCMCPSSITR-IBGZPJMESA-N 416.566 2.338 10 20 HECD Cn1cnnc1SCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 726937982 VMDNBBCLZAHWBV-UHFFFAOYSA-N 415.441 2.079 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCC3CCN(C(C)=O)CC3)cc2F)CC1 730126747 RZPAHYJJKWYWIF-UHFFFAOYSA-N 419.545 2.025 10 20 HECD CCS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 733889495 ACFBHZSGYTYFOQ-UHFFFAOYSA-N 406.479 2.386 10 20 HECD CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 734215148 DDRUZIURWQQYER-IRXDYDNUSA-N 420.529 2.233 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3SCCO)nc12 740966272 BROKJOIVEPLNMH-UHFFFAOYSA-N 417.443 2.053 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1C(=O)N(C)C 751817859 QZMOYDAHHCNTLZ-UHFFFAOYSA-N 406.486 2.328 10 20 HECD CCN(CCS(C)(=O)=O)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 753204242 VADCJQFHDGVBIJ-UHFFFAOYSA-N 420.531 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@@H](NC(N)=O)c3cccs3)CC2)cc1F 753740068 ZDQBTZIJQQEHPQ-OAHLLOKOSA-N 406.483 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 754864948 CPMOVCRDZUFZBV-IYBDPMFKSA-N 417.529 2.314 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H](CO)CC(F)F 758381987 NTJJGVZIEMUONX-GFCCVEGCSA-N 411.371 2.357 10 20 HECD COCCS(=O)(=O)c1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1 758506197 ODDKVEFSTUEJNV-UHFFFAOYSA-N 404.532 2.233 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cncc(F)c1 759162217 YJDAARSGDNNLOQ-UHFFFAOYSA-N 410.428 2.406 10 20 HECD Cn1ccnc1[C@](O)(CC(=O)NCc1cccc(Br)c1O)C(F)(F)F 765730402 URDLECWVDKBVAY-CQSZACIVSA-N 422.201 2.345 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc([N+](=O)[O-])c1F 768269952 ZEPRGOPBZHICPQ-UHFFFAOYSA-N 403.413 2.215 10 20 HECD O=C(Nc1cccc(-n2ccnn2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 768713304 JNPKGMLQRGFHKE-LJQANCHMSA-N 421.457 2.119 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccnc3Cl)cc2F)CC1 774220934 OCDBVPAXQIBXBD-UHFFFAOYSA-N 419.888 2.271 10 20 HECD CC1(C)CC(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC(C)(C)N1 774494714 NGYONRQPZCUQTK-GOSISDBHSA-N 417.550 2.325 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN2CCOc3cc(N(C)C)ccc32)c(OC)c1 774754465 SPTNBHCCDJHREL-QGZVFWFLSA-N 416.474 2.187 10 20 HECD COc1cccc(CC(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)c1 774858031 LDSZVRVVTXMNCK-UHFFFAOYSA-N 415.446 2.205 10 20 HECD CCOCCOC1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 777720123 FEDPZZUGVOPKEH-IYBDPMFKSA-N 409.502 2.386 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2 785295583 WVMZUCDZNRHSPY-CQSZACIVSA-N 420.469 2.458 10 20 HECD C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785421488 CWKKMVMGLVJTJF-CRAIPNDOSA-N 418.538 2.131 10 20 HECD COc1cccc(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 787156036 IAAHSVKMTVIUDO-UHFFFAOYSA-N 413.543 2.224 10 20 HECD CC(C)(C)c1csc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788321086 SKAQDMAHBQNXQP-UHFFFAOYSA-N 416.547 2.210 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCC(O)(c3cccnc3)CC2)cc1 788950491 BWTGTNUQRHEQBS-UHFFFAOYSA-N 424.545 2.491 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCS1 789825506 MMGFCIJABVITME-BFYDXBDKSA-N 423.554 2.410 10 20 HECD CC(C)C[C@@]1(CO)CCCN1C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803306202 RRHFHGRGMAJKNI-FDDCHVKYSA-N 417.550 2.100 10 20 HECD C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662866 IMENHFBYIGRTPC-IZPCHGGPSA-N 419.522 2.465 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@@H](CC(C)C)C3)CC2)cc1 804314952 CZDQJLOJUUTXEX-RXVVDRJESA-N 417.550 2.490 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]3c3nncn3C)cc2)CC1 805026046 ZZUPTIZFFWILCU-LJQANCHMSA-N 410.522 2.031 10 20 HECD CCc1cc(CNC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)on1 805746323 VYKCDAWSPBDLEG-UHFFFAOYSA-N 410.268 2.370 10 20 HECD CCCNC(=O)OC[C@@H]1CCCCN1Cc1cc(O)n2ncc(C(=O)OCC)c2n1 805775244 ZCMCECXJQBTJTA-HNNXBMFYSA-N 419.482 2.102 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccc(-n2ccnn2)cc1 807290262 GPKWFEDPRRGDCS-KRWDZBQOSA-N 416.485 2.137 10 20 HECD CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 808039446 BGKVDMKTKKVQRH-SJLPKXTDSA-N 418.538 2.084 10 20 HECD O=C(Nc1ccc2c(c1)OCCO2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918295962 USNKOCKMSMUAAE-KRWDZBQOSA-N 412.442 2.310 10 20 HECD Cc1cccc(OCCNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918777381 KNITVILCEQTQGR-UHFFFAOYSA-N 417.531 2.108 10 20 HECD Cc1cc(C(=O)CN2CCC[C@](C)(CO)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1319523061 GGTZUBLXXLLDOL-NRFANRHFSA-N 419.547 2.019 10 20 HECD CS(=O)(=O)NCCc1ccc(C(=O)Nc2c(Cl)ccc3nonc23)s1 1324140576 GNMLTNZYOVWPNH-UHFFFAOYSA-N 400.869 2.282 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ccc[n+]([O-])c3)CCC2)cc1)c1cc(O)nc(O)c1 1788424211 HTNXWPUDFLIBIS-UHFFFAOYSA-N 420.425 2.188 10 20 HECD CCC(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808468815 YNWOJZPXRQTZQK-VGOFRKELSA-N 419.485 2.290 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCC=CO1 1819373355 RIEXSQRQLHMNOQ-CABCVRRESA-N 413.434 2.215 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CC2(O)CCC2)CC1 1832460050 KQGSTQWQWFFURM-QGZVFWFLSA-N 417.506 2.031 10 20 HECD C/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900817 YETMFEBVRNBUBQ-TWQVXDNOSA-N 423.604 2.433 10 20 HECD CN(C(=O)CSc1ccccc1C(=O)N1CCS(=O)(=O)CC1)C1CCCCC1 110662435 VLHNPJAKAVCJIE-UHFFFAOYSA-N 424.588 2.440 10 20 HECD CCN(CC)c1ccc(CNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1 195646171 WVQHHJLMHIRQCL-UHFFFAOYSA-N 420.513 2.221 10 20 HECD C[C@H](NS(=O)(=O)c1cccc2c1OCCO2)c1ccc(N2CCOCC2)cc1 725828616 INWCETKKTDCUHS-HNNXBMFYSA-N 404.488 2.334 10 20 HECD COc1ccc(N2CCC(NC(=O)CSCC(=O)Nc3cc(C)on3)CC2)cc1 726562298 HLRJJCGLGFQXST-UHFFFAOYSA-N 418.519 2.449 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC(n4ccnc4)CC3)CC2)cc1 728749267 PPIPWJPIJFAJOL-UHFFFAOYSA-N 412.538 2.060 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1F 728761118 IZHRQVOFMQSMAD-MRXNPFEDSA-N 412.465 2.091 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3CN3CCCC3)cc2)C1 729599181 OGNAPGVZLYMSNN-PZJWPPBQSA-N 413.566 2.158 10 20 HECD COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 734066355 SQILCDARRRSYPM-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD Cn1c(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc2c1c(O)nc(=O)n2C 742423837 WVOICVXZUTXSNQ-LLVKDONJSA-N 420.420 2.055 10 20 HECD NC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCCCC3)cc2)=NN1c1ccccc1 742475901 FEBCGQSBHCDIQN-NRFANRHFSA-N 405.502 2.413 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CN2CCCC2=O)NC(=O)OC(C)(C)C)cc1 742749340 GDHCBJOOANJEFM-QGZVFWFLSA-N 404.511 2.057 10 20 HECD CCN1C[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751977 YMEYVCRXFFSBQP-FUHWJXTLSA-N 418.538 2.303 10 20 HECD CCO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 743559651 LLRABJXNCZDQCW-HNNXBMFYSA-N 403.483 2.345 10 20 HECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1 746133666 HTWWRFPGJNAPLR-LJQANCHMSA-N 411.506 2.340 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1F 746798319 CSSKTNCSQZXHIP-OAHLLOKOSA-N 413.449 2.332 10 20 HECD NS(=O)(=O)c1ccc(CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 751294965 VCVLBMCCAJSJOF-GOSISDBHSA-N 418.515 2.180 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C2)cc1 762273890 FCOUNQJWJKPOSL-QGZVFWFLSA-N 418.515 2.166 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)N1CCc2cc(S(N)(=O)=O)ccc21 766271161 XIYOFUKAOOQSOS-UHFFFAOYSA-N 415.515 2.075 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1sccc1-n1cnnn1 768914594 FPDNGTQYUZDXKY-CQSZACIVSA-N 418.910 2.477 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)c2)CC1 769847493 JABFJQOTXXTTNZ-UHFFFAOYSA-N 412.515 2.471 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(N)(=O)=O)c(C)c3)c2)CC1 770285834 GEHBATKWSZHFFF-UHFFFAOYSA-N 402.520 2.037 10 20 HECD O=S(=O)(Nc1ccc(O)cc1F)c1ccccc1S(=O)(=O)N1CCCC1 775287615 DQFQKWSOQGODNP-UHFFFAOYSA-N 400.453 2.117 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC[C@H](OCCO)C1 780506909 LMHBSCJWWBQCNQ-YJBOKZPZSA-N 413.465 2.440 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 780833468 YLFCRDIIYYWWSD-GOSISDBHSA-N 407.486 2.412 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)Nc2cccc(C(N)=O)n2)cc1 782424020 VKOOMHWSVWEUPI-UHFFFAOYSA-N 421.457 2.007 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 784768404 XINNQGIDTMEYJR-MRXNPFEDSA-N 419.913 2.115 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(Br)c(F)cc1F 786401116 DVGIXBNCJSIGCF-UHFFFAOYSA-N 415.190 2.436 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc(C(F)(F)F)nn3)CC2)cc1 788300020 SAGBQUZTPHDYOI-UHFFFAOYSA-N 424.427 2.448 10 20 HECD Cc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788312030 AVKKFNLKDXBJDB-QFIPXVFZSA-N 423.513 2.048 10 20 HECD CCn1nc(C)c(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C 789844298 FMEXSPONWBKGIM-UHFFFAOYSA-N 415.563 2.006 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)ccc2[nH]1 792326302 CAKJQBCYQCVMML-UHFFFAOYSA-N 419.485 2.383 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(OC)cc2O)cc1OC 794390169 ZJRYIVSDDPBVEI-UHFFFAOYSA-N 406.391 2.273 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@@H](C)O[C@@]3(CCCOC3)C2)c1 794890330 OABPFMQXKCMFKK-HXOBKFHXSA-N 418.534 2.197 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(C)ccc3-n3cnnc3)CC2)cc1 797843185 SCMNHTRBEJQVHP-UHFFFAOYSA-N 420.517 2.136 10 20 HECD CNC(=O)CNC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c1 800687805 QKPMRXPUZPEERV-UHFFFAOYSA-N 405.458 2.217 10 20 HECD C[C@@H](NC(=O)N1CCC[C@@H](S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 800702118 IPCZLXGTSYFCQQ-VQIMIIECSA-N 409.552 2.193 10 20 HECD COc1ccc(N2CCN(CCNc3nc(O)c4cc([N+](=O)[O-])ccc4n3)CC2)cc1 804388245 QJCLEKHJWMMDPN-UHFFFAOYSA-N 424.461 2.486 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc4n(n3)CCCC4)CC2)cc1 804751620 BYRIKEBEYIOHJW-MDZDMXLPSA-N 409.490 2.072 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]3C3CCC3)cc2F)CC1 805006666 APMVQVSJPMTUBF-FQEVSTJZSA-N 416.541 2.375 10 20 HECD CCOC1CC(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 805638112 CSYAQXSRMXPXHS-BXXOZEPKSA-N 422.497 2.414 10 20 HECD CN(C)C(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806458462 YLQNWXRIVIVTDR-QGZVFWFLSA-N 422.501 2.425 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(Cc3ccncc3)CC2)c1 917069352 SNAMVUKJMUNLDX-UHFFFAOYSA-N 424.545 2.140 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCc3ccc(N4CCSCC4)cc3)ccc21 917383402 FIXXXKIXWWWYIW-UHFFFAOYSA-N 424.526 2.193 10 20 HECD NC(=O)[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 918601784 JHVVMCYYYBBNIM-GJSJWPQCSA-N 409.558 2.063 10 20 HECD Cc1nc[nH]c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800714789 FAVLEZLNBNVTIE-CLLJXQQHSA-N 404.854 2.348 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)C1 1810550133 AEJPGTCUCGHSJS-DJJJIMSYSA-N 411.861 2.262 10 20 HECD O=C(COc1cccc(Cl)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248738 JEBAQHMPOIILQH-UHFFFAOYSA-N 417.849 2.042 10 20 HECD O=C(c1cc(-c2ccccc2)no1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250190 SYVWMPXMMMZZQS-UHFFFAOYSA-N 420.425 2.279 10 20 HECD O=C(Cc1ccncc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501836 IUVSSVOMICZTPI-UHFFFAOYSA-N 401.850 2.206 10 20 HECD COc1ccc(N2CCC(NC(=O)CN(C)S(=O)(=O)c3ccccc3)CC2)cc1 110473923 CUBWAYNJIXHGKH-UHFFFAOYSA-N 417.531 2.101 10 20 HECD C[C@H](NC(=O)NC[C@@H](O)COc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 139967344 YYLMKGYLQSWPDS-OXJNMPFZSA-N 417.481 2.462 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)C[C@@H](O)COCc2ccccc2)n(C)c2ccccc12 582082399 ITEDSOSPONFMPO-LJQANCHMSA-N 423.513 2.139 10 20 HECD Cc1cc(C(=O)N2CCN(CC(N)=O)CC2)c(C)n1-c1ccccc1Br 729344960 NGRQJMYHOYGWAH-UHFFFAOYSA-N 419.323 2.100 10 20 HECD CN(CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1)Cc1ccccc1O 731842850 KHTBKXLBDPDGFY-UHFFFAOYSA-N 411.911 2.366 10 20 HECD CN1C(=O)COc2ccc(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 743248679 VUYJONRRJRGXPD-UHFFFAOYSA-N 414.437 2.339 10 20 HECD NS(=O)(=O)c1ccc(CC(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 743429419 OBTNEKMFNCTPRM-UHFFFAOYSA-N 400.456 2.404 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC4(CCOCC4)C3)cc2)C1 745690568 DCNIDWFDNBYUED-GOSISDBHSA-N 400.523 2.100 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3cccc(OC)c3O)C2=O)c1 747955957 QKQRXIQUQVKQLZ-KRWDZBQOSA-N 415.446 2.023 10 20 HECD O=C(NCc1ccccc1O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 748346573 NBXPOWXOUKHNMP-OAHLLOKOSA-N 419.459 2.018 10 20 HECD C[C@@H](NC(=O)COC1CN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 748533485 PSFCACVBJRSVMG-MRXNPFEDSA-N 419.522 2.336 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3[C@H]4CC[C@H]3CC(=O)NC4)cc2F)C[C@@H](C)O1 748616338 ASJOAKFHTPPQJJ-JHNDHUHGSA-N 404.486 2.002 10 20 HECD Cn1cnc2cc(S(=O)(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)ccc21 751229546 XVUHZBUHUQXQOP-UHFFFAOYSA-N 418.494 2.152 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(CNC(C)=O)ccc2OC)c1 751316735 ACKYKZQDASGFJH-LBPRGKRZSA-N 408.476 2.085 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)[C@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)C1 753862403 ZIZFWQSKJWEVSI-IRXDYDNUSA-N 421.513 2.147 10 20 HECD C[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN1Cc1ccccc1 758328940 WWKQAAAAQULADE-YOEHRIQHSA-N 403.504 2.157 10 20 HECD CNS(=O)(=O)c1cccc(CNC(=O)NCCCSc2nccs2)c1 759562542 YPVSVXZPAKTJBD-UHFFFAOYSA-N 400.551 2.033 10 20 HECD COc1cc(OC)cc(OCCNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 763594325 MCAAHTMCIIAWLJ-UHFFFAOYSA-N 415.490 2.419 10 20 HECD COc1cc(N2CCN(CC(=O)N3CCCC[C@@H]3C)CC2)c([N+](=O)[O-])cc1OC 766934560 YOXAIRAZAUZMTE-HNNXBMFYSA-N 406.483 2.135 10 20 HECD O=C(CS(=O)(=O)C1CCCC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768915340 KIRZNJZBROYFAV-MRXNPFEDSA-N 414.955 2.484 10 20 HECD C[C@@H]1CCc2c(sc(=O)n2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 772897532 IMPOZCJSWDWTAJ-CQSZACIVSA-N 419.522 2.327 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(Cl)o3)cc2F)CC1 775223804 BPZLNNPGECDCSX-UHFFFAOYSA-N 422.888 2.147 10 20 HECD COc1ccc(Cn2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 779179676 GEFJFDUQHFENHE-UHFFFAOYSA-N 416.459 2.269 10 20 HECD CCO[C@H]1C[C@](CO)(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 780310905 DAXUZUUKQWHHCP-GHTZIAJQSA-N 409.502 2.028 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C 785597987 HXUQXQDHNWSZMZ-FQEVSTJZSA-N 423.492 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1F 786311380 QYEFWZPOBJGZGL-UHFFFAOYSA-N 410.442 2.339 10 20 HECD Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 788153770 QJGFVHQXLDBABB-HZPDHXFCSA-N 414.481 2.075 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1(C)C 789841438 XXNWHAQGCAPYNH-HNNXBMFYSA-N 405.514 2.298 10 20 HECD CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCOCC3)c(F)c1)CC2 792176521 FZILOMWMTOXTSS-UHFFFAOYSA-N 419.522 2.475 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 804277505 DIDWVNQEODWFKV-FQEVSTJZSA-N 408.546 2.316 10 20 HECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(-n2ccnn2)cc1 806282240 INKBYOQVEUKZBS-ZDUSSCGKSA-N 416.532 2.200 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)o1 807098612 WSBVBQQTPKPMTN-UHFFFAOYSA-N 400.523 2.169 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 807292768 YCQPCMKISCMUPC-UXHICEINSA-N 409.486 2.387 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1 808484247 NJJBEFKONUHAMG-LLVKDONJSA-N 401.868 2.076 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cnc2[nH]c(O)nc2c1 809613526 XLZMFFMEINGCQL-UHFFFAOYSA-N 421.379 2.449 10 20 HECD CC1(C)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1[C@H]1CCCO1 810024842 TWIVFYPQMSJHQJ-CTNGQTDRSA-N 405.514 2.168 10 20 HECD CCCN(CC)C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 811975039 YWUZZIHEONUNOA-IEBWSBKVSA-N 403.571 2.308 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2ccc3c(c2)OCCO3)c(C)n1-c1ccccn1 915821806 ZEORZFFLDASQKM-UHFFFAOYSA-N 413.455 2.379 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccccc3-n3cccn3)CC2)cc1 919165623 ZJQAHGXIOQJYHJ-UHFFFAOYSA-N 420.469 2.387 10 20 HECD CCCNC(=O)[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1355051426 PSGGXLRZQTVLDR-NSHDSACASA-N 409.398 2.015 10 20 HECD CN1CCC(CC(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1841126312 KDKCIHYUYKITDH-UHFFFAOYSA-N 421.925 2.300 10 20 HECD CCOC(=O)C1=C(COC(=O)c2ccc(C)c(O)c2O)NC(=O)N[C@@H]1c1ccco1 109998420 BZOCRWAFWMFAOY-OAHLLOKOSA-N 416.386 2.027 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4ccccc4)C[C@H]3C)nc12 303429447 BORIJZWZELTDSL-MRXNPFEDSA-N 409.490 2.318 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2 462374015 SUBGFSHMHDVLTC-UHFFFAOYSA-N 413.499 2.176 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CCC[C@@]34NC(=O)NC4=O)ccc21 465374237 MTJSYCDMYPEGHI-OPAMFIHVSA-N 412.490 2.013 10 20 HECD CN(Cc1ccc(N(C)C)cc1)Cn1nc(C[C@@H]2CCS(=O)(=O)C2)n(C)c1=S 732497386 OCXOKOYTEOVRJB-INIZCTEOSA-N 423.608 2.084 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccn(-c2ccncc2)n1 733855831 LZCUCHVRMVVKDY-UHFFFAOYSA-N 422.514 2.075 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c2)o1 743896191 BJOPHZDTSJDGOB-UHFFFAOYSA-N 421.457 2.137 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(OCC4CC4)CC3)cc2)C1 745691369 JPEFLOLBLVFPIZ-LJQANCHMSA-N 414.550 2.489 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C3CC3)[C@H](C)O)c2C)cc1 745741220 AOBKNWZHBALZHT-HRAATJIYSA-N 412.486 2.404 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCCN1CCOC[C@@H]1C 745803689 WASFQODWIKTUHT-ZDUSSCGKSA-N 400.317 2.407 10 20 HECD CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 746040244 SRLIKAFCASDCLZ-UHFFFAOYSA-N 423.517 2.042 10 20 HECD Cc1nccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 748035045 SAOBQBNZBIPFFU-UHFFFAOYSA-N 404.473 2.283 10 20 HECD CCOc1cc(NC(=O)C(=O)NCc2ccccc2O)c([N+](=O)[O-])cc1OCC 748486259 OFXDCDWXZUFDAP-UHFFFAOYSA-N 403.391 2.353 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@]3(N(C)C)CCSC3)cc2F)CC1 748626640 FXUOZTGGEXHRDX-OAQYLSRUSA-N 423.602 2.204 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H]2C[C@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 752142905 RYDDTCLZOCYLCZ-MAUKXSAKSA-N 419.547 2.160 10 20 HECD CCCO[C@@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754028695 BQPGYVWBCOTVLC-FYYLOGMGSA-N 405.583 2.459 10 20 HECD CCC1(CC)[C@@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1OC 759599763 HHLPOEHLTBNUHS-VQTJNVASSA-N 407.530 2.462 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ncccc3C)CC2)cc(OC)c1OC 760111451 UWXSFFSPMFJWSL-UHFFFAOYSA-N 400.479 2.448 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@H]4C[C@@H](C)CCN4C3=O)CC2)cc1 760952869 WDQJLLOGCSVYQJ-FXAWDEMLSA-N 400.523 2.270 10 20 HECD C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[S@](=O)C[C@H](C)C1 763878069 LOSNMFIOTAPBST-PWUJBNGKSA-N 424.522 2.489 10 20 HECD CCC1(CO)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 764353977 ZSLKJVKICXOURJ-GOSISDBHSA-N 402.539 2.082 10 20 HECD O=C(NCc1cccc(Br)c1O)Nc1cnn(CCN2CCOCC2)c1 765298286 NIZPXSDGUJNAQD-UHFFFAOYSA-N 424.299 2.005 10 20 HECD CS(=O)(=O)NC[C@@H]1CCCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 772599978 QBKARMPFNPZQIN-KRWDZBQOSA-N 410.540 2.346 10 20 HECD CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774363915 NRPYBKHWWPQYAJ-UHFFFAOYSA-N 414.458 2.279 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)Oc3ccccc3)CC2)cc1 778277149 AKPNKIIXHCYVCC-SYGIOELKSA-N 423.513 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3COc4ccc(C)cc43)CC2)cc1 778375981 OAKAPOGAWGFBRF-VFCOFNOGSA-N 421.497 2.458 10 20 HECD Cc1ccc(C(=O)N2CCN([C@H]3CCCN(Cc4ccccc4)C3=O)CC2)c(O)c1O 781019359 HNFVBYDZGIJJEP-FQEVSTJZSA-N 423.513 2.355 10 20 HECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)N1CCN(c2ccc(F)cc2)CC1 783710853 LHHGFCVIIQTNGE-CQSZACIVSA-N 402.422 2.174 10 20 HECD C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785428326 KDTGFKSVIJOOMB-WBVHZDCISA-N 418.538 2.131 10 20 HECD COc1ccc2c(c1)OC[C@@H](C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)C2 786254663 GTKGVEPNBVOPDV-FQEVSTJZSA-N 423.513 2.231 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(NC(=O)N(C)C)c3)cc2)CC1 786259937 SUJUULFTCXIISB-UHFFFAOYSA-N 423.517 2.379 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cncc(Br)c3)cc2)CC1 786262444 LXNBDZKZIUKFIA-UHFFFAOYSA-N 417.307 2.443 10 20 HECD C[C@H](Sc1n[nH]c(CO)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787485395 BFVWKCVSLHKJIR-JTQLQIEISA-N 408.439 2.192 10 20 HECD Cc1ccc(CCNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1 787911283 ACWJLZAZMIWCRW-IYBDPMFKSA-N 417.481 2.316 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1CCOC2(CCC2)C1 789866901 AJQKQFQOFSAXSW-QGZVFWFLSA-N 403.548 2.074 10 20 HECD CCn1ccc(CN(C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 790992438 XAPKNQSPDFRHST-MDZDMXLPSA-N 410.518 2.380 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 791153749 GWBSCRGXVLUACY-GDCKJWNLSA-N 415.534 2.174 10 20 HECD O=C1CC[C@H](OC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C(=O)N1 798590820 UWBQMELNNDEYOH-UTEVDWOZSA-N 424.525 2.078 10 20 HECD CNC(=O)[C@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677309 MEBBYVWEDDSWHO-VQTJNVASSA-N 414.550 2.103 10 20 HECD COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686226 DCVTVOPSZXLNFP-GOSISDBHSA-N 415.534 2.123 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC1CCC2(CC1)NC(=O)NC2=O 807545017 NERWEFYCOUHIOB-UHFFFAOYSA-N 413.522 2.339 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCC[C@H]1CCO 809558733 ARCADCLVFGCUEG-WFASDCNBSA-N 413.312 2.171 10 20 HECD CC1CCN(c2ccc(CNC(=O)N(C)[C@H]3CCN(S(C)(=O)=O)C3)cc2)CC1 813634720 TUUUBDXCMLDQEQ-IBGZPJMESA-N 408.568 2.098 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)CC2)cc1 872096196 YNMGEWZZQAFXMM-UHFFFAOYSA-N 421.494 2.047 10 20 HECD CN(CC(=O)NC1CC1)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 914436928 FODSHVDLISQJDL-UVTDQMKNSA-N 423.585 2.467 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 917355457 DKWDAWCSOGXKSE-KKSFZXQISA-N 416.474 2.486 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2c(F)cccc2[nH]1 918340198 MSNBUFWZQKEDMQ-UHFFFAOYSA-N 401.463 2.472 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cn2)C[C@H](C)O1 919814717 MOMBMDVYTQXORU-STQMWFEESA-N 420.491 2.025 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCC=CO1 1819373356 RIEXSQRQLHMNOQ-GJZGRUSLSA-N 413.434 2.215 10 20 HECD Cn1c(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc2ccccc21 1843248834 RSHVLHDULBDSRQ-UHFFFAOYSA-N 420.469 2.044 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc3cccnc3s2)C1 1843688128 OKGNZZKSJMHWOS-UHFFFAOYSA-N 410.455 2.233 10 20 HECD COc1cccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1O 729860239 USUIUTJKHFGBPI-LJQANCHMSA-N 405.454 2.453 10 20 HECD CCn1nc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc1=O 731974500 QGWCXZNSIVKKNP-UHFFFAOYSA-N 410.396 2.049 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NCc2cc(OC)ccc2O)cc1 734065173 QNIVYLQGQWKGHQ-UHFFFAOYSA-N 421.519 2.431 10 20 HECD CC(C)Oc1ccc([C@H](O)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 734872156 LXHVCMYGWYCWQG-GOSISDBHSA-N 408.476 2.014 10 20 HECD CCN(CC)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 745352400 YKLKPZJOLDYWMR-OAQYLSRUSA-N 417.598 2.333 10 20 HECD CCN1CCN(CCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)CC1 746018833 NUSQDGPDELDANO-JOCHJYFZSA-N 402.583 2.288 10 20 HECD COc1ccc(N2CCN(C(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1F 753739700 YAKPFMBZRXSEMT-IRXDYDNUSA-N 417.481 2.048 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(OC)c(OCCO)c3)CC2)cc1F 754220454 RIHCMJZPUKZESJ-UHFFFAOYSA-N 404.438 2.176 10 20 HECD O=C(Nc1cnn(CC(F)F)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 762415817 JHOOJRIOVXLFAZ-HNNXBMFYSA-N 408.405 2.000 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1 769540254 IUWBSAJZJIJWOX-UHFFFAOYSA-N 418.393 2.014 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc([S@](C)=O)c3)CC2)cc(OC)c1OC 770251996 LMTNDHKFCSSRBF-LJAQVGFWSA-N 418.515 2.412 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cc(C)nc(O)c4)n3)CC2)cc1 771054502 BEISALRPTDUFRX-UHFFFAOYSA-N 409.446 2.046 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(Cc2ccccn2)CC1 771769094 OSCANBVJANJDGY-UHFFFAOYSA-N 413.497 2.085 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nc(Cl)sc3=O)cc2F)C[C@H](C)O1 772247082 SDPCCTSWLPMJBP-QWRGUYRKSA-N 414.890 2.027 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)N2CCCC2)c1 775087906 WTJYMQVDQJRCGS-QFIPXVFZSA-N 424.545 2.331 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N(C2CCCCC2)[C@H]2CCS(=O)(=O)C2)c1 775372734 HLKOGFTUFJMVNC-RDJZCZTQSA-N 424.563 2.400 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cccc(C)c3O)CC2)c1 775645991 DIKPCYOPULSNSI-UHFFFAOYSA-N 410.517 2.055 10 20 HECD C[C@@H]1C[C@@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCO1 776306258 NBRGXQVBIHJANR-AEFFLSMTSA-N 413.497 2.374 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1 779513252 GCGVIZRHJWGZDH-GQSKFBFOSA-N 420.462 2.220 10 20 HECD COc1ncc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)cc1C(N)=O 784059609 POVWLKWSSCWNKN-UHFFFAOYSA-N 411.462 2.076 10 20 HECD C[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)c1nnc2n1CCCCC2 786055003 HTZMWCPYEZNDKY-MRXNPFEDSA-N 424.549 2.439 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C(C)(C)NC(=O)OC(C)(C)C)cc2)CC1 787320031 QUBSIKWEOOWBLK-UHFFFAOYSA-N 418.538 2.275 10 20 HECD COC(=O)c1cccc(NC(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)n1 787635470 ZYRFPLRDJZVYRI-UHFFFAOYSA-N 408.414 2.466 10 20 HECD Cc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 788165549 YGHSPCHGXWQMJC-UHFFFAOYSA-N 418.444 2.393 10 20 HECD CSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789826277 PISGJBAKKMRDSG-KKUMJFAQSA-N 411.543 2.313 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@]2(CCCOC2)O1 797432515 GZARKDLOXRZANQ-OPAMFIHVSA-N 421.513 2.266 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(-c4nnc(N)o4)cc3)CC2)cc1 798219460 IZEGCWCHEYDWJU-UHFFFAOYSA-N 409.446 2.055 10 20 HECD CN1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H](c2ccccc2)C1 803688723 ZUKPSDCZZJQOIJ-JOCHJYFZSA-N 406.530 2.201 10 20 HECD C[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)CN1CCOCC1 804022557 VXASLKCWJRETAT-SFHVURJKSA-N 417.550 2.138 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](N4CCCC4)[C@H]3C)CC2)cc1 806620539 ZAGHXLBGCSBSLS-KNQAVFIVSA-N 415.582 2.085 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1 807095172 AHSMRFZVOBFROY-UHFFFAOYSA-N 422.529 2.098 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)[C@@H]1CCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807672290 XMIXOMGXUBEMBC-OXQOHEQNSA-N 408.502 2.194 10 20 HECD O=S(=O)(NC[C@H]1CCCN(Cc2cccc(Br)c2O)C1)C1CC1 809785384 VSEYDHBEKHQSBE-GFCCVEGCSA-N 403.342 2.449 10 20 HECD O=C(CNC(=O)NCc1cc(Cl)cc(Cl)c1O)NCCN1CCCCCC1 814423914 ZMVCDEXDBDFAOV-UHFFFAOYSA-N 417.337 2.490 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C(=O)C2CC2)CC1 914536999 ZHTJOVVKSGKRKC-UHFFFAOYSA-N 400.523 2.066 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 916233611 DMRULZFHOAEOBH-QFIPXVFZSA-N 421.545 2.341 10 20 HECD O=C(Nc1ccccc1-n1cncn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918294049 CAOJLSMKIAQUIW-KRWDZBQOSA-N 421.457 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4cncn4c3C)CC2)cc1 1116581345 PXBRBNIEHRRUEW-UHFFFAOYSA-N 408.458 2.157 10 20 HECD C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[C@@H]1N1CCN(C)CC1 1319827982 BOLHSFDHXJRPFJ-KNQAVFIVSA-N 403.590 2.035 10 20 HECD C/C=C(/C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1790812125 IOBACAPNSDDERJ-ODCKRZMPSA-N 408.882 2.311 10 20 HECD CO[C@H](C)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792316088 OIMBXYLHPZMRDR-GFCCVEGCSA-N 421.544 2.016 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccns1)C1=NN(c2ccccc2)C(=O)C1 1794872085 IPLHGJULPHSHNV-RBVVOMGSSA-N 423.498 2.188 10 20 HECD CCOCCN(CC)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 730809097 XYECOKQERJZWQY-UHFFFAOYSA-N 407.536 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3n[nH]c(-c4ccccn4)n3)CC2)cc1 735234633 OYUXYRSUSRFZRI-UHFFFAOYSA-N 410.503 2.316 10 20 HECD COC(=O)N(C)CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754951 SGWJHFLANUVTEF-INIZCTEOSA-N 408.499 2.133 10 20 HECD CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)N1CCC(C(N)=O)CC1 743873042 HFGLCNJBCDZTOK-GFCCVEGCSA-N 412.328 2.089 10 20 HECD C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 745779597 PAIIAISZLPPZIC-RXVVDRJESA-N 404.555 2.336 10 20 HECD CN(C)c1ccc(CNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1F 746718603 KIBLJCBZFKNLJO-UHFFFAOYSA-N 419.501 2.336 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)N3CC(=O)Nc4ccccc43)cs2)cc1 751936536 JLNZUWCFWGPNHI-UHFFFAOYSA-N 422.466 2.458 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 753154072 LBKNAQVGQGGWIX-WRONEBCDSA-N 413.547 2.294 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@]3(C)CCCO)CC2)cc1 755732141 XFPMTZNVMQPTRB-DJYGDJEFSA-N 415.534 2.054 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCCOc3ccc(C)cc3C)CC2)cc1 758186169 PJORWPXCDVDTDA-JOCHJYFZSA-N 413.562 2.464 10 20 HECD COC(=O)C[C@H](C)C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 759003435 DSDDFADQOLNIPS-LBPRGKRZSA-N 409.394 2.143 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)C3=CCN(C)CC3)CC2)cc(OC)c1OC 759298985 PKOBDOWXTQWXPU-INIZCTEOSA-N 418.538 2.194 10 20 HECD CCOCCCN1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H](C)C1 765976824 AZHXAQWUGADPQX-UGKGYDQZSA-N 423.623 2.148 10 20 HECD COc1cccc(CC(=O)N2CCN(Cc3cc(OC)c(OC)cc3O)CC2)c1 768439756 JJTHZXWGDUDKBK-UHFFFAOYSA-N 400.475 2.305 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc4c(c3)COC4)CC2)cc1 770000252 RTOZQXUKSPHSPP-UHFFFAOYSA-N 410.518 2.347 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc(N(C)C)cc1 773847872 UKZMSGYWKIAGIP-AWEZNQCLSA-N 419.489 2.422 10 20 HECD COc1ccc(N2CCN(C[C@@](C)(O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1F 777598500 PFTRIORLGMIBQS-OAQYLSRUSA-N 422.522 2.268 10 20 HECD C[C@H](C1CC1)n1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 778544245 XQGJGMCGGKIHCB-MRXNPFEDSA-N 411.506 2.288 10 20 HECD COc1cccc(CNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)c1O 778915861 WPXOVFLIAZKDHO-UHFFFAOYSA-N 408.401 2.276 10 20 HECD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1 779473150 IZLVSHGQYBZHHR-SOFGYWHQSA-N 416.499 2.261 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(F)cc1F 785294397 MJPJGIOMQGUNIF-SECBINFHSA-N 407.373 2.020 10 20 HECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)nn1 786556643 PPSOGTXSWRKXRO-UHFFFAOYSA-N 410.430 2.207 10 20 HECD COCc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 787503170 GLFVSHJUXGWQAM-UHFFFAOYSA-N 413.543 2.319 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccnc3)cc2F)C[C@H](C)O1 789828629 XSFWBMPURUGOKB-HOTGVXAUSA-N 414.481 2.109 10 20 HECD C[C@H]1[C@H](C)C[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844398 HAZXPBXRPKMQAB-OAGGEKHMSA-N 405.514 2.296 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccccc1F 793827015 MPBHJYXCWIWBLG-UHFFFAOYSA-N 412.509 2.467 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 807098441 WIHSFSBECWVCAU-KRWDZBQOSA-N 416.566 2.078 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807676056 CGTKDAHBXVALNZ-UWJYYQICSA-N 422.529 2.189 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc(N(C)C)cc1 807677555 QEXKYEBALNVTCF-JKSUJKDBSA-N 406.490 2.388 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1O 809680044 OTVJGUMTRUMJFO-UHFFFAOYSA-N 420.447 2.392 10 20 HECD CN(C)CCN1CCC(NC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 916382516 GWWXXWSKVYJKCP-UHFFFAOYSA-N 405.612 2.065 10 20 HECD COc1ccc(SCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918334464 GWNNKDGWGSQLLG-UHFFFAOYSA-N 420.556 2.339 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 920870314 QBVRTVREFRNCKM-ZDUSSCGKSA-N 407.448 2.177 10 20 HECD CN(C)CCNC(=O)c1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1 1351757707 TYVIPQYUOCVMHM-UHFFFAOYSA-N 413.541 2.481 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cnc2ccoc2c1 1796600436 IWYHBAJUVXFMRS-QDMKHBRRSA-N 408.414 2.200 10 20 HECD Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1805006931 FEZTVFUDCSQTQV-FOIQADDNSA-N 421.457 2.158 10 20 HECD Cn1ccc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)c21 1843249550 XJFRZTWVWYCETE-UHFFFAOYSA-N 406.442 2.115 10 20 HECD CC(C)(CNC(=O)CN(Cc1ccco1)Cc1ccccc1O)N1CCOCC1 96970909 WXYGICRKBPLSAC-UHFFFAOYSA-N 401.507 2.214 10 20 HECD C[C@H](NC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1)c1ccc(N2CCOCC2)cc1 725907095 PMRQWAVZRQNYSZ-ZDUSSCGKSA-N 423.922 2.315 10 20 HECD C[C@@H]1CN(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 726713950 WWCLFQVKYQBEHM-OAHLLOKOSA-N 412.481 2.277 10 20 HECD Cc1[nH]c2ccnn2c(=O)c1CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 729352562 RJJAYPQEMPGEKH-LJQANCHMSA-N 423.517 2.147 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H](O)COc1ccc(F)c(F)c1 729599555 HSMPPMYOKIXHGL-QGZVFWFLSA-N 421.444 2.041 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCCN(S(C)(=O)=O)CC3)cc2)CC1 731048995 VKKPJJYADNLQEA-UHFFFAOYSA-N 408.568 2.100 10 20 HECD Cc1nc2ccccn2c1[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N(C)C)c(F)c1 731543370 JLPQVYFSWWHUNA-FQEVSTJZSA-N 424.480 2.231 10 20 HECD COC(=O)CN(CC(=O)NCc1ccccc1OC)Cc1cc(Cl)ccc1O 731844542 FLGSMLDMUORNMF-UHFFFAOYSA-N 406.866 2.346 10 20 HECD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)c2cc(O)cs2)cc1 731912289 UHEXONUDARAJNP-LLVKDONJSA-N 412.489 2.324 10 20 HECD CNS(=O)(=O)C1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)CC1 732206385 XEVFVRVTNSASLK-UHFFFAOYSA-N 407.511 2.430 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 735393449 MKLSIVZBKVAIOS-UHFFFAOYSA-N 402.426 2.003 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(Br)c[nH]3)CC2)cc1 742927119 JEBZUUBNFGGPFN-UHFFFAOYSA-N 407.312 2.338 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC2(C1)OCCO2 745605209 BMWWJLZQKWGPCF-UHFFFAOYSA-N 415.412 2.200 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 745863110 RAIMKVRNNJGDRU-FPOVZHCZSA-N 418.582 2.356 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4ncccc4c3)cc2)C1 747251441 TWNKENCJIZXPKH-SFHVURJKSA-N 424.526 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3ccc([S@](C)=O)cc3)CC2)cc1 749811270 OJJXNXHWXUASKN-LJAQVGFWSA-N 415.559 2.213 10 20 HECD C[C@H]1C(=O)Nc2cc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)ccc2N1C 750572398 FLDNEMMRKHUUCX-HNNXBMFYSA-N 424.501 2.345 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N(C)C)c(C)c3)CC2)cc1F 754212544 KRXXICXEYFDVDS-UHFFFAOYSA-N 414.481 2.496 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C3=Cc4cc(OC)ccc4OC3)CC2)cc1 755248166 MAMLJBZCBTYFII-UHFFFAOYSA-N 423.513 2.418 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 755308600 NKSQIRLZLMPQOT-GOSISDBHSA-N 413.497 2.478 10 20 HECD CCO[C@@H]1COCC[C@H]1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 759221485 RQDOBSZPYXGGSW-BAAGSCJXSA-N 409.502 2.433 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1 762264064 PEBZETJWQZBMLD-UHFFFAOYSA-N 417.421 2.475 10 20 HECD O=C(COC(=O)[C@@H]1C[C@@]12CCOC2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764640436 QKGKDSCAVYRTTN-FDDCHVKYSA-N 405.406 2.370 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)Nc1ccc(F)nc1 769026534 WMHVJUZZGMVQGE-UHFFFAOYSA-N 411.481 2.008 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCC[C@@H]1c1ccncc1 769443264 ZFIHGKBQKOTYNN-HXUWFJFHSA-N 414.531 2.363 10 20 HECD COCCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 773245615 YWHWABGXWLIGIP-HOTGVXAUSA-N 422.497 2.415 10 20 HECD CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362210 LPNQANFYJYSPNK-GDLZYMKVSA-N 418.515 2.442 10 20 HECD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2ccc(O)c(O)c2)c(OC)c1 778924697 DZLALFSQOGMWIK-MRXNPFEDSA-N 400.431 2.036 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)/C=C\c1ccc(O)c(O)c1 779520067 OFRMBZMAKOLZJU-POHAHGRESA-N 406.460 2.399 10 20 HECD CC(C)c1nc([C@@H]2COCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)no1 779633823 WTZTVMDUKWOVPR-SFHVURJKSA-N 401.511 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cc4c(cc3C)OCO4)CC2)cc1F 781536648 UFJSGNUMDNXOFU-UHFFFAOYSA-N 415.421 2.159 10 20 HECD O=C(OC[C@H]1CCCO1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398195 NDGOGNCVACTCGW-CQSZACIVSA-N 422.415 2.437 10 20 HECD CCn1c(CNC(=O)C(=O)NCCCSc2nccs2)nc2ccccc21 785464590 NNHLPHPCTONJCO-UHFFFAOYSA-N 403.533 2.428 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccccc1S(C)(=O)=O 785755718 TUIKZCKSDVTGJW-UHFFFAOYSA-N 402.516 2.128 10 20 HECD CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321322 UVNWJBDECDOHNP-DBVUQKKJSA-N 417.550 2.095 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(N2CCOC2=O)c1 789560006 KMCVUIDQXPDRSI-UHFFFAOYSA-N 420.516 2.015 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC[C@H](C)C3)cc2F)C[C@@H](C)O1 789818762 KUZDZNJSDQBHJN-OAGGEKHMSA-N 423.554 2.267 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3COCCN3C3CCCC3)cc2F)CC1 793455352 CQPLNKZYCRUQEM-QFIPXVFZSA-N 418.557 2.227 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1 793915740 QVWDDBJEADYJDR-UHFFFAOYSA-N 409.465 2.318 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3cc(C)cnc23)cc1 797432680 NSOCGLYLNLRHBW-UHFFFAOYSA-N 406.489 2.220 10 20 HECD COc1cc(Cl)cc(CNCCNS(=O)(=O)c2ccc(F)cc2F)c1O 799736031 GHTNISAHDAKLDQ-UHFFFAOYSA-N 406.838 2.401 10 20 HECD CC(C)[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCS1 803299800 NWBXOYFURGJKHA-VQIMIIECSA-N 405.564 2.300 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)cc1 804318201 CTBDVVWVFUYJAD-SFHVURJKSA-N 403.523 2.243 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H](Oc2ncccc2F)C1 807290456 KERNWLDDRPHMJV-IBGZPJMESA-N 424.476 2.283 10 20 HECD CC(C)C[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCO1 808076087 MHQZPYCRYQDZLU-CTNGQTDRSA-N 417.550 2.192 10 20 HECD CCN1CCN(C(=O)[C@@H](C)OC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 916596378 JNPBBUGHQQJKTF-OAHLLOKOSA-N 420.465 2.171 10 20 HECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 918117963 LHGGRVSHFYNFHK-RBBKRZOGSA-N 423.561 2.490 10 20 HECD CC(C)(C)C(=O)N1CCC(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918204359 ZXGWWOFNOWADKB-UHFFFAOYSA-N 420.529 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)(C)C)n[nH]3)CC2)cc1 919321213 SIVRADQVTOXVPC-UHFFFAOYSA-N 400.479 2.221 10 20 HECD COCc1ccccc1CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 920254757 OBOVVSHYVLUHAD-VAWYXSNFSA-N 423.513 2.363 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(F)(F)c1ccc(F)cc1 920854866 SNCYNGNAFCXCGR-UHFFFAOYSA-N 412.433 2.469 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1C[C@@H]1C1CC1 1792851528 CSYZLMBKVHMVMP-KQVLKZGSSA-N 420.893 2.001 10 20 HECD CC(C)(C)n1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)n1 1794739292 LMFBFEXXOUZOFA-QDMKHBRRSA-N 413.478 2.010 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)[nH]1)c1cc(O)nc(O)c1 1798663514 CXRHPEOFWMWNSM-ZSBIGDGJSA-N 424.379 2.405 10 20 HECD O=C(c1cccs1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038869 DQDQZDSWDSPBFP-FNORWQNLSA-N 400.456 2.395 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)CNC2=NS(=O)(=O)c3ccccc32)cc1 9932355 MPKZITVBDGPVJE-UHFFFAOYSA-N 414.531 2.230 10 20 HECD Cc1nc2ncnn2c(C)c1CCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 145545104 NJCOHIUJQFAIJZ-HNNXBMFYSA-N 408.506 2.388 10 20 HECD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)N1CCOc2cc(N(C)C)ccc21 475938302 JPPGLDIRHDCFMI-IBGZPJMESA-N 410.453 2.396 10 20 HECD CCOCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 726722543 ZBHAANGEANGFIR-UHFFFAOYSA-N 415.465 2.454 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](c4ccccc4F)C3)nc12 727435774 SUPBKILRBIZVHD-KRWDZBQOSA-N 400.410 2.324 10 20 HECD CCCN(CC(=O)NN1C(=O)N[C@@](CC)(c2ccccc2)C1=O)Cc1ccccc1O 727831356 XHMCCYSQWONYJI-QHCPKHFHSA-N 424.501 2.493 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729502511 ANEWPLJHHHELRB-PKOBYXMFSA-N 424.492 2.419 10 20 HECD CCN1CCCC[C@H]1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 732250921 MGPZCJISMFDMFA-QUCCMNQESA-N 401.555 2.062 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1O 737277937 ARHDMRXWIZMQEC-UHFFFAOYSA-N 416.434 2.398 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCS(=O)(=O)C1 745446722 NSCRXIVVCOUDPI-LLVKDONJSA-N 405.314 2.121 10 20 HECD C[C@H](O)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 747615872 ANZNHTGBUWNBMR-STQMWFEESA-N 410.517 2.488 10 20 HECD CCCNC(=O)[C@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 747798301 NAISAEWFBALNHL-SFHVURJKSA-N 417.550 2.165 10 20 HECD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 748636124 RAALIDUETJVAJT-IMJJTQAJSA-N 408.449 2.319 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCN(c2ccccn2)C1 753126644 JJWIXHVNPFDTNQ-HXUWFJFHSA-N 409.534 2.368 10 20 HECD Cc1cc(F)c(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1F 762606902 FZKRLIREUQXKSZ-UHFFFAOYSA-N 416.471 2.309 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)cc1 763655463 RFICOHPVLYCFQN-UHFFFAOYSA-N 414.531 2.360 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCc2cccc(F)c21 768203664 WHWULOCPOUIMCK-UHFFFAOYSA-N 403.479 2.333 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1Cl 768496955 GEHGMKYTNDYPHR-UHFFFAOYSA-N 422.843 2.350 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)c3cccc(O)c3)cc2F)C[C@H](C)O1 769688217 IMXZBZAYBSVARV-GJZGRUSLSA-N 415.465 2.191 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cn3)cc2F)C[C@@H](C)O1 772926272 ABRQLXJHXFCHTA-CHWSQXEVSA-N 404.417 2.228 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(C(F)(F)F)n[nH]3)CC2)cc1 773726960 JUJSNVGARWGRFM-UHFFFAOYSA-N 411.428 2.379 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc(N(C)C)cc1 773844863 CZNOPTBEVNXTKL-HNNXBMFYSA-N 422.485 2.218 10 20 HECD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NCc1ccc2c(c1)CCCN2C 775199524 AJHFWEWHTXPXGD-UHFFFAOYSA-N 402.520 2.024 10 20 HECD C[C@H](NCC(=O)NC[C@@H]1COc2ccccc2O1)c1ccc(N2CCOCC2)cc1 775255463 QZTCJJNYFAQKAX-FXAWDEMLSA-N 411.502 2.130 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCC(=O)N[C@@H](C)c2ccc(F)cc2)c1 775373179 OTUISUOZBIRFSQ-KBPBESRZSA-N 403.454 2.184 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)c(OC)c1 782113810 FKXGFJIKBAUGCS-UHFFFAOYSA-N 409.489 2.175 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3N)cc2F)C[C@@H](C)O1 782166391 GIQICOAITQEAMS-TXEJJXNPSA-N 403.414 2.255 10 20 HECD COC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)CC1 783083307 LCXITBAVWRNTSC-UHFFFAOYSA-N 409.435 2.240 10 20 HECD O=C1CN(S(=O)(=O)c2cccc3nonc23)c2cc(Br)ccc2N1 784037908 FUDZTKZIEJMTBA-UHFFFAOYSA-N 409.221 2.133 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC([C@@H]4CCCO4)CC3)CC2)cc1 784361108 FQLWSXAJEKDTTQ-GMAHTHKFSA-N 403.567 2.069 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C3=NO[C@H](c4ccccc4)C3)cc2)CC1 786660758 ISBHSIBFRSIILT-QFIPXVFZSA-N 406.486 2.489 10 20 HECD COc1ccc(F)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1OC 788437082 PLBJPHAHVWAAEX-UHFFFAOYSA-N 408.451 2.330 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(OCC(C)C)cc2)ccc1O 790408139 UBKYCPGWIHCGDS-UHFFFAOYSA-N 414.505 2.136 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(-c3coc(C)n3)cc2)cc1 797431232 KFRKBBXVDNLRJW-UHFFFAOYSA-N 422.488 2.327 10 20 HECD COc1ccc(COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)nn1 801322850 UPHFMFXNOWIGMB-UHFFFAOYSA-N 421.456 2.410 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccnc(SC)c3)CC2)cc1 804317673 MCGJEXMXJZLXRI-UHFFFAOYSA-N 414.531 2.214 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@@H](C(=O)N(C)C)C1 806177640 FAMSDPQUTFSYRI-RTBURBONSA-N 416.566 2.253 10 20 HECD Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(N2CCCC2)n1 807291536 YCOUOCRQHMZUSK-UHFFFAOYSA-N 419.529 2.299 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCN(Cc2cccc(F)c2)CC1)c1ccc(N(C)C)cc1 807670516 GBMPTXUHELRRGM-QGZVFWFLSA-N 412.509 2.413 10 20 HECD COc1ccc(CNS(=O)(=O)c2cc(Cl)c(NC(C)=O)cc2OC)c(O)c1 808311554 JSNVIDXCZDPPMJ-UHFFFAOYSA-N 414.867 2.500 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(=O)N3CCCCC3)cc2F)C[C@@H](C)O1 918213086 NMCXOMOTEVGZMT-HZPDHXFCSA-N 406.502 2.251 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(-n2cccn2)cc1 918308576 MMYRSLAKHJIWDA-UHFFFAOYSA-N 419.485 2.306 10 20 HECD C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1)n1cccn1 918444747 WAGWEXZJOJQEQS-OAHLLOKOSA-N 421.457 2.386 10 20 HECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(C)c(O)c1O 1116514442 GOYMKHSLZHRUSB-AWEZNQCLSA-N 408.451 2.031 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1 1259344033 VJELCSWQACBHAZ-UHFFFAOYSA-N 404.488 2.367 10 20 HECD C[C@@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 1343430332 VYEPXHRUARUWBP-GOSISDBHSA-N 416.566 2.343 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1781071902 LOWZRYBLYKAKFT-TVNIXMEMSA-N 408.882 2.241 10 20 HECD C[C@]1(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)CC1(F)F 1843442900 BPAMJCCIVWWYAR-LJQANCHMSA-N 416.428 2.028 10 20 HECD Cc1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1843558019 MWHIINCAJGHSCZ-GQCTYLIASA-N 409.442 2.037 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1F 303668686 OOUBWAJHIRMJOD-UHFFFAOYSA-N 405.495 2.436 10 20 HECD Cc1cc(C)n2nc(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)nc2n1 725855465 VWGSEIIJBISXJI-UHFFFAOYSA-N 413.457 2.163 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)COCC(=O)NCc1cccnc1 727752709 AMFJFWLXQYKZRN-UHFFFAOYSA-N 410.518 2.363 10 20 HECD Nc1c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(F)cc1[N+](=O)[O-] 728206929 AVCBTWSXDLGOLU-UHFFFAOYSA-N 406.389 2.346 10 20 HECD CNC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 732207612 ZTKZHMSHWNDGBA-HUUCEWRRSA-N 419.481 2.247 10 20 HECD CN(C)c1ccc(CNCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F 733322913 GJHNUQXOGDQJDL-UHFFFAOYSA-N 407.511 2.202 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccsc1 741080693 DMUBKFFLDOPJPK-KKSFZXQISA-N 416.547 2.157 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1Cl 741096752 FUKZMSKJDSHYFQ-UHFFFAOYSA-N 412.877 2.331 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(CCS(C)(=O)=O)CC1 745813107 XVYIFQUYIZBEHP-UHFFFAOYSA-N 424.611 2.182 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCOCC1 746413782 JKNFAMKMYNVJJF-UYAOXDASSA-N 402.539 2.393 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(O)n1 755190877 CIWNKRMUIPRMBO-ZIAGYGMSSA-N 416.453 2.103 10 20 HECD CN(C)Cc1ccsc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756095441 CXHSCEFYRLDLQZ-QGZVFWFLSA-N 400.548 2.441 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCN(CC(F)F)CC1 766764496 NKZNXEAIPYLAMN-UHFFFAOYSA-N 414.472 2.269 10 20 HECD NC(=O)[C@H]1CCCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769958449 QMUQIKCHRYOLEU-JSGCOSHPSA-N 423.516 2.028 10 20 HECD C[C@]1(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)CCOC1 770115682 ILDCRJHAOBCILY-SFHVURJKSA-N 421.431 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCC(=O)[C@H](C)C4)n3)CC2)cc1 771055670 IVGIBPCYKWJWQH-HZPDHXFCSA-N 412.490 2.442 10 20 HECD O=C(CCNC(=O)c1cc(F)ccc1Br)NCc1ccc(O)c(O)c1 771814861 KNFBDWJTVJKBRQ-UHFFFAOYSA-N 411.227 2.436 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](CC(C)C)c2nc(-c3nc[nH]n3)no2)c1O 775048278 QFEHMMTXUCHNII-NSHDSACASA-N 403.399 2.354 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4ccc5c(c4)OCO5)CC3)cc2)CC1 775648023 MUIVHLYWPHMAJI-UHFFFAOYSA-N 422.529 2.125 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](n2cncn2)C1 776879535 SUUVWHXNJKLPPC-GDBMZVCRSA-N 415.453 2.328 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CC(=O)N(C2CCCC2)C1 777826102 HJXWTRRLSJQHMJ-AWEZNQCLSA-N 408.882 2.338 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC(c4cn[nH]c4)CC3)CC2)cc1 778285919 QUNCZGHNLGWEJL-VOTSOKGWSA-N 423.517 2.029 10 20 HECD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779498886 GJXCGVDGQBGVOU-VFADXPBXSA-N 413.449 2.422 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 785294034 JZDNCINPXGRUMU-GFRLJBLXSA-N 424.906 2.316 10 20 HECD COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786257822 UKIBXEFETLAPAE-UHFFFAOYSA-N 412.446 2.202 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 788913224 VXROLXDCQCSDEH-DENIHFKCSA-N 410.562 2.378 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCN1CC(F)F 788933272 UHKNYTPIAKZCQX-KRWDZBQOSA-N 408.493 2.091 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](C3(C)OCCO3)C2)cc1 788938121 BAIQWKCVZJVOIH-GOSISDBHSA-N 403.523 2.151 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789825469 LWIYZYUBEYKURW-RVKKMQEKSA-N 403.498 2.314 10 20 HECD O=C(NCCC[C@H]1CCCCO1)C(=O)NCc1ccc(N2CCSCC2)cc1 789855064 IENUFKQSOHXWPB-LJQANCHMSA-N 405.564 2.322 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)[C@H](C)C1 789861729 RMBLBRWSBFWZBO-XLIONFOSSA-N 418.607 2.045 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCN(C)C3CC3)cc2Cl)C1 793936081 HUIVJYVPMPSOHU-OAHLLOKOSA-N 406.958 2.403 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCc3ccccc3[N+](=O)[O-])CC2)cc1 796113064 GOALEYPJVKHIEV-UHFFFAOYSA-N 412.490 2.427 10 20 HECD COc1ccccc1CCNC(=O)CNCc1ccc(N2CCOCC2)c(F)c1 797883044 MZBAMPILFBLNHQ-UHFFFAOYSA-N 401.482 2.119 10 20 HECD Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)nnn1CCOc1ccc(F)cc1 800326272 HSFKDTDZOKASQC-UHFFFAOYSA-N 415.377 2.256 10 20 HECD CC(C)[C@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803300102 PLBZSIOWWLHMEM-ILZDJORESA-N 403.523 2.020 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)ccc21 803688473 ZJNQYSAPKOZETB-UHFFFAOYSA-N 418.538 2.105 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](CN(C)S(C)(=O)=O)C2)cc1 804967200 KNBKGTPVMIOZLE-GOSISDBHSA-N 410.584 2.346 10 20 HECD COc1ccc(C[C@@H](CO)CNCc2ccc(N3CCOCC3)c(F)c2)cc1O 809749220 LJQBZWTVNMZKDR-GOSISDBHSA-N 404.482 2.317 10 20 HECD CN(C)[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cncn1C 857456518 OLWIZTAKCVXBJT-KSSFIOAISA-N 407.465 2.409 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 918246518 QIMQLTUAGHWZNH-IYBDPMFKSA-N 411.506 2.016 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc(F)cc1F 918440928 UUZMOXBJGHSCGV-UHFFFAOYSA-N 407.392 2.320 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC)cc3OC)CC2)cc1 918462064 PSOLCECDIWVXGS-UHFFFAOYSA-N 413.474 2.390 10 20 HECD CC(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 919792341 XVGDCFOTLNHHRC-UHFFFAOYSA-N 402.539 2.217 10 20 HECD CCOc1ccccc1N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 919806634 MUTOVXCSXCSPLH-UHFFFAOYSA-N 419.503 2.125 10 20 HECD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCCC[C@H]1C 920636514 WMXJUFZQCHXHED-DYVFJYSZSA-N 412.508 2.346 10 20 HECD COCCCN(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 921198707 CYYALHGTAWRVLH-UHFFFAOYSA-N 416.501 2.120 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(-n4ccc(C)n4)c3)nc12 1115907440 SKOKCQZCDQRGHF-UHFFFAOYSA-N 421.413 2.463 10 20 HECD CN1CCN(c2ccc(CN[C@@H](CS(C)(=O)=O)c3ccccc3)cc2F)CC1 1342635968 LXWRAOUFNPCKCY-FQEVSTJZSA-N 405.539 2.453 10 20 HECD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1)n1cncn1 1788429653 RLYPJVISKAOMJW-CYBMUJFWSA-N 422.445 2.093 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cccnn3)cc2)CCC1)c1cc(O)nc(O)c1 1789723141 VCKFUOSOEIQRRC-UHFFFAOYSA-N 405.414 2.344 10 20 HECD Cc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285892 YGYQPHAEFZOZAP-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)CC2)c1cc(O)nc(O)c1 1816720267 ILNGZCAHICMKEB-AGIUHOORSA-N 414.487 2.221 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1)CC2)c1cc(O)nc(O)c1 1816728793 VHXINTDFFZYPBY-CMPLNLGQSA-N 420.516 2.071 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CC[C@H](C(=O)N(C)C)O3)ccc21 537128012 PUIUEVUAKFLKMK-YLJYHZDGSA-N 401.507 2.270 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1 726561414 UQRIEAUALFHBSF-UHFFFAOYSA-N 403.504 2.466 10 20 HECD O=C1CC[C@@]2(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)SCCN12 726564584 NQVFTGRZURAPTL-IBGZPJMESA-N 411.474 2.439 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726725771 GYTHTSBZYAEXGR-UHFFFAOYSA-N 411.458 2.206 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N(C)C)C3)cc2F)C[C@@H](C)O1 732205319 OJPIMTWNHMHWSG-ZIFCJYIRSA-N 406.546 2.082 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 733351467 FXIXQBUYCSXTLA-PMACEKPBSA-N 415.582 2.452 10 20 HECD COCC[S@@](=O)Cc1cccc(NS(=O)(=O)c2cccc3nsnc23)c1 735027861 MBAIMEZGYFHACC-RUZDIDTESA-N 411.530 2.387 10 20 HECD CSC[C@@H](CCO)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 741078607 LTVAYLCDHXOHNE-CQSZACIVSA-N 421.485 2.455 10 20 HECD C[C@@H]1C[C@@H](NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c2c(O)ccc(F)c21 756740668 SJJUVCMXZKCQCO-MLGOLLRUSA-N 408.499 2.256 10 20 HECD COC(=O)C(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 757438282 PIWCBZMNWBVKRK-UHFFFAOYSA-N 412.489 2.184 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc(C)ccc3[N+](=O)[O-])CC2)cc1 758226733 ZGQANYTVODVFAG-GOSISDBHSA-N 401.463 2.474 10 20 HECD CC(=O)Nc1ccccc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 766431202 DZYOCVNKOZMIOS-IBGZPJMESA-N 408.502 2.206 10 20 HECD Cc1n[nH]c(C)c1[C@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 773545850 XHKZOLPXOVHMFV-HXUWFJFHSA-N 415.513 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCOc3ccccc3)CC2)cc1 778225735 NWHPEQATCIDNKU-OUKQBFOZSA-N 423.513 2.437 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC([C@H]4CCCO4)CC3)CC2)cc1 784078672 VVBQWONIKWETLA-JOCHJYFZSA-N 416.566 2.418 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(-c4cnn(C)c4)nn3)CC2)cc1F 788791219 WTFMHEQOBPVLFJ-UHFFFAOYSA-N 411.441 2.379 10 20 HECD CC(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 788882989 GLADWSKPNQZIIU-UHFFFAOYSA-N 415.469 2.140 10 20 HECD CCCC[C@H](COC)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823014 CEUIHUOLCRQGEW-JFIYKMOQSA-N 423.529 2.377 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795397324 PQHFZBMHQXSBRS-NVXWUHKLSA-N 418.538 2.165 10 20 HECD CCOC[C@H](C(=O)O)N(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 797710487 ZRYWOMCONRNRKW-HBUWYVDXSA-N 411.474 2.070 10 20 HECD CCc1cc(CN(CCN2CCN(C)CC2)CC(=O)OC)c(O)c(C(C)(C)C)c1 799144418 APEHYIUGLXQFPP-UHFFFAOYSA-N 405.583 2.475 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(-n2ccnn2)cc1 803688927 FZHTWQWXLGGYHE-MRXNPFEDSA-N 418.501 2.143 10 20 HECD CN1CCCc2cc(CNC(=O)NC[C@H](N3CCOCC3)C(F)(F)F)ccc21 805849092 ZOLRAPXQIOZOIZ-KRWDZBQOSA-N 400.445 2.131 10 20 HECD CO[C@H](CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 807768155 DBWPGHOSFSMHME-RHSMWYFYSA-N 413.465 2.160 10 20 HECD Cc1csc2ncn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(=O)c12 809985747 QUAGQAFOFBEWCO-UHFFFAOYSA-N 416.478 2.059 10 20 HECD CN1CCC(ONC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 816533457 XGQDUEHCSHMJTR-UHFFFAOYSA-N 411.505 2.010 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 915082358 CTBMNACJDHBRGB-INIZCTEOSA-N 417.531 2.279 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)CN3CCCCC3)CC2)cc1 916196417 FHSVMEKLRUZDMZ-HXUWFJFHSA-N 417.598 2.381 10 20 HECD CSCC[C@H](NC(=O)c1ccccc1)C(=O)OCC(=O)c1ccc(O)c(O)c1 916590448 BGCDAYREXRHUJY-HNNXBMFYSA-N 403.456 2.375 10 20 HECD Cc1cc(C(=O)NCCS(=O)(=O)NCc2ccccc2)c(C)n1-c1ccccn1 917179577 PDSOQVIQHRCAKB-UHFFFAOYSA-N 412.515 2.339 10 20 HECD Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807993781 LPBXAMGNLZNSAL-YWZLYKJASA-N 421.457 2.158 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2)[nH]n1)c1cc(O)nc(O)c1 1817844358 YPXSHGWRYYOYHE-HNNXBMFYSA-N 408.418 2.231 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C23CC(c4ccccc4)(C2)C3)C1 1847136911 LXFATGULDOPTPJ-UHFFFAOYSA-N 419.481 2.432 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCN(CC4CC4)C3)cc2F)CC1 731120555 DCVCQOOZAMKKOI-IBGZPJMESA-N 403.546 2.251 10 20 HECD CN(CCN1CCN(c2ccccc2)CC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 738340594 MMYQABWSWRMTPQ-UHFFFAOYSA-N 423.605 2.465 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc2c(c1)CCO2 738895400 KBGCBHDEQUQINF-UHFFFAOYSA-N 401.488 2.178 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(-n2cncn2)c(F)c1 743957880 FFTAVWZIJZTXEI-UHFFFAOYSA-N 409.421 2.246 10 20 HECD NC(=O)COc1cccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 745898761 AZCNZACZYQSCPD-IBGZPJMESA-N 413.474 2.147 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccc2c(c1)NC(=O)CCN2C 749377229 YYWRGOOHUQSQMS-UHFFFAOYSA-N 424.501 2.346 10 20 HECD CN1CCN(c2ccc(CNC3CCN(S(=O)(=O)C(C)(C)C)CC3)cc2)CC1 755220006 NWJZEPYHLZGDOA-UHFFFAOYSA-N 408.612 2.121 10 20 HECD CCOc1cc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1[N+](=O)[O-] 755531509 SLTJSPBQSIXFQJ-UHFFFAOYSA-N 410.404 2.428 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCO[C@@H](C)C3)CC2)cc(OC)c1OC 759296844 GATPXSOECYGHFG-JKSUJKDBSA-N 407.511 2.359 10 20 HECD Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 759595773 LYIOSFRGRQUCOT-WWRUEGTHSA-N 412.442 2.414 10 20 HECD O=C1N[C@@H](c2ccc3c(c2)CCO3)C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 761093757 UAJCRMQUQXMRRD-FQEVSTJZSA-N 411.433 2.390 10 20 HECD COC[C@@H](O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 765902296 BXSZODRKIBUITB-LQELWAHVSA-N 414.574 2.243 10 20 HECD Cn1cc([C@H](O)C[C@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 766776879 MSVIPDXRXWTCMY-NHCUHLMSSA-N 413.522 2.054 10 20 HECD CN1CCCc2cc(CNC(=O)C3=NN(c4ccc(F)cc4)C(=O)CC3=O)ccc21 773880982 RYNKSKVOEXPCKF-UHFFFAOYSA-N 408.433 2.186 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1)O[C@@H](C)C2 774362901 HDAYTVAXRJSXIL-LBPRGKRZSA-N 400.431 2.117 10 20 HECD CN1CCN(c2ccc(CN3CCO[C@H](CNC(=O)OC(C)(C)C)C3)cc2)CC1 776015065 ACKSRQZERULSGB-HXUWFJFHSA-N 404.555 2.164 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776248707 KCXSKHCDDJIQIH-UWJYYQICSA-N 412.534 2.487 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(CC(C)C)c3)CC2)cc1 778295707 SBWHRDSRLVSUHJ-CMDGGOBGSA-N 411.506 2.391 10 20 HECD Cc1cc(C(=O)N2CCN(C(=O)CO)CC2)c(C)n1-c1ccccc1Br 778402270 ORABFIKBICBYJR-UHFFFAOYSA-N 420.307 2.133 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H](OCC4CC4)C3)CC2)cc1 779544692 MQKZXYLLAVKVBN-JOCHJYFZSA-N 416.566 2.418 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)F)c2)cc1C 790053652 HKBRTLXBICIHPZ-UHFFFAOYSA-N 408.452 2.019 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CCC(NC(=O)C2CC2)CC1 793583840 STZAQDMQZOLDKE-UHFFFAOYSA-N 417.525 2.488 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCN2Cc3ccccc3C2)C2CC2)cc1 793864603 IFUJBRZASSTPJK-UHFFFAOYSA-N 406.530 2.376 10 20 HECD COc1cccc(CNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1O 802783114 ZRLBMJVYBSLIOB-MRXNPFEDSA-N 404.467 2.359 10 20 HECD CCO[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803679674 VEFUIQWGIFJLCW-NHCUHLMSSA-N 417.550 2.382 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3C[C@@H](OC(C)C)C3(C)C)CC2)cc1 804317203 WCZYUWFVXBTQND-VQTJNVASSA-N 417.550 2.489 10 20 HECD CN(C)CC1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCCC1 807856564 TVOJCHIPRSMZNI-IBGZPJMESA-N 417.550 2.138 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 808282710 JJDNIHBIPZVFKM-LJQANCHMSA-N 401.532 2.316 10 20 HECD COc1ccc(N2CCN(CCCNCc3ncc(C4OCCO4)s3)CC2)cc1 809603203 LQGIVQNIULWJOA-UHFFFAOYSA-N 418.563 2.499 10 20 HECD Cn1c(=O)c2c(NCc3ccc4c(c3)CCN4Cc3ccccc3)[nH]nc2n(C)c1=O 813354798 FOTQGUVOBWQGQY-UHFFFAOYSA-N 416.485 2.135 10 20 HECD Cc1sc(NS(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)nc1-c1ccccc1 817953612 PJTRNADSAWKFKJ-UHFFFAOYSA-N 414.468 2.449 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1 915731856 BRCDTNIHVABXIU-UHFFFAOYSA-N 422.407 2.300 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3ncc4ccccc4c3=O)cc2F)C[C@@H](C)O1 917711305 FVHGEOGAIYWMLE-IYBDPMFKSA-N 424.476 2.466 10 20 HECD CC[S@](=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918372610 NGHANRRBGYMAEY-ADKRDUOOSA-N 413.543 2.446 10 20 HECD CC(=O)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920638314 VGQROQRNINBVTP-GFCCVEGCSA-N 420.443 2.150 10 20 HECD O=[N+]([O-])c1ccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 920994541 DWCASWDUAUMUHE-UHFFFAOYSA-N 420.516 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(COCc4ccncc4)n3)CC2)cc1 1327300883 BHGYSRFVGMDESV-UHFFFAOYSA-N 423.473 2.081 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC=CCC1)C2)c1cc(O)c(O)c(Cl)c1 1799766931 IQPOHSRNYGKWPF-LJGDNWOOSA-N 420.893 2.311 10 20 HECD COc1cc(F)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 141681256 FKXBMVPYLJXLEO-CQSZACIVSA-N 401.438 2.487 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 147117309 UHMSGEMFRKFADS-UHFFFAOYSA-N 419.384 2.100 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 302892401 VWADFRKPUAJNSY-DEOSSOPVSA-N 420.513 2.495 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(CN4CCOCC4)CC3)CC2)cc1 726712998 ITCBLTRSILWDCW-UHFFFAOYSA-N 416.566 2.418 10 20 HECD CCCCc1noc(C[S@@](=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 729872897 SNRYAMFPWIMVLN-GDLZYMKVSA-N 420.535 2.018 10 20 HECD CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NCc2ccccc2O)n1 731128777 BXPGVXSPYJPJNY-UHFFFAOYSA-N 408.414 2.010 10 20 HECD CNC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 731131883 TXEFVAWJMVTLMW-UHFFFAOYSA-N 422.529 2.466 10 20 HECD COCCS(=O)(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 732115170 VMFWCWNXAUKICN-UHFFFAOYSA-N 420.531 2.356 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c1 734018069 DHJFREKYAVLOHY-IBGZPJMESA-N 406.504 2.329 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC[C@H](OCCO)C2)c([N+](=O)[O-])c1Br 734484841 JQESHSPZGYUTAY-VIFPVBQESA-N 420.216 2.252 10 20 HECD O=C(NCCCOC[C@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 740920739 SXKPKCSZUUYHKH-QGZVFWFLSA-N 409.502 2.029 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741096723 DGKFTLYEDPCTSV-UHFFFAOYSA-N 422.485 2.028 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743716265 GUEAOTJOHLZQRT-UHFFFAOYSA-N 416.499 2.068 10 20 HECD COC(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903828 IVSIIFLPWBMRPZ-AWEZNQCLSA-N 412.437 2.350 10 20 HECD Cc1cc(CCNC(=O)NCCS(=O)(=O)NC(C)C)c(C)n1-c1ccccc1 746973471 USDFGISOLSOSNG-UHFFFAOYSA-N 406.552 2.264 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 752342495 NQQMJYVNBQTDFE-UHFFFAOYSA-N 405.480 2.006 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@H](O)COCc3ccccc3F)cc2)CC1 755303504 IZKOQWHSJYCWIC-HXUWFJFHSA-N 402.466 2.451 10 20 HECD CC(C)C(=O)NCCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 756057882 PVGOGSITTNFOHS-IYBDPMFKSA-N 408.518 2.401 10 20 HECD Cc1cc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ncn1 757982955 MRKWRZXVEJCYSL-UHFFFAOYSA-N 402.366 2.399 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c2C)cc1F 758470290 DZTYFZNYBPHMBY-CYBMUJFWSA-N 410.467 2.205 10 20 HECD COc1cccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1O 759221197 NSMWTFJISWHMFK-UHFFFAOYSA-N 402.447 2.389 10 20 HECD CN(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)cc1 765002418 IFFCGURXHLBTND-NRFANRHFSA-N 410.518 2.022 10 20 HECD C[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(-n2cnnn2)cc1 765257123 WONIATYDOADGGI-APWZRJJASA-N 405.506 2.215 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1 765823016 QYOBFQHQVMYIGU-OXJNMPFZSA-N 412.486 2.300 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H]3CN(C)CC[C@H]32)c1 768498813 JBECZRGVBAUHML-XMSQKQJNSA-N 401.551 2.343 10 20 HECD C[C@H](c1ccccc1)[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 771423258 RKDUOMPNSXODSG-PIPMEXSNSA-N 424.545 2.352 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773854046 AHFKAVZYIAOGLE-HNNXBMFYSA-N 412.490 2.036 10 20 HECD C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775254353 HLIRAFWBKNDRCO-IIBYNOLFSA-N 404.532 2.311 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCn4cccc4[C@@H]3C)CC2)cc1 778232242 GQNDWLUBXDPKKI-BBVFFXRHSA-N 408.502 2.305 10 20 HECD CNC(=O)[C@H]1CN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)CCO1 781577423 PRYLZTFUGPGEFG-LJQANCHMSA-N 408.454 2.421 10 20 HECD C[C@H](NC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1)c1ccc(N2CCOCC2)cc1 782782320 DCGQJMTWCITIJM-HNNXBMFYSA-N 420.473 2.124 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncnn1C 788733370 PHEXJUNELHCJPY-LBPRGKRZSA-N 412.416 2.231 10 20 HECD O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789801417 SZKJPITYSQFSTH-RYQLBKOJSA-N 403.498 2.221 10 20 HECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793715747 ABCFVHQAJOPYNV-NEWSRXKRSA-N 414.550 2.090 10 20 HECD Cc1c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nnn1Cc1ccncc1 794855008 XTJMWQCMDTVVQS-UHFFFAOYSA-N 406.490 2.139 10 20 HECD O=C(NC1(c2nc[nH]n2)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 797758903 WAGDYJUYPZCESF-UHFFFAOYSA-N 419.488 2.182 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)CCCN3CCCC3)CC2)cc1 798354765 MGEUQQIBAAXVTP-UHFFFAOYSA-N 417.598 2.335 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCCS(=O)(=O)c1ccccc1 803367719 MCEQDVJTWMDECV-UHFFFAOYSA-N 418.515 2.111 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCC2(C(=O)N(C)C)CCCC2)cc1 806265425 NDUMDMRHPQMSOY-UHFFFAOYSA-N 416.566 2.256 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 806277694 FNJADDXWYBPCAF-FQEVSTJZSA-N 417.556 2.442 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1nc(-c2cccc(F)c2)no1 806281025 LDCXKPZSCIRTFF-UHFFFAOYSA-N 421.479 2.247 10 20 HECD COC(=O)c1c(C)csc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 806878047 GNLQNAQFWZVSLZ-UHFFFAOYSA-N 401.488 2.480 10 20 HECD O=C(NC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768972 CKSNQXXCXANCHR-KBPBESRZSA-N 413.490 2.242 10 20 HECD CC(C)O[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1(C)C 809438193 KXZNXCSBWWPMDF-VQTJNVASSA-N 417.550 2.190 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@](C)(O)CNC(=O)OC(C)(C)C)cc2)CC1 811815327 MVUKAEFPBZKNOA-OAQYLSRUSA-N 407.511 2.010 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2ccc(N(C)C)c(C)c2)c(O)nc1=O 815063651 DZEIQJSMELABQN-UHFFFAOYSA-N 403.527 2.359 10 20 HECD Cc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1NS(C)(=O)=O 883990545 OJEGUSCKLHMACP-UHFFFAOYSA-N 417.531 2.475 10 20 HECD CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(CCOC)C2)sc2c1CC[C@@H](C)C2 914460993 ZJKCLLZSXLPBIZ-OLZOCXBDSA-N 408.520 2.483 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2F)cc1 917751876 MZCKATKSVZWVHX-UHFFFAOYSA-N 415.468 2.347 10 20 HECD COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918001016 XEBXPNWEDQBSCD-KRWDZBQOSA-N 410.474 2.497 10 20 HECD O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 918192218 OQMATUBNRSPMQD-UHFFFAOYSA-N 417.441 2.482 10 20 HECD Cn1c(C(=O)NCc2ccc(N3CCOCC3)cc2)cc(Br)c1C=O 1318591079 CDWZXJUPRVMSQA-UHFFFAOYSA-N 406.280 2.367 10 20 HECD Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 1320511092 LHSQFBMVISMJDC-HNNXBMFYSA-N 404.492 2.184 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC[C@@H](CO)CC1CCOCC1 1322043925 OGQNSNBBIIRGPO-SFHVURJKSA-N 423.529 2.011 10 20 HECD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)n1cncn1 1791858632 XEVBVSNPPVBJMW-CYBMUJFWSA-N 422.445 2.093 10 20 HECD CN(C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816855404 CWLDEVWRQCLFAM-AWEZNQCLSA-N 421.885 2.342 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)on1 1825965089 WPHCTOFXMZLQQA-MRXNPFEDSA-N 414.462 2.336 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424128 PXQQQJWWTHVSSC-KRWDZBQOSA-N 417.506 2.341 10 20 HECD COCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827424313 WNJIIEVNDRNUKD-KRWDZBQOSA-N 417.506 2.153 10 20 HECD CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1846005280 HPHIZUWPXPRKKR-SFHVURJKSA-N 422.529 2.436 10 20 HECD CN(CC(=O)NCC(C)(C)N1CCOCC1)Cc1ccc(N2CCCCC2)cc1 15571648 RLQJGKTZRKKTST-UHFFFAOYSA-N 402.583 2.336 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c(C)n1-c1ccccc1 18360661 OFWDEXJMWCIBAZ-SFHVURJKSA-N 404.488 2.244 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)n(C)c2ccccc12 472789214 OHWPWEFDPOKMHM-UHFFFAOYSA-N 422.485 2.209 10 20 HECD Cc1cc(C(=O)CN2CCN(CCO)CC2)c(C)n1-c1ccc(OC(F)F)cc1 727101866 MRRJMLWSKAMSLV-UHFFFAOYSA-N 407.461 2.488 10 20 HECD Cc1cc(C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccn1 729342085 XGORFUIWJAELTN-MSOLQXFVSA-N 417.531 2.297 10 20 HECD Cc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 729785807 MMFCHHZJPBZFLH-GASCZTMLSA-N 400.454 2.398 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc2c1OCCO2 738903547 NRKIQZLOKUUTIU-UHFFFAOYSA-N 417.487 2.014 10 20 HECD COC[C@H](C)NC(=O)NC(=O)COC(=O)c1cc(C)ccc1-n1c(C)ccc1C 745241806 BLGOLJMFZSCIIQ-AWEZNQCLSA-N 401.463 2.420 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ccccc1Cn1cncn1 745527609 XNHASCVQMIKHEC-UHFFFAOYSA-N 407.474 2.208 10 20 HECD CN(CC[C@H]1CCCCN1C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745691359 JJBUYLCBLLMLEP-WOJBJXKFSA-N 415.582 2.404 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1cccnc1 746326937 VRIYSEJJJFOQIU-UHFFFAOYSA-N 419.551 2.046 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1 749918109 LBDBBMCZMXLDCH-LJQANCHMSA-N 402.520 2.220 10 20 HECD COC(=O)[C@@H]1C[C@@H](O)CN1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 754658656 VVDSODHDXNIOME-QAPCUYQASA-N 422.428 2.486 10 20 HECD CCS(=O)(=O)CCN(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 758715097 KXWMBTZQXNCEMK-HUUCEWRRSA-N 415.531 2.015 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@H](CC(F)(F)F)C3=O)CC2)cc1 760948105 DEMAPYHLNQMELC-MRXNPFEDSA-N 414.428 2.080 10 20 HECD CCN(C1CCN(Cc2cc(Br)cc(OC)c2O)CC1)S(C)(=O)=O 769389277 MPUFLHHTIABUDI-UHFFFAOYSA-N 421.357 2.409 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@H](COC(C)C)C3)cc2F)CC1 771319406 IWZPJEOCLYNFLR-IBGZPJMESA-N 422.545 2.303 10 20 HECD CCCCCCNC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 774509806 NETBAOCEMVYAJI-UHFFFAOYSA-N 407.511 2.058 10 20 HECD CCCN(CC(=O)Nc1ccccc1C)C(=O)COC(=O)c1cccc(O)c1O 776281517 GCCCLXXHQQHOPH-UHFFFAOYSA-N 400.431 2.440 10 20 HECD O=C(NC[C@H]1COC2(CCOCC2)O1)N(Cc1ccccc1O)C[C@@H]1CCCO1 777757326 YSVQUKUXULQVOH-ROUUACIJSA-N 406.479 2.005 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N(CCO)C1CCOCC1 780387686 RRDNHOOLZHCMJP-UHFFFAOYSA-N 413.465 2.440 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 781516354 FIBVUPJDOICQCJ-UHFFFAOYSA-N 405.401 2.381 10 20 HECD CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422620 PFTCTGBWDFSRIL-QFIPXVFZSA-N 423.561 2.277 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCc3cccc4c3OCO4)cc2)CC1 786259090 JUDDLIMDQGJCRP-UHFFFAOYSA-N 409.486 2.333 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C 787575336 XKPXCXFYKZVKPI-LLVKDONJSA-N 400.460 2.246 10 20 HECD C[C@H]1OCC[C@@]12CN(CC(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)CCO2 791591997 YCNFXRNCNGPJOY-OYLFLEFRSA-N 420.465 2.280 10 20 HECD NC(=O)c1ccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 792591023 WKGCHOAIFNSKHA-UHFFFAOYSA-N 421.419 2.500 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3c(F)cncc3F)CC2)cc1 796626704 PMSNIEWKCDXDGM-DOTOQJQBSA-N 406.477 2.202 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)ccc21 797653086 CCJRSEYVAAFJDO-UHFFFAOYSA-N 403.508 2.036 10 20 HECD CC(=O)NCCNC(=O)CCC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800570414 NCWQEUSDPDYABD-HNNXBMFYSA-N 422.957 2.225 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@]3(CCCOC3)C2)cc1F 804852694 MDGXVTVWDIQHLH-KSFYIVLOSA-N 421.513 2.085 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(Cc2cc(Br)ccc2O)CC1 809728677 FIPHFNOXUGLUBE-GOSISDBHSA-N 404.308 2.499 10 20 HECD CN(c1ccc(CNC(=O)CNS(=O)(=O)c2cccnc2)cc1)C1CCCCC1 810244328 QOWDLVBFXDOELK-UHFFFAOYSA-N 416.547 2.445 10 20 HECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCOCC3)cc2)CCCCC1 813656398 XQVHNZUGGFJQOY-UHFFFAOYSA-N 410.536 2.066 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc2cnccc12 918285087 XCUWVLDZTXLFPH-UHFFFAOYSA-N 408.433 2.465 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2ccccc2)n1 918337501 LQBGMDJQYCCOMO-UHFFFAOYSA-N 410.499 2.037 10 20 HECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 919913111 GQMPRMYTZLYGOD-QWFCFKBJSA-N 415.582 2.308 10 20 HECD C[C@@H](NS(=O)(=O)c1cc(C(=O)O)ccc1F)c1ccc(N2CCOCC2)cc1 920865621 HSPSEXBEVPCXLB-CYBMUJFWSA-N 408.451 2.400 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1N1CCCC1=O 1116669091 FXVQDVUJPPSDEK-INIZCTEOSA-N 412.442 2.129 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCc3nc(-c4ncccn4)no3)CC2)cc1 1319603714 MYAIFNHBPHTRJB-UHFFFAOYSA-N 408.462 2.207 10 20 HECD O=S(=O)(c1ccc(-c2nnc(C3=S=C4CCCC4=C3)o2)cc1)N1CCOCC1 1345602265 PWZIRHGJIFLPFI-UHFFFAOYSA-N 417.512 2.308 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1799945553 HYCVTDNQDUCWGO-LXOAJXDASA-N 408.502 2.464 10 20 HECD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)n1ccnc1 1800712874 XXFZIUVZZKZOGG-MHEUCROKSA-N 418.881 2.461 10 20 HECD O=C1CSC(=S)N1CC(=O)N1CCCC12CN(C(=O)C13CCC(CC1)CC3)C2 1847056109 HZIXQLSRCIYFEH-UHFFFAOYSA-N 421.588 2.021 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c(C)c1 51134051 XZMFYDJMRUQHTM-UHFFFAOYSA-N 404.488 2.301 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3CN3CCCC3)cc2)C1 729599182 OGNAPGVZLYMSNN-TZIWHRDSSA-N 413.566 2.158 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C[C@@H]2CCCN2CC)C1 729628349 SCHLFMQYRXZFRP-CTNGQTDRSA-N 400.567 2.434 10 20 HECD CN1CCC[C@@H](N2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)C1 734662138 VBYIPZRZNPKUSV-OAQYLSRUSA-N 417.623 2.161 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCNC(=O)[C@H]1c1c(C)nc2ccccn12 734668907 NPYVSOMEGCJVIQ-OAQYLSRUSA-N 420.517 2.400 10 20 HECD COCCCN(C)CCNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 743555267 UOPPIZLHSAAABK-CALCHBBNSA-N 410.534 2.207 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)Cc2cc(Cl)cc(C(C)=O)c2O)C1 750044501 YIHRAAZNWPUSIW-CQSZACIVSA-N 410.898 2.482 10 20 HECD O=S(=O)(c1cnn(C2CCOCC2)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 751136763 MKWYDLVMNUCTBZ-GOSISDBHSA-N 421.519 2.310 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c[nH]c2ncccc12 751227065 BWLZJSRJWCHOHN-UHFFFAOYSA-N 404.467 2.142 10 20 HECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)c([N+](=O)[O-])n1 751588612 NCKWDHZTVGRVKX-UHFFFAOYSA-N 423.432 2.464 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C2=O 753636524 NDDKQDXISSVFNL-FHDQPZTMSA-N 403.479 2.036 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 765802402 QKRLWCLOEDYMBI-KSSFIOAISA-N 403.504 2.014 10 20 HECD Cc1ccc(S(N)(=O)=O)cc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 767383340 LTMLGXDBTVCZGX-UHFFFAOYSA-N 416.547 2.425 10 20 HECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)nc1C 768012461 WITCULFZLWGCOV-UHFFFAOYSA-N 409.493 2.365 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cccc(OC)n4)n3)CC2)cc1 771054775 FDFAXBSJPYQATG-UHFFFAOYSA-N 409.446 2.040 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCO[C@H](C)C4)n3)CC2)cc1 771069520 WLNYTGZNHHISKO-HZPDHXFCSA-N 400.479 2.252 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 772775730 OCVFIHWMTGEJKX-YCRREMRBSA-N 412.442 2.012 10 20 HECD CCOC(=O)CNC(=O)C1CCN(Cc2cc(Br)cc(C)c2O)CC1 775741535 SJIXGEPHSPJBMW-UHFFFAOYSA-N 413.312 2.354 10 20 HECD CCn1cc(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 780450736 PFTCSYLKWWBPLP-UHFFFAOYSA-N 423.496 2.018 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)ccc3F)cc2)CC1 786122785 ZUHDXNOZHBCHSG-UHFFFAOYSA-N 409.458 2.112 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCCN1C1CC1 787140115 LRZVJRZFBDNBQQ-OAQYLSRUSA-N 424.524 2.185 10 20 HECD C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331264 ILGLJAIKWJFFDN-ZBFHGGJFSA-N 413.440 2.329 10 20 HECD CCOC(=O)C1(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC1 789168184 HPSASCKYAGWZPQ-QGZVFWFLSA-N 401.507 2.128 10 20 HECD CN(C)S(=O)(=O)c1ccccc1NNC(=S)Nc1ccc2c(c1)OCCCO2 793325322 CTELGLMXFLFLMJ-UHFFFAOYSA-N 422.532 2.412 10 20 HECD Cc1ccc(CCNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1 793762447 PNOMESDAGPSIAV-UHFFFAOYSA-N 409.530 2.457 10 20 HECD COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 793867242 JDTXVUWLXUACEK-KRWDZBQOSA-N 411.502 2.334 10 20 HECD COc1cncc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 798429973 UZBRUPTVWYSYOE-OKILXGFUSA-N 409.483 2.321 10 20 HECD CCn1c([C@@H]2CCOC2)nnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 801896342 UWOMQAAOBOOYGZ-OAHLLOKOSA-N 417.510 2.154 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3ccc(F)c(F)c3F)ccc21 803689157 LVYLVEUGCSKMAW-UHFFFAOYSA-N 405.420 2.461 10 20 HECD COCCOc1cc(C)ccc1CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807859183 KIRKVXBPWAYADJ-UHFFFAOYSA-N 413.518 2.361 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O 808185713 COOKBZRCGMGVBR-HXUWFJFHSA-N 414.550 2.151 10 20 HECD CC[C@@H](O)c1nccn1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 810004549 VSLFNKJMIAWCRU-ZRGWGRIASA-N 404.486 2.396 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3COc4ccccc43)CC2)cc1 813891942 POQDLHQRSCUKQC-RXQFDZFGSA-N 421.497 2.192 10 20 HECD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCN(CCC(F)(F)F)CC1 857531673 NSGXEKDJPGRYII-UHFFFAOYSA-N 423.457 2.253 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCCc4nc(O)ccc43)cc2)C1 918119009 XNWALHUCUDRVDB-JXFKEZNVSA-N 423.517 2.366 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1 918310622 QMOYHGSNDITGKB-UHFFFAOYSA-N 421.505 2.414 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)Sc3nnnn3C3CC3)CC2)cc1 918664649 ZDDWQJODCHBGTC-AWEZNQCLSA-N 402.524 2.236 10 20 HECD C[S@@](=O)Cc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919840596 SHIOINDXRMCKRY-AREMUKBSSA-N 406.529 2.052 10 20 HECD CCC(=O)N[C@@H](CCSC)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968815 LIRSBGWENAQNGQ-IBGZPJMESA-N 407.580 2.159 10 20 HECD CC(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920637234 BSXWRAPJIDQDIJ-LBPRGKRZSA-N 420.443 2.150 10 20 HECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1cc2c(cc1O)OCO2 1341569680 STJPELQKFKBDTA-CQSZACIVSA-N 408.451 2.105 10 20 HECD CCC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510619 UDXOJPFBZHYZJQ-XOPAWIAISA-N 418.490 2.083 10 20 HECD COc1cc(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1800297714 SWMVAPCFTMCRQM-BJWYYQGGSA-N 411.458 2.375 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1802228241 ODXJHUPKEMUXLR-CILYOPLKSA-N 416.474 2.070 10 20 HECD O=C(CC1CCC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1814115965 POGBIULTGCZQLR-IIBYNOLFSA-N 410.474 2.398 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n[nH]1 1829728110 SKFWNRMUCYLUES-KRWDZBQOSA-N 413.478 2.071 10 20 HECD COc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)ccn1 1844472189 ZSMHILVFYSDNDL-UHFFFAOYSA-N 417.849 2.286 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)C1(O)CCC1 1845500212 DEQFDUGMPQMKRM-GFCCVEGCSA-N 408.882 2.119 10 20 HECD CCCCC[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055730 PNHJZGXRDIDEJV-CQSZACIVSA-N 411.593 2.267 10 20 HECD O=S(=O)(Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc2nsnc12 19107797 YKMXCEPCQHEJEI-UHFFFAOYSA-N 424.529 2.277 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 60749323 BRUPDXTVTQTRAF-UHFFFAOYSA-N 408.502 2.464 10 20 HECD Cc1ccc(-n2nccc2NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)nn1 494792830 HMHBATVHFYDGID-UHFFFAOYSA-N 404.455 2.439 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1 514409283 LFUYHVFRMYCVPA-QGZVFWFLSA-N 412.534 2.258 10 20 HECD COc1cccc(O)c1CNCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 725849127 ILUXDAGHPANWMS-INIZCTEOSA-N 406.504 2.148 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)cc1F 735498247 QQZQTJHQGOROLQ-UHFFFAOYSA-N 421.494 2.332 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN([C@H](C)c4cccnc4)CC3)CC2)cc1 735871677 SXIFAVWLCWUMKJ-HXUWFJFHSA-N 423.561 2.118 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1F 742293527 JSEVCTMQTXGASD-UHFFFAOYSA-N 418.498 2.341 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cn(Cc2cccs2)nn1 743312396 GMGCRVANNLUIRD-UHFFFAOYSA-N 415.494 2.418 10 20 HECD O=C1C[C@H](Cc2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)C(=O)N1 743339794 YQPFCDZSJATIKS-PMACEKPBSA-N 422.481 2.419 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3nn(-c4ccccc4)cc3O)CC2)cc1 743409105 SANAKKRGKHDLRB-UHFFFAOYSA-N 421.501 2.139 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2Cc2ccc(N3CCOCC3)c(F)c2)cn1 754153950 KYJFLYWHUQEEKZ-NGOKVRLYSA-N 406.527 2.184 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccccc4OC[C@@H]3C)CC2)cc1 754272284 SDDASZFUAHQKKU-UGKGYDQZSA-N 411.546 2.461 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@]4(CCOC4)C3=O)c2C)cc1 755820456 FXFVXGRVDJPTSF-QFIPXVFZSA-N 411.458 2.386 10 20 HECD C[C@H](c1cccc(S(N)(=O)=O)c1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 760948704 DOSWSGNJMXUYMH-LLVKDONJSA-N 423.878 2.218 10 20 HECD Cc1cc(C(=O)CN2CCC(C)(CO)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 762619575 KFFCFXOMYQDSQQ-UHFFFAOYSA-N 419.547 2.019 10 20 HECD COCC[C@H](C)S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 766480018 SCKDGKMWXYZXBO-ZDUSSCGKSA-N 410.458 2.386 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CONC(=O)C3CCCC3)cc2F)C[C@@H](C)O1 768517363 PQCFJOMTUNADFY-GASCZTMLSA-N 407.486 2.294 10 20 HECD C[C@H](OCc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 769559599 PDBOXIXTOKTAIA-KRWDZBQOSA-N 402.516 2.143 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(O)c([N+](=O)[O-])c1 770627962 CRZMFTKEUVTVIL-CQSZACIVSA-N 406.826 2.449 10 20 HECD O=C(CCCN1C(=O)CCC1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771055591 ZPOXINQRYHXRHF-INIZCTEOSA-N 407.898 2.055 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(COC4CCCC4)n3)CC2)cc1 771058050 SCGQOQHTTMLHGO-UHFFFAOYSA-N 400.479 2.429 10 20 HECD C[C@H]1[C@H](C)N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 771404439 JBFRSNQCTIBNEF-STQMWFEESA-N 409.533 2.419 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)N3CCCCC3)CC2)cc1 774887010 CLRJNPPLWWJJCG-UHFFFAOYSA-N 416.566 2.161 10 20 HECD C[C@H](CCO)C1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC1 776041474 JIUMCWLJUHPUDT-MJGOQNOKSA-N 416.566 2.376 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2c(c1)OCC(=O)N2 777827237 YFGQISKKUULJLL-UHFFFAOYSA-N 404.806 2.192 10 20 HECD C[C@]1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCCOC1 781146848 CMNJCJCXUUZMER-QFIPXVFZSA-N 413.497 2.375 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784762039 AZVSCVNACNKIRA-MRXNPFEDSA-N 418.881 2.169 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(F)c1 786066850 HTSDFRNVIRQGPN-UHFFFAOYSA-N 420.510 2.014 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@H](c2ccco2)C1 789841472 ZFIZXUINKKFZFL-INIZCTEOSA-N 415.465 2.012 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC3CCN(C(C)(C)C)CC3)CC2)cc1 793736163 AWYHRWXXKIKRPA-UHFFFAOYSA-N 416.566 2.159 10 20 HECD COc1ccc(CNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c(O)c1 795358388 OFYSOSADIKAAKE-UHFFFAOYSA-N 418.393 2.171 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c(O)c1 797389832 APTDIZBPAOYRKN-HHHXNRCGSA-N 410.879 2.188 10 20 HECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CC[C@@H](C)C1 804316375 CKEKMINZKATASN-YLJYHZDGSA-N 417.550 2.444 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCCN1Cc1ccccc1 806425956 TVOAECPMKXVPEJ-HSZRJFAPSA-N 418.541 2.460 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCSC[C@@H]1c1nccs1 807095982 GHMJORCEKOXECD-MRXNPFEDSA-N 404.561 2.450 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C12CCC2 807609268 LJLSHDFPNCDGSY-YSIASYRMSA-N 416.518 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCSC3)CC2)cc1 813715144 GDIJOEDUPSKZIZ-JJEJIETFSA-N 403.548 2.159 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(Cl)c(F)cc3N)nc12 815259208 QGCYRUKZXWJEHU-UHFFFAOYSA-N 408.773 2.343 10 20 HECD COc1ccc(N2CCN(C(=O)CCC(=O)N3CC(=O)Nc4ccccc43)CC2)cc1 916552793 YZGYZUOUQYVKJO-UHFFFAOYSA-N 422.485 2.109 10 20 HECD CN(C)Cc1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918008999 YYUCHLVTQUSQCP-OAQYLSRUSA-N 423.561 2.449 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 918443371 FRUXYJIZGVSVPC-UHFFFAOYSA-N 419.503 2.066 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3cccc(F)c3)CC2)cc1 920252044 GLDVDVOIDGDDLN-KTKRTIGZSA-N 411.477 2.398 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 1320386683 OUDGHKXOBSJQTI-INIZCTEOSA-N 412.442 2.232 10 20 HECD Cc1nccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798971179 RRWDWDYSFHKXEU-BTTYYORXSA-N 416.865 2.415 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CNS(=O)(=O)c1ccc(Cl)s1 437023006 VLYBSRRNLOFFEW-UHFFFAOYSA-N 415.924 2.171 10 20 HECD C[C@H]1COCCN1c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 738550686 GZFWMEWDFJZMFR-ZDUSSCGKSA-N 405.476 2.241 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1ccc(CN2CCOCC2)cc1 746493060 PMVJNEDIKFKKMA-UHFFFAOYSA-N 410.518 2.422 10 20 HECD Cc1nccn1C[C@@H](C)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749196318 MVLCUNIVYJAMQY-HNNXBMFYSA-N 403.502 2.427 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)Cc3ccc([S@@](C)=O)cc3)CC2)cc1 749811267 OJJXNXHWXUASKN-GDLZYMKVSA-N 415.559 2.213 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H]([C@H]4CCOC4)C3)cc2F)C[C@@H](C)O1 750262600 RFQIZQHXMURZIZ-HNJRGHQBSA-N 419.541 2.414 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4CCOC4)CC3)cc2)C1 753120211 AUESBNRUJYYOQC-WOJBJXKFSA-N 414.550 2.346 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1(O)CCCCC1 754994634 USMKVGWJIDOJMW-UHFFFAOYSA-N 413.497 2.254 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3C[C@H](C)O[C@H](C)C3)CC2)cc(OC)c1OC 759296279 CPANCTHIYMRITA-MUJYYYPQSA-N 407.511 2.500 10 20 HECD CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2O)c(OC)c1 761279135 DOXZKVZJHGSCMM-UHFFFAOYSA-N 414.505 2.031 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC4(CCC4)C3)cc2F)C[C@@H](C)O1 766269755 PKHFXWBKCHMWRK-CALCHBBNSA-N 405.514 2.310 10 20 HECD CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769735274 IVWVTIVDUXDLHE-UHFFFAOYSA-N 409.483 2.107 10 20 HECD CCOC1CC(CNC(=O)NCCCSc2nccs2)(N2CCOCC2)C1 770740678 QTFWGJFSAAFFCB-UHFFFAOYSA-N 414.597 2.194 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](C)c3c(C)n[nH]c3C)nc12 772030406 IJQUBPVGFBEPCA-SNVBAGLBSA-N 401.423 2.189 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1F 774959797 DGZCRGODPIMMTF-NRFANRHFSA-N 412.509 2.461 10 20 HECD CCOC(=O)N1CCC(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1 775004252 OUPFRUOUUSLGBV-UHFFFAOYSA-N 418.538 2.227 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)no1 784765899 CDGHWNXFBAFNRP-CQSZACIVSA-N 406.870 2.315 10 20 HECD Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 786225178 OQFSQKBVDSRPGA-SFTDATJTSA-N 424.545 2.100 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1 788931106 FLKFENRNRPMPIS-DYESRHJHSA-N 403.548 2.074 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OC[C@H]1CNC(=O)O1 801222398 XAMKWTDOYPQGSZ-VPMLRQHESA-N 412.514 2.381 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803298818 XAKAMGHWSKQTEI-KZNAEPCWSA-N 403.523 2.022 10 20 HECD CN(C)CCN(Cc1cccs1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662901 IYOBPGZRUSDHPM-UHFFFAOYSA-N 406.527 2.160 10 20 HECD O=C(NCCOCc1ccccc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804344524 KMWSMLNDRGILGR-FQEVSTJZSA-N 412.486 2.233 10 20 HECD CCOCCN(CC)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769615 HYIIOUQJXJFBNO-HNNXBMFYSA-N 413.465 2.258 10 20 HECD O=C(Cc1cnccn1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425384 LFJJJSMUBNGESS-UHFFFAOYSA-N 419.441 2.273 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CC1(F)F 1818836430 MRYGXGLVHGRSFM-JQWIXIFHSA-N 407.377 2.177 10 20 HECD CC(=O)C[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429190 QODJMBNWBBKTSP-KBXCAEBGSA-N 417.506 2.341 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(c3ccc(F)cc3)CC1)C2 1843248879 DJPPNRCQOHWSDV-UHFFFAOYSA-N 411.433 2.181 10 20 HECD O=C(c1ccc(Cl)nc1Cl)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250030 CNXGXMZQXKUEBZ-UHFFFAOYSA-N 423.256 2.325 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 57548580 UWCHOLDFBFUBFC-UHFFFAOYSA-N 400.435 2.373 10 20 HECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(S(=O)(=O)NC2CC2)cc1 108565515 CYSFGBZBVQAOMI-UHFFFAOYSA-N 401.488 2.216 10 20 HECD Cn1cc(-c2ncc(/C=C3\CCn4c3nc3ccc([N+](=O)[O-])cc3c4=O)cn2)cn1 480042782 TUSBMNSWZUZCLF-AWNIVKPZSA-N 401.386 2.440 10 20 HECD CN1C[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1=O 726537721 PPLBRONLVLVPGB-GJSJWPQCSA-N 409.558 2.076 10 20 HECD COCCCN1CCC(NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 727030990 GDRQFZFATMORJD-UHFFFAOYSA-N 404.555 2.418 10 20 HECD COC(=O)CN(CC(=O)Nc1cccc(C(=O)OC)c1)Cc1cc(Cl)ccc1O 731844798 JEEORKWUCBHZNX-UHFFFAOYSA-N 420.849 2.446 10 20 HECD NC(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1-c1ccccc1 735520104 WAQWTICYVJCXKD-GOSISDBHSA-N 420.469 2.498 10 20 HECD CC(C)OCCN1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 746414349 NMURINXDVSQJEA-IBGZPJMESA-N 404.555 2.336 10 20 HECD COc1ccc(N2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)cc1F 753857149 LTNRJHLWCXDYKD-LBPRGKRZSA-N 406.483 2.144 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)c4cc(F)ccc43)CC2)cc1 754063765 MOUKSGKBGGQBDC-FQEVSTJZSA-N 414.525 2.274 10 20 HECD O=C(COC(=O)CC1CCSCC1)NCc1ccc(N2CCOCC2)c(F)c1 762013271 RSYCUFSULRVIQC-UHFFFAOYSA-N 410.511 2.355 10 20 HECD CCOc1ccc(O)c(CN2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)c1 768157456 XYPYOQACSOOKCV-UHFFFAOYSA-N 406.504 2.306 10 20 HECD COCCNC(=O)C1CCN(Cc2cc(Br)cc(OC)c2O)CC1 768235614 BBNWKKOQOSPIFT-UHFFFAOYSA-N 401.301 2.138 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(S(N)(=O)=O)o1 769292178 SEPLBTIPTDUSCV-UHFFFAOYSA-N 403.254 2.057 10 20 HECD Cn1ccnc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1F 769647877 UBBNFGJGQGSMLL-KRWDZBQOSA-N 418.450 2.156 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCCc2ccc(O)c(O)c2)c1 770626298 VKZRSMWAXDEPJB-UHFFFAOYSA-N 422.503 2.109 10 20 HECD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N2CCCCC2)c(F)c1 773008642 WWACHPRWEPCIEO-ICSRJNTNSA-N 418.557 2.400 10 20 HECD C[C@@H](N[C@H]1CCCN(c2ccn(C)n2)C1=O)c1ccc(N2CCOCC2)c(F)c1 773024535 IJMOVMRUTAGGLL-QAPCUYQASA-N 401.486 2.242 10 20 HECD O=C(CN1CCC[C@@H](C[C@@H]2CCOC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 773703730 VIVYXRFOWMRNTO-PMACEKPBSA-N 419.541 2.417 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H]3CCn4ccnc4C3)cc2F)C[C@@H](C)O1 777460534 YJJDKKPWHNVQFS-BFYDXBDKSA-N 401.486 2.450 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CC(C)(C)O)C[C@H]3C)CC2)cc1 780386520 AKOAGHUUZSTSHO-QGZVFWFLSA-N 404.555 2.151 10 20 HECD CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)c1ccc(O)c(O)c1 784001743 PYAIBLUIMHAQDZ-KRWDZBQOSA-N 414.389 2.192 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCOC2(CCC2)C1 789866899 AJQKQFQOFSAXSW-KRWDZBQOSA-N 403.548 2.074 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC[C@H]3C[C@H](C)O)CC2)cc1 790688002 WMZIVARLLOWSTI-ICSRJNTNSA-N 404.555 2.152 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C[C@@H](C2CC2)O1 792043469 GBUBBRAZQLSCDN-BPAFIMBUSA-N 400.523 2.097 10 20 HECD CCc1ccnc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 798064761 FMZRKUGURLDESB-HJWRWDBZSA-N 408.502 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)CSCC(=O)Nc3nc(C)cs3)CC2)cc1 799892462 MRGNNFNFWCEMNG-UHFFFAOYSA-N 420.560 2.481 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCOC2(CCCCC2)C1)c1ccc(N2CCOCC2)cc1 803307612 JCHQQZBRJCZRKQ-GOSISDBHSA-N 415.534 2.262 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCCCOC 803675462 UWEJQCBIUNIECP-UHFFFAOYSA-N 401.301 2.436 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])c(NCCN2CCN(c3ccc(OC)cc3)CC2)n1 804388480 WAEXNIAYJAHIGI-UHFFFAOYSA-N 415.450 2.019 10 20 HECD O=C(COC(=O)c1ocnc1C1CC1)NCc1ccc(N2CCOCC2)c(F)c1 808682577 VASLDDHXQSVUOS-UHFFFAOYSA-N 403.410 2.001 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c(O)c1 815631616 KLTJOMYWXPTVJO-DJJJIMSYSA-N 411.458 2.417 10 20 HECD Cc1cc(N(C)C)ccc1CNc1cc(C(N)=O)ccc1CN1C(=O)CN(C)C1=O 864044142 WLCFNXSETUORGL-UHFFFAOYSA-N 409.490 2.166 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(F)c(F)c1 918442932 XYLRGLDGZHUMSY-UHFFFAOYSA-N 403.429 2.428 10 20 HECD Cc1ccc2nc(CNC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cn2c1 919655204 UGYWOYABTCIVIO-GOSISDBHSA-N 420.517 2.344 10 20 HECD C[C@@H]1CCc2ccccc2N1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1115886075 CJMZBZZUPHEJLX-CQSZACIVSA-N 403.504 2.335 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2ccc(N3CCCC3)cc2)c1 1318348416 KTMWDEJSKVCTQK-INIZCTEOSA-N 416.547 2.312 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2c(F)cccc2NS(C)(=O)=O)c1 1319206123 JYDVXPGCFJQZNH-NSHDSACASA-N 411.455 2.472 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn1C 1817845178 DYHPNZGOJVVPFV-INIZCTEOSA-N 424.461 2.483 10 20 HECD O=C(CC[C@H]1CCOC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502478 CIZJBGXPMWCYAL-ZDUSSCGKSA-N 408.882 2.385 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OC)c1 141689364 JYPQYXFYVPKJFQ-OAHLLOKOSA-N 413.474 2.356 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC(C)(C)c3noc(C)n3)CC2)cc1 729814337 ATLVQMOCOIEZEC-UHFFFAOYSA-N 416.526 2.133 10 20 HECD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1Cl 734073472 OMZHFZNCBDJIFA-UHFFFAOYSA-N 419.865 2.449 10 20 HECD COC1CCC(N(C)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 734661035 YKDSYOHWJXYCNC-PGYGNJIDSA-N 402.539 2.487 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 735858390 XVZXEYSKUSDEAN-XMMPIXPASA-N 409.530 2.417 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(OC)c(O)c3)CC2)cc1 743363966 YVBQSDFVVPLJNV-UHFFFAOYSA-N 414.506 2.031 10 20 HECD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743717875 XQQHICKWWNLZFR-AWEZNQCLSA-N 418.515 2.263 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NCCc2ccc(O)c(O)c2)cc1 750793677 AZNHFJCRCGMCAE-UHFFFAOYSA-N 420.531 2.420 10 20 HECD COc1ccc(OC)c(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 751236190 GNVYESUHBQAEAI-UHFFFAOYSA-N 420.531 2.391 10 20 HECD COc1cc(N2CCN(C(=O)c3cc4c(cc3O)OCO4)CC2)cc(OC)c1OC 760086868 WYAWUXDZNUAPJM-UHFFFAOYSA-N 416.430 2.109 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(OCCF)c1 760091968 SXRDPFKFAAEEOX-UHFFFAOYSA-N 419.428 2.266 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc(Cl)n2C)cc1 765089971 MEIPFODFMDBBPS-UHFFFAOYSA-N 406.917 2.416 10 20 HECD Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769895605 DPXUPXNVUVSXIR-UHFFFAOYSA-N 419.503 2.157 10 20 HECD COCCC1(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CC1 771059151 XWUQMHRRUACOPM-UHFFFAOYSA-N 400.479 2.038 10 20 HECD CCNS(=O)(=O)[C@H]1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 771467311 RZDKHFKWVVGXTB-SFHVURJKSA-N 407.511 2.430 10 20 HECD CCOC(=O)c1c(C)oc2nc(COC(=O)/C=C/c3ccc(O)c(O)c3)nc(N)c12 772777992 ZAIVUOVBOARPTF-FNORWQNLSA-N 413.386 2.458 10 20 HECD COCCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 773245617 YWHWABGXWLIGIP-IYBDPMFKSA-N 422.497 2.415 10 20 HECD COCC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(N)=O 775977707 UOBXJVRIIDPRDW-INIZCTEOSA-N 408.296 2.477 10 20 HECD CC[C@@H](C)Oc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccn1 777361931 VOINOOCWQQYKDK-MRXNPFEDSA-N 417.531 2.424 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(N4CCNC4=O)c(C)c3)c2)CC1 781045829 RRRJQAGLIABEKZ-UHFFFAOYSA-N 421.501 2.445 10 20 HECD COCc1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ncn1 782424908 HICKXAALFYGQIN-UHFFFAOYSA-N 423.473 2.450 10 20 HECD COC(=O)COc1ccc(N(C)Cc2nc(O)c3ccc(C(=O)OC)cc3n2)cc1 784562336 XBLJNCDUFUDIJK-UHFFFAOYSA-N 411.414 2.310 10 20 HECD O=C(NCCCOc1ccccc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785587353 JYNDQICWDUCDEO-FQEVSTJZSA-N 412.486 2.485 10 20 HECD CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786259139 LDZPVSVEBQMTRH-XQNSMLJCSA-N 420.513 2.149 10 20 HECD Cc1csc(CCCCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788334659 YSVHDTIOYBECQU-UHFFFAOYSA-N 416.547 2.043 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(N2CCOC2=O)c1)c1ccc(N(C)C)cc1 789573834 WJYOUOVLHCSGHU-HNNXBMFYSA-N 410.474 2.203 10 20 HECD CCS[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799079 IAGNCQXLJWQFSQ-QGZVFWFLSA-N 423.554 2.413 10 20 HECD CCOC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 789866388 NHKGXUOWSWBHGB-JPMGXVIASA-N 403.523 2.077 10 20 HECD O=C(Nc1cccc(N2CCC2=O)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 790910879 DFTNGUGCPXESNZ-IBGZPJMESA-N 423.469 2.275 10 20 HECD CN1CCN(c2ccc(CNc3cccc(S(=O)(=O)NC4CC4)c3)cc2)CC1 792175270 QMIRKTFZPLBZQL-UHFFFAOYSA-N 400.548 2.491 10 20 HECD COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c(O)c1 794388056 NLDRAKPDLAPCLF-AWEZNQCLSA-N 421.519 2.090 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(F)c1 795078853 UOUXAZKEOGMGPO-QGZVFWFLSA-N 419.522 2.455 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1 797109886 RDJSQSXJBBLGMC-LBPRGKRZSA-N 412.421 2.323 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](S(N)(=O)=O)C3)cc2Cl)C1 799993988 MTORUXNVYIFTQR-DZGCQCFKSA-N 414.959 2.149 10 20 HECD C[C@@H](OC(=O)[C@H]1CCCC(=O)N1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 800244170 NMZNXCWOUDRYHQ-SJKOYZFVSA-N 420.421 2.001 10 20 HECD Cc1cc(C(=O)NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1ccccn1 804498714 RROCXTZZYSXSPI-FUHWJXTLSA-N 404.536 2.327 10 20 HECD Cc1nn(C)cc1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805018787 VRTCOBLTMYJCBC-ZDUSSCGKSA-N 400.451 2.277 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@H]3CCCN(C)C3)cc2)CC1 805024546 JPAPGBMXSTZVEJ-FQEVSTJZSA-N 400.567 2.339 10 20 HECD CNC(=O)CC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 806457607 POGPWECSYQMPEA-KRWDZBQOSA-N 420.529 2.377 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1nc2cc(OC)ccc2n1C 806667310 APSSFELWDGQATB-UHFFFAOYSA-N 410.474 2.343 10 20 HECD CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 806831086 PUFBXLWLAFOGSV-UHFFFAOYSA-N 418.519 2.305 10 20 HECD COc1cccc2c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)n[nH]c12 809619313 RTTURLKBZRZMNN-OAHLLOKOSA-N 407.474 2.203 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 814181424 YZFNNYNHVBIONR-MJGOQNOKSA-N 415.534 2.428 10 20 HECD O=C(COC(=O)c1cccc(O)n1)Nc1cccc2c1C(=O)c1ccccc1C2=O 814473656 HHPMPGSJIGWROX-UHFFFAOYSA-N 402.362 2.358 10 20 HECD O=S(=O)(CCN[C@H](CCc1ccccc1)c1ccccc1O)N1CCOCC1 815591659 NMRVBFDYJCZUBY-HXUWFJFHSA-N 404.532 2.318 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(-c4ncc[nH]4)c3)cc2)CC1 816379081 GKAVIEIPIGRLPD-UHFFFAOYSA-N 404.474 2.070 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1 915695941 BYUTYPQVMJBQNQ-UHFFFAOYSA-N 424.505 2.142 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(Cc1ccccn1)c1ccc(F)cc1 917791790 QJXMHQKPRLTWSN-UHFFFAOYSA-N 412.446 2.252 10 20 HECD O=C(Cc1ccc(OC(F)F)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335095 LVSJQLSSPUXBKM-UHFFFAOYSA-N 424.469 2.382 10 20 HECD COc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918439647 OJRFNFGWCQECMF-UHFFFAOYSA-N 401.438 2.050 10 20 HECD CCOC(=O)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 1319832956 SMLWKACRZMEXJP-INIZCTEOSA-N 424.500 2.326 10 20 HECD O=C(CCc1cnc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715916 XJXNIOXBWIVLAD-QDMKHBRRSA-N 418.881 2.359 10 20 HECD C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1)C1(O)CCC1 1847257930 LTOHPKPOIYEKHU-UGFHNGPFSA-N 408.882 2.118 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 33685058 BCHKUFSGYPXDGA-UHFFFAOYSA-N 410.467 2.362 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(c3ncnc4ccsc34)CC2)cc1 303908474 MJXRCOWHSJWNEZ-UHFFFAOYSA-N 410.547 2.196 10 20 HECD CCC1CCC2(CC1)NC(=O)N(CC(=O)N[C@@H](C)c1cc(OC)ccc1O)C2=O 728980616 LQJPQDIGXWINRS-FHDQPZTMSA-N 403.479 2.469 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 731348230 BZEFDBVZENZNHA-UHFFFAOYSA-N 404.536 2.375 10 20 HECD CCn1cc(CN(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 733795698 HSSQIOOEAGFVQN-CALCHBBNSA-N 417.529 2.404 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1nnc(C(F)F)s1 738914741 RWINHQUDFFLFJI-UHFFFAOYSA-N 417.463 2.032 10 20 HECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)cc1 739926902 MZHZKXDEFVVPKZ-HSZRJFAPSA-N 424.501 2.496 10 20 HECD C[C@@](O)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccsc1 741080692 DMUBKFFLDOPJPK-IIBYNOLFSA-N 416.547 2.157 10 20 HECD COc1cc(Br)cc(CN[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1O 742390981 XYHNUULNAMPKOS-YGRLFVJLSA-N 409.284 2.180 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CCn2ccnn2)NC(=O)OC(C)(C)C)cc1 742754263 OFZFYLNIPFLMOV-QGZVFWFLSA-N 402.499 2.116 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 749348807 XBXILAAHMLMIMK-UZLBHIALSA-N 410.518 2.441 10 20 HECD COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NCCCSc1nccs1 749730091 INKZFDGZCCXLNV-UHFFFAOYSA-N 408.505 2.347 10 20 HECD CC(=O)c1cc(Cl)cc(CN(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c1O 750045936 YULZUOBUUDSYMH-HOTGVXAUSA-N 401.912 2.416 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1 751313798 QMTOCWWXCNXRAP-LLVKDONJSA-N 423.443 2.014 10 20 HECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 752377975 FZKIMIHHCPLNTQ-UHFFFAOYSA-N 423.922 2.455 10 20 HECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 752902250 IVVBWCARIMSXCE-RTWAWAEBSA-N 415.582 2.085 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(F)cc3F)CC2)cc1F 754036658 DUCKOYDOVCRXHG-UHFFFAOYSA-N 407.392 2.191 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@]3(C)CCOC3)cc2F)C[C@@H](C)O1 755122716 ZZUBUICFLIDAQT-ZSDSOXJFSA-N 408.470 2.025 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(O[C@H]2CCOC2)c1 755889018 KFYRVEJNXCQETJ-INIZCTEOSA-N 420.849 2.424 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)c1cncc(I)c1 756950442 VIUFSEOCNWQTAP-UHFFFAOYSA-N 423.254 2.453 10 20 HECD COc1ccccc1S(=O)(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759099487 CFYKLLDNLIVCIO-UHFFFAOYSA-N 422.503 2.232 10 20 HECD COCCNS(=O)(=O)c1ccc(CNCc2cc(Cl)cc(OC)c2O)cc1 761197811 DYAGQPQDFYDVOX-UHFFFAOYSA-N 414.911 2.269 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNc3cc(N4CCSCC4)ncn3)cc2)C1 764782664 HCKVNIQXAKNJIC-QGZVFWFLSA-N 412.563 2.344 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(OC)c(OC)cc2OC)c1 766430821 HDOQSQWJLVBJGP-LLVKDONJSA-N 404.419 2.243 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)c1 767795290 WHJQIGVGEDPOOL-ZDUSSCGKSA-N 411.451 2.434 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 772484551 HFSXVYGWFSSPNK-IPELMVKDSA-N 410.536 2.235 10 20 HECD O=C(Nc1ccnn1-c1ccncc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 780050497 LFDPCXJKGWRTFY-GOSISDBHSA-N 421.457 2.119 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 788334595 XQBNZANONFHIKP-RBBKRZOGSA-N 423.513 2.033 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3nccs3)cc2F)C[C@@H](C)O1 789819961 PJNNWBIJKOALBN-ZIAGYGMSSA-N 420.510 2.171 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 789823781 GJDDNLFJTYODDX-GJZGRUSLSA-N 423.554 2.457 10 20 HECD COC(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OC 795052687 GFMBXLQMBJBBPY-UHFFFAOYSA-N 413.474 2.251 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3cccc(F)c3)C2)cc1F 803665060 WEUOTHLJNGWIRK-IBGZPJMESA-N 403.429 2.247 10 20 HECD NS(=O)(=O)c1cccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 806438326 AAWGTEPOHOSGRN-UHFFFAOYSA-N 404.275 2.346 10 20 HECD Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 806912162 BULOSGNCPARDQH-UHFFFAOYSA-N 407.396 2.378 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 807099668 CAJGFPBRKGXQHJ-DEOSSOPVSA-N 407.514 2.378 10 20 HECD C[C@H]1CO[C@H](C)CN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769844 IYFYEKNHTLILLK-ZNMIVQPWSA-N 411.449 2.009 10 20 HECD Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918283450 KPHMAPUTWQIORO-UHFFFAOYSA-N 414.481 2.292 10 20 HECD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 919877751 AAUJBHLFSXFQQG-UHFFFAOYSA-N 418.475 2.148 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 1321703267 WGJXVCKEBXLZIP-PLTLITPRSA-N 417.380 2.044 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1c(C)nn(C(F)F)c1C 1323859159 HWPWMRJHBMQRAQ-AWEZNQCLSA-N 411.405 2.139 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cscn1 1816487536 YZQPOECYVXXIGQ-ZDUSSCGKSA-N 414.447 2.292 10 20 HECD O=C(Cc1ccc2c(c1)CCC2)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848076894 VTTGVWCTJOLRSX-OALUTQOASA-N 407.470 2.040 10 20 HECD CCN(CC)C(=O)CCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 726382452 UTMXYDCSAJZBBL-SFHVURJKSA-N 402.539 2.043 10 20 HECD COc1ncnc(OC)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 731975632 KZONQZJGSWZXFU-BETUJISGSA-N 404.442 2.177 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1cc(S(N)(=O)=O)cc([N+](=O)[O-])c1C 735855948 CCIMJSNJNNDHPD-UHFFFAOYSA-N 407.448 2.309 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@@H](C3OCCO3)C2)c1 738148937 RMACPBAGHDPENK-QGZVFWFLSA-N 404.507 2.012 10 20 HECD CN(CC(=O)NCc1ccc(OCC(N)=O)cc1)Cc1ccc(N2CCCCC2)cc1 738297759 BHAHKMYMUKJPKM-UHFFFAOYSA-N 424.545 2.289 10 20 HECD O=C(NCCNc1nccc(C(F)(F)F)n1)NCc1ccc(N2CCOCC2)cc1 738461429 UPKGEXJZCNQVHM-UHFFFAOYSA-N 424.427 2.243 10 20 HECD CCc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 740277047 XPJNYXTUJISBSU-ZIAGYGMSSA-N 419.453 2.463 10 20 HECD CCn1nc(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1Cl 741913522 KCXQYHMUXNQOCD-HNNXBMFYSA-N 403.914 2.497 10 20 HECD C[C@H](COCC(F)(F)F)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 742760099 JHEADKLZYIHJED-UKRRQHHQSA-N 416.444 2.155 10 20 HECD Cc1cc(C(=O)CN2CCCOC[C@@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749515680 OCYRRSGPEOOMCW-HNNXBMFYSA-N 405.520 2.035 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCC(=O)N3C)c2C)cc1 752013962 DMPYOLJGZAFZAP-SFHVURJKSA-N 412.442 2.227 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 753154067 LBKNAQVGQGGWIX-AFJIDDCJSA-N 413.547 2.294 10 20 HECD COC(=O)c1ccc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1F 761835669 NMLLSWQKBYICHT-UHFFFAOYSA-N 401.438 2.382 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)c1 761973558 RKPURWMYMMBFQB-NSHDSACASA-N 404.375 2.386 10 20 HECD COc1cc(N2CCN(C(=O)c3nccn4cc(C)nc34)CC2)cc(OC)c1OC 762263890 KJMOCZJNZAXXGL-UHFFFAOYSA-N 411.462 2.026 10 20 HECD CC(C)c1nc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n[nH]1 763008420 ILNBRRSTGKXSGI-GOEBONIOSA-N 413.526 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)CONC(=N)COc3ccc(F)cc3)CC2)cc1 764568356 GAMRMKSROOPLQQ-UHFFFAOYSA-N 416.453 2.060 10 20 HECD COC(=O)C1(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCCCC1 767644264 IFMUSUFUVDRMCL-UHFFFAOYSA-N 403.523 2.199 10 20 HECD C[C@H](NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc(N(C)C)cc1 773088103 MAPQFZJRMBLEMK-HNNXBMFYSA-N 415.515 2.419 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCc4ccccc4C3)CC2)cc1 775123744 WEGJUFQURLGYSN-FQEVSTJZSA-N 407.514 2.454 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(OC)cccc2OC)cc1 775271384 KXFFYLPDNSJQAD-UHFFFAOYSA-N 400.478 2.266 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N2CCC(C(=O)NCCC(C)C)CC2)c1 775372822 JSXRTQVLWKPIBN-INIZCTEOSA-N 405.539 2.452 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccc(F)cc3)c3cnn(C)c3)nc12 775753092 NSTOMRQJOYMIGD-LJQANCHMSA-N 424.436 2.363 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 779223051 ZQOAECXPKBGTGP-NWSQWKLXSA-N 405.583 2.314 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3ccc(F)cc3F)cc2)C1 779878124 ZORHWCQYEQFGEQ-OAHLLOKOSA-N 423.485 2.286 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(-c4ccccn4)no3)cc2)CC1 786655539 FMZUSUCVLXOGGZ-UHFFFAOYSA-N 405.458 2.335 10 20 HECD CCOc1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 787216260 VKUNSOAWCRXPCG-UHFFFAOYSA-N 411.502 2.197 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H]3CCOC(C)(C)C3)cc2F)C[C@@H](C)O1 789818734 KOJVMUCTOUJJEW-UXLLHSPISA-N 421.513 2.129 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c3ncccc23)cc1 797431432 OLJTVNPZBGDCMI-UHFFFAOYSA-N 410.452 2.051 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)c1 804117514 CJDNRDIEQYCWPZ-WMZOPIPTSA-N 410.518 2.334 10 20 HECD O=C(NCCC[C@@H]1CCCCO1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807994836 VBWHGDRPMXDONO-RBUKOAKNSA-N 404.507 2.365 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1(C)C 809127613 RGPSOLIJIYKXHF-SGXKBVARSA-N 404.507 2.220 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1COc2ccccc2[C@H]1O 812009400 PDUOQMUXLWXPEK-WIYYLYMNSA-N 415.465 2.081 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccco4)n3)cc2F)C[C@@H](C)O1 917713253 JXHPAJNGQIAERE-ZIAGYGMSSA-N 414.441 2.002 10 20 HECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(Cc2ccc(N(C)C)cc2)CC1 920258811 XFDZYIAIWBGNRH-UHFFFAOYSA-N 418.519 2.476 10 20 HECD CCOC(=O)C[C@H]1CCCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 1320578196 GQLNDLLZIOLSIR-HXUWFJFHSA-N 404.507 2.345 10 20 HECD Cc1cnn(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)c1 1788286199 PXLVBTLZJKPNNA-UHFFFAOYSA-N 421.457 2.446 10 20 HECD CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817848386 GXIRMCBKCBXBDM-IAQYHMDHSA-N 415.450 2.137 10 20 HECD COc1ccc(N2CCCN(C(=O)COCCNC(=O)OC(C)(C)C)CC2)cc1 732551297 ITTLISKLXKMWIE-UHFFFAOYSA-N 407.511 2.275 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CC3CCOCC3)cc2F)C[C@@H](C)O1 735358682 BSHZUAOYGUXEHQ-HZPDHXFCSA-N 422.497 2.415 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CN1CCOCC1 738978690 WMQVPVSHALNABM-OKZBNKHCSA-N 422.545 2.207 10 20 HECD CCOc1ccc(N(CC)CC(=O)N(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 744391945 QMKWILRTXBXOIW-UYAOXDASSA-N 424.563 2.106 10 20 HECD C[C@H](NC(=O)CNC(=O)CN1CCOc2cc(N(C)C)ccc21)c1ccc(F)cc1 746492970 ONHHRDOLGNYCLL-HNNXBMFYSA-N 414.481 2.084 10 20 HECD COc1ccc(N2CCCN(C(=O)Cn3c(S)nc4ccccc4c3=O)CC2)cc1 746686324 PRTPFYTWBAJCEZ-UHFFFAOYSA-N 424.526 2.433 10 20 HECD C[C@@](O)(CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 756326542 MVIVZTVTQYMLDI-HSZRJFAPSA-N 407.422 2.495 10 20 HECD CS(=O)(=O)c1cccc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)c1 756335868 KMXLVXIJIASVLS-GOSISDBHSA-N 418.515 2.415 10 20 HECD CCCn1ncc(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1C1CC1 766169414 IGQIOQWNWVRCHX-UHFFFAOYSA-N 413.434 2.453 10 20 HECD Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769701187 HBHJHKREUCBEPZ-UHFFFAOYSA-N 403.460 2.217 10 20 HECD CCC[C@@]1(CO)CCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 770299744 LSURPSVWRWNLNC-GCJKJVERSA-N 402.539 2.225 10 20 HECD Cc1ccc(C(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c(O)c1O 770476100 HEKYMKLUWSSXHP-MRXNPFEDSA-N 414.458 2.010 10 20 HECD CCc1nc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)co1 772385183 FLMYXAVTTKLILX-KBPBESRZSA-N 419.453 2.463 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2C[C@@H](OCCOC)C[C@@H](CO)C2)cc1F 774849311 DGQWNSWCQNVRKC-MSOLQXFVSA-N 411.518 2.227 10 20 HECD C[C@H](NC[C@@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccc(N2CCOCC2)c(F)c1 777126321 VEOGIVSDOXQAQZ-HTZUNMPGSA-N 404.486 2.033 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)NC1CCCCC1 777826363 KZVUTOKQEOCMBN-UHFFFAOYSA-N 411.886 2.179 10 20 HECD COc1ccc(Cn2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)n2)cc1 778508702 RNBOYDPVMMSDOE-UHFFFAOYSA-N 407.474 2.261 10 20 HECD CCc1oc(C(=O)OC)cc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 778603809 KNPVIBSTWYZKTH-UHFFFAOYSA-N 408.476 2.148 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cnn(-c4ccccc4)c3)ccc21 785971078 MDIHOZKUDZYMMB-UHFFFAOYSA-N 403.486 2.187 10 20 HECD Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 786111015 ICEMDKVNMOSTIJ-IBGZPJMESA-N 401.482 2.374 10 20 HECD COc1ccc(OC)c(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 786683975 OTKJTRJAOGWIDV-UHFFFAOYSA-N 411.502 2.279 10 20 HECD CCOCCOCCN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787334017 FDEPHKUADFBZBO-UHFFFAOYSA-N 410.470 2.385 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CC[C@@H]1c1ccccc1 789832598 BCDFUZWAUXMXSE-HXUWFJFHSA-N 411.477 2.377 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@]2(CCO[C@@H]2C)O1 790503013 ZBJMPSLHSAHZFD-WHSLLNHNSA-N 407.486 2.140 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](C)c3cc(OC)ccc3O)ccc2[nH]1 792345458 YWAKLDMIUQWIEA-LLVKDONJSA-N 410.430 2.058 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)c(O)c1 797388850 CBMJKAWVYJWFPW-UHFFFAOYSA-N 404.444 2.149 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CN2CCC(S(=O)(=O)N3CCCC3)CC2)c1O 800537710 GXCPRUSQIFPGBE-UHFFFAOYSA-N 403.888 2.344 10 20 HECD O=C(CN[C@H]1CCc2ccccc2OC1)NCc1ccc(N2CCOCC2)c(F)c1 801570335 DSRBXPXGWPVDTF-IBGZPJMESA-N 413.493 2.262 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCN(c2nccs2)CC1)c1ccc(N(C)C)cc1 803176633 NUAVKGSJSVVUAG-CQSZACIVSA-N 401.536 2.172 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C12CCC2 803308762 JPJQDJHMPQOEMW-NSISKUIASA-N 415.534 2.164 10 20 HECD COCCc1ccnc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 806657544 HOHYDSDFDPLAPP-GOSISDBHSA-N 411.506 2.294 10 20 HECD CC(C)COC(=O)N1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807672774 HUJXOTNZIKZNEX-QGZVFWFLSA-N 418.538 2.257 10 20 HECD O=C(Cn1cc(Br)c(O)nc1=O)NCc1cc(Cl)cc(Cl)c1O 807836551 FGSMMTFNSGZMGH-UHFFFAOYSA-N 423.050 2.040 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H](F)C(F)(F)F 810192522 MVAZSDBPSAHOJB-HNNXBMFYSA-N 415.366 2.459 10 20 HECD Cc1cc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)nc(N2CCCC2)n1 813600355 OBSGQSQKWLJDJT-UHFFFAOYSA-N 410.522 2.221 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H](CO)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 815273399 RFTCDFLJTNXUGH-KRWDZBQOSA-N 419.547 2.019 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(F)c[nH]3)cc2F)C[C@@H](C)O1 815392746 VXJQXGIBKWNBIC-BETUJISGSA-N 407.417 2.380 10 20 HECD CC(C)(C)N1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918782574 SKXLURVQIRCVRS-GOSISDBHSA-N 415.582 2.450 10 20 HECD CC(=O)N[C@@H]1CCCN(C(=O)COC(=O)c2sccc2-n2c(C)ccc2C)C1 919568788 MZUFKCZMKSLVPM-MRXNPFEDSA-N 403.504 2.440 10 20 HECD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1cc2c(cc1O)OCO2 1341569678 STJPELQKFKBDTA-AWEZNQCLSA-N 408.451 2.105 10 20 HECD COCCC(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1809408113 RXXQUBDJYXTSPG-GQCTYLIASA-N 418.490 2.084 10 20 HECD Cc1nocc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826044628 MYUYBMFUSLHIIZ-KRWDZBQOSA-N 414.462 2.336 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnnc(Cl)c2)C1 1842125289 LAWWZCCMKCAPBE-UHFFFAOYSA-N 423.256 2.325 10 20 HECD C[C@H](NC(=O)C(=O)Nc1nnc(C(C)(C)C)s1)c1ccc(N2CCOCC2)cc1 141700607 JPYVTUHVSSYYKH-ZDUSSCGKSA-N 417.535 2.488 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)C3CCCC3)cc2F)CC1 730235998 RRRQZGKUHGXXHJ-MRXNPFEDSA-N 404.530 2.279 10 20 HECD CCCc1[nH]nc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1[N+](=O)[O-] 731808451 YYGHHWSGSLBBDK-UHFFFAOYSA-N 405.430 2.301 10 20 HECD O=C(CN1C(=O)CCc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 732272849 FLVAQHMDWCVZMG-UHFFFAOYSA-N 407.514 2.491 10 20 HECD CN1CC[C@H](N(C)C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 737676906 CBEIIJRFKQTSDE-UROBUVALSA-N 423.585 2.419 10 20 HECD O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NCc1ccc(N2CCOCC2)cc1 740818705 CYGKXWZXJIJEGM-UHFFFAOYSA-N 424.469 2.378 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(F)c3)cc2F)C[C@@H](C)O1 743175862 VWSVXZCBZPHZMC-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCOCC1 746413780 JKNFAMKMYNVJJF-QUCCMNQESA-N 402.539 2.393 10 20 HECD Cc1nnc2n1C[C@@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CC2 750795392 OTENBCTUVCVPGL-YOEHRIQHSA-N 403.914 2.289 10 20 HECD COc1ccc([C@H](CNC(=O)c2ccc(C)c(O)c2O)N2CCOCC2)cc1OC 751533951 TXYGBCAUCRUYDB-KRWDZBQOSA-N 416.474 2.227 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H](Cn2ccnn2)C1 752647770 DTRNLSNIUZMPON-KRWDZBQOSA-N 416.501 2.000 10 20 HECD CC(=O)N1CCN(c2ccc(OC[C@@H](O)COCc3ccccc3F)cc2)CC1 755303502 IZKOQWHSJYCWIC-FQEVSTJZSA-N 402.466 2.451 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1 756642665 PYUXVNLYRXLLKS-OAHLLOKOSA-N 405.539 2.456 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccc(S(N)(=O)=O)nc2)c(C)n1-c1ccccc1 762876077 MLOBKBKBDDIIJL-UHFFFAOYSA-N 413.455 2.176 10 20 HECD COc1c([N+](=O)[O-])cc(N2CC[S@](=O)C[C@@H](C)C2)c([N+](=O)[O-])c1Br 763039982 DDKWOJPYSCGQLA-GPQZVPNXSA-N 422.257 2.479 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 765385012 KSXAWRKTCYSFAF-LJQANCHMSA-N 419.522 2.416 10 20 HECD CCOCCCNC(=O)C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768320716 ZSCMLPUPXNTREN-UHFFFAOYSA-N 407.530 2.417 10 20 HECD OC[C@@H](c1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768445012 DZGMCDDPYFWJJB-AZUAARDMSA-N 404.894 2.323 10 20 HECD O=S1(=O)CC[C@@H](N(Cc2cc3c(cc2O)OC[C@H]3O)Cc2ccccc2F)C1 768463474 JOMBKXJNCSOZSQ-DNVCBOLYSA-N 407.463 2.146 10 20 HECD O=C(NCCc1ccco1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 775113131 GEHLTFGLSFFJGM-CQSZACIVSA-N 407.417 2.325 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](CO)C3CCOCC3)cc2F)C[C@@H](C)O1 782501587 UCIUFCGKSDFLHF-CLCXKQKWSA-N 409.502 2.026 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC([C@H]4CCCO4)CC3)CC2)cc1 784361110 FQLWSXAJEKDTTQ-JTHBVZDNSA-N 403.567 2.069 10 20 HECD O=C(NCCCCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785664386 YESIIGRBWLYGHB-UHFFFAOYSA-N 413.493 2.418 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 785670930 PNOACMXIGLGUPT-BETUJISGSA-N 420.510 2.137 10 20 HECD Cc1nc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 786481780 GRQHVGCPXLDTST-QGZVFWFLSA-N 403.504 2.024 10 20 HECD CN(Cc1ccc(F)cc1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789832543 ACDLRWRLKSZZKT-UHFFFAOYSA-N 417.456 2.201 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)O)c(OC)cc1Cl 790405435 RREBRKOKCUFGAP-UHFFFAOYSA-N 415.807 2.340 10 20 HECD CCC1(CNC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCC1 793716347 CJIZMUIEVQFXTN-SFHVURJKSA-N 414.550 2.091 10 20 HECD CN1CC[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1=O 793929741 MJSMELPGETVLKX-PBBNAPBQSA-N 423.585 2.467 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCC(S(=O)(=O)N4CCCC4)CC3)ccc21 800703556 UBNBKWOUDKMAFF-UHFFFAOYSA-N 420.579 2.169 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](C)c1nccs1)c1ccc(N2CCOCC2)cc1 803308369 DQAGAMRUDJEJHB-CABCVRRESA-N 402.520 2.077 10 20 HECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688098 KZMYHCRQQAQVKW-LJAQVGFWSA-N 413.543 2.081 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ncc(-c2ccccc2)cn1 807755645 GGAFCBMMZQCPAU-UHFFFAOYSA-N 403.486 2.484 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)c1 812715214 FOFLWPMJQORNOF-NRFANRHFSA-N 418.515 2.221 10 20 HECD COc1ccccc1OCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918335532 OTTKEYFFECMIBS-UHFFFAOYSA-N 418.515 2.015 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc2ccccc2c(O)n1 918643318 JVKCNGCIGZELPN-UHFFFAOYSA-N 411.483 2.105 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C)nc1Br 1116647164 WRLJRBVUQZYJCV-ZDUSSCGKSA-N 423.263 2.468 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C1(F)CCC1)CCO2 1782008091 VPAYABPBZKHOLA-GOSISDBHSA-N 412.845 2.087 10 20 HECD CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783219819 CYQQPIQBQJJKEB-LAOKGPNQSA-N 418.490 2.131 10 20 HECD CC[C@@H](C)[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712662 PILPMSDHUCFCGF-HFVZKWEFSA-N 410.898 2.410 10 20 HECD CCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)COC1 1800718992 PUTIOFITGKLPDQ-BTTYYORXSA-N 408.882 2.430 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2)CC1 1825827241 AXEBKNVCHJFWSD-GOSISDBHSA-N 410.474 2.435 10 20 HECD CCn1ccc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n1 1842515644 MYHCGWNTLRVKCQ-UHFFFAOYSA-N 404.854 2.098 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(F)c3)CC2)cc1 12069522 TZPHOMBRFWELBL-UHFFFAOYSA-N 414.481 2.101 10 20 HECD COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(N2CCOCC2)cc1 165503470 CQJBTFAFNZVFCH-IBGZPJMESA-N 402.491 2.070 10 20 HECD COc1ccc(CCN2C(=O)C(=O)N(CN(C)Cc3ccc(N(C)C)cc3)C2=O)cc1 725765467 NIOUXODIXFDRKY-UHFFFAOYSA-N 424.501 2.184 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)C(=O)OC4)n2)c[nH]1 727247671 IBRHRKNPPUGREC-UHFFFAOYSA-N 419.440 2.396 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2OC)c1 734017349 FALZJCIRWCZCIK-SFHVURJKSA-N 414.458 2.339 10 20 HECD CN1CC[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 737727348 DIWSAHKRYCWAMX-GMCKNXKJSA-N 409.558 2.076 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)c3cccs3)cc2)C1 741081420 QDSMWZRSUMWXPA-WMZOPIPTSA-N 416.547 2.373 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCCc1cnn(-c2ccccc2)c1 746493185 TXKBCKTXYVPMSV-UHFFFAOYSA-N 405.502 2.496 10 20 HECD COC[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 746756829 LCHOPOHXJFUBPA-SFTDATJTSA-N 424.545 2.445 10 20 HECD CNS(=O)(=O)[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)C1 750218356 ZXDKTEWMTBFFFV-HXUWFJFHSA-N 415.559 2.389 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc4c3OCCO4)CC2)cc1F 754040384 PJIMGFLBZDLEGI-UHFFFAOYSA-N 408.451 2.116 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cncc(Cl)c3)cc2F)CC1 754802259 BDOIWOHIHKHUQU-UHFFFAOYSA-N 412.918 2.495 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccnc(O[C@@H]2CCOC2)c1 755371105 HAJHGDCISPOGKA-OAQYLSRUSA-N 411.502 2.388 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)C[C@@H]3CCOC3)CC2)cc1 759767710 WVQCPZNJNSHEQJ-MOPGFXCFSA-N 404.555 2.322 10 20 HECD COC(=O)[C@H]1CCCC[C@@]1(C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 759841609 AUNGYENPAIHJBO-DENIHFKCSA-N 403.523 2.055 10 20 HECD CN1CCC(N2CCC(N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)CC2)CC1 761187594 WIGXATGBQHDJRW-UHFFFAOYSA-N 420.941 2.368 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@]3(C)CCO[C@H]3C3CC3)CC2)cc1 767325769 YGSRGWYNIRVHFL-JTHBVZDNSA-N 416.566 2.322 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(-n4ccnn4)c3)cc2)C1 769017007 NSOGKPHBFWGUSW-QGZVFWFLSA-N 419.489 2.291 10 20 HECD CCOc1nccc(C)c1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 769085353 PAKGIZWFKGJYPI-UHFFFAOYSA-N 413.474 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3ccc(C)cc3)CC2)cc1 772726491 IHWVQYGXSOLHGO-VDZCTEQFSA-N 423.513 2.058 10 20 HECD CCCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 773247643 XXIRXXNFNOWWDN-UHFFFAOYSA-N 412.490 2.352 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1 773849574 WDAZVSBHNMYKKJ-INIZCTEOSA-N 424.501 2.041 10 20 HECD COC(=O)c1cn(C2CN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)C2)nn1 779544472 FPMMDAMBBZWYGK-UHFFFAOYSA-N 409.446 2.178 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(S(C)(=O)=O)ccc3F)c2)CC1 781271194 VSYLDFCQZCOIQC-UHFFFAOYSA-N 419.478 2.150 10 20 HECD CO[C@H]1Cc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cc2C1 784689656 KALCAXBIKDZRJR-ZHRRBRCNSA-N 423.513 2.453 10 20 HECD CCc1ncc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784762089 CQNRSZKXBNEKKD-HNNXBMFYSA-N 417.897 2.117 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](O)C[C@@H]3C(=O)OC)c2C)cc1 788602535 QSAHHTCVBQXYPU-FXAWDEMLSA-N 400.475 2.284 10 20 HECD COC1CCC(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789854810 DSLUYNUNHCBKEW-UHFFFAOYSA-N 405.564 2.177 10 20 HECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 789984459 RGQJHNPPHUHFEE-HBFSDRIKSA-N 414.550 2.090 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnnn3-c3cccc(F)c3)cc2)CC1 790045705 MTNGUJSXSQBUPT-UHFFFAOYSA-N 422.464 2.005 10 20 HECD COc1ccc(NC(=O)Cn2cc(NC(=O)c3c(F)ccc(O)c3O)cn2)cc1 790070525 BPOOXOLULDJCKA-UHFFFAOYSA-N 400.366 2.333 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1 790849445 SKAHTXZBANFWSU-UHFFFAOYSA-N 411.392 2.313 10 20 HECD CCC1=C(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCCO1 791540542 OOKVMGWTUUPOAM-UHFFFAOYSA-N 406.454 2.296 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(OCC4CC4)nc3)ccc21 803574791 WJMYVWIWAZBEPT-UHFFFAOYSA-N 408.502 2.185 10 20 HECD CC1CCN(C[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C2)CC1 803660857 HEOJJYKXZNOIJI-IBGZPJMESA-N 418.557 2.478 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cccc2cccnc12 804008898 KKBSYHKIDYQTAT-UHFFFAOYSA-N 418.497 2.346 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1nc(O)c2sccc2n1 807096848 UZWYBLDSTQSPFP-UHFFFAOYSA-N 413.503 2.046 10 20 HECD CC[S@](=O)[C@H]1CCC[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 809235065 SOWKCSRMZCIWOY-GIWHPOJPSA-N 419.591 2.440 10 20 HECD COCCn1c(-c2cnn(C)c2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 812087029 GNKUWFZUUGVIRU-UHFFFAOYSA-N 411.510 2.050 10 20 HECD CN(Cc1ccccc1S(N)(=O)=O)C(=O)NCc1ccc(N2CCCC2)cc1 814284296 PXUAGUMKQCUXMX-UHFFFAOYSA-N 402.520 2.276 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cn(Cc2ccccc2)nn1 815538033 RNFZTHNXHHKHTH-UHFFFAOYSA-N 402.505 2.020 10 20 HECD C[C@@]1(C2CC2)NC(=O)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1=O 916592287 WAZVJBLPPCBUPB-QHCPKHFHSA-N 417.421 2.121 10 20 HECD CCCC(=O)NC1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 917448904 KASPXEQVNSDTGR-UHFFFAOYSA-N 417.550 2.308 10 20 HECD COc1ccc(N2CCCN(C(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 917821745 YUTWXFXIWMMHHH-PMACEKPBSA-N 413.518 2.299 10 20 HECD CCCC(=O)NC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918221304 UYACTWRBQVULRY-UHFFFAOYSA-N 420.529 2.377 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)cc1 918434515 ONEDJROIWPBHEU-UHFFFAOYSA-N 407.478 2.072 10 20 HECD COCCOc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cn1 918455858 FVLNPBGFRHKCOD-UHFFFAOYSA-N 412.490 2.303 10 20 HECD CC[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCc1ccccc1 920636815 MUPKKNGFNFFAOJ-KRWDZBQOSA-N 406.460 2.016 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3cc(C(N)=O)c4ccccc43)CC2)cc1 1341406001 ARZXQGXIKOAVSE-UHFFFAOYSA-N 406.486 2.488 10 20 HECD CC1=C(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)CCO1 1810278010 BIXVODYBHNTDDK-UHFFFAOYSA-N 401.463 2.032 10 20 HECD CC(C)(C)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425842 AZFZHJHSWNTDBF-KRWDZBQOSA-N 418.538 2.114 10 20 HECD COCCn1cc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1=O 141999613 JPRFZHRUNWLUPC-MRXNPFEDSA-N 400.479 2.214 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc21 489814302 WZPIIESVSAARIF-OAQYLSRUSA-N 413.518 2.368 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H]2CCC[C@H](C(=O)NC(C)C)C2)n(C)c2ccccc12 553082566 HVQJQLQQYDCSAC-IRXDYDNUSA-N 412.534 2.303 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)Cc2nc(O)c3sccc3n2)n(C)c2ccccc12 577434879 DZKLZCFINJXXOE-UHFFFAOYSA-N 423.498 2.472 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(O)c(OC)c3)C3CC3)nc12 726377031 YODKFGUEUIUACL-UHFFFAOYSA-N 412.446 2.490 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 745795321 FIUPZYLSTZBALH-IBGZPJMESA-N 417.598 2.237 10 20 HECD Cc1nc2n(n1)CCN(C(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)C2 752895895 SODAIVZQSZTKGE-KBPBESRZSA-N 402.474 2.065 10 20 HECD CCOC(=O)c1cc(NC(=O)NCc2cc(OC)ccc2O)cc(S(C)(=O)=O)c1 753546074 JPRLXTTUCWNISK-UHFFFAOYSA-N 422.459 2.303 10 20 HECD COC(=O)[C@@H](NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCCC1 755131878 PNSDRWTWAZHXTL-NRFANRHFSA-N 403.523 2.055 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761401216 PRTCNPJPWBMOCT-KGLIPLIRSA-N 400.884 2.166 10 20 HECD COC(=O)[C@@H]1COCCN1Cc1cc(Br)cc(Br)c1O 775694126 GNEIXWGGLYGTLS-NSHDSACASA-N 409.074 2.291 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cc(C(C)C)no3)CC2)cc1 778278275 WUVNZQXXCLCOFW-CMDGGOBGSA-N 412.490 2.328 10 20 HECD CCOC(=O)c1cc(F)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 778557409 QBRCKEOVDADKOW-UHFFFAOYSA-N 416.452 2.175 10 20 HECD COc1ccc(CN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]2CCS(=O)(=O)C2)cc1 779513380 ISOMWQYFHVZQCN-HFTQHKIXSA-N 417.483 2.336 10 20 HECD COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295377 UDDAJPQSJQWNAV-SNVBAGLBSA-N 406.822 2.224 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 785422924 PUDFDCVZFWXBHE-LJQANCHMSA-N 403.429 2.247 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cccc(N2CCOC2=O)c1 785424419 PFJYNRCBXPWJHP-HNNXBMFYSA-N 410.474 2.203 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)cc3C)cc2)CC1 786122736 XXKZOATVRKLARF-UHFFFAOYSA-N 401.532 2.450 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)cc2)CC1 786261949 HPCNQUDUTKVCEU-FQEVSTJZSA-N 424.476 2.236 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(S(C)(=O)=O)s1 786881271 CLLCQESYZHFFCU-UHFFFAOYSA-N 423.560 2.330 10 20 HECD C[C@H]1CCC[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842459 CQPZUOPYXWHXFB-CVEARBPZSA-N 405.514 2.440 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3nc4cccnc4s3)CC2)cc1 792386720 YMMOULIIEANJKI-UHFFFAOYSA-N 412.471 2.206 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCc3ccc(F)cc3F)CC2)cc1 793823735 QEJOFPXYYGYENL-UHFFFAOYSA-N 417.456 2.371 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cncc(-c4ccccc4)c3=O)CC2)cc1 800839357 DGPIJSUFSBDRPT-UHFFFAOYSA-N 404.470 2.268 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H]1c1cccnc1)c1ccc(N2CCOCC2)cc1 803306691 WGWLYIVGRSTXEI-LAUBAEHRSA-N 408.502 2.459 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@]2(CCCOC2)C1)c1ccc(N2CCOCC2)cc1 803308790 KDTZJIHLGSNXEP-FDDCHVKYSA-N 415.534 2.120 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCc2ccccc2OC1)c1ccc(N2CCOCC2)cc1 803309225 RVRGEJSJBKDHFT-YLJYHZDGSA-N 423.513 2.210 10 20 HECD COc1cccc2c1CC[C@@H]2NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 804530012 RDWWIEIKPCNXRX-NRFANRHFSA-N 423.513 2.294 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3COC4(CCCC4)O3)cc2)CC1 805024351 ITKZPDLFCCJBFH-HXUWFJFHSA-N 415.534 2.341 10 20 HECD CN(C)CC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C 806388232 BZXCNVCHEISJIJ-AZUAARDMSA-N 419.566 2.382 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCN(CC(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673919 BMMAJHURHOUZLM-CQSZACIVSA-N 400.445 2.026 10 20 HECD CC(C)S(=O)(=O)CCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 808366878 CERSHQGWWVYPEW-UHFFFAOYSA-N 419.494 2.379 10 20 HECD C[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1nccs1 808816485 NVQYANUNPOROGC-ZBFHGGJFSA-N 403.504 2.276 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 810049059 IZNKPHZWYOOXMR-GOSISDBHSA-N 419.499 2.478 10 20 HECD CO[C@@H]1CCC[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 814563514 YSUGUQBICFJGHD-IAGOWNOFSA-N 408.470 2.027 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc2N1 918295683 SJIANIDGIFESPC-GOSISDBHSA-N 423.469 2.423 10 20 HECD CC(C)CN1C(=O)/C(=C/NC[C@H](c2ccccc2)N2CCCC2)C(=O)NC1=S 920980671 VPMVUKDFIBTKTP-XCMFGDQWSA-N 400.548 2.196 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1ccccc1)n1cccn1 1342914410 FEWGXAIWGYNFKA-PXNSSMCTSA-N 409.442 2.174 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3nccs3)CC2)cc1 51336457 FLPINWWTTLJGRO-UHFFFAOYSA-N 403.552 2.206 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)N(C)C[C@@H]2COc3ccccc3O2)c(O)c1O 727003702 CVCAYGPEDHOJMO-UONOGXRCSA-N 401.415 2.250 10 20 HECD CC[C@]1(C)NC(=O)N(CC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)C1=O 728839631 KKTBUNVECWDKDO-SFHVURJKSA-N 414.428 2.364 10 20 HECD COC(=O)CN(CC(=O)NC(=O)Nc1ccccc1)Cc1cc(Cl)ccc1O 731845459 YSQVLEVHDDAAJZ-UHFFFAOYSA-N 405.838 2.369 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 734406532 UIIGYHCIADVADP-HSZRJFAPSA-N 406.486 2.071 10 20 HECD COc1ccc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)c(OCC(=O)O)c1 734482919 KSANAKINKQGDTG-NTUHNPAUSA-N 411.457 2.225 10 20 HECD Cn1cc(-c2cccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)cn1 741672433 FUOFTGHMADJRAE-UHFFFAOYSA-N 424.526 2.252 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCC[C@@]34NC(=O)NC4=O)c2C)cc1 744623929 AUMBGTJNZTWZQB-OYHNWAKOSA-N 410.474 2.211 10 20 HECD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1F 749849762 GWKCUCNHSOFLMM-UHFFFAOYSA-N 405.904 2.201 10 20 HECD O=S(=O)(Nc1ccc(O)cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1 758169390 RQGIBOADHZMEIQ-UHFFFAOYSA-N 400.453 2.117 10 20 HECD CC[C@H](CN1CCCC1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 758713521 UTZJROQHFHIRDZ-RTBURBONSA-N 401.555 2.062 10 20 HECD CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCNC1=O 760116777 NKIVQOVQWHPFDP-GMCKNXKJSA-N 409.558 2.076 10 20 HECD C[C@H](NCc1ccc2c(c1)CCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 765608053 HPIQIRAZPLJUGD-INIZCTEOSA-N 402.516 2.493 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1 768900752 PZSJZRJRRRRCOQ-GOSISDBHSA-N 412.486 2.464 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@@H](C)c3cccnc3)cc2F)C[C@@H](C)O1 774131224 VKDDBMRISOFWKC-XHSDSOJGSA-N 414.481 2.328 10 20 HECD Cc1noc(C)c1CN(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 774182617 ZMPARBBFTJQSLM-UHFFFAOYSA-N 402.520 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](OC)C(C)(C)C)CC2)cc1 778295892 XQTDBFFRGYCRKP-GDWUOILNSA-N 403.523 2.077 10 20 HECD C[C@@H]1CN(C)C(=O)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 782881347 RZKMZXJMRXEOFL-OJLMPMFISA-N 423.585 2.419 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785295295 SQJHBGLFIJFNEM-KGLIPLIRSA-N 414.458 2.135 10 20 HECD CCc1nnc(-c2cccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2)o1 785295428 VDPUDPSOBPLRQP-LBPRGKRZSA-N 410.430 2.396 10 20 HECD C=C1c2ccccc2C(=O)N1CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786257173 NWYMSKPDJGTXGS-UHFFFAOYSA-N 418.497 2.098 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4c(C)nn(C)c4nc3C)cc2)CC1 786260574 YSRVHGCAIKGPMT-UHFFFAOYSA-N 420.517 2.184 10 20 HECD CCS[C@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799145 JLRAEMMSTICCBD-SJORKVTESA-N 423.554 2.411 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCc2ccccc2CC1 789862551 VTEPMUKRSIHUSL-UHFFFAOYSA-N 409.555 2.483 10 20 HECD CO[C@@]1(C)CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 792893348 RSVFGULNDNAWJB-AVRDEDQJSA-N 402.539 2.489 10 20 HECD CCC[C@@]12CCCN1C(=O)N(CCN1CCN(c3ccc(OC)cc3)CC1)C2=O 794776751 PBWDGKXUHIBWFF-QFIPXVFZSA-N 400.523 2.414 10 20 HECD CCOC(=O)Cc1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 795803226 HVFLMVXRRUNUPE-UHFFFAOYSA-N 418.515 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C(C)(C)c3c(C)noc3C)CC2)cc1 797509625 VIUJAJZBLHSWIA-UHFFFAOYSA-N 415.490 2.470 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)cc1 803306962 VPKMZINNLGMETL-IEBWSBKVSA-N 423.513 2.383 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCC3(C2)OCCO3)cc1)C1CCCCC1 803677602 RRVJXXUJNCTVSI-UHFFFAOYSA-N 401.507 2.047 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2ccccc21 803685924 PEUVMQYUBMJAJM-KRWDZBQOSA-N 406.530 2.253 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN(C2CCC2)C1 803686234 DGQPZJJAMSVLSI-YLJYHZDGSA-N 412.578 2.454 10 20 HECD Cc1cccc(CN2CCN(C(=O)C(=O)NCCCSc3nccs3)CC2)c1 806279945 FPXSOUGZNWIRLR-UHFFFAOYSA-N 418.588 2.394 10 20 HECD O=C(NC[C@@H]1COC2(CCCC2)O1)C(=O)N(Cc1ccco1)Cc1ccccc1O 806691015 GGUNKSLBXYPXCE-GOSISDBHSA-N 414.458 2.316 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)cc1 806952126 WBXCASKJXPRCOM-SFHVURJKSA-N 403.523 2.196 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1nccn1CC(F)(F)F 807099348 SLVAZMPDLKYJPZ-UHFFFAOYSA-N 411.428 2.095 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCc4ccccc4OC3)CC2)cc1 807694999 KAPWYKVVMTUKOU-IBGZPJMESA-N 423.513 2.244 10 20 HECD COC(=O)Cc1occ(C)c1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 813508730 NCKSRMJKCPBXOB-UHFFFAOYSA-N 409.822 2.478 10 20 HECD C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccc(Cl)c2nonc12 814378846 VHRQXFFIOYQNJH-MWLCHTKSSA-N 406.851 2.433 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 815470992 RBIPYSVTCLAFSN-JTQLQIEISA-N 421.475 2.124 10 20 HECD O=S1(=O)CCN(c2ccc(CN[C@H](c3ccc(F)cc3)c3nc[nH]n3)cc2)CC1 815579599 QXFLJBSXWLREOM-LJQANCHMSA-N 415.494 2.058 10 20 HECD CC(C)CN1C(=O)/C(=C/Nc2cccc(Cl)c2N2CCOCC2)C(=O)NC1=S 839401791 ZAWGVOCMEOWHLK-JLHYYAGUSA-N 422.938 2.372 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 917355453 DKWDAWCSOGXKSE-IERDGZPVSA-N 416.474 2.486 10 20 HECD CCO/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428686 BUEUFJXGBLEVKB-UEICXMAYSA-N 403.479 2.276 10 20 HECD CCOc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N(C)C)cc2)cc1 18214910 OPDFTTOLDZRZRB-UHFFFAOYSA-N 405.520 2.136 10 20 HECD C[C@@H](NC(=O)c1ccccc1OCC(=O)N(C)C)c1ccc(N2CCOCC2)cc1 145570394 WONBSKYTNSPIBL-QGZVFWFLSA-N 411.502 2.481 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)n(C)c2ccccc12 472811688 RYFFEOVEILGQHS-UHFFFAOYSA-N 402.458 2.381 10 20 HECD COc1ccc([N+](=O)[O-])cc1CNC(=O)C1=S=C(NC(=O)c2ccco2)C=C1C 543190346 XFTVGAMCCHOZCQ-UHFFFAOYSA-N 415.427 2.238 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(S(C)(=O)=O)ccc2Br)c1 734017007 WACFEXNDECVMPA-UHFFFAOYSA-N 414.277 2.497 10 20 HECD O=C(Cn1c(=O)nc(O)c2ccccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 735518428 VFGQJXOSOTZDAY-INIZCTEOSA-N 409.442 2.016 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3F)c2)CC1 740609856 NHKQUVKSQKDIPB-UHFFFAOYSA-N 422.438 2.236 10 20 HECD CC(C)(C)OC(=O)CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 741932793 WMZGZTSQCCNSPO-UHFFFAOYSA-N 410.382 2.442 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cn3nc(C)c(Cl)c3C)CC2)cc1 742920461 QGJZDHYMPLFJCK-UHFFFAOYSA-N 405.930 2.100 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3sc(S)nc3C)CC2)cc1 742920607 KZFPREKCKNLXDR-UHFFFAOYSA-N 406.577 2.230 10 20 HECD C[C@@H](O)[C@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 747615870 ANZNHTGBUWNBMR-OLZOCXBDSA-N 410.517 2.488 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3ccc(N(C)C)cc3)C2=O)c1 747873538 UQTFCVCXCMOIRJ-HXUWFJFHSA-N 412.490 2.375 10 20 HECD COc1ccc(N(C)CC(=O)NCC(=O)N[C@@H](C)c2ccc(F)cc2)c(OC)c1 752112054 NMZCYPKYOUSQCL-AWEZNQCLSA-N 403.454 2.273 10 20 HECD CCOC(=O)[C@@H](C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 752816297 SCDWBLHWQRWKLM-NSHDSACASA-N 412.489 2.184 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)sc1S(N)(=O)=O 754200547 PTNRJOUYITYIOH-UHFFFAOYSA-N 409.533 2.324 10 20 HECD Cc1ccc(O)c([C@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1 756590728 PLXJVCYRVYGFFX-KRWDZBQOSA-N 403.548 2.488 10 20 HECD COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 756663049 CMUYIFMRMMMTDD-UHFFFAOYSA-N 405.432 2.091 10 20 HECD C[C@H](N[C@@H](Cc1ccccc1)C(=O)NCCN(C)C)c1cc([N+](=O)[O-])ccc1O 756857499 OYAZJEVECQQSAW-KXBFYZLASA-N 400.479 2.240 10 20 HECD COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 759380158 WELJDAHIAIALFF-ZDUSSCGKSA-N 400.431 2.007 10 20 HECD COc1ccc([C@@H]2NC(=O)N(CCN3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1 761188349 ZKKAIUKBXYBRMB-NRFANRHFSA-N 424.501 2.119 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1sccc1S(=O)(=O)N1CCCCC1 762264472 ZGADJRNARFVCTD-UHFFFAOYSA-N 410.517 2.306 10 20 HECD COc1ccc(N2CCCN(c3ncccc3S(=O)(=O)NC(C)C)CC2)cc1 763034369 HLNIKDXKRHKDDR-UHFFFAOYSA-N 404.536 2.494 10 20 HECD NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2cccc(Br)c2O)c1 765945567 ZOKVKHUWVILNGI-UHFFFAOYSA-N 419.684 2.386 10 20 HECD NC(=O)COc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768910865 APUICEIBMSKWQK-KRWDZBQOSA-N 417.893 2.304 10 20 HECD Cc1cccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 769037350 LZFRMDJXKCTHBJ-FPOVZHCZSA-N 410.518 2.230 10 20 HECD COc1ccc(O)c(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 769541915 PHEAREVRMDPWOH-UHFFFAOYSA-N 421.471 2.042 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cnc4ccccc4c3)cc2)C1 770231425 QJYMJIAERSFINH-GOSISDBHSA-N 424.526 2.415 10 20 HECD O=C(C[C@@H](O)c1ccc(Cl)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 772609353 MKAKEEPOOIMTKA-LJQANCHMSA-N 422.934 2.315 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccc(N(C)C)cc1 773858586 RJCUZRNNQGISHK-OAHLLOKOSA-N 417.531 2.156 10 20 HECD COC(=O)[C@H]1CN(Cc2cc(Br)cc(Br)c2O)CCO1 775676055 JWVYACBXPWBPJP-LLVKDONJSA-N 409.074 2.291 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)ccc1C 775836262 LTCTYLHOXPBTQV-OAHLLOKOSA-N 404.536 2.258 10 20 HECD CCc1ccccc1S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 777898507 HPZNTFZNAOHHHC-GOSISDBHSA-N 401.532 2.429 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc(OCC(F)F)ccn3)CC2)cc1 777977332 USDXODNWDPCYOA-UHFFFAOYSA-N 420.460 2.286 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1 784026101 BRZKOQICRJEBQF-UHFFFAOYSA-N 422.485 2.470 10 20 HECD Cc1nc(Br)ccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296119 BRNIBLZVVYSTHY-VIFPVBQESA-N 408.252 2.250 10 20 HECD O=C(OC[C@H]1CCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785396175 FNMLLJXJSHVYGA-LBPRGKRZSA-N 422.415 2.295 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(NC(C)=O)c3C)nc12 785756989 OQRITZOCOFVOLY-UHFFFAOYSA-N 412.402 2.235 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1 785865155 HMOYVHVRAMKGAW-ROUUACIJSA-N 418.582 2.153 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cn4cc(Cl)ccc4n3)ccc21 786504824 WKIWVLNINCANAW-UHFFFAOYSA-N 411.893 2.303 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cc(F)ccc1F)c1ccc(N2CCOCC2)cc1 787037194 JGSSEYUGUIBLKH-AWEZNQCLSA-N 403.429 2.295 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1 789798386 GRMBQOLSYHUUAB-FGTMMUONSA-N 403.498 2.364 10 20 HECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789825665 NJJUVWIXDVRODC-OHRYMORCSA-N 421.513 2.129 10 20 HECD CC(C)(C)[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 790666430 PXPYGMMFCKTNSD-MJGOQNOKSA-N 402.539 2.345 10 20 HECD O=C(COC(=O)[C@@H]1Cc2ccc(F)cc21)NCc1ccc(N2CCOCC2)c(F)c1 796070239 YUZWFYRUBLTLJZ-GOSISDBHSA-N 416.424 2.301 10 20 HECD CS(=O)(=O)CC1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 813584082 NCNYLKHZEUNJGH-UHFFFAOYSA-N 411.593 2.206 10 20 HECD CN(C/C=C\C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)CC(F)(F)F 814588855 XQACVOXNSYTGKM-OICCZTGUSA-N 412.456 2.055 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn2ccnc12 815397623 CKLMDFBGRXVXJW-UHFFFAOYSA-N 421.501 2.106 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc4c(cc3O)OCO4)CC2)cc1 916731666 LRBRDROHDYFYJM-UHFFFAOYSA-N 413.474 2.072 10 20 HECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)Nc1c(Cl)ccc2nonc12 1346941762 YIJCHUPZVPXLAN-UHFFFAOYSA-N 418.841 2.088 10 20 HECD O=C(CC1(O)CCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429447 VJYDXQKLFOUNTG-QGZVFWFLSA-N 417.506 2.031 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc3occc3c2O)C1 1845657466 HEYUKZXRQIBFMB-UHFFFAOYSA-N 409.398 2.075 10 20 HECD COc1cc(C(=O)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc(OC)c1OC 18150640 QMXCGYCBMORIIH-UHFFFAOYSA-N 415.490 2.167 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1F 60749464 UQGLUPQJRVGFBA-UHFFFAOYSA-N 415.465 2.488 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)CCN2C(=O)CNC(C)=O 735654028 CHMIDQFHTGAGCL-UHFFFAOYSA-N 422.529 2.440 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 746355125 RMGVBGKQCUJBSB-STQMWFEESA-N 417.485 2.045 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)CC2)cc1F 753738845 LWWLBIXLVKEGNY-OAHLLOKOSA-N 410.453 2.398 10 20 HECD COC(=O)c1c(C)cccc1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754039738 FGVZJIJLHKABBE-UHFFFAOYSA-N 422.478 2.440 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3nc(Cc4ccccc4)no3)nc12 755103298 SVTBARFABXHXEM-CYBMUJFWSA-N 422.445 2.436 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)cc(OC)c1OC 760084056 IXTPKBACPFJFMU-UHFFFAOYSA-N 402.447 2.394 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc([C@@H]2CCCO2)s1 760383145 ULDOODTYVSWAGA-INIZCTEOSA-N 421.544 2.159 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCC[C@@H]1N1CCOCC1 763586075 FXCUYPJXLVNOEJ-CTNGQTDRSA-N 420.529 2.105 10 20 HECD Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1 768425965 XLWDQBBPDPYXFM-JOCHJYFZSA-N 405.458 2.478 10 20 HECD COc1cccc(CN2CCN(C(=O)c3ccc(OC)c(OC)c3OC)CC2)c1O 769539739 MOVUWIGUYBTVLT-UHFFFAOYSA-N 416.474 2.385 10 20 HECD COc1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)on1 772325601 CBDZYTJEWKCGKQ-UHFFFAOYSA-N 406.350 2.254 10 20 HECD CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775255444 QMJPFTBPZUPOBF-WZONZLPQSA-N 409.530 2.490 10 20 HECD COCC1=CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 775830021 WTRRTLKXQHBICF-UHFFFAOYSA-N 417.531 2.203 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)c1 777961710 LJACPSAJMUIEOG-VIFPVBQESA-N 400.384 2.496 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CO)c3ccccc3)cc2F)C[C@@H](C)O1 782053643 TZHQNEWOOKRSPA-LLGFUMIMSA-N 415.509 2.379 10 20 HECD COC(=O)c1cc(F)cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 782426637 OLXHZAGJBTUUOV-CQSZACIVSA-N 422.478 2.488 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(F)n3)cc2F)C[C@@H](C)O1 783207139 PREJNUQFJIAOSA-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)(C)OC(C)(C)C3)CC2)cc1 785798468 ZEEJILXZDWKPOJ-ZHACJKMWSA-N 415.534 2.316 10 20 HECD O=C(NCCCc1nc2ccccc2[nH]1)C(=O)NCc1ccc(N2CC=CC2)cc1 788459169 KPHMGTBRCOOIEV-UHFFFAOYSA-N 403.486 2.304 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCS3)cc2F)C[C@@H](C)O1 789833673 IFPADPZGHZHGLO-LZWOXQAQSA-N 409.527 2.067 10 20 HECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854415 HPJUHNUETIQRFI-CYBMUJFWSA-N 402.520 2.338 10 20 HECD Cn1nccc1[C@H]1CCC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 790486162 MRUUHDFTVBFYPC-RBUKOAKNSA-N 402.564 2.471 10 20 HECD C[C@H]1CCCN(C[C@@H](C)NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 793899658 BKFDTZVENUYQEM-ZWKOTPCHSA-N 400.567 2.480 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CCCn2ccnc2C)cc1F 804853555 RHVPLAGJPSABLD-UHFFFAOYSA-N 403.502 2.342 10 20 HECD C[C@@H](NC(=O)N1CC[C@@H](C(=O)N2CCCC2)C1)c1ccc(N2CCOCC2)cc1 804988379 BOGKHQMJYGKAPP-IEBWSBKVSA-N 400.523 2.238 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]4CN(C)CC[C@@H]43)cc2)CC1 805025916 ZXEUYRPRLIKHTD-IRLDBZIGSA-N 412.578 2.482 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCOC4(CCCC4)C3)CC2)cc1 808105148 YDMYWAWQHZUWIL-SFHVURJKSA-N 415.534 2.342 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc2[nH]ccc12 808924325 KCXHUYDTFRPRMS-NSHDSACASA-N 411.414 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(-c4ccco4)[nH]n3)CC2)cc1 913298610 OHEUMJCBXAZJNY-UHFFFAOYSA-N 410.430 2.184 10 20 HECD NS(=O)(=O)c1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)c([N+](=O)[O-])c1 917085572 SNIUYOBVPBCQBV-UHFFFAOYSA-N 420.491 2.063 10 20 HECD C[C@@H](c1ccccc1)N(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 1319814775 XHPXCUBXSBUNGQ-LPHOPBHVSA-N 402.516 2.259 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccc(OC)cc1 1320399081 PZTBOQFLRLUACO-HNNXBMFYSA-N 409.385 2.489 10 20 HECD C[C@@]1(CO)CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1323317851 ATAGAHHFJYOLLS-GOSISDBHSA-N 410.517 2.489 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@H]3C[C@H](O)c3cnn(C)c3)cc2F)CC1 1324777560 ZLTXUYTZHCHXCW-UGKGYDQZSA-N 401.530 2.399 10 20 HECD Cc1ncncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1798883712 PVWGXANHBLXOFG-BTTYYORXSA-N 416.865 2.415 10 20 HECD Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845263 IQQPADHDZGNMSD-OAHLLOKOSA-N 410.434 2.472 10 20 HECD O=C(Cc1cscn1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501276 VLAXQBFDKYLMFD-UHFFFAOYSA-N 407.879 2.267 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C[C@@H]1Oc2ccccc2NC1=O 27946561 MHMRFOCONAJMBD-IBGZPJMESA-N 411.458 2.044 10 20 HECD CC(C)N1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 727832210 PJJPPNZOXXZDOO-OALUTQOASA-N 420.573 2.472 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1c(S)nc2ccccc2c1=O 728302151 KZQNSVRGGVICCC-UHFFFAOYSA-N 424.526 2.180 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1 729279035 YPZISCZMPMBQIZ-DOMZBBRYSA-N 410.517 2.493 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 734703287 LQNGVSFLADJQAN-UHFFFAOYSA-N 412.490 2.026 10 20 HECD NC(=O)CSc1ccccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739768623 TXZURXSYSGYUFO-UHFFFAOYSA-N 412.515 2.218 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cnc4onc(C)c4c3)CC2)cc1 740950317 UDDKFYUYGFSBJM-UHFFFAOYSA-N 410.430 2.045 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1C(=O)N(C)C 741097141 LRELLRWFIQXEIG-UHFFFAOYSA-N 406.486 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(CCO)Cc3ccccc3)CC2)cc1 743358370 JAYZHNHPMDGDDZ-UHFFFAOYSA-N 412.534 2.021 10 20 HECD CCN1CCN(CCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 743734825 AGXWUIJSYROHRL-KRWDZBQOSA-N 410.509 2.401 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nn1C 748637489 QUQXSUUMKMCKBX-UHFFFAOYSA-N 424.484 2.306 10 20 HECD C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1CCN(c2ccc(F)cc2)CC1 753643374 JMVYYTAAZDEHAH-CVEARBPZSA-N 401.482 2.495 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-c4n[nH]c(C)n4)cc3)nc12 757078819 LGJLOKXEEBGNLB-UHFFFAOYSA-N 422.401 2.062 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](c3cccs3)N(C)C)CC2)cc1 758188099 YHLAOQRTZMCJOH-TZIWHRDSSA-N 418.607 2.132 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]([C@@H](C)O)C3)cc2F)C[C@@H](C)O1 760877834 ZSNGRJUTKJIWDE-MTNOOBJLSA-N 407.530 2.148 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)Nc1cc(N2CCCS2(=O)=O)ccc1F 761627388 FGAUXRWLENTISI-UHFFFAOYSA-N 409.439 2.141 10 20 HECD COc1ccc(N2CCN(CCN[C@@H](C)c3ccc(-n4cnnn4)cc3)CC2)cc1 765401463 LGCHLPNBDLXSPS-SFHVURJKSA-N 407.522 2.144 10 20 HECD Cc1nc2ccccc2c(=O)n1CC(=O)NCc1cccc(Br)c1O 765755341 IHVNHEHAQPTSSK-UHFFFAOYSA-N 402.248 2.489 10 20 HECD C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 768254276 DCGVNPUBBGMJDQ-BVIKNXMNSA-N 409.502 2.121 10 20 HECD NC(=O)c1cc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1Cl 772908377 YJOBATAJMUSMGE-UHFFFAOYSA-N 420.872 2.143 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773110475 DUUDQOPKSWYVSI-HNNXBMFYSA-N 404.536 2.362 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773614224 SKPCTLOMAGJXMF-INIZCTEOSA-N 418.538 2.257 10 20 HECD COc1cccc(CNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1O 775516333 HUQXECMUOCOHGX-UHFFFAOYSA-N 405.476 2.472 10 20 HECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1ccc(S(=O)(=O)NC2CC2)cc1 776748757 FSZSJFPJZMDWOF-UHFFFAOYSA-N 402.881 2.287 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 779062620 YLGTXUZERUVLQI-GOSISDBHSA-N 423.579 2.411 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 779866589 ZIQJAEQMQAXWSW-UHFFFAOYSA-N 405.476 2.298 10 20 HECD CCN(CC)C(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785408679 WFTKRPCPSCTCLU-UHFFFAOYSA-N 412.489 2.280 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCCOC[C@H]1CCCO1 785567184 QBAJHVHCMFBMGM-OAQYLSRUSA-N 417.550 2.337 10 20 HECD C[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)[C@@H]1CO 785865076 VPKPDGDEVXIINN-SUMWQHHRSA-N 401.429 2.454 10 20 HECD COCc1cccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 787519779 NAOXEOQXODIZTO-UHFFFAOYSA-N 411.502 2.243 10 20 HECD COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1 788405142 ZYWQMRYHONGJCU-MRXNPFEDSA-N 411.502 2.278 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(Br)nc2OC)c1 789562531 JGJDKDGACCSPRL-SECBINFHSA-N 424.251 2.383 10 20 HECD CCSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841416 XFCXFKAXCCXPKT-AWEZNQCLSA-N 411.543 2.051 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)COCc1ccccc1 793953042 DRURROYCQSQYSL-MRXNPFEDSA-N 401.482 2.477 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3[nH]nnc3-c3ccccc3)CC2)cc1 797715849 VFWUGQQFYRMKGF-UHFFFAOYSA-N 406.490 2.032 10 20 HECD CC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ccccc21 803665019 RSFKBDAFUFJAAB-SFHVURJKSA-N 412.465 2.122 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@H](c4ccc(F)cc4)C3)ccc21 803686591 MZAUFTXBSXPNRZ-NRFANRHFSA-N 411.477 2.424 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1F 804852795 NSAZNYWQYCRXJM-MRXNPFEDSA-N 421.513 2.478 10 20 HECD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCc1cc(Cl)cc(Cl)c1O 805187178 ZAKYCSIKZYBNQR-HNNXBMFYSA-N 417.337 2.441 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 806421661 WXKKCVFYUGTCTG-UZLBHIALSA-N 408.502 2.242 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NCc2cccc(OC)c2O)s1 807565534 MYZAOUIJMMPZAD-QWRGUYRKSA-N 407.496 2.277 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccnc(-n2cccn2)c1 918204593 MDBULUKHQCBFFI-UHFFFAOYSA-N 420.517 2.475 10 20 HECD C[S@@](=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918373355 WTDUBECZSQMEKH-ADXZGYQBSA-N 413.543 2.197 10 20 HECD CCc1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n[nH]1 919087374 KLKXIIAKFQWUGJ-OKILXGFUSA-N 418.469 2.198 10 20 HECD CSc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccn1 919738130 VCLSCGFCSPNQDX-UHFFFAOYSA-N 419.478 2.252 10 20 HECD C[S@](=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1330730853 NLMMXFNGVUWOSP-BCOMRZATSA-N 414.531 2.447 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C1CCC1 1786305751 ZTMMIEVZUGPREX-JDFRZJQESA-N 408.882 2.145 10 20 HECD O=C(CC(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1817102140 OADCWHFLGNYXTA-NSHDSACASA-N 413.356 2.474 10 20 HECD C/C=C(/C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031738 JLYTZVTXCZWKKO-BNNQUZSASA-N 403.479 2.071 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1 729062756 DLFPSOTXGWUXMH-CYBMUJFWSA-N 422.441 2.181 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CSCN1C(=O)C(C)(C)C 730322957 OFJHBPLZMCOALZ-QGZVFWFLSA-N 421.563 2.202 10 20 HECD O=C(Nc1nc2c(s1)COCC2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735584553 MKJDHSSJSCQURR-AWEZNQCLSA-N 417.487 2.068 10 20 HECD COc1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)cc1Cl 743281596 CWAWAOMXEJKOCC-WQLSENKSSA-N 406.938 2.099 10 20 HECD COc1cccc(CNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1O 745800786 OCLGRZKOKQAJEB-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(C(N)=O)cc3)CC2)cc1F 753857845 PXNLEWYSFACCGS-CQSZACIVSA-N 400.454 2.082 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1 760322925 PJVIXCHBYIXWCI-ZDUSSCGKSA-N 412.421 2.168 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(C4OCCO4)c3)cc2)C1 763962560 GRDZFJRPACOJLD-IBGZPJMESA-N 409.486 2.364 10 20 HECD COCc1ccc(/C=C2/SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)o1 764412117 PMSUOEHHEQNQLT-OVCLIPMQSA-N 424.525 2.475 10 20 HECD CNc1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 765386852 QFPFTXQDYLXMTH-OAHLLOKOSA-N 411.462 2.268 10 20 HECD Cn1cc([C@H](O)C[C@@H]2CCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 766776868 MSVIPDXRXWTCMY-LEWJYISDSA-N 413.522 2.054 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC4(O)CCCCC4)n3)CC2)cc1 771066692 JCDPDMPCZWVBGB-UHFFFAOYSA-N 414.506 2.207 10 20 HECD Cc1csc(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 774146888 MDOIHZPULCKQRW-OKILXGFUSA-N 420.510 2.137 10 20 HECD COc1cccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3O)CC2)c1 774841103 NPHYBNGCYNVAAV-UHFFFAOYSA-N 401.419 2.276 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 775137182 KZDOFRYOAZVEKY-UHFFFAOYSA-N 424.549 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CC3(Cl)Cl)CC2)cc1 778238860 QNEOJSXYMGREEX-LMVHVUTASA-N 412.317 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(O)c(F)c3)CC2)cc1 778390323 NYXVORPBZSUJCC-HJWRWDBZSA-N 413.449 2.061 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)cc1 778458241 UTJOWPBZUUNAAY-GDWUOILNSA-N 415.534 2.362 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 781520658 IZZFUJQHWLDYQB-UHFFFAOYSA-N 409.442 2.113 10 20 HECD CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784222577 SYXKNRFHHHGRFQ-CQSZACIVSA-N 409.435 2.240 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN3c3ccccc3)nc12 785130869 DPFTYGUQXFNIPS-KRWDZBQOSA-N 410.430 2.324 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1 785294988 GCSVXOPKZJVHRR-AWEZNQCLSA-N 415.515 2.337 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cc1 785432623 FVHIROUKONPOMJ-IBGZPJMESA-N 403.429 2.247 10 20 HECD CC(C)n1ncc2c1C[C@@H](NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)CC2 788938605 SZLDHVBYDLWPQY-IBGZPJMESA-N 409.534 2.354 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC[C@@H](C)C1 792466533 XUKUCNSGMIDNAH-MJGOQNOKSA-N 407.530 2.416 10 20 HECD COc1ccc(CNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c(O)c1 792888737 CJTCEOQUFWAZPF-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1c(F)cncc1F 796625647 JTUPSJFERIYTJN-ZDUSSCGKSA-N 408.424 2.303 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1-n1ccnn1 796764130 UTSRRDCTCYBHDZ-KRWDZBQOSA-N 411.531 2.353 10 20 HECD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 797639534 FADNPUAFBCNCFD-IAQYHMDHSA-N 422.507 2.023 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cn(C)nc1-c1ccccc1 806776091 ONACDZRRJYHPKJ-UHFFFAOYSA-N 405.502 2.428 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC(C)(C)NC(=O)OC(C)(C)C 807098388 XSIQZSPVINZJDT-UHFFFAOYSA-N 406.527 2.097 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807672288 XMIXOMGXUBEMBC-OXJNMPFZSA-N 408.502 2.194 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4O[C@@H](C)C[C@H]4C)n3)CC2)cc1 809464657 JTRTXWHGLIVSCQ-QEEYODRMSA-N 400.479 2.456 10 20 HECD CCCN(CC)C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 811980368 YWUZZIHEONUNOA-PKOBYXMFSA-N 403.571 2.308 10 20 HECD Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918438494 FUJHUSFFXRRZMS-UHFFFAOYSA-N 403.429 2.489 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(N2CCOC2=O)c1 919840782 WNBDEJGHJZJVIE-UHFFFAOYSA-N 415.471 2.130 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3c(C)cnn3C)n2)cc1 1323532553 KQJIVPWWFUJUOC-UHFFFAOYSA-N 405.505 2.289 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2ccc(C)n2)cc1 1338287566 LZANZPHPQFAECB-SFHVURJKSA-N 409.442 2.496 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 1343655863 IJLIADNMTYDRSR-XMMPIXPASA-N 423.513 2.141 10 20 HECD CC(C)CCC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783126227 UYUGRCYCYKXCRX-QNBZTBGESA-N 418.490 2.083 10 20 HECD CC(=O)C[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1802223870 YBAWZVDPOQXOMR-WQCNXYOZSA-N 424.501 2.033 10 20 HECD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c[nH]1 1816724719 CPUUFMSHXQZSCN-LBPRGKRZSA-N 413.459 2.125 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)C2=COCCC2)CC1 1831915876 VBFGESAGBWDNCJ-GOSISDBHSA-N 415.490 2.420 10 20 HECD C[C@]1(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1(F)F 1846990482 SGGUBSRHRTURHQ-MJICGBHWSA-N 408.401 2.065 10 20 HECD COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N 28996963 XAORSBVJDHILCS-GFCCVEGCSA-N 407.492 2.356 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc2c(c1)c(=O)[nH]c(=O)n2C1CC1 109770130 WWLUYTGNQKSULD-UHFFFAOYSA-N 407.474 2.148 10 20 HECD CCOC(=O)Cc1cccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 507986302 SGDIOBOIRLROLF-UHFFFAOYSA-N 404.488 2.446 10 20 HECD CSc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cn1 727229578 FCVFWVHQEOUNET-UHFFFAOYSA-N 400.504 2.237 10 20 HECD Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3nc(-c4cccnc4)cs3)ccc21 727247161 VRCMZXRFTCKGHS-UHFFFAOYSA-N 401.473 2.196 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3ncn(C)c3Cl)ccc21 728770583 SMBXKTBFULUYGZ-UHFFFAOYSA-N 424.910 2.410 10 20 HECD NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C1 732572427 VGLWHCVIDCGKEJ-GOSISDBHSA-N 407.518 2.464 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](CN4CCCC4)C3)cc2)C1 746413186 CIJGWPLZSVIEKL-WOJBJXKFSA-N 413.566 2.016 10 20 HECD CC(C)NS(=O)(=O)CCNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 747007781 IZFGVKZRRZIQEU-UHFFFAOYSA-N 417.491 2.485 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](NC(=O)NCc3cc(OC)ccc3O)C2)c1 748636867 YGVVIVSBNRNXFJ-OAHLLOKOSA-N 401.463 2.496 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 748853378 NZEWOZOELDCPRC-ZIAGYGMSSA-N 419.432 2.149 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3cnc(N(C)C)n3C)cc2F)C[C@H](C)O1 751784470 YVZMWYOBPOLYQI-GJZGRUSLSA-N 418.517 2.238 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)s1 752347375 CJJSMWIPTFLINU-UHFFFAOYSA-N 423.470 2.146 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@H]1c1ccccc1F 753121354 HKPCTFXAFSHJPF-FQEVSTJZSA-N 412.465 2.045 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3nc4ccccc4o3)CC2)cc1 754071108 KMVKEWKKXQNIHQ-LJQANCHMSA-N 410.518 2.451 10 20 HECD COC(=O)[C@@H](c1cccnc1)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759871377 AKHYGFNSTYOAOB-LJQANCHMSA-N 401.463 2.144 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@@](C)(c4ccccc4)C3=O)CC2)cc1 761181551 CFCWCRCBNYGKNM-QHCPKHFHSA-N 408.502 2.284 10 20 HECD CCOC(=O)c1cc(NC(=O)NCCc2ccc(O)c(O)c2)cc(S(C)(=O)=O)c1 761658128 UYFNXSXKQXRGPV-UHFFFAOYSA-N 422.459 2.042 10 20 HECD COc1ccc(O)c(CNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c1 769530719 NRTSEMYPYUZAAZ-AWEZNQCLSA-N 407.492 2.010 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)COC4)cc2)C1 770041307 LNTLBVNADAOVEL-SFHVURJKSA-N 408.502 2.418 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(S(N)(=O)=O)ccc3Cl)c2)CC1 770286848 QZPBEEWOXLTXNH-UHFFFAOYSA-N 422.938 2.382 10 20 HECD CN(C)S(=O)(=O)c1cccc(NC(=S)NCc2ccc(OC(F)F)cn2)c1 773195777 GLEIUYIQAULVMO-UHFFFAOYSA-N 416.475 2.420 10 20 HECD CNC(=O)N1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775723046 BVUUCXNHNXEJNG-UHFFFAOYSA-N 407.106 2.374 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@@H](C4CCCCC4)C3=O)CC2)cc1 777628309 NUGSRDZPFZOIQO-FQEVSTJZSA-N 400.523 2.318 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1 785296150 CBLYRBFFMATCBP-SNVBAGLBSA-N 413.352 2.120 10 20 HECD Cc1cc(C(=O)CN(C[C@H](C)O)[C@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 785533398 DVADZXRFHXENTM-CVEARBPZSA-N 402.491 2.112 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](c3cccc(O)c3)C2)cc1 788964261 LZNCEGBCJXJETL-OAQYLSRUSA-N 411.502 2.455 10 20 HECD CCCN1CCC(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789856257 RDWVQMALCLJLNX-UHFFFAOYSA-N 418.607 2.094 10 20 HECD COC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(C)o1 789864835 SLKBVVVIDGMYNE-GOSISDBHSA-N 417.531 2.261 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)cc1 790071641 NQGPLNDBNVUWCE-UHFFFAOYSA-N 411.839 2.295 10 20 HECD Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 790934318 KIPZKOOZHICAGI-HNNXBMFYSA-N 412.490 2.153 10 20 HECD COc1ccc(OC)c(NC(=S)NNc2ccccc2S(=O)(=O)N(C)C)c1 793325515 FXRVSNLMCVBKSN-UHFFFAOYSA-N 410.521 2.268 10 20 HECD CC1(C)CCCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793733639 NOIDASIRSCYGIO-IEBWSBKVSA-N 414.550 2.090 10 20 HECD COc1ccc2c(c1)CCCN2CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C 796322549 FFWAUTRHIOVMCE-AWEZNQCLSA-N 415.515 2.073 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc1 799769708 YSDCWKAQOISHGH-UHFFFAOYSA-N 417.531 2.344 10 20 HECD CS(=O)(=O)[C@H]1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 800704467 GBDXGNDOCOSMLC-INIZCTEOSA-N 417.478 2.085 10 20 HECD CCn1ncnc1COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 801321772 FMXPZDOBFKQNPI-UHFFFAOYSA-N 408.461 2.223 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(N(C)C)cc1 807671692 SCUIUBMWZNPIPS-YOEHRIQHSA-N 410.522 2.332 10 20 HECD Cc1nc(CN2CCN(C(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)cs1 807674314 JWOCBZICWOWRSX-HNNXBMFYSA-N 415.563 2.039 10 20 HECD Cc1nc(N2CCN(C(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)sc1C 807674490 LVBIXBZAUXKMIF-OAHLLOKOSA-N 415.563 2.352 10 20 HECD O=C1CSc2cc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)ccc2N1 810196286 IITNKMBOVKNUPS-UHFFFAOYSA-N 417.512 2.218 10 20 HECD O=C(NCCCn1cc(CO)nn1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 810439604 XCSBNTLWOCLJPH-UHFFFAOYSA-N 407.434 2.331 10 20 HECD COc1ccc(OC)c(NC(=S)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1 812261376 MCETUBZHINHVHL-UHFFFAOYSA-N 410.521 2.268 10 20 HECD COC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 914771702 XVUMDRNYPWYHFJ-UHFFFAOYSA-N 418.515 2.272 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)CCCC(=O)N4)nc12 919109873 NXHAEUHEQRAQKY-UHFFFAOYSA-N 424.413 2.243 10 20 HECD CCOC(=O)C1CCN(C(=O)CN2CCN(c3ccc(OCC)cc3)CC2)CC1 1116416023 RTKMWKMLRRCRGR-UHFFFAOYSA-N 403.523 2.009 10 20 HECD CCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777850407 AJSJYFSRXQVCKD-QVKFZJNVSA-N 405.495 2.057 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243743 HBWZKCHZJGMAAD-VPBCXWTOSA-N 422.909 2.391 10 20 HECD COc1ccc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1800533676 BRHQSFKZDIRGRZ-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]1(F)Cl 1802496521 FWGRTCNHBDEEQJ-GTBZPGQXSA-N 424.856 2.379 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)C1 1810550135 AEJPGTCUCGHSJS-YJYMSZOUSA-N 411.861 2.262 10 20 HECD CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814163097 YPARCOUUSNQHAT-XUYSBGGMSA-N 411.458 2.328 10 20 HECD C[C@@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CC1(F)F 1816729202 XYIBANWFWRTLGH-XYZCENFISA-N 424.429 2.220 10 20 HECD O=C([C@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428966 MOWRWPFOMVYGHE-WMZOPIPTSA-N 417.506 2.153 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C3=Cc4ccccc4OC3)CC2)cc1 7257372 DIBLPQCDIXKVBB-UHFFFAOYSA-N 408.454 2.363 10 20 HECD CC(=O)N1CCN(C(=O)CCNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 97553744 GOWFFXMRDBRREI-UHFFFAOYSA-N 410.518 2.213 10 20 HECD COCCn1cc2c(n1)[C@H](NC(=O)C(=O)NCc1c(C)c3ccccc3n1C)CCC2 574936787 HPBONYJTZUZLAH-GOSISDBHSA-N 423.517 2.140 10 20 HECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727141331 IOZUSOCRMZDJSK-WMZOPIPTSA-N 418.538 2.308 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(C(=O)OC)cn3)cc2F)CC1 730235377 UQNRSPBXLFWKSK-UHFFFAOYSA-N 400.454 2.079 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4cc[nH]n4)C3)cc2)C1 734272113 DHMWOOPTSJFUNT-MSOLQXFVSA-N 410.522 2.201 10 20 HECD COc1ccc(N2CCC(NC(=O)N[C@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 741084481 FUOCMYGEGIOSKG-QFBILLFUSA-N 409.552 2.319 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)n1nnc(-c2ccccc2)n1 742689722 JIPCTBQCBQGPOH-QGZVFWFLSA-N 420.517 2.426 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(-n3nnnc3C)ccc2F)c(OC)c1 752110535 KAMBRGQTKWEHJM-UHFFFAOYSA-N 400.414 2.202 10 20 HECD CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 752387975 DRBOJKUVDGJSKA-UHFFFAOYSA-N 410.879 2.436 10 20 HECD COc1cc(NCCNC(=O)NCc2ccc(N3CCOCC3)cc2)cc(OC)c1 752656064 ZRDNSJGWDDBGRC-UHFFFAOYSA-N 414.506 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)CCn3cnc4ccccc4c3=O)CC2)cc1F 753739306 WXQIZOPMQFXTLY-UHFFFAOYSA-N 410.449 2.283 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCS(=O)(=O)C2(CCCCC2)C1 753863196 WFUDOEKUAJVQAB-UHFFFAOYSA-N 421.563 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)NCC3(C(=O)N(C)C)CCCC3)CC2)cc1F 753920552 WWSJZOVVYBISJZ-UHFFFAOYSA-N 406.502 2.315 10 20 HECD COc1ccc(N2CCN([C@H]3CC(=O)N([C@@H](C)c4cccnc4)C3=O)CC2)cc1F 753976848 BVAGGKHLKQMCIT-KXBFYZLASA-N 412.465 2.240 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccnc(O[C@H]2CCOC2)c1 754141960 QJVQYNJFYRGGQZ-KRWDZBQOSA-N 401.438 2.155 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@]4(CCOC4)C3)CC2)cc1 757109579 DRKNZHKOHQBKJF-QFIPXVFZSA-N 402.539 2.029 10 20 HECD CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 764254476 NCKYPBXFQSXSSK-CQSZACIVSA-N 419.503 2.066 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Nc1nc(CS(C)(=O)=O)no1 765245414 UWXLYDBUEWBDRW-UHFFFAOYSA-N 407.496 2.268 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1 768078520 IQVATECHUYBLTE-LLVKDONJSA-N 413.386 2.453 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(S(=O)(=O)NC2CCCC2)c1 770631976 XJZXRPITIXTGRN-UHFFFAOYSA-N 404.488 2.291 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 773742567 XNNBOWVHRISUFI-HNNXBMFYSA-N 406.504 2.130 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NC(=O)NCc2ccc(N(C)C)c(F)c2)CC1 777727124 SWBWYERMBAXNRX-UHFFFAOYSA-N 414.547 2.141 10 20 HECD CCNS(=O)(=O)c1ccccc1S(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 778081366 ITCSGJXMLDISQD-CQSZACIVSA-N 411.549 2.090 10 20 HECD COc1ccc(Cn2nccc2NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785303227 HULRRTQOWBUKQS-AWEZNQCLSA-N 424.457 2.037 10 20 HECD COC(=O)c1cn(CC(=O)OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)nn1 786556239 NSAZJBYEXMTBMK-UHFFFAOYSA-N 414.393 2.037 10 20 HECD CN(C)[C@@H]1CCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788154326 MMQGCFUANOBXQB-HUUCEWRRSA-N 409.533 2.467 10 20 HECD COc1ccccc1CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C1CC1 788321136 SWZSPWXVKYMIGZ-UHFFFAOYSA-N 423.513 2.339 10 20 HECD C[C@@H](O)c1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 793642543 KLIHPYSFLZBXKM-OXQOHEQNSA-N 412.486 2.270 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c(O)c1 797389061 NDAJSYRIBSIPRI-HUUCEWRRSA-N 413.474 2.269 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 806282735 RQDHKBPYQYXSJB-RDJZCZTQSA-N 418.588 2.378 10 20 HECD COCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 806853823 OIHHFKQSBGLMFQ-UHFFFAOYSA-N 406.533 2.098 10 20 HECD CN(C[C@H]1CCCO1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769356 TXHNSQLNPCZRNQ-RHSMWYFYSA-N 411.449 2.010 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@@H]1CO 807952721 KCTJRNXJOQTTRG-ZRGWGRIASA-N 407.942 2.422 10 20 HECD COc1ccc(N2CCCN([C@H]3CC(=O)N(c4cccc(C(=O)O)c4)C3=O)CC2)cc1 917639632 RDLDEHVUMKWRPH-FQEVSTJZSA-N 423.469 2.238 10 20 HECD CN(Cc1ccccc1)C(=O)CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 918090161 KMMALFIKUQBABA-UHFFFAOYSA-N 424.545 2.353 10 20 HECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 918117964 LHGGRVSHFYNFHK-UNMCSNQZSA-N 423.561 2.490 10 20 HECD Cc1nn(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1Cl 918171132 XTNOFFCRCZMDGE-MRXNPFEDSA-N 403.914 2.171 10 20 HECD CCc1noc2ncc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc12 918398831 AOWLRAUOQZTUML-HNNXBMFYSA-N 407.474 2.417 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1=CCCS1 1804283427 VTPSISFIXMWAMT-RRJKNOHSSA-N 416.499 2.476 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1cncs1 1804285814 VFEJWBUJXCQNBV-LJWNITHASA-N 415.471 2.225 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccno2)CC1 1825915697 HUYFVPAJQNSKMO-OAHLLOKOSA-N 400.435 2.028 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1 1843070328 LTQKRUBOQCPNBS-UHFFFAOYSA-N 420.469 2.424 10 20 HECD CN(C)C(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 728467651 PVSZECHDIQOIKO-IBGZPJMESA-N 408.502 2.020 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1 729063745 LNOQDYKKCNDSBI-ZDUSSCGKSA-N 413.430 2.169 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(CCN2CCOCC2)CC1 729600585 SVTCVMDOCVAGKB-UHFFFAOYSA-N 416.566 2.167 10 20 HECD CC[C@@H](C)NC(=O)CN1CCN(C(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731363495 HMBIUEMJZSZZMZ-QGZVFWFLSA-N 421.561 2.414 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2ccccc2OCCN2CCOCC2)c1 734066961 JCHCTQBKZILHCB-UHFFFAOYSA-N 415.490 2.111 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccccc3OC(F)F)nc12 735731298 QFDQXAAZEKKBMV-UHFFFAOYSA-N 421.356 2.499 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H](C(F)(F)F)C2)c1 739871762 FCAIFKOSFYAAQF-QGZVFWFLSA-N 402.413 2.190 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)CC2)cc1 741284655 XUKSRRDHHVEKDZ-NJYVYQBISA-N 416.566 2.320 10 20 HECD CCC(CC)(CCO)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 745690281 ALTHVJFLKQDVMR-GOSISDBHSA-N 404.555 2.376 10 20 HECD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 746093501 ILUFEJUNZFPENT-QGZVFWFLSA-N 416.482 2.185 10 20 HECD Cc1ccc(C(=O)OCC(=O)N(C)CC(=O)Nc2ccccc2Cl)c(O)c1O 750620602 ZMBCFFVZDJVXOP-UHFFFAOYSA-N 406.822 2.314 10 20 HECD COCCOc1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)cn1 761061224 KTNSNUUISDZUPJ-UHFFFAOYSA-N 405.838 2.430 10 20 HECD CN(Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1)C(=O)c1ccccc1 762178264 CSUQBDUUJQOKMP-UHFFFAOYSA-N 402.432 2.086 10 20 HECD CC(C)N(C)S(=O)(=O)c1cccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 763278792 DVHMLOKAEPKIJC-CQSZACIVSA-N 406.504 2.488 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc2c(c1)S(=O)(=O)CC2 764238104 YRZFAJVGJZXDQT-UHFFFAOYSA-N 401.488 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C[C@H]4CCCCO4)n3)CC2)cc1 771067042 MUNSNNWJAPHDQM-GOSISDBHSA-N 400.479 2.081 10 20 HECD CCNS(=O)(=O)[C@H]1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 771401185 ZROIPEVWDOBTNE-SFHVURJKSA-N 405.520 2.257 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4nc(C)cn4c3)CC2)cc1 774211779 XXOSFSLAOCNJKQ-UHFFFAOYSA-N 407.474 2.375 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 774362838 FSYGXBCSBQDHQL-UHFFFAOYSA-N 420.425 2.043 10 20 HECD COc1cccc(OC)c1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 775156478 DAJYPYBAVMJEKL-UHFFFAOYSA-N 419.503 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3Cc4ccccc43)CC2)cc1 778242757 XLRSOEUBDJHQSR-OEIFXAAASA-N 405.498 2.356 10 20 HECD COc1ccc2c(c1)OC[C@H](C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)C2 786254665 GTKGVEPNBVOPDV-HXUWFJFHSA-N 423.513 2.231 10 20 HECD CCC1(CC)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCS1 788321455 WKOJWPVUZTVRNC-UHFFFAOYSA-N 405.564 2.274 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CCCc2occc21 788608357 FVXVZUONFYTZRK-KRWDZBQOSA-N 401.438 2.065 10 20 HECD CN1CCCc2cc(CNC(=O)[C@@](C)(O)Cn3cc(C(F)(F)F)ccc3=O)ccc21 792103059 FDHKPJFNVORKPG-FQEVSTJZSA-N 423.435 2.317 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3OC(C)C)nc12 792838774 UIMSPSKARXLZNV-UHFFFAOYSA-N 400.391 2.151 10 20 HECD Cc1ccn(-c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)n1 792968140 GSNPBLKVPMCINA-UHFFFAOYSA-N 419.485 2.272 10 20 HECD COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c(O)c1 794388057 NLDRAKPDLAPCLF-CQSZACIVSA-N 421.519 2.090 10 20 HECD COCC[C@H]1CCCCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803301257 OBJKSZNPTCXVPU-RTBURBONSA-N 417.550 2.366 10 20 HECD CCc1cnc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)s1 803310043 FYKZKBAGLRZFHR-AWEZNQCLSA-N 402.520 2.036 10 20 HECD CN(CCCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686754 PHKJMLGFHRVRKO-UHFFFAOYSA-N 418.538 2.058 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 804318353 IIZCRMRXSGUHKB-XLIONFOSSA-N 416.566 2.111 10 20 HECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc2c(c1)CC(=O)N2C 804569025 BBBRFIAYNBAJMD-LBPRGKRZSA-N 418.544 2.138 10 20 HECD CC(=O)OCCCS(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805018480 LTWBSMARYUTCAW-AWEZNQCLSA-N 406.451 2.129 10 20 HECD COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1cc(OC)ccc1O 806735740 FNWPXQBUTCFJLO-UHFFFAOYSA-N 424.475 2.151 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671075 LDEFTINFDVKJAR-GOEBONIOSA-N 404.511 2.055 10 20 HECD Cc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(N2CCOCC2)c1 807672357 YAZXEMVKXHNJJO-SFHVURJKSA-N 424.545 2.391 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CN1Cc1ccccc1 807749550 VJDDHTBKFQXPPS-WIYYLYMNSA-N 408.546 2.490 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnnc(-c2ccccc2)c1 810172237 DSSADAUPCJTMLW-UHFFFAOYSA-N 422.510 2.308 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2cc(C(F)(F)F)ccn2)c1 816768103 NUBRAOZBUMRGGE-UHFFFAOYSA-N 403.382 2.150 10 20 HECD COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1 918309411 YYPBENRIXUTQKP-UHFFFAOYSA-N 413.474 2.138 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 920867506 UATIWEWJKLMATR-ROUUACIJSA-N 417.550 2.364 10 20 HECD COCCn1cc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1=O 1320275441 DYYPIAYOVJXNOD-GOSISDBHSA-N 401.463 2.413 10 20 HECD Cc1cc(C(=O)NC2CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)no1 1323117993 AUTCUGVYSMQUJS-UHFFFAOYSA-N 409.490 2.463 10 20 HECD O=C(C1=CCCS1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004005 RIROMOUXSHYYCP-IBGZPJMESA-N 424.906 2.216 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CO)o1)c1cc(O)c(O)c(Cl)c1 1798798984 NYRWTANUNIMNGP-CLLJXQQHSA-N 420.849 2.402 10 20 HECD O=C(c1cncs1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427169 QXFHZVQBLYYIGD-HNNXBMFYSA-N 416.503 2.496 10 20 HECD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)co1 1827427243 SVNQEVSPTCHQNP-QGZVFWFLSA-N 414.462 2.336 10 20 HECD CCn1nccc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842519034 QLYUKTYVAVSZJH-UHFFFAOYSA-N 404.854 2.098 10 20 HECD Cc1nnsc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1843512765 DYUGBIJPUITOBD-UHFFFAOYSA-N 408.867 2.042 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)n(C)c1 23745092 IMSSTKVDBCGPSA-UHFFFAOYSA-N 406.552 2.394 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCCNc3ccccn3)cc2)C1 729599155 NQLHSIVNGBJDNB-LJQANCHMSA-N 424.549 2.475 10 20 HECD CCN(CC)c1ccc(CNC(=O)CN(C)S(=O)(=O)c2cccnc2)cc1F 731347189 PMDSDCNNIXSJIG-UHFFFAOYSA-N 408.499 2.004 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1 731761755 BYOUWBJJDWTISU-UHFFFAOYSA-N 403.571 2.227 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c1 734067207 KUDVRPMWVIBORC-UHFFFAOYSA-N 415.490 2.111 10 20 HECD COc1ccc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)c(OCC(=O)O)c1 734482920 KSANAKINKQGDTG-QPEQYQDCSA-N 411.457 2.225 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3CCN(c4ccccn4)CC3)CC2)cc1 741145548 WGPWMPBOUOYSGW-UHFFFAOYSA-N 423.561 2.388 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(C(F)(F)F)nc3O)CC2)cc1 742921139 OPKJXBWSTVQSBZ-UHFFFAOYSA-N 424.423 2.367 10 20 HECD O=C(CN1CCN(c2ccccn2)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 743339022 MVPDYQPBVCRIGQ-HXUWFJFHSA-N 410.518 2.117 10 20 HECD CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 743699085 IZGAKULEBWRNPH-RYUDHWBXSA-N 423.425 2.403 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1F 746718562 JEKIHMBDGWDDCT-UHFFFAOYSA-N 408.499 2.141 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3OCCc4ccccc43)CC2)cc1 750054521 VHTNVYRCNYWIMB-JOCHJYFZSA-N 410.470 2.201 10 20 HECD COc1ccc(N(C)CC(=O)NCC(=O)N[C@H](C)c2ccc(F)cc2)c(OC)c1 752112056 NMZCYPKYOUSQCL-CQSZACIVSA-N 403.454 2.273 10 20 HECD C[C@@H](NCCC(=O)N1CCN(c2ncccn2)CC1)c1cc2c(cc1O)CCCC2 756525315 NSLMSVSSTMEJQJ-QGZVFWFLSA-N 409.534 2.451 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNCC3(N(C)C)CCCCC3)CC2)cc1 758184661 FKNIHUPXIPDTTF-NRFANRHFSA-N 404.599 2.032 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](c3cccs3)N(C)C)CC2)cc1 758188095 YHLAOQRTZMCJOH-FPOVZHCZSA-N 418.607 2.132 10 20 HECD CNC(=O)c1cccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759225512 OEXHYGBTBCMOGG-UHFFFAOYSA-N 413.474 2.034 10 20 HECD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cccc(Br)c1O 764934825 NECOKWGJKQETBR-UHFFFAOYSA-N 402.226 2.322 10 20 HECD C[C@H](CC(=O)N(C)c1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 765979231 JWTZUBOUWDQMAM-GOSISDBHSA-N 415.559 2.453 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1 770340178 ZZNNADOYYCIXIM-CYBMUJFWSA-N 405.505 2.198 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cnc5n4CCCC5)n3)CC2)cc1 771059038 XEGQQTCSABJQCX-UHFFFAOYSA-N 422.489 2.169 10 20 HECD COCCCN(Cc1cc(Br)cc(C)c1O)[C@H]1CCS(=O)(=O)C1 775644306 GUXUFXURTBWXQP-HNNXBMFYSA-N 406.342 2.489 10 20 HECD O=[N+]([O-])c1cc(CN[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)ccc1N1CCCCC1 776498175 IRJLHHIJYJVWKK-XLIONFOSSA-N 423.535 2.411 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cnc(-c2ccccc2)nc1 780048650 PAIVCXSOVQBXEH-UHFFFAOYSA-N 417.469 2.235 10 20 HECD Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)c(O)c1O 780857596 YETSFSMPUSGCCI-UHFFFAOYSA-N 416.499 2.042 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(F)c(OC)c3)CC2)cc1F 782113250 CHROUGFTXTWJKP-UHFFFAOYSA-N 405.401 2.269 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1c[nH]nc1-c1ccccn1 782778382 QNDYSWUQMUKGCL-UHFFFAOYSA-N 422.514 2.280 10 20 HECD C[C@H](OC(=O)c1ccn(C)n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 785683389 SAZHEKLQXQASTP-LBPRGKRZSA-N 403.394 2.380 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCCCO1 785861274 SILMKUZQHGWYLM-UHFFFAOYSA-N 407.404 2.269 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)ccc3C)cc2)CC1 786120788 TUPLCDLPATYVCY-UHFFFAOYSA-N 405.495 2.281 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnc(CC4CC4)nc3)CC2)cc1 792971655 HHQMAMPWWNANLU-UHFFFAOYSA-N 409.490 2.161 10 20 HECD Cc1ccccc1CS(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 798899072 KIKQJBGNJGUOCX-UHFFFAOYSA-N 414.508 2.471 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2cnc3n2CCC3)c(C)n1-c1ccc(F)cc1 802209567 DGSAMUQPTNFHQF-UHFFFAOYSA-N 402.451 2.495 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCC2([S@](C)=O)CCC2)cc1)C1CCCCC1 803676242 BXWLTFDHPJTVGD-LJAQVGFWSA-N 419.591 2.489 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)Cc2cncn2C)NC(=O)OC(C)(C)C)cc1 806944360 DYKXWWBXCKNHHW-SFHVURJKSA-N 401.511 2.411 10 20 HECD COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 807290632 LSONYHDIAJIZHF-QGZVFWFLSA-N 409.486 2.271 10 20 HECD CC[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)OC 812369915 WTSIGYBYPXOBOV-AWEZNQCLSA-N 423.447 2.256 10 20 HECD COCC[C@@H]1COCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 812887238 RNNVZDQZFJYKJY-MRXNPFEDSA-N 408.454 2.138 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1 1324626709 GEQTUFSLDBVULP-AHRSYUTCSA-N 413.518 2.298 10 20 HECD CC(C)N(C)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800719324 IJEFMOICOAIIIG-QDMKHBRRSA-N 409.914 2.343 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CCCS1 1823013797 MOEXAPMAQHPHFL-KGLIPLIRSA-N 417.491 2.417 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(F)cn2)C1 1842537094 YIBSGSLISCZPOP-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(F)nc2)C1 1844430396 VUQQHJVPMPTOKQ-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CSc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1846496185 WTOLXUJLEDRUIG-UHFFFAOYSA-N 413.499 2.274 10 20 HECD CCc1nc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cs1 726619477 PORHDYBIPZCFKA-MRXNPFEDSA-N 415.563 2.449 10 20 HECD CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730192618 INQPSSZWJAXCHC-HXUWFJFHSA-N 404.530 2.375 10 20 HECD COC[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 733196316 APTJWEHSSOQTIN-SCTDSRPQSA-N 407.530 2.414 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)(C)C)c2)c1 734017013 WWAOIVRKSAEYEE-UHFFFAOYSA-N 422.503 2.416 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc([S@@](C)=O)c3)CC2)cc1 737137958 FQWIEAMWMOOOMJ-GDLZYMKVSA-N 415.515 2.110 10 20 HECD COc1cc(N(C)CC(=O)NCCOc2ccc3c(c2)OCO3)cc(OC)c1OC 741795732 NRBGMCYQRZXSDH-UHFFFAOYSA-N 418.446 2.073 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCC[C@@H](N(C)C)C3)CC2)cc1 749543527 RMONKRCVXNEBQB-TZIWHRDSSA-N 417.598 2.379 10 20 HECD COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)CC2)nn1 749568711 PWIBQZAQBMVPDU-UHFFFAOYSA-N 420.473 2.028 10 20 HECD CSc1ccncc1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 750252800 CAZSFWFVGNBEOS-AWEZNQCLSA-N 400.504 2.456 10 20 HECD COC(=O)c1ccc(F)cc1S(=O)(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751042181 CELUQVLYTQREDQ-AWEZNQCLSA-N 422.478 2.488 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1 752022967 JBKROOFTUPAACQ-JTSKRJEESA-N 415.538 2.395 10 20 HECD O=C(CN1CCO[C@@H]([C@@H]2CCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 756898828 ZHJSLUGOUDHBKM-VQTJNVASSA-N 420.465 2.280 10 20 HECD COCc1nc2n(n1)C[C@@H](NC(=O)NCc1ccc(N3CCC(C)CC3)cc1)CC2 757689556 ROBHJIMHLJHHAY-SFHVURJKSA-N 412.538 2.475 10 20 HECD O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 759046850 CUEIZJVJRVMPLH-UHFFFAOYSA-N 419.503 2.423 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCCCSc2nccs2)CC1 759601959 RDLIQPNACUSLGF-UHFFFAOYSA-N 406.599 2.081 10 20 HECD CCOC(=O)c1ccc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)nc1 768265238 SQPQAXWGRDQKCR-UHFFFAOYSA-N 410.518 2.417 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2ccccc2)Cc2cc[nH]n2)c1 769753294 QPLKZULMRAQKRG-UHFFFAOYSA-N 400.460 2.329 10 20 HECD COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 773020646 PWUWWGAOLPDYJR-NPMXOYFQSA-N 424.501 2.406 10 20 HECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc21 773845921 KUHBFRVUZJCTNJ-HNNXBMFYSA-N 421.501 2.269 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](C(=O)OCC)(C(C)C)C3)nc12 773925355 YBMLFSOLXDFPRM-FQEVSTJZSA-N 404.467 2.023 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)c3c(C)noc3C)CC2)cc1 778278610 YYJCWGPRURCWEW-BOLDSZDNSA-N 412.490 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3nccs3)CC2)cc1 778304985 SYIKWHBOGDYIQW-BQYQJAHWSA-N 400.504 2.015 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCS(=O)(=O)c2ccccc21 791031598 FZCCJRKXLVYXJM-LJQANCHMSA-N 400.500 2.101 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(C)c(OC)c3)CC2)cc1 793864855 PTPOYNPVAPIXTC-UHFFFAOYSA-N 411.502 2.367 10 20 HECD COc1ccc(CNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c(O)c1 794390181 ZUPHFKDKZADFGD-KRWDZBQOSA-N 404.467 2.359 10 20 HECD CCN1CCN(S(=O)(=O)c2cccc(NCc3cc([N+](=O)[O-])ccc3O)c2)CC1 796395722 JEPBRXODKVRMTB-UHFFFAOYSA-N 420.491 2.239 10 20 HECD COC(=O)[C@@H](C)[C@@H](C)S(=O)(=O)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 802166494 GLIYDJYTEMKHKD-GXTWGEPZSA-N 410.467 2.490 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC[C@@H](OCC2CC2)C1)c1ccc(N2CCOCC2)cc1 803299599 MBMLCNWNSGXYCF-LAUBAEHRSA-N 415.534 2.118 10 20 HECD CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290127 QCDIUHBDFSVULN-GDLZYMKVSA-N 411.527 2.075 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1C 808114808 HSWLMTPGXZVCOV-UHFFFAOYSA-N 408.860 2.202 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc2c1COC2=O)c1ccc(N2CCOCC2)cc1 808922882 XTJRRJFSNIMHKW-AWEZNQCLSA-N 409.442 2.010 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ncccc3N(C)C)cc2F)CC1 811934015 PBMVGOATAZSPOA-UHFFFAOYSA-N 414.529 2.428 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C\c3ccc(F)cc3)n3nnnc3C)CC2)cc1 818024450 LWSNVFYGAXGOTO-RCCKNPSSSA-N 422.464 2.476 10 20 HECD O=C(CNS(=O)(=O)c1cccs1)Nc1c(-c2ccccn2)nc2ccccn12 820006369 VCKGGDYVBDCYNR-UHFFFAOYSA-N 413.484 2.375 10 20 HECD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 917117169 KTFJICFMJKPFMU-UHFFFAOYSA-N 415.515 2.084 10 20 HECD COc1ccc(N2CCCN(CN3C(=O)N[C@@H](Cc4ccccc4)C3=O)CC2)cc1 917486932 APMBAUPXNVEDHC-NRFANRHFSA-N 408.502 2.328 10 20 HECD COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)CO2 917833925 VSHXJCBFLJUDBR-IEBWSBKVSA-N 423.513 2.264 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCc3nc4cccnc4[nH]3)CC2)cc1 1318359920 TWQRDMVSJRACOB-UHFFFAOYSA-N 422.533 2.228 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)[C@H](C)c1ccc(C)cc1 1324120571 FYAZZDOETWYCLQ-CFLQYTFWSA-N 401.459 2.161 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990898 KSECUKQMXFYCHY-OXJNMPFZSA-N 410.474 2.398 10 20 HECD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)cn1 1808140030 XWAGVOJARRZEBX-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1cc(O)nc(O)c1 1817844256 VWZOHVCSVAPGDG-ZDUSSCGKSA-N 414.447 2.292 10 20 HECD Cc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426717 BNTXFQSOVZVIRG-KRWDZBQOSA-N 414.462 2.336 10 20 HECD CC(C)NC(=O)Nc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 115734040 UDMDEOHUPYMIBV-UHFFFAOYSA-N 420.491 2.224 10 20 HECD COc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3S(C)(=O)=O)CC2)cc1F 302673128 SKCIMDJUWXKILU-UHFFFAOYSA-N 409.439 2.473 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cscn3)cc2F)C[C@@H](C)O1 728339322 VCNWNYIGPDQBOD-BETUJISGSA-N 407.467 2.369 10 20 HECD C[C@@H](NC(=O)N(C)CCN(C)C1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 729603522 WGVSSTCUIHVDJY-LJQANCHMSA-N 417.598 2.252 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CCCN(C(=O)C4CC4)C3)cc2F)CC1 730193705 RTXUNQMHOQSRIH-IBGZPJMESA-N 416.541 2.232 10 20 HECD COC(=O)NCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733544442 NHAGLOANJRBPSY-LBPRGKRZSA-N 424.409 2.078 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1 734074049 HZYNLQKZDJRMNE-UHFFFAOYSA-N 420.425 2.303 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCC[C@@H](CNS(N)(=O)=O)C3)c2C)c1 739696671 NSYOSPVLIRTXBL-KRWDZBQOSA-N 404.536 2.048 10 20 HECD CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCOCC2)cc1 743884752 JWBIYXJPNCZQGL-UHFFFAOYSA-N 403.504 2.215 10 20 HECD COC[C@@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccc(C)o1 746756627 ZJJYIRNCILVNTF-HXUWFJFHSA-N 416.522 2.406 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(O[C@@H]2CCOC2)CC1 748616299 AFFMYCKDUABCDX-LJQANCHMSA-N 421.513 2.266 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc3nc(O)nc(O)c3c2)cc1 751406982 SKSSLBGTULJWGI-KRWDZBQOSA-N 423.473 2.323 10 20 HECD CN1Cc2ccccc2[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 757629927 RGAHDRPYSISQGH-SIKLNZKXSA-N 421.545 2.374 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(-c4nnc(C)o4)c3)nc12 758977115 BXHFFIVZUPVTPT-UHFFFAOYSA-N 423.385 2.327 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)[C@@H]4Cc5ccccc5CN4C3=O)CC2)cc1 761181656 DGYMZBCKRMLKRE-QFIPXVFZSA-N 420.513 2.206 10 20 HECD COc1cc(N2CCN(Cc3cn(Cc4cccnc4)nn3)CC2)cc(OC)c1OC 761220794 YITIUCCVZXKPIX-UHFFFAOYSA-N 424.505 2.069 10 20 HECD CCS(=O)(=O)N(C)CCCN[C@H](C)c1ccc(N2CCOCC2)cc1Cl 764944409 KFPMCELDAMDCIG-OAHLLOKOSA-N 403.976 2.499 10 20 HECD C[C@@H]1CN(CCCNC(=O)NCc2cccc(Br)c2O)CCCO1 765567114 YNXRTZOZAWATER-CYBMUJFWSA-N 400.317 2.455 10 20 HECD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440181 UCISVULOEJYISO-JLTOFOAXSA-N 415.465 2.102 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3sc(NC4CC4)nc3C)nc12 770080200 YQFRFFSBLOWFNZ-UHFFFAOYSA-N 417.447 2.308 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccc(OCC(=O)N(C)C)cc1 773745588 MIMFUGUGFQYXSG-ZDUSSCGKSA-N 422.428 2.404 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(N2CCNC2=O)cc1 777827561 CCWJTZNQZGRMKR-UHFFFAOYSA-N 417.849 2.391 10 20 HECD O=C(Nc1ccc(C(=O)NS(=O)(=O)c2ccnc(Cl)c2)cc1)C1=S=CC=C1 782640797 WFJXEQFUDYOVJS-UHFFFAOYSA-N 421.887 2.070 10 20 HECD COC(=O)c1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 785296214 MAOZROMOMOJGMY-JTQLQIEISA-N 406.822 2.224 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc(OC)c3)cc2F)CC1 795099655 GPUAKTXOSYYFGE-UHFFFAOYSA-N 407.511 2.455 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)[C@@H](C)[C@@H](C)C(=O)OC)ccc21 802153106 HXDJTDVGUJVZSY-HIFRSBDPSA-N 424.519 2.162 10 20 HECD C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663525 QYFZYHJDZNTDGF-QGZVFWFLSA-N 412.509 2.241 10 20 HECD C[C@@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C)c1ccc(N(C)C)cc1 805309069 JUFAHEKPDXSFHL-XIHRNRATSA-N 401.555 2.196 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc4c3COC4=O)cc2)C1 808908469 QMXXQNHAUFLTEK-HNNXBMFYSA-N 408.458 2.380 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Br)o1 918335526 OKVUNBYWFXHMRA-UHFFFAOYSA-N 413.293 2.207 10 20 HECD CCO[C@H](CC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 920672850 KVGFTVULFONAHQ-YZVOILCLSA-N 410.486 2.414 10 20 HECD Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995390 YQXJWZUSZFLLNW-QRWLVFNGSA-N 421.457 2.158 10 20 HECD CCc1oncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810542895 DBMAMLSTGOLCPV-UHFFFAOYSA-N 414.462 2.202 10 20 HECD Cc1scc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1C 1842555554 UWYBWFARWPUNDH-UHFFFAOYSA-N 423.585 2.042 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)Cc2ccsc2)C1 1843067445 FGQNHYOYHLQLQG-UHFFFAOYSA-N 422.510 2.287 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCCC12CN(C(=O)[C@H]1CC[C@H](O)CC1)C2 1845502380 RESAVNDZWBGANZ-MQMHXKEQSA-N 408.882 2.119 10 20 HECD O=C(Cc1cccs1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038504 BQKPLWCTFNWEDV-FNORWQNLSA-N 414.483 2.324 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc(CNC(C)=O)cc3)CC2)cc1 726601873 UTBOSMMIBYHUTA-UHFFFAOYSA-N 417.531 2.279 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(OC)ccc3OC)CC2)cc1 726725439 DFUXPGWFOPJXJN-UHFFFAOYSA-N 413.474 2.436 10 20 HECD COCCCN1CCC(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 727033291 SJPHLHFATUMLHI-GOSISDBHSA-N 404.555 2.384 10 20 HECD CNC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 734275647 ABZKIYGJRAASSZ-AWEZNQCLSA-N 410.465 2.424 10 20 HECD CSCCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 737038424 VNTNRBUTJINPBE-UHFFFAOYSA-N 418.542 2.495 10 20 HECD COC(=O)Cn1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 743165110 BZDPERQIBDIBIP-OKILXGFUSA-N 419.457 2.131 10 20 HECD CN(C)C1(CNC(=O)NCc2ccc(N3CCOCC3)cc2)Cc2ccccc2C1 743559526 JGIAWOWADSKICZ-UHFFFAOYSA-N 408.546 2.422 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 747254684 QKAASVFKISAFHW-CQSZACIVSA-N 422.478 2.488 10 20 HECD CCc1ncc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 747463763 RKPLFQMREVZAFU-OKILXGFUSA-N 415.469 2.047 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(O[C@H]2CCOC2)CC1 748616297 AFFMYCKDUABCDX-IBGZPJMESA-N 421.513 2.266 10 20 HECD Cc1c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cnn1-c1ccc(O)nn1 752151889 NBEDAEXKJYOLSL-INIZCTEOSA-N 409.446 2.203 10 20 HECD C[C@H](NC(=O)N1CCOCC2(CCOCC2)C1)c1ccc(N2CCOCC2)cc1 753129886 YFBZAIYINKIYAK-SFHVURJKSA-N 403.523 2.423 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)cc1F 753875667 CAFHNDHWEGQWLL-UHFFFAOYSA-N 402.426 2.053 10 20 HECD CCOC(=O)[C@@H]1CCCCN1C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 756337335 UDSJHJIDMJKSCI-MOPGFXCFSA-N 404.507 2.317 10 20 HECD CCNc1nnc(SC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1 758195683 BXPRTDOGAKHRDL-OAHLLOKOSA-N 409.581 2.254 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(C2OCCO2)c1 763990031 YFRFBLUVPCSYCP-UHFFFAOYSA-N 402.472 2.219 10 20 HECD CCN(CCCN[C@H](C)c1ccc(N2CCOCC2)cc1Cl)S(C)(=O)=O 765253729 LRGFTRKEGBGNJI-OAHLLOKOSA-N 403.976 2.499 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cc(C(=O)OC)ccn3)cc2F)CC1 770684240 YPNKUUACJHEAMW-UHFFFAOYSA-N 415.469 2.471 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@H](O)c3cccc(F)c3)CC2)cc1 772612910 QESFUDRIIDMULE-NRFANRHFSA-N 401.482 2.196 10 20 HECD COc1ccc(O)c(CNCc2ccccc2OCC(=O)NC[C@H]2CCCO2)c1 776039251 QYMDWEJVUJYSSY-LJQANCHMSA-N 400.475 2.365 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@@H](C)C3)cc2F)CC1 787322543 LOUGCCUXJOGCPD-SJLPKXTDSA-N 404.530 2.279 10 20 HECD CCS[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324613 WLUGDAASRMFTGQ-RBUKOAKNSA-N 405.564 2.320 10 20 HECD CN1CCN(c2ccc(CNc3ccc(C(=O)NCCO)c(Cl)c3)cc2)CC1 788864993 HFDZPZDQDHZSGL-UHFFFAOYSA-N 402.926 2.426 10 20 HECD C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789832631 BLRRQDZBMLMJKC-NVXWUHKLSA-N 405.514 2.440 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 792749224 QLHVRQMUAFUZTB-HLLBOEOZSA-N 400.516 2.285 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H](S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 800702114 IPCZLXGTSYFCQQ-APWZRJJASA-N 409.552 2.193 10 20 HECD CNC(=O)C1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 800744824 VRAJMENJCULDRG-CQSZACIVSA-N 419.481 2.247 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCSC[C@H]3c3nccs3)ccc21 803686107 WFPPRIPIPRHJPJ-KRWDZBQOSA-N 416.572 2.458 10 20 HECD COc1cccc(N2CC[C@@H](CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 804083106 JHQOEZQQRHRAMM-IBGZPJMESA-N 424.545 2.362 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc2)CC1 805025634 RWBIZGZGYYRYQD-GHTZIAJQSA-N 400.567 2.480 10 20 HECD CC(C)(C)OCc1cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)no1 807291879 JFMCYOCMYGFZLR-UHFFFAOYSA-N 412.490 2.299 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccn(C)n3)cc2Cl)C1 807956613 QXSAFKIMCKSROO-HNNXBMFYSA-N 417.941 2.285 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)[C@H]2C1 808353887 BBHZOZFOVVNAND-ILWGZMRPSA-N 414.550 2.312 10 20 HECD COc1ccc(N2CCN(CCNCc3cnc(C4OCCO4)s3)CC2)cc1 809610597 YAZJZCLWZHMKGN-UHFFFAOYSA-N 404.536 2.109 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 809728964 NBUGSGLPWSTJPU-QGZVFWFLSA-N 404.854 2.298 10 20 HECD Cc1cc(N/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)n(-c2nc3ccccc3[nH]2)n1 814318279 IASJLNUASJUZPJ-UKTHLTGXSA-N 423.502 2.252 10 20 HECD Cc1cc(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)ccc1N(C)C 815049357 ZEDACFSRACEGMP-UHFFFAOYSA-N 415.559 2.423 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cc1 918461477 DVYIJZHVHCXJOZ-UHFFFAOYSA-N 424.501 2.122 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cc(OC)cc(OC)c3)nc12 920088943 CVKLARRLPFFVIC-UHFFFAOYSA-N 400.435 2.261 10 20 HECD CCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496600 MTIOCYYTEVYWOZ-GFCCVEGCSA-N 409.537 2.062 10 20 HECD O=C(Cc1ccc2ncccc2c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249089 VCTAZNQDFLINBX-UHFFFAOYSA-N 418.453 2.101 10 20 HECD Cc1cc(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1-c1ccccc1F 108807705 SPXLGKVVWQXKSR-UHFFFAOYSA-N 422.460 2.447 10 20 HECD COCCCOC1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CC1 579029267 BZUDLLOSORARHW-UHFFFAOYSA-N 401.507 2.147 10 20 HECD CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 727990897 BYUIEUNOGZWJJQ-SFHVURJKSA-N 409.527 2.370 10 20 HECD O=C(N[C@@H]1CCCOC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 730036540 YLUBTKMGZNWWOG-CYBMUJFWSA-N 421.431 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cc(S(N)(=O)=O)cc(C)c3C)CC2)cc1 735753640 NRMSFIKKMHZHHN-UHFFFAOYSA-N 418.519 2.314 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1n[nH]cc1Br 738461686 WSDXANAUDXZZRV-UHFFFAOYSA-N 412.263 2.147 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 740232996 RBWRCHZFLRHIRC-MRXNPFEDSA-N 424.862 2.379 10 20 HECD CNC(=O)c1cccc(CCNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 741081722 YZSLKFORUKQEDK-KRWDZBQOSA-N 410.518 2.486 10 20 HECD CCN(CC)c1ccc(CN(C)CC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 741678164 KRARXLIHBRJUNU-UHFFFAOYSA-N 404.536 2.251 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](C)C(=O)OC(C)C)cc2F)CC1 745808418 LIBUMTXNFAIAMQ-INIZCTEOSA-N 408.518 2.355 10 20 HECD COc1ccc(CN(C)C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 747012452 WZFHISWIJCUATH-UHFFFAOYSA-N 402.470 2.217 10 20 HECD O=C(NCCOc1cccnc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068292 NCUQAXNAFPYKIT-UHFFFAOYSA-N 419.484 2.458 10 20 HECD COc1ccc(OC)c([C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 755305793 SZJXBGCIXCQSOQ-OAQYLSRUSA-N 400.475 2.485 10 20 HECD C[C@@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)c(F)cc1O 756583477 ODNXFBHVWIUZAR-KGLIPLIRSA-N 416.335 2.351 10 20 HECD C[C@H]1CN(c2ccc(CN3C(=O)N[C@H]([C@H]4CCCOC4)C3=O)cc2F)C[C@@H](C)O1 761097490 IYTGGXSRDMZVAO-QMYADUOMSA-N 405.470 2.286 10 20 HECD Cc1cc(C(=O)COC(=O)c2ncsc2S(N)(=O)=O)c(C)n1-c1ccccc1 762955924 QOYPUOOSLGBHED-UHFFFAOYSA-N 419.484 2.238 10 20 HECD COc1cc(Br)cc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 765869133 XJDQQBQKMFMRRI-UHFFFAOYSA-N 409.236 2.427 10 20 HECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCc1c(O)ccc2c1CCCC2 769560482 KUINBBFGNFZIHD-UHFFFAOYSA-N 409.398 2.092 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 770036378 OESPJPQLXSLUKS-UHFFFAOYSA-N 405.432 2.477 10 20 HECD Cn1cnn(-c2ccc(NC(=O)NCc3ccc(N4CCSCC4)cc3)cc2)c1=O 771458553 CXSBBCBVRHAPRA-UHFFFAOYSA-N 424.530 2.446 10 20 HECD COc1ccc(N2CCN(C(=O)c3cnc4scc(C)n4c3=O)CC2)cc1F 776347543 SZCSNFZOKCNYSI-UHFFFAOYSA-N 402.451 2.175 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC(C)(C)c3nccs3)CC2)cc1 778284161 JWWKWICFKJRCBX-HJWRWDBZSA-N 414.531 2.408 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCCC[C@@H]3O)CC2)cc1 779330131 IWRGQRGNZJVVLY-KNQAVFIVSA-N 418.582 2.400 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 781976169 DDXLYMRNUKVFMK-GOSISDBHSA-N 417.550 2.145 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 785298064 VGMDNDILOGZJBF-CYBMUJFWSA-N 413.474 2.312 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)C2 786674745 QNSMKOHQYSOGOT-IBGZPJMESA-N 409.534 2.262 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CCC(=O)c4cccn43)CC2)cc1 789875194 OQXWASZVYDENAP-NRFANRHFSA-N 410.518 2.343 10 20 HECD C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 793647258 USLJIWRSFRCNPR-IRXDYDNUSA-N 411.502 2.070 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1 798000157 ZDOBPRAKMYIXJR-ZDUSSCGKSA-N 410.467 2.289 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1 801635195 IXGFMBJCTAJHAN-UHFFFAOYSA-N 415.494 2.282 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 804118709 YHFFHOVNBQCJGO-GOSISDBHSA-N 410.518 2.115 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccc2c(c1)CC(=O)N2C 804569412 HJJJDGBPEPETIT-HNNXBMFYSA-N 408.502 2.107 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NC[C@H](N1CCOCC1)C(F)(F)F 804967442 SEDCLYWIKKEPMV-KRWDZBQOSA-N 400.445 2.349 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1Br 806855188 BKLIILWPSHXNGF-UHFFFAOYSA-N 420.263 2.111 10 20 HECD COC[C@@]1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 813513726 RSRAZJIDUCGCFQ-LHSJRXKWSA-N 408.495 2.419 10 20 HECD O=S(=O)(CC[C@H]1CCOC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815016882 BRGXPERCUHWVMF-PBHICJAKSA-N 402.944 2.356 10 20 HECD O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NCCc1ccc(O)c(O)c1 917371656 NNHOKSYPFQTAGJ-UHFFFAOYSA-N 418.515 2.004 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cn(-c2ccc(Br)cc2)nn1 1319771816 GOVMCKDWAPPPRR-UHFFFAOYSA-N 403.236 2.414 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 1320637638 PKESNWFFZYTXGI-GFCCVEGCSA-N 407.448 2.487 10 20 HECD Cc1nc(N(C)C)sc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1341475656 CXCXLBNFUNCWBH-OAHLLOKOSA-N 401.536 2.149 10 20 HECD Cc1ccccc1NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600416 GNSWDRSLSWINIO-BJWYYQGGSA-N 410.474 2.165 10 20 HECD CN(C)c1ccc(CNC(=O)Cn2nnc(-c3ccc(Br)cc3)n2)cc1 7095718 CZHXZUBPGUSOFO-UHFFFAOYSA-N 415.295 2.485 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1 51278685 NGCQWHQQWUVUJP-UHFFFAOYSA-N 404.417 2.239 10 20 HECD Cc1nn(-c2ccccc2)cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726526358 GQDMIFZXMGJXQB-UHFFFAOYSA-N 424.526 2.346 10 20 HECD CCCN(CC(=O)NN1C(=O)N[C@](CC)(c2ccccc2)C1=O)Cc1ccccc1O 727831355 XHMCCYSQWONYJI-HSZRJFAPSA-N 424.501 2.493 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc3n(c2=O)CCS3)cc1 728021415 RFBWRGZMUIDXFM-KRWDZBQOSA-N 414.531 2.236 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1 729033789 RHFVUEUVOSNLPE-OLZOCXBDSA-N 408.480 2.148 10 20 HECD O=C(NC[C@H]1CN2CCC[C@H]2CO1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729502505 ANEWPLJHHHELRB-HKUYNNGSSA-N 424.492 2.419 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccnc1-n1cncn1 731277935 HBNDDKOEIUHGLQ-UHFFFAOYSA-N 411.441 2.084 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)cc(O)cc3F)CC2)cc1 735952574 QQYRNHRFCJNKHM-UHFFFAOYSA-N 406.385 2.185 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cccc([S@](C)=O)c1)c1ccc(N2CCOCC2)cc1 737157173 HSHHOMDPUXXARA-WNNBVUDTSA-N 415.515 2.077 10 20 HECD CCOc1ccc(N(C)CC(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)cc1 739926904 MZHZKXDEFVVPKZ-QHCPKHFHSA-N 424.501 2.496 10 20 HECD CCN(CC)C(=O)CN1CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 740919741 KWYJYEHMEINKSN-UHFFFAOYSA-N 413.566 2.149 10 20 HECD CCCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 746363997 KVRYYDITDSHBFW-UHFFFAOYSA-N 413.522 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)c3ccccc3Cl)CC2)cc1 748470653 RFVGIXOKVOVHFS-HXUWFJFHSA-N 418.877 2.274 10 20 HECD COC(=O)C[C@H]1CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 749465925 LFBGZUXPZPJNSR-OAHLLOKOSA-N 406.438 2.428 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCCCSc1nccs1 749731879 ZSPHDSWCJCRTJH-UHFFFAOYSA-N 413.546 2.092 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3OCCc4ccccc43)CC2)cc1 750054523 VHTNVYRCNYWIMB-QFIPXVFZSA-N 410.470 2.201 10 20 HECD Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 752639801 ZWPAFEKERMMUOM-UHFFFAOYSA-N 413.453 2.414 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)c3ccc(OC)cc3OC)CC2)cc1 754071566 SDHPAHVAOMRXRK-IBGZPJMESA-N 415.534 2.332 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccn(-c4ccccc4)n3)CC2)cc1F 754212948 HDROKKBPQZZMPX-UHFFFAOYSA-N 423.448 2.307 10 20 HECD C[C@H](NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)c1ccc(N2CCOCC2)cc1 759247973 SITCHECLIODNMO-HNNXBMFYSA-N 413.499 2.404 10 20 HECD CS(=O)(=O)NC1(CNC(=O)NCCCSc2nccs2)CCCCC1 759547544 JTJYRVMZMVLBMP-UHFFFAOYSA-N 406.599 2.177 10 20 HECD C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 759568361 MSZUNQWRFZYZRT-SZVBFZGTSA-N 414.506 2.293 10 20 HECD Cc1c(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cnn1C 759926516 YIJZYADVMUMPMR-UHFFFAOYSA-N 404.382 2.342 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(c4ccncc4)CC3)CC2)cc1 759929032 SCNZDFNKRIREHL-HSZRJFAPSA-N 410.562 2.453 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cc(OC)c1OC 760105216 AWHYWJKPGJDXNE-UHFFFAOYSA-N 415.490 2.492 10 20 HECD O=C(NCCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)c1ccc(F)cc1 761118502 CODUMXMWUZQKJN-UHFFFAOYSA-N 405.813 2.379 10 20 HECD CN(C)C1(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCC1 763032657 YHVYWULLZQAJOF-UHFFFAOYSA-N 412.513 2.043 10 20 HECD O=C(NCCOCC(F)(F)C(F)F)NCc1ccc(N2CCOCC2)c(F)c1 764763538 NBJBZLZUYGSBQQ-UHFFFAOYSA-N 411.371 2.379 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1 768144207 KCGYLXIFNPOSSC-NSHDSACASA-N 403.410 2.058 10 20 HECD O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 769156849 UJVAHNPQRHWXGP-TUNNFDKTSA-N 417.550 2.461 10 20 HECD O=C(CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1)NC1CCCCC1 769319899 DMFZALSYSYWWSJ-UHFFFAOYSA-N 418.557 2.229 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccccc2OCCN2CCOCC2)c1O 774983577 PQIMXPXLFNOVQZ-UHFFFAOYSA-N 417.462 2.310 10 20 HECD Cc1ccsc1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786801185 QDXCLDOHGWXXCX-UHFFFAOYSA-N 405.495 2.089 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(F)ccc(OC)c3OC)nc12 788172009 FPTCZBYERROHGI-UHFFFAOYSA-N 419.365 2.125 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccc(N2CCCC2=O)c1 788232289 FVOGMBPYZQHCIE-UHFFFAOYSA-N 418.497 2.122 10 20 HECD C[C@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC[C@@H]1CCCO1 789009127 GUPJUNDKGFMVJQ-KBPBESRZSA-N 407.422 2.303 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H]1CCCO1 789832623 BLQQSLVMBCUJOC-CAQIIQHBSA-N 421.513 2.129 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(F)(F)C3(O)CCCC3)CC2)cc1 791300205 IEMDKSUWBQLWBV-UHFFFAOYSA-N 411.493 2.264 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 792749230 QLHVRQMUAFUZTB-UXLLHSPISA-N 400.516 2.285 10 20 HECD COc1ccc(CNC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)c(O)c1 792961745 YKPRODHRTYJQFG-UHFFFAOYSA-N 412.490 2.069 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c(O)c1 793062149 PPAAIDKZBHYUSX-UHFFFAOYSA-N 423.466 2.079 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795249366 RUGZIBKNXSYBLJ-SJORKVTESA-N 413.540 2.027 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H]2CCCC(=O)N2)c(C)n1-c1ccc2c(c1)OCCO2 800242158 PVABDRDUUMPKJH-QGZVFWFLSA-N 412.442 2.260 10 20 HECD C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccc(N2CCOCC2)cc1 803301985 DOEPZINBARAALD-SFHVURJKSA-N 411.502 2.033 10 20 HECD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677310 MEBBYVWEDDSWHO-WOJBJXKFSA-N 414.550 2.103 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccn1 806844536 ZJSYGGQBSDBILS-OKILXGFUSA-N 416.453 2.098 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 808543588 KNHAJSBDVYUMSG-UHFFFAOYSA-N 420.399 2.019 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCC[C@@]13CCOC3=O)c2[N+](=O)[O-] 813282081 JYHUJHDXRLXXNR-QFIPXVFZSA-N 420.377 2.292 10 20 HECD Cc1cc(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1Br 819721501 VGMNSYVHPIXIIZ-CQSZACIVSA-N 404.264 2.344 10 20 HECD O=C(NCCc1cn2c(n1)CCCC2)NCc1ccc(N2CCC(O)CC2)c(F)c1 918208145 AVFRHPUYDNMGPJ-UHFFFAOYSA-N 415.513 2.362 10 20 HECD O=C(Nc1ccccc1-n1ccnn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918295147 AQFVXRYOMAXPBO-QGZVFWFLSA-N 421.457 2.119 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 1321703266 WGJXVCKEBXLZIP-JMDOCYRQSA-N 417.380 2.044 10 20 HECD CNS(=O)(=O)c1cccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)c1C 1321892747 IKIUTARGQLMTAE-UHFFFAOYSA-N 406.527 2.406 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)c1ccc(Cl)cc1 1324541484 LAUGKVPIMRZFEB-MGPUTAFESA-N 407.850 2.249 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccs1)C1=NN(c2ccccc2)C(=O)C1 1795271563 RDGDFZXZKWZXRD-RBVVOMGSSA-N 423.498 2.188 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)[C@@H]1CCc2ccccc21 1796602883 XFFGCIUPAAZRSP-SFNKJDCFSA-N 407.470 2.475 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1CC1(F)F 1796934174 BFHORFLZTJGOPE-UKMLZYKCSA-N 416.428 2.073 10 20 HECD O=C(CC1CCOCC1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1809566396 IHPUXSIRZNPSEN-UHFFFAOYSA-N 417.506 2.154 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)no1 1826049358 WQFNVKJZXGMSGX-KRWDZBQOSA-N 414.462 2.336 10 20 HECD CCCCC[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055729 PNHJZGXRDIDEJV-AWEZNQCLSA-N 411.593 2.267 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc([N+](=O)[O-])c(O)c3)CC2)cc1 24110262 AOJQYFOIHWNDAL-UHFFFAOYSA-N 414.462 2.251 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COCCNC(=O)OC(C)(C)C 732550266 WGENBOGGYNROLY-UHFFFAOYSA-N 407.511 2.023 10 20 HECD CCOCCCN1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](C)C1 734660706 GCQHNBCZHIHBMJ-UGKGYDQZSA-N 418.582 2.459 10 20 HECD CCCC(=O)N1CCCC[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742948485 ULJLVYIWZLQJNO-NRFANRHFSA-N 416.566 2.115 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 746355045 BEVVMUANFCMOII-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCC(F)F)cc1 748979647 BHIFADYWWVXRAG-UHFFFAOYSA-N 419.428 2.422 10 20 HECD CNS(=O)(=O)[C@@H]1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 750053849 UXCCULTYGBWKAP-GOSISDBHSA-N 409.939 2.440 10 20 HECD O=C(N[C@H]1CCc2n[nH]cc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751068589 QPKAQJIGVOZCKC-LBPRGKRZSA-N 418.500 2.265 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 754563021 LNHIINYDNGGLLF-YWTNHNAXSA-N 407.530 2.460 10 20 HECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc3c(c1)CCCN3C)C2=O 756957634 XOYNJMWXVQTUED-HOTGVXAUSA-N 412.534 2.432 10 20 HECD Nc1cnccc1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 765411297 SDXVGDIOEIGRBA-UHFFFAOYSA-N 401.378 2.235 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC([C@](C)(O)C(F)(F)F)CC3)nc12 767897554 PBVUIHHVUVVXCE-KRWDZBQOSA-N 416.400 2.137 10 20 HECD COC(=O)CN(Cc1cc(OC)cc(OC)c1)Cc1cc2c(cc1O)OC[C@@H]2O 768442737 NNSZKMPKUDIBDB-IBGZPJMESA-N 403.431 2.010 10 20 HECD CNS(=O)(=O)c1ccc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(F)c1 768485113 SXNNCDBZOCGXBL-HNNXBMFYSA-N 420.510 2.048 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 775122176 QRCFKUXYVHQJCU-DYESRHJHSA-N 407.514 2.374 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 775370394 GAEBXKDSIDNQTF-HUUCEWRRSA-N 401.463 2.018 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCc2cc(OC)c(OC)cc2OC)c1 775370588 WXIANEFCVBWTIM-CYBMUJFWSA-N 404.463 2.394 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(OC[C@H]2CCOC2)CC1 784223970 SOPHRDVBJRNXAB-SFHVURJKSA-N 421.513 2.389 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCn3cnc4ccccc43)ccc21 785410661 HFIQACRKCCXWHO-UHFFFAOYSA-N 405.502 2.241 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(F)cc(F)c3)cc2)CC1 786122625 WOOOFUBEJVIZFE-UHFFFAOYSA-N 409.458 2.112 10 20 HECD CC[C@@H]1CO[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789819196 MKPSYERGIXFHMK-XLMAVXFVSA-N 421.513 2.081 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1 789840182 GRDSGMDKIWJWIA-FGTMMUONSA-N 417.525 2.488 10 20 HECD CC(C)(C)N1CCC(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789855954 MZLOMJGXHVUKLS-UHFFFAOYSA-N 418.607 2.235 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c1 790392785 AARZSPVMYOXZIW-CEXJFXJFSA-N 418.534 2.195 10 20 HECD CCCN(CC)C[C@H](C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 794269948 ALRJUYKQYYHTEO-JZHDPFOFSA-N 416.566 2.137 10 20 HECD CC(C)(C)CS(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 799763603 VAEAETUSPMIEAA-UHFFFAOYSA-N 421.542 2.408 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCN(CC(F)F)CC2)cc1)C1CCCCC1 803676566 MODMYTTXNDOHKB-UHFFFAOYSA-N 422.520 2.481 10 20 HECD CNC(=O)CC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 806457608 POGPWECSYQMPEA-QGZVFWFLSA-N 420.529 2.377 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)cc1 806688931 AYJMZLPTYCSAEK-LJQANCHMSA-N 403.523 2.293 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COCCN1CC(F)F 806951034 ZHFCRMXIBSDSBC-BBRMVZONSA-N 419.419 2.339 10 20 HECD CCCn1ccnc1CCCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290155 RJKFKSFYPVOMIA-UHFFFAOYSA-N 409.534 2.377 10 20 HECD Cc1csc([C@@H](C)CNC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 807349783 APQDPNBHJUZCOT-HNNXBMFYSA-N 416.547 2.166 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(C)nc4cc(C)nn34)CC2)cc1 916744641 JPOZAZHLMFCFLV-UHFFFAOYSA-N 422.533 2.297 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 918295540 QFBGICDKGKVXDP-GOSISDBHSA-N 412.442 2.325 10 20 HECD O=C(Nc1ccc(-n2ccnc2)nc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918297307 QFPVSSZGUSLZGA-SFHVURJKSA-N 421.457 2.119 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3)cc2F)C[C@@H](C)O1 918853036 UGSAQLSJUXQTNH-GASCZTMLSA-N 401.438 2.308 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CN)CCO3)cc1 1781753183 DTUMZCOUBPLDII-XDHUDOTRSA-N 424.545 2.132 10 20 HECD O=C(/C=C/C1CC1)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720425 RJUGNHOPMXHARR-UXONFWTHSA-N 400.460 2.141 10 20 HECD CC(C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843444 OPZINZQQYRTBSO-CQSZACIVSA-N 417.466 2.337 10 20 HECD COCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423840 KJIBPJALPMKCEU-KRWDZBQOSA-N 405.495 2.153 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CCNC(=O)c3ccco3)cc2F)C[C@@H](C)O1 55529437 LSLSNGIXSXCZEW-HUUCEWRRSA-N 403.454 2.469 10 20 HECD C=CCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 143591936 NXIYZYYSJYYOSK-UHFFFAOYSA-N 413.449 2.482 10 20 HECD CCS(=O)(=O)N(C)C1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 731360056 UXRUSIGJEGMRPC-UHFFFAOYSA-N 408.568 2.242 10 20 HECD CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1 731897646 UBBRVDYLCPVGSF-PXNSSMCTSA-N 402.539 2.360 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 741894568 UROLUOBHXHZNNE-UHFFFAOYSA-N 412.490 2.474 10 20 HECD O=C(CCN1CCN(c2ccccc2)CC1)NCc1ccc(N2CCOCC2)cc1 742247101 ORQSGKBULBQDNI-UHFFFAOYSA-N 408.546 2.352 10 20 HECD CCC(=O)NCc1cc(S(=O)(=O)NCc2ccc(N(C)C)cc2)ccc1OC 751967160 DMMNDQFSCGFYRH-UHFFFAOYSA-N 405.520 2.266 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)[C@@H]3CCN(C)C[C@@H]3C)cc2F)CC1 754370860 WDVABUGAKGNQER-FXAWDEMLSA-N 405.562 2.449 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCCc3ccncc3C)CC2)cc1 755052212 CXUZWJWBOFDWOB-UHFFFAOYSA-N 411.550 2.453 10 20 HECD C[C@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)cc(F)c1O 756583661 PUQQQPWJKFECSK-ZFWWWQNUSA-N 416.335 2.351 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](CCO)C3CCCCC3)CC2)cc1 760863594 OOPNQSFLOVSKBD-FYYLOGMGSA-N 405.583 2.099 10 20 HECD Cc1ncc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 772020440 IOBFBWUPZVTIQE-MRXNPFEDSA-N 401.536 2.195 10 20 HECD O=C1C[C@H](c2cccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)c2)CN1 772473419 FOUPDPWYLMLYSE-SFHVURJKSA-N 406.486 2.145 10 20 HECD CN(C)C(=O)c1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772905273 DUAGCLSNHSEJMK-UHFFFAOYSA-N 414.481 2.092 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H](c4cc[nH]n4)C3)CC2)cc1 778244071 OPOLFLPWQANWRA-CNZFZVQHSA-N 423.517 2.029 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc3c(c2)OCCCO3)cc1 784564045 MJWSMEIHDVSCKU-UHFFFAOYSA-N 400.431 2.475 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nn1[C@H](C)C1CC1 784688689 XDDSOAILISRNCE-MRXNPFEDSA-N 411.506 2.254 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Nc3ccc4c(c3)OCCO4)cc2)CC1 786044864 TZUDDXZAAJQZBU-UHFFFAOYSA-N 410.474 2.448 10 20 HECD CCOC(=O)CC1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)cc2)CC1 788950426 AHIZXDGHMUNQSF-UHFFFAOYSA-N 403.523 2.341 10 20 HECD COc1ccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c(O)c1 794382636 DXRGUAXUFWSYJE-ULQDDVLXSA-N 420.531 2.314 10 20 HECD CCCN(C)S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249437 UNGXNCCBCNSDCM-QGZVFWFLSA-N 414.572 2.495 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1 796791157 RJHGYMWOCXPCEB-LBPRGKRZSA-N 415.446 2.103 10 20 HECD COc1ccc(CN2CC[C@@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2=O)c(OC)c1 805442262 RVOIZISOHBUZBH-RLXIPRIJSA-N 412.442 2.046 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O 806279530 RGPCWQYLOYZBHQ-HNNXBMFYSA-N 424.592 2.181 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1 806423858 FDXIJFXFDXOFKB-JOCHJYFZSA-N 408.546 2.458 10 20 HECD CCn1ncnc1CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 807900411 XADCVDJHJHORMA-AWEZNQCLSA-N 418.929 2.120 10 20 HECD COc1ccccc1CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)OC 810107861 YLCJIFDOMXDGAL-UHFFFAOYSA-N 417.481 2.351 10 20 HECD COC(=O)Cc1sccc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 815453734 ULHQNFGKXXBXGF-UHFFFAOYSA-N 404.488 2.345 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cccc(NS(C)(=O)=O)c3)CC2)cc1 918368647 AWFLGZNRIBDZQD-UHFFFAOYSA-N 403.504 2.419 10 20 HECD CN(CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)c1cccs1 919969956 LKGOYBJZBMJALJ-UHFFFAOYSA-N 401.532 2.345 10 20 HECD Cc1cnoc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804288786 GSOWLTUPURONIT-PLCSWTFUSA-N 413.430 2.065 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)cn3)CC2)C1 1810542958 GORUTCARHXYIEC-UHFFFAOYSA-N 414.437 2.186 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cnc(Cl)c(Cl)c2)C1 1844448555 CMYFHKVSCYNELI-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)cc(Cl)n2)C1 1844567656 IEXXWVHFEDJRNB-UHFFFAOYSA-N 423.256 2.325 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c(O)c1 1846791224 XLFYBUILKGMXSC-VMPITWQZSA-N 424.453 2.348 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1 730066836 QKCVKTNECUPJMC-ZDUSSCGKSA-N 408.476 2.244 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC3CCC4(CC3)OCCO4)cc2F)CC1 730116832 GJHLXSUOWBOHDW-UHFFFAOYSA-N 420.529 2.453 10 20 HECD CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743954632 CPMWMZLKZBBULJ-UHFFFAOYSA-N 416.499 2.071 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 748039291 XOXFQYDWLABTOW-HSZRJFAPSA-N 422.485 2.149 10 20 HECD O=C(CNC(=O)Nc1ccccc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405802 JGCQVTSUQDVYET-UHFFFAOYSA-N 400.454 2.225 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c1 751316740 AHGSQEIGYFDDNA-CYBMUJFWSA-N 418.475 2.148 10 20 HECD COc1ccc(N2CCN([C@H]3CC(=O)N([C@H](C)c4cccnc4)C3=O)CC2)cc1F 753976845 BVAGGKHLKQMCIT-BEFAXECRSA-N 412.465 2.240 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)[C@@]12CCCO2 759323886 UWKLOTRFMOXSOB-XPNTWCBSSA-N 417.550 2.421 10 20 HECD COc1cc(N2CCN(C(=O)CNC(=O)C3CCCCC3)CC2)cc(OC)c1OC 759406770 XRVLICPKVSJPEY-UHFFFAOYSA-N 419.522 2.058 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1F 760528287 USXBAJBVAPBXJK-UHFFFAOYSA-N 412.508 2.308 10 20 HECD CSC[C@@H](CCO)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 765256331 IWPBDIUCSUGDMQ-GFCCVEGCSA-N 416.546 2.098 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cccc(-n4ccnn4)c3)CC2)cc1 769017032 OPNDTYHODFYIBF-UHFFFAOYSA-N 421.505 2.220 10 20 HECD COc1cccnc1NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 771804673 WLMRPYUKECJGTE-UHFFFAOYSA-N 402.451 2.470 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C3CCC(CO)CC3)CC2)cc1 772587692 CTNGFQKJCZTHIF-UHFFFAOYSA-N 418.582 2.400 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)c1 775184492 IDOAKSOWQMWEAM-UHFFFAOYSA-N 422.478 2.113 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)cc1 777857116 RCRGYWQSIXOTNJ-UHFFFAOYSA-N 420.447 2.096 10 20 HECD O=C(COC(=O)c1cn(-c2ccccc2Br)nn1)c1ccc(O)c(O)c1 782748484 LMMGVHMOCVMEOZ-UHFFFAOYSA-N 418.203 2.481 10 20 HECD CCN1CCN(c2ccc(CNc3ncnc4c3NC(=O)CS4)cc2F)CC1 784182475 PQKWNUUNESPRBX-UHFFFAOYSA-N 402.499 2.414 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1Cl 786683835 NOBUSXVGGRNABO-SFHVURJKSA-N 416.909 2.038 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncnn1C 788733368 PHEXJUNELHCJPY-GFCCVEGCSA-N 412.416 2.231 10 20 HECD COc1ccc(CNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c(O)c1 792971917 QWZHMJHOWUSUAR-ZDUSSCGKSA-N 407.492 2.212 10 20 HECD CNC(=O)[C@@]1(C)CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 797466275 HVEWUZMFNFPVCV-XOBRGWDASA-N 410.465 2.424 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCN(C2CCC2)C1 803663129 KDOBERMXLMDTLG-DOTOQJQBSA-N 404.530 2.277 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cnc(NC(C)=O)s3)CC2)cc1 804960556 RKLUWADOQDSAIS-UHFFFAOYSA-N 410.521 2.011 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NCc2ccc(OC)cc2O)s1 805877968 CBFXNTOTNLVUOB-WDEREUQCSA-N 407.496 2.277 10 20 HECD Cc1cc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ncn1 806199777 LGJFKUYKJPTDIX-UHFFFAOYSA-N 407.474 2.289 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(c2nnc3ccccn23)CC1 807095185 AOLJPKMOTIIXDB-UHFFFAOYSA-N 420.517 2.126 10 20 HECD Cc1nc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)sc1C 807338814 HQNAQCCFEYXORV-INIZCTEOSA-N 403.504 2.290 10 20 HECD CC(=O)NCc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807386763 IFNOZBSJGNRHBD-UHFFFAOYSA-N 420.263 2.046 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C[C@H]1C 808851724 IXMGQTWQVJUYJV-RBUKOAKNSA-N 412.578 2.339 10 20 HECD Cc1cc(C(=O)COC(=O)c2cncs2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 809231442 NEFRGCWEFSXKKH-UHFFFAOYSA-N 419.484 2.238 10 20 HECD C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 809401523 UCGZJYWYMNELJU-VGOFRKELSA-N 424.545 2.473 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2nnc(SC)s2)cc1 809607718 GQZDVKTZLPDOPS-UHFFFAOYSA-N 407.565 2.381 10 20 HECD O=C(CN1CC2(CCC2)[C@H]1[C@H]1CCCO1)NCc1ccc(N2CCOCC2)c(F)c1 810092898 JPMJQYJBOKMSHB-IFMALSPDSA-N 417.525 2.312 10 20 HECD CCOCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)no1 812009820 SKAUZFOJPRJINR-HNNXBMFYSA-N 417.510 2.375 10 20 HECD CO[C@@](C)(C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 812656130 GNVURERTNLQZBH-ZCCHDVMBSA-N 422.497 2.414 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3cccc(N4C(=O)CNC4=O)c3)CC2)cc1 918039991 XXJILUHUXCMTNX-UHFFFAOYSA-N 423.473 2.496 10 20 HECD CCN(CC)C(=O)CCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918209800 OSLAABLCBHJSMT-UHFFFAOYSA-N 408.518 2.235 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC(CC(N)=O)CC3)cc2F)C[C@H](C)O1 918210926 ZGKMZDQFZCRECI-GJZGRUSLSA-N 406.502 2.236 10 20 HECD CCOC(=O)N[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 918224198 NGSVGUHOIHLCEO-INIZCTEOSA-N 408.474 2.082 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccccc3OC)CC2)cc1 920255570 ZHAHETPYWXNBCP-VAWYXSNFSA-N 409.486 2.225 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@@H](C)O[C@H](C)C1 921203188 DAPTUJCEALVTCU-LZJOCLMNSA-N 407.530 2.412 10 20 HECD CN1CCN(c2ccc(CN[C@H]3CCCN(C(=O)N4CCCC4)C3)cc2F)CC1 1322444216 CJWUIDWJHJAGMB-IBGZPJMESA-N 403.546 2.347 10 20 HECD Cn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c1 1817843971 LDFTVIVHQOYWCA-HNNXBMFYSA-N 410.434 2.174 10 20 HECD CC(=O)NC1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 50992394 RTFZMYUXUXVCIV-UHFFFAOYSA-N 405.454 2.001 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCN([C@@H]4CCS(=O)(=O)C4)CC3)c2C)c1 109108083 UAFRLKOSIDWBKS-HXUWFJFHSA-N 415.559 2.347 10 20 HECD Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)C(=O)NCc1c(C)c2ccccc2n1C 673315636 PJGCGFGQOLLKEA-FQEVSTJZSA-N 423.517 2.053 10 20 HECD COc1ccc(CN2C[C@H](C(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 726497350 PXDTXOGQUPIANQ-LJQANCHMSA-N 423.513 2.401 10 20 HECD CSc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 727230478 OYIOCAKHFYKIBO-UHFFFAOYSA-N 404.467 2.034 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)[C@@H](C)N3CCOCC3)cc2F)C[C@@H](C)O1 729597463 POQLRPYFRSXJAB-XMTFNYHQSA-N 422.545 2.348 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)cc2)CC1 735391495 HNDZRUMKMYYKDZ-UHFFFAOYSA-N 420.513 2.464 10 20 HECD O=C(Cc1nc2ncccn2n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805335 IYPPTAGNHKUVCQ-ZDUSSCGKSA-N 402.405 2.053 10 20 HECD CN(CC[C@H]1CCCCN1C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 745691358 JJBUYLCBLLMLEP-VQTJNVASSA-N 415.582 2.404 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 747827959 PGLJWQMPRBBBAW-UHFFFAOYSA-N 412.490 2.393 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 753212842 NCRDUTBQKZKGES-CQSZACIVSA-N 421.519 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)CCNC(=O)OCC(F)(F)F)CC2)cc1F 753739450 SBXCOQSZAJEAIX-UHFFFAOYSA-N 407.364 2.162 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)cc2F)CC1 753926832 YBQRUWKDCARGHI-FUHWJXTLSA-N 403.546 2.392 10 20 HECD O=C(CN[C@H](CCO)c1cccs1)NCc1ccc(N2CCOCC2)c(F)c1 754394510 IRBXDMNYSLCELC-QGZVFWFLSA-N 407.511 2.053 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)CCNCc2ccc(N3CCOCC3)c(F)c2)cc1 757957965 QDTWIFZEYQFJEW-UHFFFAOYSA-N 423.466 2.134 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3nnnc3/C=C\c3ccccc3)CC2)cc1 758220869 CGMMVHAXOXXQSC-YVRYJGMNSA-N 420.517 2.035 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 759590898 BKHHKGCVYUSOLP-IVVMODTJSA-N 401.390 2.393 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCn3cc([N+](=O)[O-])cn3)cc2F)C[C@H](C)O1 768521604 AEGYDGYAHSVVJS-KBPBESRZSA-N 420.445 2.043 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 770265653 LVRRBRACNVZJOB-UHFFFAOYSA-N 417.487 2.267 10 20 HECD CC(C)[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 772115663 WZWHDORAGGEYIW-HBFSDRIKSA-N 402.539 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(Cc3cccnc3)C3CC3)CC2)cc1 778224704 CZACCWAFVOZHDP-KHPPLWFESA-N 420.513 2.486 10 20 HECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cn1 781709434 FWRASHYVQPIRTL-UHFFFAOYSA-N 422.526 2.240 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)C)cc1 785434568 VBQKVJOPMGTWLQ-IBGZPJMESA-N 402.926 2.441 10 20 HECD CC[S@](=O)CC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787947715 HCXKQIDDCHBYLI-ZNNHIBJESA-N 413.451 2.101 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCc2ccccc2C1 788931843 JUHWRSBCJFJHGB-LJQANCHMSA-N 420.557 2.466 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CSc2ccccc21 789800831 PVGZYVVHDJMZQD-QGZVFWFLSA-N 415.490 2.242 10 20 HECD CC[C@H](CSC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789818728 KOHDXAJLUXSCFJ-IJEWVQPXSA-N 411.543 2.313 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)ccc1O 790406037 BDECZMJOFMJXFZ-UHFFFAOYSA-N 424.422 2.428 10 20 HECD COC(=O)Cc1sc(NS(=O)(=O)c2c(C)cnn2C)nc1-c1ccccc1 795553171 GERFUKWNRKXSDA-UHFFFAOYSA-N 406.489 2.368 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1-n1ccnn1 796764136 UTSRRDCTCYBHDZ-QGZVFWFLSA-N 411.531 2.353 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c(O)c1 797387872 PXTOVORIPOSILG-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1 799251448 WOBPQJWCFATASW-UHFFFAOYSA-N 424.501 2.485 10 20 HECD COCCS(=O)(=O)CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800049163 GTFAMKCHNJNDIP-AWEZNQCLSA-N 402.944 2.254 10 20 HECD CCN(CCOCCO)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 800431045 UVHFILDKPCAJGB-UHFFFAOYSA-N 402.491 2.379 10 20 HECD C[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803308371 DQAGAMRUDJEJHB-HUUCEWRRSA-N 402.520 2.077 10 20 HECD C[C@H]1OCCN(C(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1C 803450754 PCKAWCBSWWLPDN-ZIAGYGMSSA-N 411.449 2.009 10 20 HECD CN(CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)Cc1ccc(F)cc1 803687349 KXVDKGHXHMPSAX-UHFFFAOYSA-N 412.509 2.073 10 20 HECD C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687973 JANZIBAYZHXQHE-HNNXBMFYSA-N 418.538 2.057 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CC[C@@H](C)C3)cc2F)CC1 805007758 PHQTZHBFRYOIQE-IAGOWNOFSA-N 404.530 2.136 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@]2(CCc3ccccc32)C1 806277695 FNJADDXWYBPCAF-HXUWFJFHSA-N 417.556 2.442 10 20 HECD CNS(=O)(=O)c1cc(NC(=O)NCc2ccc(N3CC=CC3)cc2)ccc1F 806545469 XCWLUDNNQATJLC-UHFFFAOYSA-N 404.467 2.432 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807103545 RRWIYAJQYBYNQZ-IEBWSBKVSA-N 416.566 2.221 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N(C)[C@@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 816816746 GXCRAXCXBGIFQA-QGZVFWFLSA-N 405.520 2.209 10 20 HECD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1 912560530 OSVYRFHCSIQDGA-UHFFFAOYSA-N 421.460 2.079 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 918303727 FUBMCFDMTHEJJC-UHFFFAOYSA-N 422.485 2.393 10 20 HECD C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920867548 UQQDZIUJFDVUSR-CQSZACIVSA-N 404.492 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1319060387 AFTRAEHEPUOOJL-UHFFFAOYSA-N 410.474 2.310 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccc([N+](=O)[O-])cc4C3)CC2)cc1 1323792541 QYLXYKPAQSJFKB-NRFANRHFSA-N 412.490 2.102 10 20 HECD CCC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823714040 WWXHXQGTYQRVNZ-SECBINFHSA-N 423.878 2.413 10 20 HECD CC(C)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987229 HYDDHQSPXGALGD-UHFFFAOYSA-N 418.538 2.114 10 20 HECD Cc1nn(C)c(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1842299985 GZGALHVFVZTFKJ-UHFFFAOYSA-N 422.844 2.063 10 20 HECD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)cc(O)n1 1843372603 MJLOMUKCCPIKRH-UHFFFAOYSA-N 417.849 2.291 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037768 TUTPREMTMNATCW-XUDQMGBKSA-N 400.475 2.456 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(CC(F)(F)F)C1 144327463 HJCCAKMJPQRBGY-CQSZACIVSA-N 404.408 2.098 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O 302621693 FLMCZWKDVSFGNE-UHFFFAOYSA-N 405.476 2.471 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Cl)c2F)cc1C(=O)O 728015548 SCHLBXLYLZOLAK-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CN(CCN1CCN(c2ccccc2)CC1)CC(=O)NCc1ccc(N(C)C)cc1 738338348 AKWNCGMQSPPQKG-UHFFFAOYSA-N 409.578 2.123 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3Cc4cc(F)ccc4O3)CC2)cc1 740644348 AREZDGMKAQNLKH-QFIPXVFZSA-N 413.493 2.466 10 20 HECD Cc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)ccc1-n1cncn1 742054755 HUGIXKTVDHHWBM-UHFFFAOYSA-N 411.487 2.063 10 20 HECD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NCc1c(O)ccc2c1CCCC2 743520680 KSLKQDOKOIRTMU-UHFFFAOYSA-N 414.506 2.325 10 20 HECD CN(C)c1ccc(CN(C(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)C2CC2)cc1 745882531 HHHVOSRBRNLUBT-LJQANCHMSA-N 410.522 2.356 10 20 HECD Cc1ccc(NC(=O)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(Cl)c1 746399246 UUOCZLWFPIYIAG-UHFFFAOYSA-N 411.867 2.094 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cc4c(N(C)C)ncnc4n3C)CC2)cc1 747210151 HKJWIVQQWLDTGV-UHFFFAOYSA-N 408.506 2.395 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cscc3C)CC2)cc1 748718347 VDOQCWSMZUDLTA-UHFFFAOYSA-N 416.547 2.332 10 20 HECD C[C@H]1C[C@@H](NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)c2c(O)ccc(F)c21 756740662 SJJUVCMXZKCQCO-BLLLJJGKSA-N 408.499 2.256 10 20 HECD CC(C)CN1CC[C@H](CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 756988655 ZENKBTKBTFAXFM-UXHICEINSA-N 415.582 2.165 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1F 760096807 MYTPQSXNWATGIJ-OAHLLOKOSA-N 401.438 2.314 10 20 HECD CN(c1ccc(CNC(=O)N(CCO)CCN2CCOCC2)cc1)C1CCCCC1 764364979 KWQITNASRMDQLE-UHFFFAOYSA-N 418.582 2.292 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](CO)Cc1ccc(F)cc1 766763888 LOJMXFBSPXRASG-GOSISDBHSA-N 419.472 2.329 10 20 HECD CCc1nc(CC)n(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 768518067 MCGUMQOTTYSKOD-HUUCEWRRSA-N 403.502 2.472 10 20 HECD CNC(=O)COc1cccc(CC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 772062237 SOHFYYVFDGSMLE-UHFFFAOYSA-N 411.502 2.101 10 20 HECD Cc1cc(N2CC[C@@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)n(C)n1 773030901 XUJAJSPNOFMSTO-CRAIPNDOSA-N 401.486 2.160 10 20 HECD C[C@H](NC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(N(C)C)cc1 773135004 HBPZGULXDMMOFK-HNNXBMFYSA-N 401.511 2.368 10 20 HECD CN(C)c1ccc(CNC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)cc1F 773787272 RXNXGHCZPLLIIJ-UHFFFAOYSA-N 424.498 2.141 10 20 HECD CCc1ccccc1S(=O)(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 777945555 NPNCGHMOOQAOEC-UHFFFAOYSA-N 403.548 2.358 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(NC(C)=O)c3)CC2)cc1 778220697 LCKVJWXQFPMIQY-ZHACJKMWSA-N 422.485 2.497 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@H](C)[C@H]3C)CC2)cc1 778285960 RRGDIHNCJSMXGA-MGSINWNPSA-N 403.548 2.252 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCOC(C)(C)[C@@H]3C)cc2F)C[C@@H](C)O1 789815889 BFZHPSLORVVYTP-XHSDSOJGSA-N 421.513 2.081 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(OC)c(C)c1OC 797110179 XBUWUCSIIVYECP-NSHDSACASA-N 418.446 2.118 10 20 HECD CNC(=O)[C@@]1(C)CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 797444901 KQTJUCLPYVTRAX-FQEVSTJZSA-N 410.465 2.424 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cn1 797647420 GDUXERPLIBTOBF-LBPRGKRZSA-N 422.507 2.322 10 20 HECD CNC(=O)COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c1 797680783 MBKPMKZVUIDZLK-UHFFFAOYSA-N 412.490 2.278 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(S(C)(=O)=O)ccc1OC 802721852 JAWXAAUJCMNOEY-UHFFFAOYSA-N 401.462 2.004 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@@]3(CCOC3)C2)cc1)C1CCCCC1 803677762 SFAHXXKRQCEIQA-QHCPKHFHSA-N 415.534 2.090 10 20 HECD CC1(C)CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769258 DUHFCBSSFBXDRI-CQSZACIVSA-N 411.449 2.010 10 20 HECD CCc1cnc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 807770431 OHGKYYZPUYAHMV-INIZCTEOSA-N 417.531 2.278 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H](c1cccnc1)C1CC1 808294000 MFJMENQDBOYLBM-OAQYLSRUSA-N 408.502 2.144 10 20 HECD Cn1ncc2ccc(CNC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 812913998 FJHNQVBVXOULGM-IBGZPJMESA-N 420.517 2.274 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c1 815496498 KJERDHMILCGETK-ORAYPTAESA-N 411.458 2.417 10 20 HECD CCn1nncc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 815710763 UYBKATBPPAJRCL-MRXNPFEDSA-N 402.499 2.360 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1Cl 912984299 RTCPRQJEDHPLCQ-UHFFFAOYSA-N 416.868 2.094 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)C3CCCCC3)CC2)cc1 916196484 IMMIZCBIQQAOQW-QFIPXVFZSA-N 418.582 2.448 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1 916565872 MLTZYSLRSYLYPZ-GOSISDBHSA-N 422.485 2.104 10 20 HECD CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920638002 PRMLLQXKTJQVGO-GFCCVEGCSA-N 422.459 2.346 10 20 HECD COc1cc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C=O 1317897682 DZZQYEBPWYLYHD-UHFFFAOYSA-N 402.422 2.179 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccnn1C[C@H]1CCOC1 1320542603 AXYLKIFRUOHXAY-LJQANCHMSA-N 413.522 2.450 10 20 HECD C/C(=C\c1cccnc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603449 MKHQVFBHMLZKQI-CXWYDIKBSA-N 408.458 2.243 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)on1 1817843966 KYKYGSCPGDXEEY-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD Cc1ccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1842391396 GEEXQZBEDYUULV-SOFGYWHQSA-N 409.442 2.037 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3c(=O)cnc4ccccc43)cc2F)C[C@@H](C)O1 108291583 GMKOZOOAISCOMN-HZPDHXFCSA-N 424.476 2.466 10 20 HECD COc1ccc(N(CCn2cnc3c2c(=O)n(C)c(=O)n3C)Cc2ccccc2)cc1 216743287 FYRHYJIQGOKTLI-UHFFFAOYSA-N 419.485 2.149 10 20 HECD Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 472793878 SXJPLVDUHYBXLU-UHFFFAOYSA-N 421.501 2.282 10 20 HECD O=C(O)c1ccc2c(=O)n3c(nc2c1)/C(=C/c1cn(Cc2cccnc2)nn1)CC3 543116087 ADZGZCDEJXZCEL-RIYZIHGNSA-N 400.398 2.074 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 726561477 ZPPGPKZJEJKUMU-AWEZNQCLSA-N 423.560 2.209 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(N)nc(Cl)c3)CC2)cc1 726768250 PHQFKRRJRFOFQY-UHFFFAOYSA-N 403.914 2.268 10 20 HECD COC(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 733134834 CSGCDRKTMQKTIE-MRXNPFEDSA-N 410.474 2.497 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 734467802 FNWQIKNLGIDKNC-UHFFFAOYSA-N 422.576 2.057 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c1 735197385 GPAZSGTWPZNSJA-UHFFFAOYSA-N 421.881 2.250 10 20 HECD Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 735651189 VZBCCZNLHUXWTC-JOCHJYFZSA-N 420.517 2.261 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCC[C@H]2C2OCCO2)c1 742149578 KEBIXDPNYVTFLJ-FQEVSTJZSA-N 404.507 2.154 10 20 HECD CNC(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 756685347 QEOSEVNRAFJVQQ-MPGHIAIKSA-N 408.518 2.399 10 20 HECD COc1cc(Cl)cc(CNCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1O 761206546 KUCWEFXWJAJNEX-UHFFFAOYSA-N 415.855 2.031 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCCN(c3ccccc3F)C2=O)c1 763668208 AFFSBXZWQPIOCP-QGZVFWFLSA-N 422.434 2.255 10 20 HECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnn1CC(C)C 766575671 FYRFKURFAFWSPI-UHFFFAOYSA-N 413.522 2.281 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCN(c2ccc(F)cc2)CC1 772771781 ZBNIEUOVFUAJOB-KRXBUXKQSA-N 400.406 2.142 10 20 HECD COc1c([N+](=O)[O-])ccc(CNc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1O 774930567 RMPQCVYJWKQBQQ-KRWDZBQOSA-N 400.435 2.371 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3cnc(-c4ccccn4)n3)cc2F)C[C@@H](C)O1 776293689 YINFREQLFKWMLA-HZPDHXFCSA-N 424.480 2.409 10 20 HECD C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(S(N)(=O)=O)CC1 777822261 FFYSSSKPJXCGDC-MRXNPFEDSA-N 417.531 2.398 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cccc(N(C)C)c3)CC2)cc1 778251838 LNYYIEWARZDWRM-QXMHVHEDSA-N 422.529 2.282 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@@H]3CC(C)C)CC2)cc1 778277455 HPCGZSHCLOOJQW-GWQNQTGSSA-N 415.534 2.174 10 20 HECD COc1cc(OC)cc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780407032 DIEHQRXGYRVZBZ-UHFFFAOYSA-N 419.503 2.173 10 20 HECD CCOc1c(OC)cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785421125 BLUJTDYAOOQHLK-UHFFFAOYSA-N 415.490 2.101 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)nc3-c3ccncc3)cc2)CC1 787320092 RPLAQNCXWAWCFX-UHFFFAOYSA-N 418.501 2.081 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@@H]3CCC[C@H](OC)C3)CC2)cc1 796059505 BRFARWAYMODFJX-XLIONFOSSA-N 404.507 2.482 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)C2=Cc3ccccc3OCC2)cc1 797431607 UJXZKXHXORVLCT-UHFFFAOYSA-N 409.489 2.128 10 20 HECD CC[C@@H]1COCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449210 RJWOPOAXZJSYIH-OAHLLOKOSA-N 411.449 2.010 10 20 HECD O=C(COC(=O)[C@H](O)c1cccnc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 803956857 HMFYFJKTKIZZBL-HXUWFJFHSA-N 416.389 2.072 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)c3c(C)noc3C)CC2)cc1 804317501 FSRPGXKQVZTIHC-CQSZACIVSA-N 414.506 2.305 10 20 HECD CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NCc2ccc(OC)cc2O)s1 805877965 CBFXNTOTNLVUOB-GHMZBOCLSA-N 407.496 2.277 10 20 HECD Cc1cc(CC(=O)OCCn2cc(C(N)=O)nn2)c(C)n1-c1ccc(Cl)cc1 805945067 DIUKXOJQRKZXGI-UHFFFAOYSA-N 401.854 2.224 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O 807095088 KBZTZNRFLZDVGA-JWOSDPRPSA-N 401.551 2.465 10 20 HECD Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2=O)cc1 807658073 PEZDTQNXPZBXEH-OAQYLSRUSA-N 422.529 2.331 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c1O 815510329 RYNKDFUFIQAUBG-FZKQIMNGSA-N 411.458 2.417 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](CO)c4ccccc43)CC2)cc1 817783137 RLDJBCZOBZAEAF-DOJUMQAQSA-N 421.497 2.023 10 20 HECD CCOC(=O)C1CCN(C(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914614293 XWXDXFDVJRZUCM-UHFFFAOYSA-N 413.474 2.448 10 20 HECD CC(C)[C@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCN(C)CC1 916258184 MUHCEAWNICRKKV-RTWAWAEBSA-N 418.582 2.355 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1=NN(c2ccccc2)C(=O)CC1 917707488 JVIMHHJTGLKWPV-UHFFFAOYSA-N 410.449 2.462 10 20 HECD O=C(CCCOc1ccccc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334568 IBKJMZZZMBSCCB-UHFFFAOYSA-N 402.516 2.397 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1-n1cnnn1 919969355 WCNDSSJHOJFOLP-UHFFFAOYSA-N 406.490 2.109 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 920250217 CBFCEMBYHCLBGH-CMDGGOBGSA-N 409.442 2.267 10 20 HECD COC(=O)[C@@](C)(NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1319606256 HVBMCQRVRXAOTQ-QHCPKHFHSA-N 411.502 2.022 10 20 HECD Cc1ocnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798963122 ZYCHUUSCJMZSSI-ACHSLPGTSA-N 421.457 2.028 10 20 HECD Cc1ccoc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799768041 FDACOAJNVTVJBL-YWVIFJGQSA-N 420.849 2.170 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1)c1cc(O)nc(O)c1 1802234633 QWYCWDZRVYPHBC-ZMMAXQRCSA-N 423.469 2.138 10 20 HECD CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1806337489 KCSUDYLPTUUOTH-AKTGSIICSA-N 411.458 2.328 10 20 HECD CN1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847576869 PJOYQQMKFIRFPP-HRCADAONSA-N 407.898 2.051 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 472805940 PLYKRPCQMQTLJO-UHFFFAOYSA-N 413.499 2.454 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)n(C)c2ccccc12 527462156 IUCVZTPNMDMBDY-UHFFFAOYSA-N 402.458 2.381 10 20 HECD COc1ccc(-c2nnc(NC(=O)C3=S=C(C)C(CS(C)(=O)=O)=C3)s2)cc1 535688499 UGRVKNVHOVUEER-UHFFFAOYSA-N 423.541 2.235 10 20 HECD COc1ccc(N2CCC(NC(=O)CCc3c(C)nc4nc(N)nn4c3C)CC2)cc1 726562777 OYPQVSOTEHLTEA-UHFFFAOYSA-N 423.521 2.050 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(CN(C)C(C)C)CC3)CC2)cc1 728571588 GDIPQVRGVTXWPB-UHFFFAOYSA-N 402.583 2.396 10 20 HECD Cc1nc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)no1 729817706 PFAZTGOOALZIFH-KBPBESRZSA-N 419.501 2.272 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730134032 KFSPQMDWXGDXSM-GOSISDBHSA-N 420.529 2.452 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3[C@@H](C)O)cc2F)C[C@@H](C)O1 730260535 BBIBXVDAXNXTKI-AXVVYFOYSA-N 407.530 2.291 10 20 HECD O=C(COC(=O)c1cc(O)cs1)Nc1cccc(S(=O)(=O)N2CCCC2)c1 731912599 UNNMGOMGKOSWRM-UHFFFAOYSA-N 410.473 2.034 10 20 HECD CC(C)N1CC[C@H](NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)C1=O 734107231 DGEOIXLHGCFAHV-INIZCTEOSA-N 421.409 2.109 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1CN1CCOCC1 746133374 IBGIOZDFBVNVRU-UHFFFAOYSA-N 413.493 2.425 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC2CCN(CC(F)(F)F)CC2)c1 748858005 VPZRHBSRQLAJKT-UHFFFAOYSA-N 423.457 2.158 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCNC(=O)C3CCC3)cc2F)CC1 749118393 ZPKDRSMJFGPCLE-UHFFFAOYSA-N 419.545 2.073 10 20 HECD CNS(=O)(=O)C[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 749517354 RLCNAFRFKDDHGE-KRWDZBQOSA-N 405.520 2.257 10 20 HECD C[C@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 751066709 AQBGQZQUNAEQOB-QWHCGFSZSA-N 409.533 2.467 10 20 HECD COC(=O)c1cc(OC)c(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)s1 751319271 UXMDCPJOWJVZJN-SECBINFHSA-N 401.462 2.297 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 752341955 JYYJSBUBQYVEIY-CYBMUJFWSA-N 419.507 2.363 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(CCCN3CCCC3)CC2)c1 752629757 HLLWHVSXISFSQT-UHFFFAOYSA-N 409.552 2.492 10 20 HECD COc1ccc(N2CCN([C@@H](C)C(=O)NC(=O)NCc3ccccc3)CC2)cc1F 753861330 QNZXMJDETXPBDH-INIZCTEOSA-N 414.481 2.371 10 20 HECD CC(C)n1cnc(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)c1 753918657 OVPDIOFIOKDYLD-UHFFFAOYSA-N 416.492 2.364 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3c3cc(C)on3)CC2)cc1 754001183 YZVUWKZLIYTXCE-UGKGYDQZSA-N 400.523 2.312 10 20 HECD COC(=O)C1(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CCCCCC1 754083984 ZBKVZOAKRGFEDW-FQEVSTJZSA-N 419.566 2.034 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H]1C 754388862 WMZSTBXDWISQGY-BZSNNMDCSA-N 406.546 2.082 10 20 HECD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768521476 BJNHINSENSDTEK-ZDUSSCGKSA-N 424.408 2.361 10 20 HECD CCc1nn(C)cc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774280546 QJEQHJKLXVHTPE-ZDUSSCGKSA-N 421.448 2.308 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N(CCO)C3CCOCC3)cc2F)C[C@@H](C)O1 780312523 PJTKNBKPTFDIQB-HZPDHXFCSA-N 409.502 2.122 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1 785295478 HUXZAHSBYVJMBX-HUUCEWRRSA-N 413.474 2.009 10 20 HECD C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424568 PYBRBJLUOMDHEO-WQIZZMQYSA-N 401.532 2.326 10 20 HECD CN(C)CCOCCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 788017971 OONWGVRWMGUJKT-UHFFFAOYSA-N 400.470 2.134 10 20 HECD COc1ccc(N2CCN(CCCN[C@@H](c3cccnc3)c3nc[nH]n3)CC2)cc1 788505050 JINXVVVMAJQGJH-NRFANRHFSA-N 407.522 2.100 10 20 HECD COc1ccc(CNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)c(O)c1 795356453 DYOYIOMMNGKBRS-UHFFFAOYSA-N 419.908 2.077 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCCS(=O)(=O)CCc2ccccc2)c1 800059872 DZUUMUPQSBWZDA-HNNXBMFYSA-N 406.504 2.419 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCOC3(CCSCC3)C2)cc1F 803662272 AJBBBPLGYWZAOD-HNNXBMFYSA-N 409.527 2.069 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCCNC(=O)C(C)(C)C)cc1)C1CCCCC1 803677062 DWRQMCJVGRYQMA-UHFFFAOYSA-N 416.566 2.350 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)cc1 804400376 SQBRDCZKOCDCPI-HXUWFJFHSA-N 409.486 2.243 10 20 HECD COC(=O)c1cc(Cl)cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1O 804902922 XGNKWSLCDRODON-UHFFFAOYSA-N 414.823 2.162 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 806421656 WXKKCVFYUGTCTG-JXFKEZNVSA-N 408.502 2.242 10 20 HECD Cc1noc(C)c1CO[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807290486 WQZHCUXGBPEIFQ-HXUWFJFHSA-N 424.501 2.102 10 20 HECD CCNC(=O)C(C)(C)CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 808793565 KWTGVZYIAVLTQI-UHFFFAOYSA-N 403.523 2.332 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)S(=O)(=O)C[C@H]1CCCS(=O)(=O)C1 809388863 GBSDMHWWAZBEKA-SFHVURJKSA-N 414.593 2.263 10 20 HECD COCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCOC1 812396662 XJRJHRDFBFKLFE-QGZVFWFLSA-N 401.511 2.186 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCSC3)CC2)cc1 813715143 GDIJOEDUPSKZIZ-IJDCCNJMSA-N 403.548 2.159 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 917821383 DPLOJUFFRXGVAV-PWIZWCRZSA-N 413.518 2.298 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(N4CCOC4=O)c3)cc2)C1 917837621 YUYXSJWYHIVXMD-SFHVURJKSA-N 422.485 2.275 10 20 HECD O=C(Cn1cc(Br)cn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971551 QAJUJIWEQKOYPQ-UHFFFAOYSA-N 411.275 2.062 10 20 HECD CCN(CC)[C@H](CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)c1ccccc1 920980659 UXOIBKYVVAUADN-XCMFGDQWSA-N 402.564 2.442 10 20 HECD O=C(O)[C@@H](Cc1ccc2c(c1)OCCCO2)NCc1ccc(N2CCOCC2)cc1 1343648911 UNPBVIQGXNYDMF-HXUWFJFHSA-N 412.486 2.470 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccs1 1795277329 VYMVANABNZAWMU-LJWNITHASA-N 415.471 2.225 10 20 HECD CC(=O)C[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934543 ABILABKZPRZKER-WQCNXYOZSA-N 424.501 2.033 10 20 HECD CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824546144 KNDKUDCUIDPLAV-NQYLQCIDSA-N 419.522 2.133 10 20 HECD CC[C@H](C)[C@H](N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426121 LEUXZXVLUJQGOP-VHFSOBRXSA-N 418.538 2.100 10 20 HECD O=C([C@H]1CC1(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827427044 CJFYZUPGXYSVLW-HUUCEWRRSA-N 409.433 2.381 10 20 HECD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)on1 1827427443 YOEWSXHJGWKXFY-MRXNPFEDSA-N 414.462 2.336 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnnn3C)C2)cc1 1842134446 GWLWTPFIEVUCMS-UHFFFAOYSA-N 418.501 2.353 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](C)CC(N)=O)C3)cc1 1845398111 ZDXXYYQUMWFFLD-MRXNPFEDSA-N 422.529 2.423 10 20 HECD CC1CCN(C(=O)C2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)CC1 303636468 PWBUKJXKNWJGNE-UHFFFAOYSA-N 400.567 2.339 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccccc2Br)SC1=S 727177485 KMKNYZYKMOAILL-FLIBITNWSA-N 421.363 2.200 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)N3CCc4ccccc4C3)CC2)cc1 732264996 LOJGDBIXFIWTFK-UHFFFAOYSA-N 408.502 2.112 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(F)nc1 733925372 QXLSGHJCUFUIFW-UHFFFAOYSA-N 410.428 2.406 10 20 HECD Cn1c(=O)nc(O)c2c(C(=O)NCCCSc3nccs3)cc(C3CC3)nc21 733973650 TURJYCSRBFNTCM-UHFFFAOYSA-N 417.516 2.280 10 20 HECD CNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 734270888 ZIDZSDDBNLUORF-BFYDXBDKSA-N 406.502 2.107 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1 737182220 FSWIBAOKVPBQRS-GJZGRUSLSA-N 413.474 2.442 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 740907589 QKFGGIBKAJBXRL-WMZOPIPTSA-N 411.593 2.395 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 741211125 JFNCNSFGOFTPLD-HSZRJFAPSA-N 409.530 2.383 10 20 HECD C[C@H](NC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1)c1ccc(N2CCOCC2)cc1 743321588 HWMQRNFIBSRTLC-JXFKEZNVSA-N 421.497 2.219 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3cccc(-n4cncn4)c3)CC2)cc1F 753918790 GIARRSBYRVFQQZ-UHFFFAOYSA-N 410.453 2.447 10 20 HECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc(Br)ccc2O)C1 754153988 LLODRIIKAPGLQR-HNNXBMFYSA-N 421.357 2.027 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@H](C)c3nccs3)CC2)cc1 754269179 HNEUGIXHPBZESN-HKUYNNGSSA-N 404.580 2.370 10 20 HECD C[C@@H](N[C@@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)cc(F)c1O 756583660 PUQQQPWJKFECSK-UKRRQHHQSA-N 416.335 2.351 10 20 HECD CCOC(=O)N1CCC(NC(=O)CCCN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 756641454 HMZBYFSPADFTQQ-AWEZNQCLSA-N 422.482 2.468 10 20 HECD COc1cc(N2CCN(C(=O)c3ccccc3-n3ccnn3)CC2)cc(OC)c1OC 759222901 MJVVHJJZBVCWBA-UHFFFAOYSA-N 423.473 2.256 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(CO)CC3)cc2F)C[C@@H](C)O1 762626485 WUYLLTOONKCGPJ-IAGOWNOFSA-N 407.530 2.150 10 20 HECD O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1cccc(Br)c1O 765758456 XDUSEMXOQDLSPQ-UHFFFAOYSA-N 404.220 2.288 10 20 HECD C[C@@H](NC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 776107416 HDWLEXTXUACGFX-DYESRHJHSA-N 409.534 2.367 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc1 779475728 QJIVRLXUNIYMTN-UHFFFAOYSA-N 413.478 2.128 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CC3(O)CCOCC3)cc2F)C[C@H](C)O1 780311176 GIFQKRYXTYFUFO-HOTGVXAUSA-N 409.502 2.122 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCCO[C@@H](c2ccccc2)C1 788310069 HXQUUNZUXNIHHF-JOCHJYFZSA-N 423.513 2.130 10 20 HECD Cc1ccccc1C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789798985 KUTANJCKSBQWHY-QGZVFWFLSA-N 413.493 2.334 10 20 HECD CC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789823029 CFZPETDAWSBBQL-ZMPRRUGASA-N 421.513 2.083 10 20 HECD C[C@@H]1c2nncn2CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 791162658 XLUPELCMGSTHMQ-LLVKDONJSA-N 419.488 2.063 10 20 HECD CCO[C@H](CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803307648 JSTFJWCLSBCIMH-YLJYHZDGSA-N 405.539 2.268 10 20 HECD O=C(CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)c(F)c1 810092953 JPMJQYJBOKMSHB-RBBKRZOGSA-N 417.525 2.312 10 20 HECD COCCn1c(C2CCN(c3ncccn3)CC2)nnc1N(C)Cc1ccccc1O 812141718 SXXUWLBQZRSYIU-UHFFFAOYSA-N 423.521 2.441 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 915922645 XXRAHRYAQYIQTM-NRFANRHFSA-N 404.555 2.021 10 20 HECD O=C(NCCc1cn2c(n1)CCCC2)NCc1ccc(N2CCOCC2)c(F)c1 918209857 PUEBXFWJFVTYHZ-UHFFFAOYSA-N 401.486 2.237 10 20 HECD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc2c1OCCO2 919724738 BHCHSNZUNNOUCB-UHFFFAOYSA-N 418.471 2.235 10 20 HECD CN(CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Cl)cn1 919850429 QUYZRSQSEWHHNY-MRXNPFEDSA-N 415.925 2.189 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(=O)n(C)c2ccccc12 1115881733 FQZSQBPYAGOTSX-UHFFFAOYSA-N 407.470 2.420 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@@H](CNC(=O)C(F)(F)F)C3)cc2F)CC1 1261206173 DDQBJKRVYCEIKE-INIZCTEOSA-N 416.463 2.468 10 20 HECD CN1CCN(c2ccc(CN3CCN(c4ccc([N+](=O)[O-])nc4)CC3)cc2F)CC1 1320480815 VINBLFUMAKFLMK-UHFFFAOYSA-N 414.485 2.203 10 20 HECD C[C@H](NC(=O)NCCN1C(=O)COc2ccccc21)c1ccc(N2CCOCC2)cc1 1320543676 KODFSARTYXMDJZ-KRWDZBQOSA-N 424.501 2.309 10 20 HECD CC(C)(C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777847415 ACYXPGPRIMAEPC-QVKFZJNVSA-N 405.495 2.057 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)[nH]n1)c1cc(O)nc(O)c1 1817845782 WBICBXKLNCIRBQ-CMPLNLGQSA-N 407.377 2.177 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423644 BEFWOGMGOZGUBT-JNAXZKDPSA-N 419.522 2.133 10 20 HECD COc1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1 23403782 LPDYZTNHODUMEC-UHFFFAOYSA-N 421.475 2.261 10 20 HECD C[C@H](NC(=O)NCCCN1C[C@@H](C)O[C@H](C)C1)c1ccc(N2CCOCC2)cc1 140001692 OKVQZFMJQRWEHM-QRVBRYPASA-N 404.555 2.383 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(n4ccnc4)CC3)cc2)C1 728746367 CHXADPRRWOTLEA-SFHVURJKSA-N 410.522 2.132 10 20 HECD COCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC(F)F 728928901 LGLCZFROWWEVDC-GASCZTMLSA-N 417.472 2.269 10 20 HECD Cc1ncccc1/C=C1\SC(=S)N(Cc2ccc(S(N)(=O)=O)cc2)C1=O 728982496 CQKMCMJYRPPLBU-DHDCSXOGSA-N 405.526 2.439 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCc4cccc(C)c43)cc2F)CC1 730391951 ZNFVFOGVJKQIMK-UHFFFAOYSA-N 424.520 2.482 10 20 HECD Cc1cc(C(=O)CN(C)C[C@@H]2CCCOC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 730809041 WTTWQSMKTKTJIF-KRWDZBQOSA-N 419.547 2.283 10 20 HECD CCOC(=O)[C@H]1CCCN1S(=O)(=O)NCc1ccc(N2CCC(C)CC2)cc1 731039127 VGOBJHUAOSMFJW-LJQANCHMSA-N 409.552 2.285 10 20 HECD COc1ccc(O)c(CNC(=O)CCCC(=O)NCc2cc(OC)ccc2O)c1 734016898 MLUOGNJIRLOFQW-UHFFFAOYSA-N 402.447 2.218 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)NCc1cc(OC)ccc1O 734018438 RIQGWDLJENEFRB-UHFFFAOYSA-N 404.488 2.186 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H]3c3ccco3)cc2)C1 735188493 ZSOJKAHJFHPZIX-HKUYNNGSSA-N 412.490 2.264 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)c1O 737284433 MHZYOLNSALOWIG-UHFFFAOYSA-N 404.444 2.149 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCn4c(nnc4C(F)(F)F)C3)CC2)cc1 740480002 JNVJTGOKMDKEND-UHFFFAOYSA-N 424.427 2.500 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1ccccc1CN1CCOCC1 741097305 NWCHWESHHUAFOZ-UHFFFAOYSA-N 420.513 2.150 10 20 HECD COC[C@@H]1CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCO1 741795183 OQNQINNKHIWZSC-GJZGRUSLSA-N 408.454 2.136 10 20 HECD COCCNS(=O)(=O)c1cccc(C(=O)NCc2c(O)ccc3c2CCCC3)c1 743715723 DAJGPQVRPCSWSI-UHFFFAOYSA-N 418.515 2.126 10 20 HECD C[C@H](NC(=O)CCN1CCN(c2ccccn2)CC1)c1ccc(N2CCOCC2)cc1 746167161 AVULUXGGQJCBSY-FQEVSTJZSA-N 423.561 2.308 10 20 HECD O=C1NCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1ccccc1 749009349 LCXJKRMZHBTWGW-FQEVSTJZSA-N 412.465 2.045 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2O)cc1 751213205 SYDHYNQVWTUNLX-UHFFFAOYSA-N 414.461 2.043 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccnc(O[C@H]4CCOC4)c3)CC2)cc1F 754417880 VKWRVYBJALNFDM-KRWDZBQOSA-N 401.438 2.359 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OCO2 756654809 MYGLKZVRLXZOOV-UHFFFAOYSA-N 401.438 2.144 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)ccc1OCCCC(=O)O 757655892 LZTQGQAHUTZWJY-UHFFFAOYSA-N 409.416 2.443 10 20 HECD Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 764254337 QDJYPLJYRULCDX-UHFFFAOYSA-N 410.453 2.344 10 20 HECD O=C(CCN1CCN(c2ccccn2)CC1)NCc1cccc(Br)c1O 765737155 RABAIEAZWXKGER-UHFFFAOYSA-N 419.323 2.378 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC3CCCCCC3)cc2F)CC1 774650012 PKCZXYJKBQKWBR-UHFFFAOYSA-N 404.530 2.423 10 20 HECD C[C@@H]1C[C@H](C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCO1 776403419 GFOJWBMMMGZEQY-YFHUEUNASA-N 422.497 2.414 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cnc(C(F)(F)F)nc3)CC2)cc1 777786005 ZMGWALHVMHQIEC-UHFFFAOYSA-N 409.412 2.056 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@H](C)CCSC)CC2)cc1 778286290 WPZBKATXXQGQBE-DOOKAGJSSA-N 405.564 2.500 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H](CO)C1CCOCC1 782731936 FUCXSXGVGMYTQD-QAPCUYQASA-N 413.465 2.344 10 20 HECD C[C@H]1CN(C)C(=O)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 782881346 RZKMZXJMRXEOFL-IGVUGNCQSA-N 423.585 2.419 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1C 784026805 JJOIBKDICNIAKL-UHFFFAOYSA-N 404.488 2.481 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCN3C3CCCC3)nc12 786880354 INNTZBIGGXYTNS-INIZCTEOSA-N 402.451 2.062 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)NC1CCC2(CC1)CC2 789835055 NUMRCODQSOZSJF-UHFFFAOYSA-N 403.498 2.242 10 20 HECD Cc1cnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 789840609 KLACGQGLKDPECR-ZDUSSCGKSA-N 420.510 2.045 10 20 HECD COc1ccc(CNC(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)c(O)c1 797648688 CCXLOWBWZWMYTA-UHFFFAOYSA-N 412.490 2.387 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc(N(C)C)cc1 804574533 NJEYRHZKRFYSBI-HUUCEWRRSA-N 408.502 2.326 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C 806334877 JCLAJIFNWNBDEW-SFHVURJKSA-N 420.554 2.343 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)sn1 806956482 IAODVDGUHVYFLQ-UHFFFAOYSA-N 413.547 2.238 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCC2=O)c1 807387103 ZLDNKOXZSICRPR-UHFFFAOYSA-N 418.247 2.146 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 807768133 CWDKKRFDZUSUEM-LSDHHAIUSA-N 411.449 2.010 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1=O 808549088 WIHFCSRLDVKSMC-FQEVSTJZSA-N 423.513 2.357 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3ccc4c(c3)C(=O)OC4)CC2)cc1 808877014 WWSHJGKDCHLNPS-UHFFFAOYSA-N 410.474 2.309 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccn2c(O)nnc12 819518828 HASGIULYSAGBQM-UHFFFAOYSA-N 411.462 2.437 10 20 HECD CN(C)c1ccc(CN(C(=O)NCc2ccc(S(N)(=O)=O)s2)C2CC2)cc1 918060123 DRWWENONDGGBLG-UHFFFAOYSA-N 408.549 2.336 10 20 HECD COC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824604358 QHYJXQNGYISJOM-RHSMWYFYSA-N 405.495 2.009 10 20 HECD CC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826386631 SXNPQJWMCBJFBF-QGZVFWFLSA-N 403.479 2.095 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 1847454091 OINKVANDIZEEGS-OWSLCNJRSA-N 411.433 2.251 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)CC2)cc1 117792897 XNJNOKDMYJIIDX-LJQANCHMSA-N 411.502 2.142 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@@H](C(C)C)N3CCOCC3)CC2)cc1 726612670 DDFLVCTUOPNIRM-NRFANRHFSA-N 404.555 2.320 10 20 HECD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 728302599 UWSDCWSYPPSNPH-QGZVFWFLSA-N 421.497 2.475 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 734704243 YMSHAPWWUBLTQR-UHFFFAOYSA-N 422.485 2.359 10 20 HECD CCOC(=O)c1ccsc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 743896738 JFPMXDUFRCZAKG-UHFFFAOYSA-N 417.487 2.016 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]([C@@H](C)O)C3)CC2)cc1 747393276 AYKYLMUCXZDSJB-MOPGFXCFSA-N 404.555 2.010 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)C2CC2)cc1 749632136 GPXKKRUAXNXNEH-UHFFFAOYSA-N 424.501 2.137 10 20 HECD COc1ccc(N2CCN(Cn3nnn(C4CCOCC4)c3=S)CC2)cc1F 754013076 LJKMUZRNBQLNRS-UHFFFAOYSA-N 408.503 2.088 10 20 HECD C[C@H](NC(=O)NCc1ccc2c(c1)C(=O)NCC2)c1ccc(N2CCOCC2)cc1 754162619 GIXZAYQKAHODAM-INIZCTEOSA-N 408.502 2.370 10 20 HECD Cc1ncc([N+](=O)[O-])n1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 755230536 MINFIIRFXGZNGP-UHFFFAOYSA-N 417.447 2.038 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCOCC3CC3)cc2F)C[C@@H](C)O1 756047483 IDTRFNJFHATZFF-IAGOWNOFSA-N 407.530 2.414 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2F)CC1 760560026 IWNWOSJMHFJRKT-UHFFFAOYSA-N 422.482 2.354 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCN(C[C@H]2CCOC2)CC1 761357900 RNCKEUYWOBCABQ-CQSZACIVSA-N 407.898 2.311 10 20 HECD CS(=O)(=O)C1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCCC1 761983004 PFDDFDJVTNKDRB-MRXNPFEDSA-N 414.955 2.484 10 20 HECD CCN1CCC[C@@H]1CN1C[C@H](C(=O)NCc2cccc(Br)c2O)CC1=O 765728337 HVLUZRNOXZNUBH-HUUCEWRRSA-N 424.339 2.104 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)/C=C/c1ccccc1 773750854 XIWNEMXUUYBNAU-PABFRNLHSA-N 404.488 2.125 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)NC(=O)CC(C)(C)C)CC2)cc1 778320822 RTZQWPJTQSNSFU-GOSISDBHSA-N 418.582 2.264 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(C)=O 779459531 SFKJLGZOEXZTJO-LLVKDONJSA-N 404.444 2.277 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1 792702681 DAWMQKQTYWZINT-UHFFFAOYSA-N 414.530 2.455 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1 797648784 HQNGMBSOFKGUIS-ZDUSSCGKSA-N 417.437 2.462 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3cnc(C(C)C)nc3)CC2)cc1 799334518 PCHWJXVBPANALA-OAQYLSRUSA-N 413.566 2.224 10 20 HECD CN1CCN(C(=O)c2ccc(NCc3ccc(N4CCN(C)CC4)cc3)cc2)CC1 802760980 HRBGPGIHHPPBCK-UHFFFAOYSA-N 407.562 2.438 10 20 HECD C[C@H](NC(=O)C(=O)NCCN1[C@@H](C)CCC[C@H]1C)c1ccc(N2CCOCC2)cc1 803297603 BFDZISBSYSGXPS-OTWHNJEPSA-N 416.566 2.080 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3c3cc(C)no3)CC2)cc1 804318864 UUORFZYYZMUOTD-IBGZPJMESA-N 412.490 2.440 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 804845063 ZVHASXDXDSDTNR-QGZVFWFLSA-N 416.472 2.351 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCCN(C(C)C)C(C)C)CC2)cc1 807664036 XYIHHKOGRDXSDS-UHFFFAOYSA-N 418.582 2.359 10 20 HECD CN(C)CC1(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCCC1 807853565 MBHFCMODWUPPPE-UHFFFAOYSA-N 400.567 2.482 10 20 HECD O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1c(O)ccc2c1CCCC2 810447597 QONVFHDUWNZDBA-UHFFFAOYSA-N 410.442 2.144 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc4c3CCCC4)cc2F)C[C@@H](C)O1 816890957 DBJXSYSKXIVJBY-GASCZTMLSA-N 401.486 2.226 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccccn3)c2C)s1 917434397 OCUHTKLARCJFBF-UHFFFAOYSA-N 419.484 2.456 10 20 HECD CC(C)COC[C@H](O)CNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918209345 VTRXQAXIBCLQKW-JFIYKMOQSA-N 411.518 2.272 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918463612 LNEBTHRZAOHQIK-QGZVFWFLSA-N 424.501 2.042 10 20 HECD COc1ccc(N2CCCN([C@@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)CC2)cc1 918995295 YXCXVRXOPHNOJT-HXUWFJFHSA-N 424.457 2.448 10 20 HECD O=C(CS[C@@H]1CCCCO1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600721 GBTRXUOTZQSBMI-NXEZDXNNSA-N 421.519 2.004 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817842521 DLJHYSPWJDBTIL-CQSZACIVSA-N 415.450 2.137 10 20 HECD CC(C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496654 NYMIWZRNVFEWNK-CYBMUJFWSA-N 423.564 2.308 10 20 HECD CCc1cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)n[nH]1 1843146629 RXJZDIAYWIBQEE-UHFFFAOYSA-N 404.854 2.168 10 20 HECD O=C(CCc1ccccn1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033871 MLRFWJXNZWRADB-RMKNXTFCSA-N 423.469 2.048 10 20 HECD Cc1cnc(F)c(C(=O)NC[C@@H]2CC3(CCC3)CN2C(=O)c2cc(O)nc(O)c2)c1 2088596048 ZMQYXDBRCMCBLE-AWEZNQCLSA-N 414.437 2.150 10 20 HECD CCCCNC(=O)NC(=O)COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 15692243 NATZKYUKKPZJGJ-UHFFFAOYSA-N 408.410 2.245 10 20 HECD CNS(=O)(=O)c1ccc(N2CCCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 108094740 ONFAEMKPFYAMSR-UHFFFAOYSA-N 420.491 2.228 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@@H](C)Cn3cccn3)cc2F)CC1 303291164 KZIONFNMIFHBDL-QGZVFWFLSA-N 402.518 2.300 10 20 HECD COCC(=O)NC1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731050953 RLUFJBXAIGWITD-UHFFFAOYSA-N 402.539 2.360 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OC)c(Br)c2)c1 734072992 YRRQIEGZFJZHNI-UHFFFAOYSA-N 409.236 2.427 10 20 HECD Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2=O 736195450 LTMZPPAGSBPEMJ-UHFFFAOYSA-N 421.497 2.116 10 20 HECD CN1CC[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 737727346 DIWSAHKRYCWAMX-CVCOIXHCSA-N 409.558 2.076 10 20 HECD COCCc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 740609121 DMJMKGIMAFEHHP-UHFFFAOYSA-N 417.531 2.378 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCn2ccnn2)NC(=O)OC(C)(C)C)cc1 742754262 OFZFYLNIPFLMOV-KRWDZBQOSA-N 402.499 2.116 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800645 KLNPKEGWJALVDC-ZDUSSCGKSA-N 409.393 2.486 10 20 HECD CC1CCN(c2ccc(CNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)cc2)CC1 743208772 RSNUEQTUVMPSNA-UHFFFAOYSA-N 419.551 2.486 10 20 HECD CCN(CC)[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 743867062 JYUSNQNKDRZKGX-QWFCFKBJSA-N 420.573 2.472 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cn(Cc2cccs2)nn1 745561871 WMKBZGSSNLXJDH-UHFFFAOYSA-N 413.503 2.269 10 20 HECD Cn1cc(C[C@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)cn1 746759813 VPYODEFDVWPPEM-QGZVFWFLSA-N 415.513 2.295 10 20 HECD CN(Cc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1)C(=O)C(F)(F)F 748481114 GQDHEANXHBWTQI-UHFFFAOYSA-N 409.364 2.168 10 20 HECD COc1cc(CN2CC[C@@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc(OC)c1 756029188 BARSQEGLRWUUTN-QGZVFWFLSA-N 415.490 2.492 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3nc(-c4ccccc4)ccc3=O)CC2)cc1 758201892 FTCYVVRTXASVDI-OAQYLSRUSA-N 420.513 2.102 10 20 HECD COCCS(=O)(=O)c1ccc(CNCc2ccc(N3CCOCC3)c(F)c2)cc1 758504925 INFMWSQQABTUKB-UHFFFAOYSA-N 422.522 2.372 10 20 HECD CC1(Cn2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn2)COC1 759113033 BNYACLVUHUVFHI-AWEZNQCLSA-N 421.448 2.315 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCN4CCCC[C@H]34)CC2)cc(OC)c1OC 759254500 PUSQKCKZKLYVFF-QZTJIDSGSA-N 418.538 2.171 10 20 HECD COc1ccc(CCNC(=O)[C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)cc1OC 759580339 QTGYTEZTWBQFIU-MRZGDXHCSA-N 415.442 2.419 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cn1C 760572323 QAPRLLYZSLERDO-MRXNPFEDSA-N 422.503 2.277 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761401221 PRTCNPJPWBMOCT-ZIAGYGMSSA-N 400.884 2.166 10 20 HECD COC(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 761536485 WJGHKPGEFKUOOQ-RYUDHWBXSA-N 424.409 2.077 10 20 HECD CCCNC(=O)CN1CCC(N[C@H](C)c2ccc(N3CCOCC3)c(F)c2)CC1 764897737 JKFSHJISSRLEFY-QGZVFWFLSA-N 406.546 2.304 10 20 HECD CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 767477409 AMZQBSGVIDWCPE-LJQANCHMSA-N 421.538 2.411 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1ccc2c(c1)COC2 768938495 LNFRDEPFWKHKNK-UHFFFAOYSA-N 413.449 2.072 10 20 HECD C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CN(C)CCO1 770124733 ROQSDQBGQUZCEB-HDMKZQKVSA-N 412.481 2.275 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](C[C@H]4CCOC4)C3)CC2)cc1 773704186 XMRNIQXTCYEXEN-VQTJNVASSA-N 401.551 2.482 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1cccs1 774785700 FMMNMHQYWNEKSS-UHFFFAOYSA-N 412.559 2.213 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cnn(-c2ccccc2OC)c1 775286965 SFQZSXXAIFOJBB-UHFFFAOYSA-N 403.416 2.174 10 20 HECD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)O1 775453306 BDYJIZAVVZJTNB-APWZRJJASA-N 401.463 2.333 10 20 HECD COC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)cc1[N+](=O)[O-] 777648628 BGSOPTIIHSSSFS-UHFFFAOYSA-N 409.376 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(Cc3cccnc3)C3CC3)CC2)cc1 778224707 CZACCWAFVOZHDP-ZHACJKMWSA-N 420.513 2.486 10 20 HECD CCCC[C@@H](COC)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778285015 DBHALFILOLXALI-DXRVJIQQSA-N 403.523 2.221 10 20 HECD COCC1(C)CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778420254 UBLZWTZSXXFODL-HJWRWDBZSA-N 415.534 2.175 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 785296657 OMZKSRVJWWSNPS-KBXCAEBGSA-N 414.458 2.342 10 20 HECD CO[C@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 786659167 XSUGOBDFQCELRU-PZJWPPBQSA-N 412.486 2.404 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(OCCN(C)C)cc1)c1ccc(N(C)C)cc1 787175099 NBTOKBDKFZYBRB-QGZVFWFLSA-N 412.534 2.187 10 20 HECD C[C@H](NC(=O)C(=O)NCCCN1CCc2ccccc2C1)c1ccc(N(C)C)cc1 787707868 GMSGVILRERQZTA-SFHVURJKSA-N 408.546 2.494 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccncc1 789840113 DFKTZHFSPGLUEX-IBGZPJMESA-N 414.481 2.066 10 20 HECD Cc1cnc(CCN(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789856139 OVVWGCVOMYUKGU-UHFFFAOYSA-N 418.588 2.322 10 20 HECD C[C@H]1CCC[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793727033 VHSLHNJMUQJDBF-ZIFCJYIRSA-N 414.550 2.042 10 20 HECD CC[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)S1(=O)=O 804990564 XXLXFCVLOMSGTC-JTDSTZFVSA-N 409.552 2.191 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 807099737 DVEWGBXOYXTRAT-SZPZYZBQSA-N 420.557 2.268 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C(C)(C)[C@@H]3c3cnn(C)c3)CC2)cc1F 808168628 PXUTZDRXXOGLOZ-IBGZPJMESA-N 401.486 2.257 10 20 HECD COCCOCCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 808792201 UFWLWSLUWBAADP-HNNXBMFYSA-N 410.470 2.384 10 20 HECD COc1cc(O)c(CNc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1OC 809679710 JTIKTJWDNUTYLQ-UHFFFAOYSA-N 405.476 2.492 10 20 HECD CCNC(=O)CN(CC)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 835560153 SBUDAXMQKRKPNK-UHFFFAOYSA-N 405.205 2.237 10 20 HECD CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918439518 MKISFFDMTGSZIT-UHFFFAOYSA-N 413.449 2.244 10 20 HECD C[C@H](NC(=O)NCc1ccc(-n2cncn2)nc1)c1ccc(N2CCOCC2)cc1 920872256 QVVIZRSQUVPRRP-INIZCTEOSA-N 407.478 2.059 10 20 HECD CN1CCN(c2ccc(CN3CCN(C(=O)c4cccc(O)c4)CC3)cc2F)CC1 1116443554 ZPLWQVRHPLTXGH-UHFFFAOYSA-N 412.509 2.241 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1noc2ccccc12)c1cc(O)nc(O)c1 1796213679 AYSZHHFWWUREJS-QDMKHBRRSA-N 422.441 2.129 10 20 HECD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c1 1799652306 VSCLVGHHNZBIGZ-MUJYYYPQSA-N 417.556 2.107 10 20 HECD Cc1ccoc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843466864 VQNDHKGWJXUSKW-UHFFFAOYSA-N 406.442 2.198 10 20 HECD CC(=O)NCC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 1845399327 PTPLMDAZTOLSFS-UHFFFAOYSA-N 408.502 2.047 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(Cl)cc4)n3)CC2)cc1 23485925 PPKNTTGOWZNRAR-UHFFFAOYSA-N 412.881 2.351 10 20 HECD CNC(=O)c1cccc(CCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 303780099 CTZQZSAVSSORKP-UHFFFAOYSA-N 410.518 2.267 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCN3CCOC(C)(C)C3)cc2F)C[C@H](C)O1 726102810 YNHHBXGWPGNXHS-IRXDYDNUSA-N 422.545 2.349 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(CN(C)C)c3)CC2)cc1 726725804 IXQURIBVOPHNMT-UHFFFAOYSA-N 410.518 2.481 10 20 HECD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(OC)c1OC 727947228 VLYNMESMXIWUJV-UHFFFAOYSA-N 401.463 2.376 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CNC(=O)CC3CCCC3)cc2F)CC1 730235653 KNDPJEZHPWCQGV-UHFFFAOYSA-N 404.530 2.280 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(F)c3)cc2F)CC1 730391706 SNKHCFUVDQOIDY-UHFFFAOYSA-N 402.445 2.362 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCS(=O)CC1 731007412 NXPQAKOJGCUTMI-ACCUITESSA-N 414.599 2.320 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(=O)OC(C)(C)C)C[C@H]3C)nc12 731669376 IALMRHDKAQPMIU-CYBMUJFWSA-N 419.482 2.053 10 20 HECD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 731911047 YZJSUPCIWNVTOT-SSDOTTSWSA-N 402.350 2.171 10 20 HECD COC(=O)c1cc(NC(=O)[C@@H](C)N(C)Cc2ccccc2O)cc(C(=O)OC)c1 732203406 SPIQRVBMIKVTBP-CYBMUJFWSA-N 400.431 2.424 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C/c3cnc(C)s3)CC2)cc1 732869871 WGRUOUVZMQABGP-BQYQJAHWSA-N 401.488 2.365 10 20 HECD Cc1cc(O)c(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1C 742367245 MMRMRDNBVCITHY-UHFFFAOYSA-N 404.532 2.461 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@H]4CCCO[C@H]4C3(C)C)CC2)cc1 743566885 KSOGCZUJHNFOCL-NJDAHSKKSA-N 416.566 2.320 10 20 HECD C[C@@H]1CN(CCNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 745790575 BALZOEYHAZFPKQ-HZPDHXFCSA-N 412.481 2.277 10 20 HECD COC(=O)C1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 748012587 LBZRWNVMCRUMAD-UHFFFAOYSA-N 424.500 2.280 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCn3cccc3)cc2F)C[C@@H](C)O1 750943417 NDUSATNVIDCDCQ-CALCHBBNSA-N 417.481 2.491 10 20 HECD O=C(NC[C@H](O)c1ccco1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751064292 IAQAICCCJHUCAH-AWEZNQCLSA-N 408.457 2.311 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1 755718600 ISNNKZATUBKSCU-UHFFFAOYSA-N 410.584 2.453 10 20 HECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NCc1ccc(N(C)C)c(F)c1)C2=O 756957046 JZGMXQANIGCZJI-ZIAGYGMSSA-N 404.486 2.255 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCc3nc(COC)nn3C2)cc1F 757688629 NATOUAYSMNCFQJ-HNNXBMFYSA-N 404.490 2.224 10 20 HECD O=C(NCCCSc1nccs1)NCCS(=O)(=O)NCc1ccccc1 759561775 JBTFZRSTIIFQCA-UHFFFAOYSA-N 414.578 2.044 10 20 HECD O=C(COC(=O)C1Cc2ccccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 763379513 IZANNGLGEOYTQC-UHFFFAOYSA-N 412.461 2.237 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(O)(c4ccccc4)CC3)CC2)cc1 767854961 LIJJKNMTXKDCLG-UHFFFAOYSA-N 409.530 2.327 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC[C@]2(C)NC(=O)NC2=O)cc1 771832262 KHZXHCITVPQBLU-AVRDEDQJSA-N 416.522 2.029 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 773750765 WOJXAFMZHPVMGL-SNVBAGLBSA-N 407.352 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCSC(C)(C)C3)CC2)cc1 778314992 XREZMMFIDBZFOW-HJWRWDBZSA-N 403.548 2.254 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)CCOc3ccccc3C)CC2)cc1 779213521 BPPPTFMOWZAKMH-JOCHJYFZSA-N 413.562 2.497 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCCC[C@H]3O)CC2)cc1 779330130 IWRGQRGNZJVVLY-DENIHFKCSA-N 418.582 2.400 10 20 HECD CCC[C@@H]1C[C@H](C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 780157006 AVEBAIZTOOGYET-YLJYHZDGSA-N 404.507 2.482 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(C[S@](C)=O)c3)cc2)CC1 786263009 RRYHHAKAUQIGBW-LJAQVGFWSA-N 413.543 2.164 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1)c1ccc(N(C)C)cc1 787979732 PMRYUTPUMTWDKA-AVRDEDQJSA-N 424.545 2.120 10 20 HECD CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788321319 UVNWJBDECDOHNP-AHRSYUTCSA-N 417.550 2.095 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSCC[C@@H]3C)cc2F)C[C@@H](C)O1 789822413 WNRZXEYOZUDHRJ-HRCADAONSA-N 423.554 2.410 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCCS3)cc2F)C[C@@H](C)O1 789833669 IFPADPZGHZHGLO-IIAWOOMASA-N 409.527 2.067 10 20 HECD COc1cc(C)cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 789860939 OJFNPFBKSVKHPJ-UHFFFAOYSA-N 413.543 2.489 10 20 HECD CCCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950083 MMFBQGIJOYZCLD-UHFFFAOYSA-N 401.429 2.417 10 20 HECD CO[C@@]1(C)CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 792893349 RSVFGULNDNAWJB-GCJKJVERSA-N 402.539 2.489 10 20 HECD COc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c(O)c1 795358339 YMAWZELIKPYRER-UHFFFAOYSA-N 411.392 2.313 10 20 HECD CCOc1ccc(CNc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c(O)c1 796431212 MGGFIMQCEXHNMX-UHFFFAOYSA-N 405.520 2.339 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3c3nc(C)no3)CC2)cc1 796668893 LYSDAGRZRBKJGU-TZIWHRDSSA-N 415.538 2.097 10 20 HECD Cc1nnnn1-c1cccc(NC(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)c1 797740552 ZYXFGNHAKLNUJW-UHFFFAOYSA-N 416.825 2.448 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CCCc4nn(C)cc43)CC2)cc1 798362620 ZOMNLCSUNVGBFW-HXUWFJFHSA-N 411.550 2.177 10 20 HECD O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1ccc(N2CCCCC2)cc1 810246060 LYGHPKJNBUZNTG-UHFFFAOYSA-N 405.495 2.411 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCSCC2)cc1)N1CCN(C)CC1 916258479 XSFSQNIKUKTDTD-OAQYLSRUSA-N 419.639 2.311 10 20 HECD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 918670371 GWSLRUUXWUBJPD-UHFFFAOYSA-N 407.467 2.165 10 20 HECD O=C1CSc2ccc(C(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc2N1 919840940 UYJYEVXOYDVNDU-UHFFFAOYSA-N 417.512 2.218 10 20 HECD O=C(O)[C@H](Cn1ccc(C(F)(F)F)n1)NCc1ccc(N2CCOCC2)c(F)c1 1321925549 RYSNGMFIPCOFEI-AWEZNQCLSA-N 416.375 2.121 10 20 HECD COCCOCCS(=O)(=O)NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1340598260 BCRBXQOVGORGQN-UHFFFAOYSA-N 414.911 2.470 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CC3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242050 JBQIZYQPKDEDFW-JDFRZJQESA-N 408.882 2.145 10 20 HECD Cc1cc[nH]c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720890 CECZSZZDEJKVBQ-LLVKDONJSA-N 413.459 2.125 10 20 HECD COc1cc(C)c(C)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845539114 FCKYWNLEJHRNTJ-UHFFFAOYSA-N 411.458 2.249 10 20 HECD O=C(C[C@H]1OCCc2ccccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847759538 AMJDLTAGJRNESG-GBESFXJTSA-N 423.469 2.012 10 20 HECD COc1cc(Br)c(/C=C2\SC(=S)N(CC(N)=O)C2=O)cc1OC 727177377 ZUFGEEMEYALVDR-WCIBSUBMSA-N 417.306 2.153 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C 734471576 OFXNWMLAIIAZTB-UHFFFAOYSA-N 407.474 2.216 10 20 HECD Nc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Cl 738861922 ISRAVIUNVWNMGE-UHFFFAOYSA-N 421.856 2.371 10 20 HECD C[C@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)Cc1ccccc1 746694179 PYGUVAABLYBFSM-OAHLLOKOSA-N 405.520 2.404 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1C 748775910 JBQLRXIUIDIKPJ-CYBMUJFWSA-N 407.421 2.054 10 20 HECD CCc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 751243443 QSDUMUDYMPQTOF-GOSISDBHSA-N 401.532 2.429 10 20 HECD Cc1cc(O)cc(=O)n1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 759800712 AKPXZEXEMBWLIX-AWEZNQCLSA-N 407.417 2.249 10 20 HECD CCCn1nc(C)c(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 760009700 FAOZOCYVZSFEJA-UHFFFAOYSA-N 414.506 2.424 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@@H]3CO)cc2)C1 762274278 YQYMSWRWUWHCEV-KNQAVFIVSA-N 422.529 2.190 10 20 HECD CCOC1CC(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)(N2CCOCC2)C1 767887495 IWEGDRPEKDHUJJ-UHFFFAOYSA-N 404.555 2.164 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1 768197487 QYZUWOLPJCZODH-LLVKDONJSA-N 413.386 2.020 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CCO)c3ccco3)cc2F)C[C@@H](C)O1 769220304 JKVIGRMMIWUAQB-FCEWJHQRSA-N 419.497 2.362 10 20 HECD CCOc1cccc(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c1O 770395831 VSCCKHNZLFDPRI-UHFFFAOYSA-N 405.520 2.485 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 772115660 WZWHDORAGGEYIW-GGPKGHCWSA-N 402.539 2.391 10 20 HECD CCn1nc(C)c(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 772500479 NGAWPRCRWMPJPU-UHFFFAOYSA-N 405.524 2.076 10 20 HECD COC(=O)c1cn([C@H]2CCCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)nn1 773621373 XWUBLZSVQLIXRG-YOEHRIQHSA-N 400.483 2.238 10 20 HECD O=S(=O)([C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2O)C1)N1CCOCC1 779607398 MEYXUKSXEUREMP-CQSZACIVSA-N 409.335 2.325 10 20 HECD Cc1ccc(C(=O)N2CCN([C@@H]3CCCN(Cc4ccccc4)C3=O)CC2)c(O)c1O 781019360 HNFVBYDZGIJJEP-HXUWFJFHSA-N 423.513 2.355 10 20 HECD COc1ccc(N2CCCN(C(=O)Cc3ccccc3S(C)(=O)=O)CC2)cc1 785915323 BNVDKGULRBSNBW-UHFFFAOYSA-N 402.516 2.380 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN1CCc2ccccc2C1 787620558 AQMOCTXYARMRGS-UHFFFAOYSA-N 408.546 2.276 10 20 HECD O=C(NCCCCN1CCOCC1)C(=O)N(Cc1ccccc1O)C1CCCCC1 787902181 GNVJIQSYISPURZ-UHFFFAOYSA-N 417.550 2.282 10 20 HECD CCC(CC)c1cc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)on1 788313037 OJGSBYKIJLWJPS-UHFFFAOYSA-N 414.506 2.347 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnnn1-c1cccc(F)c1 789966921 LNQKMCCTQIMGMP-UHFFFAOYSA-N 413.428 2.437 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(OCC3CC3)cc2)SC1=S 790109071 YRQOQBYSLLYALS-GDNBJRDFSA-N 412.558 2.226 10 20 HECD Cc1nn(C)c(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1Br 790467530 GTABMNCYHVXKPC-OAHLLOKOSA-N 420.355 2.483 10 20 HECD COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1C 793867246 JDTXVUWLXUACEK-QGZVFWFLSA-N 411.502 2.334 10 20 HECD C[C@H](NC(=O)C(=O)N1CCO[C@H](c2ccccc2)C1)c1ccc(N2CCOCC2)cc1 803296366 BNVMIZBIIOYBOV-AVRDEDQJSA-N 423.513 2.301 10 20 HECD CC(C)COC1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 803297491 XTJRAEYYMLFGHG-GOSISDBHSA-N 417.550 2.364 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803298458 UHVMFUDGVHVCMS-AZUAARDMSA-N 416.566 2.081 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803689786 ZVKGMQHFOUYMMJ-LJQANCHMSA-N 422.529 2.089 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](c3n[nH]c(C)n3)C2)cc1F 804851788 OYEWTDAIOWCQDQ-INIZCTEOSA-N 416.501 2.121 10 20 HECD Cc1nc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c(Br)n1C 804975894 UTWDOADCUMAKBS-UHFFFAOYSA-N 413.341 2.352 10 20 HECD CN(C)Cc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387235 FEADIOMXSMTVJS-UHFFFAOYSA-N 406.280 2.471 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCn3ccnc3C2)cc1 809457805 MWOLOOZUANXZQD-SFHVURJKSA-N 421.501 2.202 10 20 HECD CCCCN(CC(N)=O)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 811823284 ODYGGDXNAWXFJW-UHFFFAOYSA-N 405.205 2.366 10 20 HECD CC(=O)N1CCc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 917832957 JZXOBKNVKICCIY-HXUWFJFHSA-N 420.513 2.227 10 20 HECD CCN1C(=O)C(=CNC[C@@H](c2ccccc2)N2CCCC2)C(=O)N(CC)C1=S 920980708 XGQIEAQJRMJMET-SFHVURJKSA-N 400.548 2.293 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790246065 IPZMIYJPXKSKMS-OMJYXIODSA-N 420.893 2.477 10 20 HECD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)no1 1827426755 FMDZECRAIJYWJV-KRWDZBQOSA-N 414.462 2.336 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)cc(OC)c3O)CC2)cc1 730358675 YVJGZXWCCPJQFK-UHFFFAOYSA-N 414.458 2.223 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1F 731408858 YGPDVBNTVFHWAO-UHFFFAOYSA-N 404.417 2.165 10 20 HECD CC(C)[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 734269230 JMZCNFWELJUCJD-SPYBWZPUSA-N 406.502 2.105 10 20 HECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1 734504062 XDHKXSSNKHIBTQ-UHFFFAOYSA-N 423.560 2.079 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1 734667065 SRIDQPDOFZZRRQ-QFIPXVFZSA-N 409.490 2.115 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCOC3CCCCC3)CC2)cc1 742928663 ZGQUTCBFSFKJLB-UHFFFAOYSA-N 404.555 2.466 10 20 HECD C[C@@H](OC(=O)c1ccnn1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 743223796 BOVFBCMQMURCCH-GFCCVEGCSA-N 403.394 2.380 10 20 HECD COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCOCC4)cc3)n2)cc1 748035283 LAHONVYNCVDKEG-UHFFFAOYSA-N 408.458 2.353 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)cc2F)CC1 757681353 CEKUPPVDZUPBRM-OXJNMPFZSA-N 403.546 2.250 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 758222034 DALBQBCMAKVQCU-GOSISDBHSA-N 401.463 2.474 10 20 HECD COCC1(O)CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 759495406 CJGYDZAHBDJGOK-HNNXBMFYSA-N 413.465 2.440 10 20 HECD C[C@H](OC(=O)c1cncnc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 760799244 MJBVAIHQIWSUHS-LBPRGKRZSA-N 401.378 2.436 10 20 HECD Cc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1N1CCCS1(=O)=O 761645538 GRXNBQYDZMSQRM-UHFFFAOYSA-N 405.476 2.310 10 20 HECD O=C(NCc1cccc(Br)c1O)N[C@H]1CCN(CC(F)(F)F)C1=O 764783278 JRFPSYOKUQRYBW-JTQLQIEISA-N 410.190 2.117 10 20 HECD CC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1F 764798803 VNELQSLHQOPZDJ-QGZVFWFLSA-N 412.465 2.416 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(C2CCCCC2)C1=O 765689771 LDGNQVXUIZNNPA-HXUWFJFHSA-N 400.523 2.256 10 20 HECD COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2cc(OC)ccc2O)cc1OC 769539238 GPBGTEIKKOYWPP-UHFFFAOYSA-N 406.391 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@H]4CCO[C@H](C)C4)n3)CC2)cc1 771069516 WLNYTGZNHHISKO-CVEARBPZSA-N 400.479 2.252 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccco2)N(C)C)cc1F 774829456 XXCWPLTYSUKOAD-GOSISDBHSA-N 404.486 2.300 10 20 HECD CCOC(=O)N1CCC[C@H](C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)C1 777828217 JWIIZGTZNGCCOK-ZDUSSCGKSA-N 412.870 2.416 10 20 HECD COC[C@@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785400119 STHOCBVDMZJPFR-LLVKDONJSA-N 410.404 2.293 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccc(-n2cncn2)cc1 785401218 WYOOXWHDDLNXPF-CVEARBPZSA-N 406.490 2.388 10 20 HECD C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785445355 WXZZVAKPABZENU-CRAIPNDOSA-N 418.538 2.131 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 785868450 DHZMNFDIHLODIJ-IAGOWNOFSA-N 405.539 2.135 10 20 HECD Cc1cccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789827402 SHFUOLFCEBYWMO-IYBDPMFKSA-N 414.481 2.075 10 20 HECD CC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789840167 GCDNWHOMQXMMLB-MRXNPFEDSA-N 405.514 2.442 10 20 HECD CN(CCC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789864586 QKWVQZIOIRTJMP-UHFFFAOYSA-N 421.563 2.046 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3csc(C)n3)CC2)cc1 790335866 LDBFLUFGEZTLDG-UHFFFAOYSA-N 424.592 2.092 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](CCc3ccccc3)C2)cc1F 803665033 RZYASRFAGAQXNM-LJQANCHMSA-N 413.493 2.368 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COc4ccccc43)cc2)C1 808368324 ZNGLPFYKFLOHEE-ROUUACIJSA-N 408.502 2.364 10 20 HECD Cc1cc(Br)cc(CN2CCC(C(=O)N3CCN(C)CC3)CC2)c1O 809732996 NULOVSNSHNYCTI-UHFFFAOYSA-N 410.356 2.449 10 20 HECD NC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 919969447 YMRWUJTZWYDKFM-OAQYLSRUSA-N 410.518 2.311 10 20 HECD Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 920637524 IAEDOJGMTUINPZ-KBPBESRZSA-N 420.487 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4sc5c(c4c3=O)CCC5)CC2)cc1 921163070 XFLVIZRSWVUZCE-UHFFFAOYSA-N 424.526 2.304 10 20 HECD CCOc1ccc(N2CCN(C(=O)Cn3c(S)nc4ccccc4c3=O)CC2)cc1 1322615347 TXOBFTUORZQUAV-UHFFFAOYSA-N 424.526 2.433 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3F)cc2)CCC1 1786588386 QHVMXMNDHTZQDB-KGLIPLIRSA-N 421.519 2.339 10 20 HECD Cc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1796998754 NQGCCQLHKCTMGZ-ZURAMSNBSA-N 423.469 2.472 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)C2CCC2)CC1 1826249518 LOVSGLPKYHSEEJ-INIZCTEOSA-N 423.604 2.267 10 20 HECD O=C(C1=COCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428758 HVGUUOMQCRQSBU-SFHVURJKSA-N 415.490 2.420 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC(OC[C@H]3CCOC3)CC2)n(C)c2ccccc12 583163872 NQRQVBDNGPTHGS-KRWDZBQOSA-N 413.518 2.147 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)CC2)cc1 731901935 HPDDLYMWPHMMSB-UHFFFAOYSA-N 419.485 2.379 10 20 HECD CCOC(=O)CCCS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 734841999 DAIRRARLTDCBTO-GJZGRUSLSA-N 416.515 2.202 10 20 HECD COC(=O)CN(CCn1cnc2ccccc2c1=O)Cc1cc(Cl)ccc1O 735309602 PUMNWEVUHOSPQY-UHFFFAOYSA-N 401.850 2.431 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 735753510 MTLBVVAMXYYOCE-UHFFFAOYSA-N 418.519 2.395 10 20 HECD O=C(CCC(=O)N1CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800903 MNOMPQLNJSBCMD-OAHLLOKOSA-N 411.449 2.012 10 20 HECD CCN(C)C[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 744424078 SHNKCZNCPVHHAU-NSHGMRRFSA-N 420.573 2.329 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc2F)CC1 745809466 SSTQTIWTDNILPB-MOPGFXCFSA-N 403.546 2.346 10 20 HECD COc1ccc(N2CCN(C(=O)NC[C@H]3CN(CC(C)C)CCO3)CC2)cc1F 753933900 QCBBFGDISGBKQC-SFHVURJKSA-N 408.518 2.023 10 20 HECD COC(=O)c1coc(S(=O)(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c1 753956306 XIVNFQDVAWPEAV-UHFFFAOYSA-N 404.448 2.178 10 20 HECD COc1ccc(N2CCN([C@@H]3CC(=O)N(c4ccccc4OC)C3=O)CC2)cc1F 753976881 DIVGOASELMBRJJ-GOSISDBHSA-N 413.449 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)c3nccs3)CC2)cc1 756688547 OSGWEOAJFKLRAL-KXPUMZMLSA-N 414.531 2.276 10 20 HECD COc1cc(N2CCN(C(=O)Cn3cc4ccccc4n3)CC2)cc(OC)c1OC 760084177 LGXBVSPHNYQBRY-UHFFFAOYSA-N 410.474 2.411 10 20 HECD COC(=O)CC[C@H]1NC(=O)N([C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 761634177 AZWGAIMYKJBMFG-UKRRQHHQSA-N 411.405 2.130 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc1 765927389 QSCUZMRGKACZTA-UHFFFAOYSA-N 406.236 2.368 10 20 HECD O=C(Cn1nnnc1/C=C/c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 768458020 OOCQYUZVWYKURO-VQHVLOKHSA-N 422.464 2.136 10 20 HECD CCCn1nccc1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769020575 FHJYVYVMXGGBOG-UHFFFAOYSA-N 424.549 2.080 10 20 HECD COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773768419 VERFRWHYRINABJ-KGLIPLIRSA-N 407.488 2.264 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 773914141 REXLYBUOSLKZHF-HSZRJFAPSA-N 417.550 2.255 10 20 HECD CN(CCO)S(=O)(=O)c1ccccc1CNCc1cc(Cl)cc(F)c1O 776175857 VXUBWLVPXCAWBV-UHFFFAOYSA-N 402.875 2.087 10 20 HECD Cc1cc(C(=O)NN2CC(=O)N(C)C2=O)c(C)n1-c1ccc(Br)cc1 776241510 JSLRKFUBHNSWPK-UHFFFAOYSA-N 405.252 2.395 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)O)C3CC3)cc2F)C[C@@H](C)O1 778215953 HCFDKSUDSDGAEZ-IYBDPMFKSA-N 407.530 2.291 10 20 HECD CCC(CC)(CCO)CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778352499 VIOJDYCQDNCHQR-KHPPLWFESA-N 417.550 2.205 10 20 HECD O=C(CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)NCC(F)(F)F 779675434 CGKUZINXHIGPHD-ZDUSSCGKSA-N 407.820 2.195 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@H](OCC2CC2)C1 789867467 GEXCNCRSODPKRU-HXUWFJFHSA-N 417.575 2.274 10 20 HECD Cc1cc(C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1-c1cccc(Cl)c1 791263188 SEQBLMCBIXNMDA-UHFFFAOYSA-N 414.893 2.428 10 20 HECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)cc2c1=O 792954386 LHXATEPFDHAZFR-UHFFFAOYSA-N 404.470 2.394 10 20 HECD CN1CCN(c2ccc(CN3CCN(C)C[C@@H]3CNC(=O)OC(C)(C)C)cc2)CC1 793604030 NEWSMCFCKJGUFX-NRFANRHFSA-N 417.598 2.079 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc(N(C)C)cc1 793812402 LSTUHPJJRQJVOL-KRWDZBQOSA-N 405.502 2.491 10 20 HECD CC(C)[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)N(C)C 803702074 XNZUXQKICOSKRQ-CKJXQJPGSA-N 423.529 2.185 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 804003812 AXNBZHPMQLGACL-NRFANRHFSA-N 422.529 2.018 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)cc1F 804851844 QQDGJGKOUNTMTO-HZPDHXFCSA-N 420.529 2.194 10 20 HECD C[C@H](NC(=O)NCC1(S(C)(=O)=O)CCCC1)c1ccc(N2CCOCC2)cc1 804988995 KSGCSXYQHFUNTB-INIZCTEOSA-N 409.552 2.241 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCN(Cc4ccco4)CC3)cc2)CC1 805023182 PTGUKOYIXSZPGY-UHFFFAOYSA-N 424.545 2.477 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC2COC(C)(C)OC2)cc1 806650069 NGXIHMZUWGGJLS-UHFFFAOYSA-N 415.490 2.142 10 20 HECD Cc1nn(C)c2cc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc12 812957884 VTNFAQLHUGKZCJ-UHFFFAOYSA-N 421.501 2.315 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc([C@@H]2CCOC2)cc1 815410237 WUEWUDYRWXQWRA-LJQANCHMSA-N 409.486 2.282 10 20 HECD CCN1CCN(C(=O)[C@H](C)OC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1 916596377 JNPBBUGHQQJKTF-HNNXBMFYSA-N 420.465 2.171 10 20 HECD Cc1nn(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(C)c1Cl 918171131 XTNOFFCRCZMDGE-INIZCTEOSA-N 403.914 2.171 10 20 HECD COC(=O)c1nc2nc(C)cc(NCc3ccc(N4CCC(CO)CC4)cc3)n2n1 918183516 MJAOCQLAJYOCMC-UHFFFAOYSA-N 410.478 2.040 10 20 HECD CCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918221256 SPBULLOWFFVZHW-UHFFFAOYSA-N 420.529 2.235 10 20 HECD O=C(Nc1ccc(-n2nccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918294327 FSZYWIRCEKIWDM-IBGZPJMESA-N 421.457 2.119 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CSc3ccc(OC)cc3)nc12 919035489 UFNHSIBWASFTIO-UHFFFAOYSA-N 417.443 2.456 10 20 HECD CN1CC2(CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 1347715666 IGDJAVBYJICVKC-UHFFFAOYSA-N 407.517 2.032 10 20 HECD CC(C)/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1784889696 RRTYEDXYUTUICY-YADGQWAMSA-N 408.882 2.407 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C(F)(F)F)CCC1)C2 1796600632 WQQSDMAIITZYRI-CLLJXQQHSA-N 413.396 2.477 10 20 HECD O=C(/C=C/c1ccoc1)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1848122610 BYHVZVZYJLOLIW-NOIKDAEWSA-N 410.426 2.325 10 20 HECD COCCn1cc2c(n1)[C@@H](NC(=O)C(=O)NCc1c(C)c3ccccc3n1C)CCC2 574936788 HPBONYJTZUZLAH-SFHVURJKSA-N 423.517 2.140 10 20 HECD COCCN1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1=O 728836681 BNUGKVLHKBTTSG-OAHLLOKOSA-N 401.429 2.138 10 20 HECD COC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729063292 YSIUPMPGCIJNGX-LBPRGKRZSA-N 401.419 2.419 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)ccc1F 743957791 AJCDQMLNOGDWNY-UHFFFAOYSA-N 400.406 2.452 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](c3ccccc3)n3cccn3)CC2)cc1 748727925 KTLHWMFRBATSCD-QHCPKHFHSA-N 419.529 2.420 10 20 HECD CCCCN(C)C[C@H](C)NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 752925797 HKGIFWJLUHETRG-CVTTXWKISA-N 416.566 2.137 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1 753662581 VLHBLODTDWWQDN-SFHVURJKSA-N 408.568 2.100 10 20 HECD C[C@@H](NCC(=O)N1CCOCC1)c1cc(Br)cc(Br)c1O 756792224 ZZUNLTZBTXDGJB-SECBINFHSA-N 422.117 2.427 10 20 HECD COc1cc(N2CCN(c3ccc(C(=O)NC4CC4)cn3)CC2)cc(OC)c1OC 758934626 IAHQEVBDAMRPEM-UHFFFAOYSA-N 412.490 2.326 10 20 HECD CC(C)(C)OC(=O)NCCN(CCO)C(=O)NCc1ccc(N2CCCC2)cc1 768246879 OIXJCFKVXIMWDJ-UHFFFAOYSA-N 406.527 2.315 10 20 HECD O=C(CCCNC(=O)c1cccnc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 772437899 VPDIBSLUDAIJQB-UHFFFAOYSA-N 414.481 2.008 10 20 HECD COc1ccc(N2CCN(CCNC(=O)/C=C/c3ccc(OC)c(O)c3)CC2)cc1 772510718 MUFKGDPTARZAFP-ONNFQVAWSA-N 411.502 2.361 10 20 HECD O=C(NCc1ccoc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 774151635 BIKXBWARULMSOB-UHFFFAOYSA-N 411.380 2.068 10 20 HECD COCCO[C@H]1C[C@@H](CO)CN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 774850731 RJRTYRPRADVBCJ-IRLDBZIGSA-N 419.566 2.478 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCCN2CCN(c3ccncc3)CC2)c1O 774993241 YWFYPTOGUVZPFL-UHFFFAOYSA-N 401.467 2.006 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1 775373247 PXADNSVUPNLENA-AWEZNQCLSA-N 421.519 2.249 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)cc1 778637341 QONYPVKSJOTGPM-LJQANCHMSA-N 404.555 2.463 10 20 HECD COc1ccc(N2CCCN(CN3C[C@@H](NC(=O)OC(C)(C)C)CC3=O)CC2)cc1 782933960 OSZNJTLJVOGTSN-KRWDZBQOSA-N 418.538 2.290 10 20 HECD CCOc1cc2c(cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)O[C@H](C)C2 785426460 ZQMKKWQLMIAKNC-OAHLLOKOSA-N 411.502 2.407 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ccccc1C 788033392 DUMMWGKIVVYZDI-UHFFFAOYSA-N 400.498 2.459 10 20 HECD CC(C)Oc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1C(N)=O 789534566 PJDFEEJWQGEDNY-UHFFFAOYSA-N 422.485 2.204 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)c3ccc4c(c3)OCO4)CC2)cc1 794254837 MYUDPPRVUBVDQY-QGZVFWFLSA-N 411.502 2.466 10 20 HECD COc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c(O)c1 794383904 SJILHWAOXFPFBX-HNNXBMFYSA-N 424.544 2.488 10 20 HECD COCCS(=O)(=O)c1ccc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 797626751 SSRYSMHXZJMHQK-ZDUSSCGKSA-N 408.476 2.271 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C3=NN(CCO)C(=O)CC3)cc2Cl)C1 800570815 VPNNWZRSJJEOTD-CQSZACIVSA-N 406.914 2.163 10 20 HECD C[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)NCCF 800705672 ZBHWJFKNSWWLBP-GFCCVEGCSA-N 402.417 2.030 10 20 HECD Cc1cnc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803299735 NEYRGVZXNPUUMH-CABCVRRESA-N 402.520 2.343 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 806519028 IJEZUCNFRFBMIN-CABCVRRESA-N 406.527 2.349 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4occ5c4CCOC5)n3)CC2)cc1 809465146 SGRCQEXXXDBMNP-UHFFFAOYSA-N 424.457 2.302 10 20 HECD CNC(=O)c1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1Cl 918306337 ZSTLNFFMDIIUMS-UHFFFAOYSA-N 402.882 2.363 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncccc1Br 1116882794 FSDSMMWXMBWDJR-LBPRGKRZSA-N 409.236 2.160 10 20 HECD CN1CCN(c2ccc(CN3CCO[C@@H](CNC(=O)OC(C)(C)C)C3)cc2F)CC1 1320423757 PHQFSSLKCFAPNM-SFHVURJKSA-N 422.545 2.303 10 20 HECD C[C@]1(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)CCCN1 1790461136 RTWBAJYATQCJGS-OAQYLSRUSA-N 410.474 2.383 10 20 HECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)cc1 1799718932 RPLANKCHGALKBM-MUJYYYPQSA-N 417.556 2.107 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCCSC3)CC2)C1 1810549896 KHRIIFDXFFOESZ-HNNXBMFYSA-N 419.547 2.481 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817842555 FWRLQEPJYINYIG-GJZGRUSLSA-N 415.450 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4cccc(C)c4)CC3)CC2)cc1 27383444 FDVWEDODFPVJST-UHFFFAOYSA-N 408.546 2.474 10 20 HECD O=C(CCn1nnc2ccccc2c1=O)NCc1ccc(N2CCSCC2)cc1 54035587 AIWRVVBDUROADS-UHFFFAOYSA-N 409.515 2.051 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCN([C@H](C)C(F)(F)F)CC2)n(C)c2ccccc12 583460730 NLUFDQOXEQWVRL-CQSZACIVSA-N 410.440 2.198 10 20 HECD COc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1[N+](=O)[O-] 725946478 VYFIMMVEOZPQHD-UHFFFAOYSA-N 401.419 2.485 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Br)cn3)nc12 727551679 JZNNNPVUVUSORL-UHFFFAOYSA-N 421.207 2.126 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc([N+](=O)[O-])c(F)c3)nc12 731516810 JXJFFHRKKXKNMT-UHFFFAOYSA-N 404.310 2.016 10 20 HECD CCOc1cc2c(cc1NC(=O)C(=O)NCc1cccc(OC)c1O)O[C@@H](C)C2 737279220 WCLZOVXLHCYIHW-LBPRGKRZSA-N 400.431 2.378 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2nccnc2N)NC(=O)OC(C)(C)C)cc1 742754594 RBRPGDRRBFCKJC-OAHLLOKOSA-N 400.483 2.121 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCCNC3CCCCC3)CC2)cc1 743363994 ZXZHSELMNKUTCT-UHFFFAOYSA-N 417.598 2.429 10 20 HECD Cc1nn(C)c(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1C 746391189 PPDRVHAKYBMDQH-UHFFFAOYSA-N 421.448 2.362 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1F 747012277 PCKQBSGMFMMYDQ-UHFFFAOYSA-N 412.465 2.269 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)/C=C\c3ccc(F)cc3)cc2)CC1 747261502 GIXLTVPAVJUKQO-XFXZXTDPSA-N 424.519 2.151 10 20 HECD COC(=O)c1ccc(OC)c(S(=O)(=O)NCCCSc2nccs2)c1 747267141 NHOIZUMLFQOMLE-UHFFFAOYSA-N 402.519 2.399 10 20 HECD CN(C)CCCOC1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 748962179 UZPGRRCVOFMINC-UHFFFAOYSA-N 422.545 2.305 10 20 HECD CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCCCSc2nccs2)c1 749730852 XIKBBRYTCBYHEE-GFCCVEGCSA-N 422.532 2.354 10 20 HECD C[C@H]1C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCN1C 751066713 AQBGQZQUNAEQOB-STQMWFEESA-N 409.533 2.467 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@@H](NC(N)=O)c3ccccc3)CC2)cc1F 753740592 SPSSKDKEMKTWNL-GOSISDBHSA-N 400.454 2.283 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H](C[C@@H]4CCOC4)C3)CC2)cc1 754115255 SQIUUQQGFZISAU-GIWBLDEGSA-N 417.594 2.317 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3C3CCOCC3)CC2)cc1 754234877 RDTCJQZBZARAJB-GGAORHGYSA-N 403.567 2.069 10 20 HECD CC(C)OCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 756479944 PIMSXFQOXWMDBD-UHFFFAOYSA-N 423.447 2.256 10 20 HECD COC(=O)c1cn(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(C)n1 760183002 NJOVHTCJXFNHTC-UHFFFAOYSA-N 403.394 2.392 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc(Br)c(C)cc3=O)CC2)cc1 766112269 BPBPIMCLWOODPV-UHFFFAOYSA-N 420.307 2.277 10 20 HECD C[C@]1(c2cccc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2)NC(=O)NC1=O 768957868 SPGUXHVHOWAXLF-JOCHJYFZSA-N 424.526 2.224 10 20 HECD C[C@H](OC(=O)C1(CCO)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 770537153 TYVMSGROZQIAAU-ZDUSSCGKSA-N 407.422 2.495 10 20 HECD O=C(N[C@@H](CO)CC(F)(F)F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771197378 SHTJSIRBIZCNOV-SNVBAGLBSA-N 424.422 2.298 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 771936328 FVZYQVGIZFLBOL-HNNXBMFYSA-N 401.511 2.388 10 20 HECD C[C@H](NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 773375267 JDIXBEVTGYXJRT-LBPRGKRZSA-N 422.473 2.427 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC[C@@H]3C)cc2F)CC1 774748460 BHPBBYXENWAPOZ-QFBILLFUSA-N 404.530 2.279 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCN(Cc3nc([C@@H](C)OC)no3)CC2)c1O 774911900 HZWYDWSVZWUVFS-CYBMUJFWSA-N 421.454 2.107 10 20 HECD COc1ccccc1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 775052038 JNJUGGVAJWJRDF-LJQANCHMSA-N 412.486 2.267 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 777829466 XWQKAWBTJJXJSE-CQSZACIVSA-N 420.849 2.189 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1c(F)cccc1F)c1ccc(N2CCOCC2)cc1 787916646 XUXSOYPEFBGBHV-OAHLLOKOSA-N 417.456 2.338 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC[C@H]2CCC[C@@H]21 789848122 ZYGUZYKVBIHZME-APWZRJJASA-N 403.498 2.194 10 20 HECD COc1ccc(CNC(=O)c2cc(S(C)(=O)=O)ccc2Br)c(O)c1 794388478 VPKZWSWQDLJQOJ-UHFFFAOYSA-N 414.277 2.497 10 20 HECD CCOc1cccc(S(=O)(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 800051836 SYQZRNIHJIDPHM-UHFFFAOYSA-N 419.547 2.194 10 20 HECD Cc1cc(C(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)c(C)n1-c1ccccn1 804272858 MPLWDDMLQPQBSR-AWEZNQCLSA-N 418.441 2.041 10 20 HECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](C)S1(=O)=O 804968917 JTGPNHUBORBWJB-YJBOKZPZSA-N 411.593 2.347 10 20 HECD Cc1cnccc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805726427 HDVJVDRZQTYEEC-MRXNPFEDSA-N 418.444 2.393 10 20 HECD C[S@@](=O)C1(CNC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CCC1 809897331 YSZLBJZQZDWREG-MUUNZHRXSA-N 406.548 2.471 10 20 HECD COc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1 810404402 QJDZCLPBOFVHCC-UHFFFAOYSA-N 400.456 2.149 10 20 HECD Cn1ncc2c1CCC[C@@H]2NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918211392 MOWZPVHEXFNHOE-SFHVURJKSA-N 401.486 2.397 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c(C)nn(C(F)F)c3C)nc12 920919437 SQHAFZHRIVDSQI-UHFFFAOYSA-N 423.376 2.106 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@](C)(CO)C3)cc2F)C[C@@H](C)O1 1322912743 WPJXTXBNQJYCHT-JKSBSHDWSA-N 407.530 2.150 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1 1847454093 OINKVANDIZEEGS-XSLAGTTESA-N 411.433 2.251 10 20 HECD O=C(COC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)NC(=O)NC1CCCC1 10877428 OFEWWTAAMPAQPN-UHFFFAOYSA-N 420.421 2.387 10 20 HECD CC(=O)N1CCN(C(=O)CCNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 97553743 SLPVLMANMBBLTL-UHFFFAOYSA-N 414.481 2.044 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncc(O)c3)cc2F)C[C@@H](C)O1 732392633 ZCOLAAGOFVNVKC-ZIAGYGMSSA-N 417.437 2.013 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NCCCSc1nccs1 733899574 KCRMUSSRYLZVKY-UHFFFAOYSA-N 406.576 2.316 10 20 HECD CC(C)(C)c1ncc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 738918125 WJDTXEPZRFBCKS-UHFFFAOYSA-N 417.535 2.331 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)CC3CCOCC3)cc2F)C[C@@H](C)O1 742278208 KQZJVBMGDLPWOX-HUUCEWRRSA-N 400.516 2.285 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3c(C)nn4c(C)cc(C)nc34)CC2)cc1 742921096 XIEURNPEDQRLDN-UHFFFAOYSA-N 422.533 2.215 10 20 HECD CN1CCN(c2ncccc2CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 743566281 DVSFQQHWNJVLMR-UHFFFAOYSA-N 409.534 2.417 10 20 HECD C[C@@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1C 749911448 QMAKVJITOYRBJH-CQSZACIVSA-N 412.465 2.369 10 20 HECD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NCc2ccccc2O)c1 751151942 YOUAIVWWPXWGRA-HJWRWDBZSA-N 407.444 2.074 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3Cc4ccccc4CN3C(C)=O)CC2)cc1F 753739761 YFQXRWHQMMCRMK-OAQYLSRUSA-N 411.477 2.456 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc(-n4ccnc4)c3)CC2)cc1 758230809 JFVRPWUGQGQFKS-OAQYLSRUSA-N 408.502 2.443 10 20 HECD Cc1cc(Cl)ncc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 766359361 CIJHSMBEJOJXOP-UHFFFAOYSA-N 420.872 2.399 10 20 HECD C[C@H](OC(=O)C[C@@H]1COC(=O)C1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 767603381 UKPDEEFDWBJGDA-QWHCGFSZSA-N 421.405 2.285 10 20 HECD COC(=O)[C@H](C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769941647 GMVVQIUDCGXPMS-PXAZEXFGSA-N 406.460 2.044 10 20 HECD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)o1 771054757 WKLFOIWGBZBHRF-CQSZACIVSA-N 412.895 2.437 10 20 HECD CCn1nccc1C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 775017546 DXDOZGQIFPNDEL-UHFFFAOYSA-N 403.394 2.474 10 20 HECD COCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCCC1 778242109 FGMVSYRMXAYBQD-VAWYXSNFSA-N 415.534 2.318 10 20 HECD CCc1cnc(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 778289339 OHTSRVVVGMRLGC-HJWRWDBZSA-N 414.531 2.235 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cc1C(=O)N(C)C(C)C 787535324 XHDJDLDNOFWQTG-UHFFFAOYSA-N 413.474 2.184 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCC[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 789822455 WQYOXPIPCOTQPA-JFIYKMOQSA-N 421.513 2.131 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CC(c2cccnc2)=NO1 790848761 NMPFMXCLSWSDJL-QGZVFWFLSA-N 403.822 2.135 10 20 HECD CC(C)N1CCC[C@@H](CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 803563354 YSOMCLROJPYJNY-ICSRJNTNSA-N 417.550 2.136 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)cc1F 803662794 NESWJHRTFZOKNR-AWEZNQCLSA-N 420.435 2.181 10 20 HECD CC(C)Nc1nc(NCCO)nc(NCc2ccc(N3CCSCC3)cc2)n1 804358036 OSJFHNYDXHGWLB-UHFFFAOYSA-N 403.556 2.261 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C3CC3)[C@@H](C)C3CC3)cc2F)CC1 805009548 LSMVJWMFVBIBOW-INIZCTEOSA-N 416.541 2.373 10 20 HECD CN1C(=O)c2ccc(S(=O)(=O)NCc3cc(Cl)cc(Cl)c3O)cc2C1=O 805134900 BQGPMRJPKXYPTR-UHFFFAOYSA-N 415.254 2.403 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccnc1F 806550283 KIMMSFYCGHTCJY-UHFFFAOYSA-N 410.428 2.406 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(Oc2ccncc2C)CC1 807102450 ZPIVGPPYJKDLEG-UHFFFAOYSA-N 410.518 2.451 10 20 HECD Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)nnn1-c1ccn(C)n1 814679889 QLDPRDPSJCEMJP-LJQANCHMSA-N 423.521 2.197 10 20 HECD COCCN1[C@H]2CC[C@H]1CC(N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2 815212284 NPTPNBOYKZUYPP-SFTDATJTSA-N 402.583 2.285 10 20 HECD CCn1nncc1C(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 815529615 DYUZZQCRZRBXOC-GFCCVEGCSA-N 418.409 2.257 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC3CCN(CC4CC4)CC3)cc2)C1 918014854 BOEMKAUEGNBCLK-LJQANCHMSA-N 413.566 2.062 10 20 HECD COc1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 918897131 MQAYQAYDVGRCEQ-UHFFFAOYSA-N 420.412 2.283 10 20 HECD Cc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccc(O)nn1 920888711 YTGRIRXZRRDTBQ-AWEZNQCLSA-N 408.462 2.004 10 20 HECD CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1cc(OC)c(OC)cc1O 1236749020 DSXBLCHQENWPAI-OAHLLOKOSA-N 424.494 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc4c(c3)CN(C(C)=O)C4)CC2)cc1 1331285881 DCZHQYFHZAFWSR-UHFFFAOYSA-N 408.502 2.318 10 20 HECD COC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1823829679 VNDARVCEFHCBEJ-MRXNPFEDSA-N 405.495 2.151 10 20 HECD CC(C)N(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429288 RJVXUQULOLMAFW-SFHVURJKSA-N 418.538 2.066 10 20 HECD O=C(CSc1nnc(N2CCOCC2)n1-c1ccccc1)c1ccc(O)c(O)c1 17277925 UCALUHBRTMOYBF-UHFFFAOYSA-N 412.471 2.490 10 20 HECD COc1ccc(N2CCC(NC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)cc1 110353310 JDDBTWZEEWQQDS-PMACEKPBSA-N 413.518 2.346 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@@H]2CCC[C@H](C(=O)NC(C)C)C2)n(C)c2ccccc12 553082564 HVQJQLQQYDCSAC-DLBZAZTESA-N 412.534 2.303 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc([N+](=O)[O-])cc3C)nc12 725988648 UZVATPNGFVKUQI-UHFFFAOYSA-N 400.347 2.185 10 20 HECD Cc1cc(C(=O)NCC(=O)Nc2ccc(-n3cncn3)cc2)c(C)n1-c1ccccn1 728073414 UAODVPATLABCER-UHFFFAOYSA-N 415.457 2.438 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1 730838286 PYPAEPACHWVVNK-OAHLLOKOSA-N 418.393 2.246 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1 731042083 CUNRAZCNLNPQPW-NRFANRHFSA-N 423.561 2.449 10 20 HECD COc1ccc(N2CCN(C(=O)CN(CCO)[C@@H]3CCc4ccccc43)CC2)cc1 733895064 NKQDJNFOZUJRRY-HSZRJFAPSA-N 409.530 2.326 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3COc4ccccc4C3)CC2)cc1 742928271 JYSPIJKPNBBDOP-LJQANCHMSA-N 410.518 2.120 10 20 HECD CNC(=O)CC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 746414905 IEAUNXSVWCQJLQ-IYBDPMFKSA-N 420.529 2.497 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 753871263 IEANEGIUUROTMS-MOPGFXCFSA-N 410.536 2.017 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)cc(OC)c1OC 759240886 CTPCHBITEQYFFL-FQEVSTJZSA-N 414.458 2.201 10 20 HECD CCOC(=O)C[C@@H](C)CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759290901 SKQNWXRMRZXWAJ-OAHLLOKOSA-N 423.510 2.133 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)CC2)cc1 761186631 SHNJHYGCFWZNIJ-XMMPIXPASA-N 420.513 2.211 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OCC(F)F)nc3)nc12 761501477 CDLKUTDSRRQCMH-UHFFFAOYSA-N 422.344 2.008 10 20 HECD O=C(c1cccc(NS(=O)(=O)c2cccc3nonc23)c1)N1CCSCC1 765069562 ZVCJWNKYYYMQDI-UHFFFAOYSA-N 404.473 2.213 10 20 HECD CCNS(=O)(=O)c1ccc(C(=O)NCc2cccc(Br)c2O)cc1 765758346 VOGXVXDJYHPUHS-UHFFFAOYSA-N 413.293 2.383 10 20 HECD CCn1c(=O)oc2cc(S(=O)(=O)Nc3nc(-c4cnn(C)c4)cs3)ccc21 767688819 FWMGGVUIVWIBJM-UHFFFAOYSA-N 405.461 2.272 10 20 HECD COC(=O)c1ccnc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 770681136 ZZBQAGQYLKIIAD-UHFFFAOYSA-N 402.426 2.290 10 20 HECD COC(=O)N1CCC([C@H](C)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 776857131 WVCOWHUZQHQLMH-HNNXBMFYSA-N 422.501 2.328 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C)cnc3OC)CC2)cc1 778302482 IDYZFETZWHFANY-HJWRWDBZSA-N 410.474 2.251 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3OCC(=O)N(C)C)c2)CC1 781278449 NLJMSVJQNYBSQT-UHFFFAOYSA-N 424.501 2.074 10 20 HECD COc1ccc(N2CCC(NC(=O)COCCNC(=O)c3ccccc3)CC2)cc1 783957740 OLZBCLVLEWSXSV-UHFFFAOYSA-N 411.502 2.227 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(OCC(=O)OC)c1 784026262 UPTBVCDEXQTUGE-UHFFFAOYSA-N 400.431 2.321 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1 784107398 FOLQUDGXJGGPFX-UHFFFAOYSA-N 405.462 2.406 10 20 HECD COC(=O)Cc1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786256706 JKMCSFBZXVNASG-UHFFFAOYSA-N 409.486 2.001 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN3Cc3ccccn3)cc2)CC1 787318429 FAXBAZDHPURBCS-HSZRJFAPSA-N 421.545 2.031 10 20 HECD Cc1nccn1-c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cn1 787482549 SOGAHYUKCHATOV-OAHLLOKOSA-N 406.490 2.135 10 20 HECD CC[C@H](CSC)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789818730 KOHDXAJLUXSCFJ-OFQRWUPVSA-N 411.543 2.313 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 801547974 ICRXHIKQLKCGAF-JYBIWHBTSA-N 400.475 2.073 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H](c1cccnc1)C1CC1)c1ccc(N2CCOCC2)cc1 803308334 WKBSGPVEFXEHOG-IIBYNOLFSA-N 408.502 2.363 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(OCC2CC2)nc1 803574354 OHIHXLPUYSWXBZ-UHFFFAOYSA-N 406.486 2.179 10 20 HECD C[C@H](c1ccsc1)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803663293 MDBIZNNEPPPHAS-OAHLLOKOSA-N 418.538 2.475 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@H]2CCn3ccnc3C2)cc1)C1CCCCC1 803677128 GOTPPZJYNSXWGK-SFHVURJKSA-N 409.534 2.399 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)C(=O)OC2)c1ccc(N2CCOCC2)cc1 808922909 YLHCMEFEXBNWMI-AWEZNQCLSA-N 409.442 2.010 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)nc4onc(C)c34)CC2)cc1 812882452 IFHPVTVUNCNLAF-UHFFFAOYSA-N 424.457 2.354 10 20 HECD O=C(C[C@@H]1CCCS(=O)(=O)C1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835079 JQIBCHGDGIJJAM-YOEHRIQHSA-N 414.955 2.341 10 20 HECD CN(C)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cncn1C 857472353 LDYJLNPGWGGQML-QFBILLFUSA-N 405.930 2.163 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-n2cnnn2)c1C 918303304 BPORBMNDZVKIPY-UHFFFAOYSA-N 407.478 2.024 10 20 HECD CCOC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 919969334 JVWQEYKFPIFBJZ-MRXNPFEDSA-N 407.486 2.272 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc(C(=O)O)cc1F 926492321 LQNNNZNABWKMJT-UHFFFAOYSA-N 408.451 2.181 10 20 HECD CCOc1ccc(N2CCN(C(=O)CS(=O)(=O)NC3CCC(C)CC3)CC2)cc1 1319869701 IASPYKFPILJVLP-UHFFFAOYSA-N 423.579 2.232 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(c2ccccc2F)C1 1343733141 PLSGAGZHXLJQEC-WBVHZDCISA-N 416.449 2.354 10 20 HECD O=C(Cc1ncccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715580 GSHQAQISNGVAMP-BTTYYORXSA-N 416.865 2.036 10 20 HECD Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)ccc2c1 1843249518 SJKHXOCWWAXGEU-UHFFFAOYSA-N 418.453 2.480 10 20 HECD O=C(COc1cccnc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500775 NOFYBSZEHWTQMZ-UHFFFAOYSA-N 417.849 2.042 10 20 HECD NS(=O)(=O)c1ccc(NNC(=S)Nc2cccc(Br)c2)cc1 16941665 BUTGEMKKSQCICA-UHFFFAOYSA-N 401.311 2.410 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3n[nH]c4ccccc34)CC2)cc1 115847354 UBXRPGVJZKSPIJ-UHFFFAOYSA-N 408.458 2.006 10 20 HECD O=C(C[C@H]1C=CS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566042 XEKWUTPFXUOJRB-CYBMUJFWSA-N 400.447 2.321 10 20 HECD Cc1ccncc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 729785808 MMFCHHZJPBZFLH-GJZGRUSLSA-N 400.454 2.398 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1 734015254 CTVTWBXSXUKEOS-HNNXBMFYSA-N 408.458 2.446 10 20 HECD COc1ccccc1[C@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 734941904 IYTZVZXHFAIPTG-IBGZPJMESA-N 417.481 2.328 10 20 HECD CN1CCN(S(=O)(=O)c2ccccc2CNCc2ccc(N(C)C)c(F)c2)CC1 735087046 VCBXXIJSEJPIIH-UHFFFAOYSA-N 420.554 2.118 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cccc(F)c3C)CC2)cc1 742295763 PCLAOIIISFZTNQ-UHFFFAOYSA-N 407.511 2.243 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)CN3CCCCC3)CC2)cc1 743363209 NLDQGVGQIRUPCH-HXUWFJFHSA-N 417.598 2.238 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 743895955 QPEAMZAMPOTVNA-UHFFFAOYSA-N 417.487 2.221 10 20 HECD Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)N(C)Cc1ccc(N(C)C)cc1 746016257 YCPKAABQLJAEBW-UHFFFAOYSA-N 412.534 2.328 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(S(N)(=O)=O)ccc1O 747337337 PCTQONIVDNSGJC-UHFFFAOYSA-N 403.504 2.302 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2O)cc([N+](=O)[O-])c1C 751306159 RNJAUFYWJNAYIZ-UHFFFAOYSA-N 424.431 2.273 10 20 HECD C[C@]1(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCO[C@@H]1C1CC1 753123200 XOBGWSXGXSTGLG-KPLVRAHFSA-N 400.523 2.145 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1F 754040348 OPEYIYJSSLNIMS-UHFFFAOYSA-N 407.467 2.304 10 20 HECD Cc1cc(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n[nH]1 756704147 UWAJCZFGVHHVPP-UHFFFAOYSA-N 403.394 2.218 10 20 HECD O=S(=O)(Cc1ccccc1CNCc1cccc(Cl)c1O)N1CCOCC1 775988019 YCLGCFAMZSVGFL-UHFFFAOYSA-N 410.923 2.497 10 20 HECD COC(=O)N1CCC([C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 776857136 WVCOWHUZQHQLMH-OAHLLOKOSA-N 422.501 2.328 10 20 HECD COCCOc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 787988498 AMAFGOPRSZGGPA-UHFFFAOYSA-N 411.502 2.245 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCO[C@@H]3CCCC[C@H]3C)CC2)cc1 787991262 UOAYXYFKIXMPEG-WIYYLYMNSA-N 417.550 2.445 10 20 HECD Cc1cnc(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 789822377 WGUXVTCUFQHFPA-CHWSQXEVSA-N 420.510 2.137 10 20 HECD CNS(=O)(=O)c1ccccc1S(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 799763741 BFCZYFJIFBZUDT-UHFFFAOYSA-N 423.560 2.014 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C 803089762 IJUDMVOBYLWDIA-UGSOOPFHSA-N 418.494 2.487 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2cccc(-n3cncn3)c2)cc1 805747555 CZRLOMJEUMMEQX-UHFFFAOYSA-N 420.517 2.388 10 20 HECD CCc1ccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 806494638 SSFPTBHRRROPTC-IRLDBZIGSA-N 424.545 2.484 10 20 HECD COC[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(C)o1 806779620 QFFITLZAARMEJS-ROUUACIJSA-N 416.474 2.305 10 20 HECD COC(=O)Cc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807387307 HOQCWMJGCUBMGS-UHFFFAOYSA-N 421.247 2.125 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC(OCCN2CCCC2)CC1)c1ccc(N(C)C)cc1 807672353 XYOZVLDUWVPNQB-SFHVURJKSA-N 416.566 2.033 10 20 HECD COCCN(CCOC)C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 809706750 JQZWVLKUHJDCIC-UHFFFAOYSA-N 409.546 2.222 10 20 HECD CCC[C@H](C)C(=O)NCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 814431382 LLCYANGZNSFZFN-HNNXBMFYSA-N 408.518 2.138 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](CO)CC3)cc2F)C[C@@H](C)O1 815277122 UJBRHTKDAWEXQI-KURKYZTESA-N 407.530 2.150 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNc2ccc(S(=O)(=O)N3CCC[C@@H]3CO)cc2)c1 864041301 RXLNYEXSGXKTRZ-MRXNPFEDSA-N 407.448 2.058 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(N3CCCC3)cc2)SC1=S 1318188911 DFOGPDRAJOIDRS-NTCAYCPXSA-N 411.574 2.037 10 20 HECD Cc1ccn2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)cnc2c1 1796604200 PBCIQZHHPAQHTQ-MUJYYYPQSA-N 421.457 2.015 10 20 HECD CC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1815076714 AGBZWGDOGPUUKI-AWEZNQCLSA-N 415.450 2.137 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cscn2)CC1 1825986520 CJEHJXWHIWYQCT-INIZCTEOSA-N 416.503 2.496 10 20 HECD CCn1c(=O)[nH]c2cc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)ccc2c1=O 108577991 DBUQLDXTEQHAAW-UHFFFAOYSA-N 422.485 2.071 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)Nc2c(C3=S=CC=C3)nc3ccccn23)o1 509813672 XOXXMSZHJCYOMX-UHFFFAOYSA-N 416.484 2.056 10 20 HECD COC(=O)CNC(=O)Cc1ccc(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729036246 MJOOJTNUYLJTOG-ZDUSSCGKSA-N 415.446 2.115 10 20 HECD CC(C)n1ccc(=O)nc1SCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 729820129 BJBXXCLJFHDXOJ-UHFFFAOYSA-N 420.510 2.208 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C(C)C)N3CCCC3)CC2)cc1 741014139 QSXFRIXHGLJWSP-NRFANRHFSA-N 403.523 2.007 10 20 HECD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1c(O)ccc2c1CCCC2 743717653 QLGYXXROVVUQTM-UHFFFAOYSA-N 405.454 2.159 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H]3CCC[C@H](O)C3)CC2)cc1 745348031 AQMWYKINHATLHG-ICSRJNTNSA-N 404.555 2.058 10 20 HECD CC(C)N1C[C@@H](NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1=O 750639740 WURUWOBLLHSTFY-INMHGKMJSA-N 406.502 2.248 10 20 HECD COC(=O)c1cc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c[nH]1 753365013 AMVNAICUKJQTBI-UHFFFAOYSA-N 424.480 2.347 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccccc3NS(C)(=O)=O)CC2)cc1F 753742056 MHARDDTYMHYEGI-UHFFFAOYSA-N 407.467 2.168 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 756576137 JZFBSKRDHOUHTE-NSHDSACASA-N 424.441 2.391 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O 760093311 XYTPZLWPFZIGSY-UHFFFAOYSA-N 421.494 2.033 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)cc1OC 760823356 SHKWUGDUEPYEER-UHFFFAOYSA-N 413.883 2.080 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1 761652477 WPDUXKMGZHOAND-UHFFFAOYSA-N 405.476 2.150 10 20 HECD CCC1(CO)CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 764322898 JYZCKGFFGYJUNL-UHFFFAOYSA-N 418.582 2.401 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(CCCN(C)C)CC3)CC2)cc1 766995667 MXRUAJVJEDGSAA-UHFFFAOYSA-N 402.583 2.398 10 20 HECD CCS[C@H](C)c1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 767307375 VAGBFHFYAWDHNW-SECBINFHSA-N 401.466 2.318 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4CCC(=O)C[C@H]4C)n3)CC2)cc1 771083844 TUPBGHNLQPVNPU-DNVCBOLYSA-N 412.490 2.442 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc4cc[nH]c34)cc2)C1 773245760 VALINOHLVUFCFN-QGZVFWFLSA-N 419.485 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CO)c3ccccc3C)CC2)cc1 778422949 OVCYVPREGOVBFP-SSSWZJSRSA-N 423.513 2.058 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](O)COc1ccccc1Br 779533273 HZTWRADNRLIZKS-STMXVASLSA-N 408.248 2.430 10 20 HECD COC(=O)c1ccc(CNCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[nH]1 781921774 GRTXCVHJHRSVHC-UHFFFAOYSA-N 424.480 2.347 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1 785423825 CGEFCMYYFJLQFV-MRXNPFEDSA-N 402.445 2.042 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCCN3CCC(C)CC3)CC2)cc1 785520473 NZUBPCGTZHRNEI-UHFFFAOYSA-N 416.566 2.018 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)Cc4ccccc4C(=O)O3)cc2)CC1 786654994 BHONEDXZHANEMD-DEOSSOPVSA-N 421.497 2.143 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccncc3)cc2)CC1 787327905 PCIMIKSEQPVJQC-UHFFFAOYSA-N 404.474 2.070 10 20 HECD C[C@H](OC(=O)CCn1ccnn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 787626657 CFHUEIKTSHYHJL-ZDUSSCGKSA-N 418.409 2.014 10 20 HECD CCCN1CCC(N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789856236 RATYUFJITVBQKG-UHFFFAOYSA-N 418.607 2.189 10 20 HECD O=C(NCCc1ccc(F)c(F)c1)C(=O)NCc1ccc(N2CCSCC2)cc1 789862538 VJBNUAMFVVFXNO-UHFFFAOYSA-N 419.497 2.493 10 20 HECD COc1cc(OC)c(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(OC)c1 790101217 JXDKHFMDBYPAIS-AWEZNQCLSA-N 415.490 2.272 10 20 HECD Cc1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccc(Br)cc2)c(O)c1O 794360415 HXPWGRDSMIZEFT-CQSZACIVSA-N 405.248 2.482 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc2Cl)C1 800050175 OYKJSCPTIBTTMG-CYBMUJFWSA-N 414.897 2.277 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCC2([S@](C)=O)CC2)cc1)C1CCCCC1 803677414 OMGWZAZVDBZDDX-NDEPHWFRSA-N 405.564 2.099 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)cc1F 804854179 ZAYUQIRQXYNVQV-DLBZAZTESA-N 420.529 2.051 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nccn1-c1ccccc1 807810358 QUYUVGYFURNULQ-CYBMUJFWSA-N 400.460 2.440 10 20 HECD O=C(c1ccc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)cc1)N1CCOCC1 808113953 NWQCGGBEMILSOK-UHFFFAOYSA-N 414.842 2.458 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cc(F)c[nH]3)cc2F)C[C@@H](C)O1 815392747 VXJQXGIBKWNBIC-CHWSQXEVSA-N 407.417 2.380 10 20 HECD COCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cc1 915082310 AQIPWVMBHJZHFC-UHFFFAOYSA-N 417.531 2.142 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3)cc2)C1 918463155 HNEUSDGEJJZRPS-OAHLLOKOSA-N 414.893 2.297 10 20 HECD O=C(NCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCSCC2)cc1 919788978 ZQQDTAQTBSGCBH-UHFFFAOYSA-N 424.526 2.335 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1Cn1cccn1 1325761155 BYIRWWUTELLDJH-SFHVURJKSA-N 409.442 2.247 10 20 HECD CC/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801632210 UUQNJDNHCBYITD-QEJRZYKFSA-N 408.882 2.311 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)c2ccco2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992362 XBLMQRRXQBTUJV-LIRRHRJNSA-N 408.414 2.114 10 20 HECD CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817842520 DLJHYSPWJDBTIL-AWEZNQCLSA-N 415.450 2.137 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@@H]32)C1 1844271668 JWBAGNGVVZXKMK-QYZOEREBSA-N 423.494 2.198 10 20 HECD C[C@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847733719 RZMSMUMVWXIKMC-JQFCIGGWSA-N 413.499 2.489 10 20 HECD CCOCCCN1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](C)C1 734660703 GCQHNBCZHIHBMJ-KNQAVFIVSA-N 418.582 2.459 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)ccc1N1CCCC1=O 734703998 VHVACCJADDGTQD-UHFFFAOYSA-N 424.501 2.451 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 745778542 DIMPXHXVASKAHW-UXHICEINSA-N 417.598 2.157 10 20 HECD CC(C)OCCN1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 746414351 NMURINXDVSQJEA-LJQANCHMSA-N 404.555 2.336 10 20 HECD CC[C@H]1CO[C@@H](C)CN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 747297097 GECGTDMUKXQEAT-RDJZCZTQSA-N 419.547 2.424 10 20 HECD CC(C)(CO)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 747615984 FXJXCSWWKKUKSD-KRWDZBQOSA-N 406.504 2.296 10 20 HECD COc1cccc(CNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1O 749118536 PFLROWJRKNHDKX-AWEZNQCLSA-N 420.491 2.156 10 20 HECD COc1ccc(C=O)c(OCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 749405778 JAGGSUBXIJMYTO-UHFFFAOYSA-N 416.449 2.303 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@@H]4[C@@H](CCCN4C4CC4)C3)CC2)cc1 749513363 DHKOEVCDJBKDFP-WMZHIEFXSA-N 412.578 2.293 10 20 HECD O=C1CCc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2N1 749632732 KBDQROLMHVEYEB-UHFFFAOYSA-N 424.526 2.379 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)oc1C 751119686 FZDXQUVMRZUGQO-CYBMUJFWSA-N 408.476 2.251 10 20 HECD CCCCn1c(=O)nc(O)c2c1nc(CN(C)c1ccc(OC)cc1OC)n2C 752111770 MTHIFTFLZOOPFB-UHFFFAOYSA-N 401.467 2.289 10 20 HECD CN(CCc1nccs1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 753580229 ZZBIIIRTEOYIKE-INIZCTEOSA-N 401.536 2.229 10 20 HECD COC(=O)C[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 754511618 CSUORGNJLSALAQ-SFHVURJKSA-N 406.438 2.332 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2nnc(O)n2c1 763061320 ITZLHFSSQLQNBM-HNNXBMFYSA-N 401.854 2.188 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1 768506379 QMJKFMKEWPEHPJ-UHFFFAOYSA-N 416.452 2.476 10 20 HECD CC(C)CS(=O)(=O)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912821 RHQWXVFGMJNZRQ-MRXNPFEDSA-N 402.944 2.197 10 20 HECD COC(=O)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(C)c(C)c1 769628650 MQENTSJSUKLFNE-QGZVFWFLSA-N 406.460 2.025 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)c2)CC1 769846791 DRUISNUPEQXMHJ-UHFFFAOYSA-N 416.547 2.331 10 20 HECD COCCCS(=O)(=O)NCC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 770276763 SYTBFXUUCPBYBO-UHFFFAOYSA-N 411.568 2.028 10 20 HECD Cc1cc2c(cc1C)[C@H](C(=O)NCc1ccc(N3CCS(=O)(=O)CC3)cc1)CO2 771234319 MVZIGUUYZYUXDS-HXUWFJFHSA-N 414.527 2.331 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1c(C)nn(CCN(C)C)c1C 771570367 XRCZYPQZFJPGKC-UHFFFAOYSA-N 407.584 2.338 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H]3CCn4ccnc4C3)cc2F)C[C@@H](C)O1 777460546 YJJDKKPWHNVQFS-UXLLHSPISA-N 401.486 2.450 10 20 HECD O=S(=O)(c1cnn(CC(F)F)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 777963742 YQGLNSOUWKKTKB-AWEZNQCLSA-N 401.435 2.224 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CO)c3ccccc3C)CC2)cc1 778422946 OVCYVPREGOVBFP-GJCOWUBNSA-N 423.513 2.058 10 20 HECD COc1ccc(CN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@@H]2CCS(=O)(=O)C2)cc1 779513383 ISOMWQYFHVZQCN-VWTAQGJOSA-N 417.483 2.336 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2)CC1 781268078 DXBTVBSMVIQQOD-UHFFFAOYSA-N 413.390 2.424 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 786613769 GWHARWCILSURAU-CQSZACIVSA-N 402.882 2.065 10 20 HECD Cc1cc(C(=O)CN2C[C@H](C)O[C@@H](CO)C2)c(C)n1-c1ccc2c(c1)OCCO2 787315077 UHBIMCFIDCCPJO-MAUKXSAKSA-N 400.475 2.130 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C 787911995 KSEPADMIJWVRCY-UHFFFAOYSA-N 406.490 2.443 10 20 HECD Cc1cc(C)nc(-n2nccc2NC(=O)NCc2ccc(N3CCOCC3)cc2)n1 789306039 MQFBDOSJVFZUDR-UHFFFAOYSA-N 407.478 2.437 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCN(CC(F)(F)F)C1 792304811 TXJLDMWCVHGIQE-NSHDSACASA-N 408.804 2.431 10 20 HECD C[C@H](NC(=O)N1CCC[C@@H](S(C)(=O)=O)CC1)c1ccc(N2CCOCC2)cc1 800702117 IPCZLXGTSYFCQQ-QFBILLFUSA-N 409.552 2.193 10 20 HECD CCN(CC)c1ccc(CN(C)c2nnc([C@@H](C)NS(C)(=O)=O)n2CC)cc1 801869440 CCFGGROZKHJZNU-OAHLLOKOSA-N 408.572 2.391 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCCC[C@H]1c1ncc[nH]1)c1ccc(N2CCOCC2)cc1 803307175 XUXKIBATVCXZAZ-APWZRJJASA-N 411.506 2.177 10 20 HECD CCOCCC1(CNC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803312528 YQLAOMGEXWNTDD-KRWDZBQOSA-N 403.523 2.023 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nccn2CCc2ccccc2)cc1F 803663513 QMXJXGVUOWNGEG-UHFFFAOYSA-N 423.492 2.264 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCN(Cc4ccccc4)C3)ccc21 803685764 KCUXCSXXAKUPLQ-NRFANRHFSA-N 420.557 2.324 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](N3CCCCC3)C2)cc1F 804853589 SETRBQJPNATHQC-SFHVURJKSA-N 404.530 2.375 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 807098286 UOXVZONDMOIYPP-INIZCTEOSA-N 418.538 2.145 10 20 HECD CCNC(=O)C1(CNC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CCC1 809728772 HKHFQGIYBPWEMA-UHFFFAOYSA-N 414.550 2.058 10 20 HECD O=S(=O)(NC[C@@H]1CCCN(Cc2cccc(Br)c2O)C1)C1CC1 809785385 VSEYDHBEKHQSBE-LBPRGKRZSA-N 403.342 2.449 10 20 HECD CN(Cc1ccccc1S(N)(=O)=O)C(=O)NCc1ccc(N2CC=CC2)cc1 814306176 XKPLJCQKRUJYNC-UHFFFAOYSA-N 400.504 2.052 10 20 HECD COCc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(C(=O)OC)c1 815369610 DPYCLKMFVNOQQF-UHFFFAOYSA-N 413.474 2.283 10 20 HECD CN(C)c1ccc(CN(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)C2CC2)cc1 914481096 XUQIIDVPYXBHGQ-UHFFFAOYSA-N 413.499 2.088 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(OCC)c(Cl)c1 1116669090 FXHZGAXLMKRIFB-AWEZNQCLSA-N 408.838 2.449 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3nc4ccccc4n3C)CC2)cc1 1335880495 CMQUOBBFNMPDPT-UYAOXDASSA-N 423.561 2.416 10 20 HECD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)nc2ccccn12 1797361718 VNASXDDACZZPGL-MUJYYYPQSA-N 421.457 2.015 10 20 HECD CN(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1799685352 NMEBESLUSNJRJD-VBUUOAMHSA-N 410.474 2.124 10 20 HECD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(F)(C1)C3)CC2)c1cc(O)nc(O)c1 1816720552 XYAKOIJNZRREJE-DVTGZZHGSA-N 418.450 2.067 10 20 HECD CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423642 BEFWOGMGOZGUBT-GZRFBZBPSA-N 419.522 2.133 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3noc4ccccc34)CC2)cc1 7371765 MLNCBFNYZYTHIZ-UHFFFAOYSA-N 409.442 2.271 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(C(N)=O)cc3)cc2F)CC1 730115440 KAQWLFPIVXMTJM-UHFFFAOYSA-N 413.497 2.066 10 20 HECD CN(Cc1ccccc1O)C(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1 733652028 RFLNZLQOEDVTFJ-UHFFFAOYSA-N 402.539 2.258 10 20 HECD C[S@](=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 737131494 PBZCCTIELDCMBA-NDEPHWFRSA-N 417.556 2.232 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])c2)CC1 740609329 HWRIYTDDDQGQHZ-UHFFFAOYSA-N 422.438 2.236 10 20 HECD Cn1cc(-c2csc(NS(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cn1 743049483 GOBBHKLFXWDHGE-UHFFFAOYSA-N 423.432 2.024 10 20 HECD CCOC(=O)c1cccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)CC)cc2)c1 749153776 GEGNGVSIJALQGX-UHFFFAOYSA-N 412.489 2.426 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 753643294 HOMTUPPDKGKMHV-ZDUSSCGKSA-N 424.432 2.318 10 20 HECD COC(=O)c1ccc(NC(=O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753857152 LWPBSHKHRZKLLB-UHFFFAOYSA-N 401.438 2.382 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCOC[C@@H]3c3ccc(C)o3)CC2)cc1 754044003 XGABCQMXXRXSCA-RBBKRZOGSA-N 415.534 2.153 10 20 HECD CNC(=O)c1cccc(CCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 761381220 ZMKFLVYNOWQGNI-UHFFFAOYSA-N 401.850 2.412 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(N2CCCCC2=O)CC1 763586887 HCMCHTZOYKFLQD-UHFFFAOYSA-N 418.513 2.349 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)CC2)cc1 765385009 KSXAWRKTCYSFAF-IBGZPJMESA-N 419.522 2.416 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(c4ccccn4)CC3)cc2)CC1 765977954 KVGPJFWJARBZBB-UHFFFAOYSA-N 400.548 2.075 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCN4C(=O)CC[C@H]4C3)c2C)cc1 766267984 CFZXMFXIGGBCLT-IBGZPJMESA-N 409.486 2.370 10 20 HECD COc1cc(Br)cc(CN(CCO)CCNC(=O)OC(C)(C)C)c1O 768535039 JLTCXPJHYMQOSL-UHFFFAOYSA-N 419.316 2.482 10 20 HECD O=C(CNC(=O)OCC(F)(F)F)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768911888 JJHULQAIMZGSJW-ZDUSSCGKSA-N 423.819 2.415 10 20 HECD COc1cccc(CNC(=O)[C@@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1O 769506967 DBZAKDZGZJVJTI-OWCLPIDISA-N 420.531 2.314 10 20 HECD CC(C)[C@@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 770562228 SDPHGYKPPKWNGZ-LRAJWGHMSA-N 410.486 2.006 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](C(=O)OCC)(C(C)C)C3)nc12 773925356 YBMLFSOLXDFPRM-HXUWFJFHSA-N 404.467 2.023 10 20 HECD CCc1ccccc1NC(=O)CNC(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775258205 UEDWTNQAJHHSRN-SFHVURJKSA-N 424.545 2.491 10 20 HECD C[C@@H](NC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(N(C)C)cc1 776243561 DUQGIXVNBCTOOT-RHSMWYFYSA-N 401.463 2.281 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCOC4(CCC4)C3)CC2)cc1 778390212 YKFICENQEJTSFF-DVBCCOPCSA-N 413.518 2.118 10 20 HECD CN(C)c1ccc(CN(C(=O)c2cc(S(=O)(=O)N(C)C)cn2C)C2CC2)cc1 778576471 LKVPJIDJNZSGRG-UHFFFAOYSA-N 404.536 2.146 10 20 HECD Cc1oncc1C(=O)Nc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c(O)c1 783779883 UUUTUAPPCLZWHJ-UHFFFAOYSA-N 412.354 2.392 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C)nn1-c1ccc(C)nn1 784029397 FIRKGUXXMIVJIP-UHFFFAOYSA-N 408.462 2.362 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1 785422108 INPVWNDHLHSARN-UHFFFAOYSA-N 414.937 2.367 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccccc1CN1CCOCC1)c1ccc(N(C)C)cc1 785442245 IYEDZXXZDDHNME-SFHVURJKSA-N 424.545 2.078 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 786613768 GWHARWCILSURAU-AWEZNQCLSA-N 402.882 2.065 10 20 HECD COCc1ccccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 787504679 MCZNUSARZMQUEY-HXUWFJFHSA-N 412.486 2.363 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@@H]12 788921073 UJOJCMVBFWRPHV-MBMVPVEPSA-N 411.546 2.423 10 20 HECD CC(C)C[C@H](CCO)CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789869600 WJZLQGSRMHHNIU-SFHVURJKSA-N 407.580 2.017 10 20 HECD CC[C@H](C)n1ncc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 792205042 IBFZDBDISPVJKF-AWEZNQCLSA-N 417.485 2.393 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 801695568 BUHBKSMEVDAKJT-CYBMUJFWSA-N 412.533 2.204 10 20 HECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 803978268 PDOYEPHREOEHAB-GOSISDBHSA-N 404.514 2.246 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnc(NC(C)=O)s3)CC2)cc1 804987014 WEJAXKXTURECFE-UHFFFAOYSA-N 410.521 2.057 10 20 HECD O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)C(=O)N(Cc1ccccc1O)C1CCCCC1 805758829 PWUBOOLNHZIAAH-INIZCTEOSA-N 413.518 2.181 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc(-c2ccco2)cs1 806862463 MIHAJNCJWBWKQD-UHFFFAOYSA-N 412.471 2.495 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](Oc2ncccc2F)C1 807100051 GYFWMARUQCOOHV-SFHVURJKSA-N 414.481 2.281 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(c2cccnn2)CC1 807745940 SNQJICUJZYAXSZ-UHFFFAOYSA-N 424.549 2.065 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1C[C@@H](OC)C1(C)C 809124178 XLPPKOFWOGFUQW-HUUCEWRRSA-N 413.312 2.433 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnc1C 813655040 BTIWXGVNVBVFBV-CQSZACIVSA-N 419.503 2.053 10 20 HECD Cc1cc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1N(C)C 815009888 QSNLHGQCFOJIFF-UHFFFAOYSA-N 418.519 2.476 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@@H]4[C@H]5CC[C@@H](C5)[C@H]4C3)CC2)cc1 818440028 RAHMQENWXGQIBY-NKYUOAJESA-N 409.530 2.405 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)cc2)C1 917835088 ZDOOARSQXBCMLS-MOPGFXCFSA-N 420.513 2.058 10 20 HECD CC(=O)Nc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1C 918312004 YNVMBKIKMVFBMF-UHFFFAOYSA-N 424.501 2.387 10 20 HECD Cc1cc(C(=O)N2CCCC[C@@H]2CCNS(C)(=O)=O)c(C)n1-c1ccccn1 918640385 UELXSMGHAXLKOD-QGZVFWFLSA-N 404.536 2.423 10 20 HECD Cc1cc(C(=O)CN2C[C@H](C)OC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920406460 PSJGMKZJUCYMPX-CABCVRRESA-N 405.520 2.033 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1nc2ccccc2o1 1796604144 LDPUMDMYTCBTSU-BTTYYORXSA-N 408.414 2.200 10 20 HECD Cc1ccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)c2c1 1796706712 QEIJRLQLODMKLM-MUJYYYPQSA-N 421.457 2.015 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C2CC(F)(F)C2)C1 1841123425 FVZKZUNQXOROQA-HWKANZROSA-N 408.401 2.065 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnnn2C)C3)cc1 1845398272 TZVZILVRVLWYTJ-UHFFFAOYSA-N 418.501 2.353 10 20 HECD O=C(c1cnnc(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848270778 DIJHWHYOHLOUIV-STQMWFEESA-N 423.256 2.324 10 20 HECD CCOc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 147112139 HCZYIATUGVTTON-UHFFFAOYSA-N 401.438 2.316 10 20 HECD NS(=O)(=O)Cc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 735517294 JIWGQEQRRLIFMA-GOSISDBHSA-N 404.488 2.002 10 20 HECD C[C@@]1(c2ccc(CNC(=O)NCc3ccc(N4CC=CC4)cc3)cc2)NC(=O)NC1=O 741086260 YHUHGMATPRHVEN-QHCPKHFHSA-N 419.485 2.117 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CC(=O)O)cc2)cc1 748641867 SXCFWWQZCIZLGO-UHFFFAOYSA-N 412.489 2.266 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc2c(c1)COC2 751240576 RBAKENHVTWWDJE-UHFFFAOYSA-N 402.516 2.404 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2nc3ccc(F)cc3s2)SC1=S 760987760 FSEDJYPEJOEITL-XFFZJAGNSA-N 417.534 2.186 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccncc3Br)CC2)cc1 763309107 XPJDHMNUZHVICB-UHFFFAOYSA-N 419.323 2.405 10 20 HECD COc1ccc2c(c1)CCCN2Cn1nc(C[C@@H]2CCS(=O)(=O)C2)n(C)c1=S 766341772 PSVHSZSYPBUNDE-AWEZNQCLSA-N 422.576 2.347 10 20 HECD O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 766779111 UMYISOANEQHGLX-UHFFFAOYSA-N 423.466 2.233 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cccc(F)c4)CC3)nc12 767041259 FSLXBZDGZXYHGD-UHFFFAOYSA-N 413.453 2.069 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(Cc2c(O)cccc2Cl)CC1 768156606 OSSQQRUTCIOBCT-UHFFFAOYSA-N 411.867 2.460 10 20 HECD O=C(NCCCO)C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768312831 DAZNDXSQWYTHEV-UHFFFAOYSA-N 404.511 2.296 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCCN1S(C)(=O)=O 769291927 PGNBELUQIFLYSU-CQSZACIVSA-N 419.341 2.317 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)Cc2cccc(Br)c2O)CC1 769306916 VPXWVTXPGIKQKK-UHFFFAOYSA-N 413.312 2.388 10 20 HECD CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769781964 DYPGAYQJIYAFAU-KRWDZBQOSA-N 420.487 2.010 10 20 HECD COc1cccc(/C=C(\C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n2nnnc2C)c1 773739258 CZPQMFWTIVAOCH-VBEHJTROSA-N 409.446 2.147 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCN(C)c1ccccc1 774985007 AFMQIHWSPYGFFN-UHFFFAOYSA-N 424.545 2.124 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)Nc2cc(-n3cnnn3)ccc2Cl)c1 775375638 NZZAPZLCMHHLCX-LLVKDONJSA-N 402.842 2.319 10 20 HECD O=C(CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NCC(F)(F)F 779671830 ZEJUWCGWMXBGFE-NSHDSACASA-N 409.355 2.442 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1F 780408198 YEPYXSPHTWOEMN-UHFFFAOYSA-N 407.467 2.304 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](C)NC(=O)c3ccccc3)cc2)CC1 786258746 GXKSTUCVDLLENU-GOSISDBHSA-N 422.529 2.180 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N(CCO)[C@H]1CCc2ccccc21 788912158 TWGIYXKISSCZIN-QFIPXVFZSA-N 407.514 2.411 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCCS3)cc2F)C[C@@H](C)O1 789833666 IFPADPZGHZHGLO-FMKPAKJESA-N 409.527 2.067 10 20 HECD C[S@](=O)C1(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 799402930 DYJZHRGMUWEKJY-MHZLTWQESA-N 401.479 2.467 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OC[C@@H]1CNC(=O)O1 801222395 XAMKWTDOYPQGSZ-BZPKPHBRSA-N 412.514 2.381 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(OC)c(-n2cnnn2)c1 802609433 AQBRQIVGLGAVRB-UHFFFAOYSA-N 424.461 2.144 10 20 HECD CCc1ccc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)o1 803662719 MCHYBMUVGUBQPF-SFHVURJKSA-N 403.454 2.263 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@H]2c2nccs2)cc1F 803663021 RDJCNOJBMLRESE-HNNXBMFYSA-N 408.524 2.281 10 20 HECD COc1cccc([C@@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)CCCN4C)CCO2)c1 803689747 YXODGGUCMZANMM-QFIPXVFZSA-N 423.513 2.294 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)cc1F 804852584 KOFAVVVYPHAIOS-CQSZACIVSA-N 408.518 2.050 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C 807099926 HNSRNWHRWGRDFZ-AVRDEDQJSA-N 408.546 2.314 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)c3nc(C)cs3)CC2)cc1 807351697 WECNPRRERJRBIH-HNNXBMFYSA-N 416.547 2.419 10 20 HECD CC(C)[C@H](C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808853714 CIUMFEDUYNTAQI-SFHVURJKSA-N 400.567 2.338 10 20 HECD COC(=O)c1cc(CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1C 809640527 YSWOIRXNDMQTKO-UHFFFAOYSA-N 403.479 2.160 10 20 HECD O=S(=O)(CCC1CCOCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 814272070 UPRPNYXWURFRQM-UHFFFAOYSA-N 400.516 2.023 10 20 HECD CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1803716695 WDLUKXVUDWPJQI-BCDXTJNWSA-N 424.457 2.017 10 20 HECD O=C(c1cccc(F)n1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501579 DDEPHNNZMPBIPB-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(-c4ccc(F)cc4)n3)CC2)cc1 47440810 LGESGQXQCWYBFU-UHFFFAOYSA-N 408.433 2.343 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)CC2)cc1 110467333 WPHFGGNIFOZWTQ-UHFFFAOYSA-N 417.487 2.087 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c1 728979701 KLRYDISTHSHDKM-CYBMUJFWSA-N 410.467 2.476 10 20 HECD CCCCCS(=O)(=O)CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730194301 GXUFQVZLVFUKEA-UHFFFAOYSA-N 413.559 2.189 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1 736668714 CWHZINRAAUCXFQ-UHFFFAOYSA-N 404.448 2.300 10 20 HECD CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 741732686 IHRQLFSMYSAPNG-HSZRJFAPSA-N 409.530 2.272 10 20 HECD CN(CCC(=O)N1CCN(c2ccccn2)CC1)Cc1ccc(N2CCOCC2)cc1 744729566 ZFRDKPXCPMABMQ-UHFFFAOYSA-N 423.561 2.089 10 20 HECD O=C(NC[C@@H](O)C1CCOCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904075 LCCSHVZQDMYQDB-MAUKXSAKSA-N 413.465 2.344 10 20 HECD COc1cccc(C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)n2nnnc2C)c1 746814537 NUXHZKIIYPERFU-QFIPXVFZSA-N 420.517 2.473 10 20 HECD O=Cc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)[nH]1 749917604 BBBBMKCQCKMXKI-UHFFFAOYSA-N 408.437 2.013 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(F)c1 751236169 GLMBIAHWWDBLSL-UHFFFAOYSA-N 423.466 2.421 10 20 HECD CO[C@@]1(C)C[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 752074235 DWBZHAGWVOGKKM-UGKGYDQZSA-N 407.530 2.414 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccnc(O[C@H]2CCOC2)c1 755430237 QCXUCMUIJCMROL-SFHVURJKSA-N 415.465 2.280 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(n3cc(C(=O)OC)nn3)CC2)cc1 759221247 RBRUEKVNUQZUPH-UHFFFAOYSA-N 414.510 2.458 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3ccncc3C)CC2)cc(OC)c1OC 760125933 GNXXODYEHCHAKQ-UHFFFAOYSA-N 414.506 2.490 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)c1 763224842 VVRFDXPYFFHHJD-CQSZACIVSA-N 407.467 2.302 10 20 HECD CCOC(=O)c1cnn2c(C(=O)NCc3cccc(Br)c3O)ccnc12 765771237 WLTGZJAPQMIENY-UHFFFAOYSA-N 419.235 2.304 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1 768075183 PTZOPCUSRGBJGQ-UHFFFAOYSA-N 400.822 2.495 10 20 HECD Cc1cc(C)n2nc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nc2n1 768910891 BDCLPKZQHHTCNR-INIZCTEOSA-N 414.897 2.495 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](CCO)c3ccco3)cc2F)C[C@@H](C)O1 769220962 JKVIGRMMIWUAQB-MDZRGWNJSA-N 419.497 2.362 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)Cc2cc(Br)ccc2O)C1 769301688 CIEPGOONKQGWGF-CYBMUJFWSA-N 413.312 2.388 10 20 HECD COc1cc(N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(OC)c1OC 769919193 TZSDRPPSFRBNOR-UHFFFAOYSA-N 410.448 2.066 10 20 HECD COC1(CO)CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 770262519 VFUUBDKPCYPCDL-IYBDPMFKSA-N 409.502 2.122 10 20 HECD CN(CCNC(=O)NCc1c(O)ccc2c1CCCC2)S(=O)(=O)c1cccs1 772015860 LMWMPSJJVODSMB-UHFFFAOYSA-N 423.560 2.452 10 20 HECD CC(C)CCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774538927 CZTQAZKECZTFKL-HKUYNNGSSA-N 416.566 2.336 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCc3ccc(S(=O)(=O)N(C)C)cc32)c1O 775110631 IMGBXXLXEOTDOD-UHFFFAOYSA-N 407.448 2.122 10 20 HECD Cc1nc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1-c1n[nH]c(C(F)(F)F)n1 775404747 NOAFVRGQCTXCBL-VIFPVBQESA-N 408.388 2.270 10 20 HECD C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 775836543 NADVBDYDWKNGAN-OAGGEKHMSA-N 418.563 2.317 10 20 HECD C[C@](O)(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 777747526 FCPFYGYOLOTDQP-DVECYGJZSA-N 424.545 2.485 10 20 HECD COC1CCC(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 781235843 NSDFVJSYLVPTCA-UHFFFAOYSA-N 408.470 2.027 10 20 HECD CC(C)[C@H]1C[C@H](CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCO1 781951825 QOSAKAZJAQYCEO-UYAOXDASSA-N 408.564 2.379 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2cn(-c3ccc(Cl)cc3)nn2)c1 783151560 LNTPLECQACFTMF-UHFFFAOYSA-N 422.850 2.355 10 20 HECD CN1CCC[C@H](OC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1=O 785413979 RWSFIVZTXZSDOO-AWEZNQCLSA-N 410.473 2.032 10 20 HECD CCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 786693578 ZBSPPPCLENFHED-QGZVFWFLSA-N 411.502 2.416 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCCN2CCc3ccccc3C2)C2CC2)cc1 787621740 HLFVGUBSFDEJPA-UHFFFAOYSA-N 420.557 2.418 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](Cc2ccccc2)C1 788314110 YGDBANDPPJGJBT-NRFANRHFSA-N 407.514 2.231 10 20 HECD C[C@@H]1CCC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789842461 CQPZUOPYXWHXFB-HZPDHXFCSA-N 405.514 2.440 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2cc(OC)ccc2O)c1OC 790217570 NZHPEYMIDOHXPY-UHFFFAOYSA-N 415.851 2.328 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@H]3[C@@H]3CCCO3)CC2)cc1 790699607 XMLVTEKPLKQKFF-SFTDATJTSA-N 402.539 2.170 10 20 HECD COCCN(C)c1ccc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 790954789 YQGUIELGVBGYRH-FQEVSTJZSA-N 411.550 2.156 10 20 HECD CN(C)c1ccc(CNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1F 792103207 HCVRHWHZWGMXRT-GOSISDBHSA-N 415.387 2.140 10 20 HECD COc1ccc(CNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c(O)c1 792759889 GTWBYTVRZLRDDN-IBGZPJMESA-N 403.454 2.413 10 20 HECD C[C@H](CCC(C)(C)C)NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793719159 LEYLDVQBGTUYQZ-AEFFLSMTSA-N 416.566 2.336 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1 794107296 FVUKKLMEKUVLOE-UHFFFAOYSA-N 409.395 2.112 10 20 HECD CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2 807361784 BVFYOHZSTOVMEK-SLFFLAALSA-N 415.534 2.031 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)C(=O)OC2)c1ccc(N2CCOCC2)cc1 808922910 YLHCMEFEXBNWMI-CQSZACIVSA-N 409.442 2.010 10 20 HECD O=C(COC(=O)C1(N2C(=O)c3ccccc3C2=O)CCCC1)c1ccc(O)c(O)c1 815440821 WSNKPKALIJMPNY-UHFFFAOYSA-N 409.394 2.433 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(Cc2ccccc2)c1 916676838 VUVKKRLOLQMMRZ-UHFFFAOYSA-N 424.526 2.096 10 20 HECD CNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918205498 LPXCULCOIPXORG-UHFFFAOYSA-N 400.454 2.021 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)N3CCCC[C@@H]3C(N)=O)c2C)cc1 7082707 LOLQVTCXASQBFN-LJQANCHMSA-N 413.474 2.126 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)Cn3cnc4ccccc4c3=O)cc2F)C[C@@H](C)O1 108164677 RFBZIOATFVFJQQ-HZPDHXFCSA-N 424.476 2.466 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2ccc(O)nc2=O)cc1 303450912 JLTGFOJNGQJFBN-UHFFFAOYSA-N 408.458 2.257 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 729061398 COVMOTWAALVZHY-GFCCVEGCSA-N 406.460 2.010 10 20 HECD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1 734017452 IRIWYGCWNVVAFI-ZSEKCTLFSA-N 403.479 2.154 10 20 HECD CCOC(=O)Cc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c1 739081749 RQJVUKXRQORRDY-UHFFFAOYSA-N 401.438 2.252 10 20 HECD NC(=O)CCSc1ccccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 741097159 MVEKWCLZVPCHHP-UHFFFAOYSA-N 424.526 2.285 10 20 HECD C[C@H](O)CN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741404169 JVQXIKDAESQTGJ-RXVVDRJESA-N 424.545 2.481 10 20 HECD O=C(CNC(=O)NCc1ccco1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800387 JQVQPRUIMLTCMY-AWEZNQCLSA-N 422.432 2.465 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccccc1Cn1cncn1 749730702 BOLZXUJKGLCWPP-UHFFFAOYSA-N 402.505 2.020 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H]1CCCS(=O)(=O)C1 758662681 MDOIEMPJFCHWHS-ZIAGYGMSSA-N 417.478 2.133 10 20 HECD COc1cc(N2CCN(C(=O)[C@H](C(C)C)N3CCCC3=O)CC2)cc(OC)c1OC 759239534 MVQRHCXBQAPZGR-FQEVSTJZSA-N 419.522 2.008 10 20 HECD COC(=O)[C@@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)C 760915242 FOEYQJISZBGVBH-STXHMFSFSA-N 423.529 2.233 10 20 HECD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1cccc(Br)c1O 765751626 ICEPWUYITBHLRP-UHFFFAOYSA-N 422.235 2.499 10 20 HECD COc1ccc(F)cc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 768911191 VRCOHFJJSAPWEM-UHFFFAOYSA-N 407.467 2.391 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c(C)noc3Cl)CC2)cc1 769039335 GJBOHADBFCFTLP-UHFFFAOYSA-N 407.854 2.080 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@H]4CC[C@@H](C)O4)n3)CC2)cc1 771057980 QYJUYCNIEBFOPW-VQIMIIECSA-N 414.506 2.470 10 20 HECD Cc1[nH]ccc(=NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1Cl 771767944 YNYOHPDFAGCBQA-HNNXBMFYSA-N 401.898 2.489 10 20 HECD CNS(=O)(=O)c1cc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)ccc1C 771827825 KENKWAAAGDXMSZ-UHFFFAOYSA-N 423.878 2.231 10 20 HECD C[C@@H](NC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773012566 IADWKRDPPKRNIU-CQSZACIVSA-N 423.560 2.326 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1 773249103 IRCCUYIVBUOBCL-UHFFFAOYSA-N 416.452 2.175 10 20 HECD CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)C1=O 775837337 RKBIIENWUAXLDN-MWTRTKDXSA-N 423.517 2.292 10 20 HECD Cc1nc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)n[nH]1 776118179 MOWIZHIVLGHTCB-MRXNPFEDSA-N 402.474 2.178 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC3(CO)CCCCC3)cc2F)C[C@@H](C)O1 776592059 XTUSZAGMCLOEIK-CALCHBBNSA-N 407.530 2.340 10 20 HECD COC(=O)c1cnc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 779676127 RMHRBNMQHNRZDX-CQSZACIVSA-N 404.854 2.017 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](c3ccccc3)N(C)C)CC2)cc1 780089543 HPEOQLZLRIQFTI-QFIPXVFZSA-N 411.502 2.190 10 20 HECD Cc1ccc(C(=O)N2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c(O)c1O 780995304 KHDAHTHDXAAQJC-UHFFFAOYSA-N 403.866 2.456 10 20 HECD NS(=O)(=O)c1cccc2c(C(=O)NCc3c(O)ccc4c3CCCC4)nccc12 783588435 KIEKHKZOQAMQHS-UHFFFAOYSA-N 411.483 2.397 10 20 HECD COc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)ccc1OC(F)F 785429268 YJBOGTNZIPOJKY-UHFFFAOYSA-N 407.417 2.295 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1 785439546 QRXUSEYXJIGXGU-QGZVFWFLSA-N 418.538 2.275 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCc3sccc3C)cc2F)CC1 786799641 GZUOBBJSWNSJAH-UHFFFAOYSA-N 418.538 2.270 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccn(-c2ccccc2)n1 788913233 VZAWQZKYGQZWCL-UHFFFAOYSA-N 403.486 2.405 10 20 HECD CCOC(=O)c1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(F)cc1C 793012963 OCHHNOHWJHKMRH-UHFFFAOYSA-N 404.394 2.019 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccncc2OCC(F)(F)F)c1 799060186 AHURTGIBKICYCK-UHFFFAOYSA-N 419.381 2.030 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)C(C)C 804319108 ZDRXVACQCMALSM-FQEVSTJZSA-N 405.539 2.348 10 20 HECD CC(=O)C(=O)COC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1 808482972 AUILKGDUOIYASY-UHFFFAOYSA-N 409.847 2.133 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 808956834 XJOYASDWDCPWBC-MRXNPFEDSA-N 416.472 2.384 10 20 HECD O=Cc1c[nH]c(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 815257361 RCUBZPJLGXQJBT-UHFFFAOYSA-N 402.362 2.398 10 20 HECD CN(C)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442968 ZWBHGZOVQPPGSV-UHFFFAOYSA-N 410.518 2.216 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 919913110 GQMPRMYTZLYGOD-HBFSDRIKSA-N 415.582 2.308 10 20 HECD Cc1nc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 1116580613 WNTKNNZXUGUCHJ-MJBXVCDLSA-N 405.474 2.098 10 20 HECD O=C(CCc1ccoc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037878 XKBOVHPJIAGUHV-QPJJXVBHSA-N 412.442 2.246 10 20 HECD CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 472791667 PJCCZMYHALZSFE-UHFFFAOYSA-N 408.458 2.110 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccoc4)no3)cc2)C1 739525470 IRCRFMFJUMOXDQ-INIZCTEOSA-N 423.473 2.280 10 20 HECD Cc1c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nnn1C 742750017 LHASHKGTXYXFSZ-INIZCTEOSA-N 402.499 2.185 10 20 HECD CC(=O)N(C)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 744906080 AKKOGBWAXKHTNQ-UHFFFAOYSA-N 424.501 2.103 10 20 HECD O=C(NCCNc1cnccn1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745772077 MCXPSUJJZVPJKG-CQSZACIVSA-N 406.437 2.458 10 20 HECD COc1ccc2c(c1)OC[C@@H](C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)C2 747375930 UREGTCWUASOOSX-OALUTQOASA-N 423.513 2.264 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1)CNC(=O)OC(C)(C)C 749789282 CNYIMZNTLIBJAR-INIZCTEOSA-N 406.527 2.483 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CC(=O)N1CCCC1 749902872 OSSLTZBTQOCEDS-HNNXBMFYSA-N 419.481 2.343 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NCCCSc2nccs2)cn1 753588574 NFRBRJGVZNBBED-PTFIGZPYSA-N 413.594 2.357 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1F 753861600 STDOVOTYELMFSW-LJQANCHMSA-N 408.495 2.093 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1 756455475 JTRBEGVBZPTUAD-CZUORRHYSA-N 414.458 2.154 10 20 HECD C[C@@H](NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1O 756481232 WBYLHYVFZLTVEV-SNVBAGLBSA-N 401.391 2.208 10 20 HECD CC(C)CO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 759566264 AQWGCNKHQPWANW-AZUAARDMSA-N 402.539 2.345 10 20 HECD COc1cc(N2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 759879425 VOQDZLAEEBSXFZ-GOSISDBHSA-N 417.462 2.476 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](c4cccs4)C3=O)CC2)cc1 761183804 KKQIYDIWXBMPDO-GOSISDBHSA-N 400.504 2.172 10 20 HECD COCCCn1c(S)nc2cc(C(=O)NCc3ccc(O)c(O)c3)ccc2c1=O 768915099 XUDKARCJRVWFAQ-UHFFFAOYSA-N 415.471 2.063 10 20 HECD O=C(OCC(=O)N(c1ccc(F)cc1)[C@H]1C=CS(=O)(=O)C1)c1cc(O)cs1 770019692 UZZXMRRUGWWBID-ZDUSSCGKSA-N 411.432 2.094 10 20 HECD CCCc1cc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)n[nH]1 771067796 OYJMWKNQWXTOEW-UHFFFAOYSA-N 410.478 2.312 10 20 HECD COC(=O)CCSc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774363952 ZYKBUJLKIXKJLQ-UHFFFAOYSA-N 418.471 2.050 10 20 HECD CCCC(O)(CCC)CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778288385 YCSNCVCGYKSUTM-ZHACJKMWSA-N 417.550 2.348 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1 779477871 BKEZNXODAOFJSK-KRXBUXKQSA-N 413.449 2.105 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1 779500464 YGHGHZHOIAZDRJ-WAPJZHGLSA-N 420.462 2.220 10 20 HECD CCc1ncc(NC(=O)C(=O)N(CC)Cc2cc(Br)ccc2O)cn1 785192333 KQQHBOVTGSWDRD-UHFFFAOYSA-N 407.268 2.494 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 788759635 VIBCRLISEPHZGJ-AWEZNQCLSA-N 401.429 2.131 10 20 HECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)N(C)C)cc1 793723973 XWZOCCNHVUCJEZ-QFIPXVFZSA-N 408.546 2.413 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 796825987 CFKJFXODUXYMSC-UHFFFAOYSA-N 411.506 2.482 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CC(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797709998 PPSZZAORGKCICS-GASCZTMLSA-N 423.485 2.215 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCc2cc(F)ccc21 802551183 POWQYTGRWNVWDZ-UHFFFAOYSA-N 411.477 2.240 10 20 HECD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)[C@H]1CCCO1 803678145 ZBXYEUCQTHYBDV-LEWJYISDSA-N 417.550 2.382 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3cc(COC(C)(C)C)on3)ccc21 803686827 HWSZEQPKMHDBAJ-UHFFFAOYSA-N 414.506 2.305 10 20 HECD CCOc1cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1OC 805743844 XDKBPKYRIZOBTJ-UHFFFAOYSA-N 409.486 2.403 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2CCN(c3ccccn3)C2)C2CC2)cc1 807694332 KRYCQZBYXPVJRD-GOSISDBHSA-N 407.518 2.034 10 20 HECD C[C@H](NC(N)=O)c1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 813342039 XQIMDENXTRQRQD-QMMMGPOBSA-N 409.449 2.034 10 20 HECD Cc1cc(C(=O)COC(=O)CS(C)(=O)=O)c(C)n1-c1ccc(OC(F)F)cc1 920593638 FKJYIFMOLRDLPN-UHFFFAOYSA-N 415.414 2.466 10 20 HECD CNS(=O)(=O)C1=CC(c2nnc(-c3ccc(COc4ccccc4)o3)o2)=S=C1 1117233147 DIAZZXHFMGLTLL-UHFFFAOYSA-N 417.468 2.411 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1C1CC1)CCO2 1782004481 WNLZHRVLHRHHAU-PZPWOCDFSA-N 420.893 2.241 10 20 HECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCCC1 18215084 NOTFXOKTSOFUQY-UHFFFAOYSA-N 417.531 2.476 10 20 HECD Cc1c(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)n(C)c2ccccc12 473258913 CBZXYZXCRRVCJD-SFHVURJKSA-N 407.474 2.293 10 20 HECD Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2ccc3c(c2)OCCO3)c(O)c1O 727005197 JZOHPSGUSOEJCF-ZDUSSCGKSA-N 401.415 2.082 10 20 HECD C[C@@H](NC(=O)CCc1nc(-c2ncccn2)no1)c1ccc(N2CCOCC2)cc1 727710334 IGQDUNHLKHYUSZ-OAHLLOKOSA-N 408.462 2.173 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1 729063078 XMXGFKCVJFLPRS-CYBMUJFWSA-N 417.437 2.192 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1O 730589925 YDFLJDMLAYTLKN-GOSISDBHSA-N 418.515 2.259 10 20 HECD O=C(NCc1cocn1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 730842006 AQVKCLPLEIBSKW-UHFFFAOYSA-N 418.387 2.019 10 20 HECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)NCc1ccc(CN2CCOCC2)cc1 732352824 IHCUSTFODAXTRI-AWEZNQCLSA-N 404.488 2.148 10 20 HECD CCc1cnc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 743693045 IMVCUMSBOMEGSM-OAHLLOKOSA-N 401.536 2.407 10 20 HECD O=C(COC(=O)Cc1cc(F)ccc1F)NCc1ccc(N2CCOCC2)c(F)c1 745550921 ZRQUPDJTJPQHGA-UHFFFAOYSA-N 422.403 2.343 10 20 HECD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 746093500 ILUFEJUNZFPENT-KRWDZBQOSA-N 416.482 2.185 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)Cc2cc(Cl)cc(C(C)=O)c2O)CC1 750044502 YIZPYDPYIPUJBO-UHFFFAOYSA-N 410.898 2.482 10 20 HECD COC(=O)c1ccccc1OC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758226211 WIULXOFVGQQMIT-SFHVURJKSA-N 400.475 2.044 10 20 HECD COCCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N(C)C)cc2)cc1 758284127 YXOHBHLRPLQISI-UHFFFAOYSA-N 405.520 2.172 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cc(CCOC)nn2C)cc1 768715583 SGGDVDYDRHVAOF-UHFFFAOYSA-N 401.511 2.052 10 20 HECD COC(=O)c1cnc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 770486595 SQGCMFQRKVHMTM-UHFFFAOYSA-N 424.379 2.049 10 20 HECD CSC[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 773741141 SCGSUWFXMRYBPD-DTZQCDIJSA-N 420.531 2.052 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 774362995 PQNVSIIRVKYZEJ-UHFFFAOYSA-N 408.414 2.323 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1 779477873 BKEZNXODAOFJSK-WAPJZHGLSA-N 413.449 2.105 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(F)c(C)c3)cc2)CC1 786121161 BOOPGACPQVOLNA-UHFFFAOYSA-N 405.495 2.281 10 20 HECD NC(=O)[C@H]1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 786789315 QURDMNFWSXKFPA-KBPBESRZSA-N 413.440 2.450 10 20 HECD Cc1ccc2c(c1)[C@H](NC(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 789802364 XGMZGZUGBWFFRY-HXUWFJFHSA-N 411.477 2.391 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCN(CC(F)(F)F)C1 792304809 TXJLDMWCVHGIQE-LLVKDONJSA-N 408.804 2.431 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2 792974438 RIKOCQRAPXPBNB-UHFFFAOYSA-N 421.425 2.351 10 20 HECD C[C@H](NC(=O)C(=O)NCCN1[C@@H](C)CCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 803297602 BFDZISBSYSGXPS-FHWLQOOXSA-N 416.566 2.080 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCCC[C@H]3C3OCCO3)cc2)CC1 805024039 FOMJGJKAEVHAFK-FQEVSTJZSA-N 415.534 2.293 10 20 HECD Cc1onc(N)c1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 809814190 CEHKVSRQBSCRNI-UHFFFAOYSA-N 402.423 2.114 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 916688100 PABFIXBTHYGCRN-UHFFFAOYSA-N 423.473 2.101 10 20 HECD CCc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918464105 QIIADGWIJWQDTB-GOSISDBHSA-N 408.502 2.206 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1n[nH]c2c1CCC2 919701138 LFYZSFDSIKOEAS-UHFFFAOYSA-N 421.480 2.084 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CO[C@H]3CCOC3)c2C)cc1 1318918693 AUJWLXCBYXXDKU-SFHVURJKSA-N 415.442 2.412 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCc3ccc(S(N)(=O)=O)cc3)CC2)cc1 1319872067 YFXQIKBRXDVSID-UHFFFAOYSA-N 417.531 2.014 10 20 HECD Cc1ccn(-c2cccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2)n1 1328712096 OQHRVIGUNCXPGK-UHFFFAOYSA-N 424.526 2.346 10 20 HECD O=C(/C=C/C1CC1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836730517 CMDZDWHTWIKQQG-ONEGZZNKSA-N 415.490 2.071 10 20 HECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)cn1 1845500672 ZTWFSBDLBUAIEQ-UHFFFAOYSA-N 417.849 2.286 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 525726239 MRNHVGGGXVLVJC-UHFFFAOYSA-N 410.517 2.052 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc(OC)cc3OC)CC2)cc1 726726861 WEAPMNZZNUZSGY-UHFFFAOYSA-N 413.474 2.436 10 20 HECD Cc1c(NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cccc1[N+](=O)[O-] 727981075 BGALASXLGJNTQE-UHFFFAOYSA-N 409.493 2.467 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1 728955346 QSMDAAPRTWAWEH-OAHLLOKOSA-N 414.506 2.253 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC3CCC(C(=O)NC)CC3)cc2F)CC1 730123446 PZVGCTHFPUDMJB-UHFFFAOYSA-N 419.545 2.072 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1nn(-c2ccc(F)cc2)ccc1=O 731601363 VFKXJOMPTQQIRW-UHFFFAOYSA-N 422.460 2.480 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(OC)c2O)cc1Br 737285892 MHFBWBSBONRDQY-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1ccc(N2CCN(CCNC(=O)COc3ccc(F)cc3F)CC2)cc1 742921152 YYECZHZDALIFQS-UHFFFAOYSA-N 405.445 2.291 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 743162646 DNFBRIDYFHSRND-UHFFFAOYSA-N 418.519 2.394 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3cnc(C(C)C)[nH]3)cc2F)CC1 747266498 FLASRXYZUFDQOS-UHFFFAOYSA-N 409.531 2.293 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1cc2c(cc1Br)OCCO2 748481701 LTXDOYGUSFLBQY-UHFFFAOYSA-N 407.220 2.181 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H]3CN(C(C)=O)c4ccccc4O3)CC2)cc1F 753738320 HTUMJGWEERVAGH-NRFANRHFSA-N 413.449 2.297 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@H]3C3CC3)cc2F)C[C@@H](C)O1 761127373 SMPIABAWOJSLTG-MRUHUIDDSA-N 405.514 2.166 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCN(C2CCCCC2)C1=O 765679228 QEZOLUCJCGLTHB-IBGZPJMESA-N 418.513 2.395 10 20 HECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2cc(Cl)ccc2O)CC1 768218498 PDDRGSMCSCXYEE-UHFFFAOYSA-N 422.894 2.134 10 20 HECD CCNc1nc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 768659608 OSLZUCLMYBFWNE-UHFFFAOYSA-N 422.482 2.024 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCOC4(CCC4)C3)CC2)cc1 778390215 YKFICENQEJTSFF-ZEVQVBBLSA-N 413.518 2.118 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)c1cccc(F)c1 782772846 FGGBHMWUDDHZKZ-UHFFFAOYSA-N 408.813 2.116 10 20 HECD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccc(-n2cncn2)cc1 785398856 PEMLJZRWWAKJAB-ZDUSSCGKSA-N 416.532 2.200 10 20 HECD C[C@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785424199 MMPVZIFABKTQSC-QGZVFWFLSA-N 409.534 2.106 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)cc1 785444282 RIMKMQXSIKIGOR-UXHICEINSA-N 416.472 2.209 10 20 HECD COC(=O)CCCCCS(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 788063754 WHVMSWQYCCDRCV-UHFFFAOYSA-N 402.488 2.020 10 20 HECD Cc1cccnc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789827396 SHFUOLFCEBYWMO-HOTGVXAUSA-N 414.481 2.075 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1 790410076 ZRVXQTDXCUMNJF-UHFFFAOYSA-N 412.489 2.032 10 20 HECD COc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccn1 806918981 LFBDLUSZNOLCCN-AWEZNQCLSA-N 420.416 2.415 10 20 HECD CCO[C@H]1COCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 807131571 PXFVBFJGBDDOBJ-QUCCMNQESA-N 404.507 2.364 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)N1CCOC2(CCC2)C1 807771938 ZGPODWRBVUIMEL-OAHLLOKOSA-N 423.460 2.155 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 807912255 HLCMPQWIXBPGKR-QGZVFWFLSA-N 414.481 2.450 10 20 HECD NC(=O)C[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 809318226 NGPHGUYQKLTHHD-HLVNSREUSA-N 423.585 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@@H]4O[C@H](C)C[C@@H]4C)n3)CC2)cc1 809464656 JTRTXWHGLIVSCQ-BXTJHSDWSA-N 400.479 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4cn(C(C)C)cn4)n3)CC2)cc1 809464836 MSAYAHBZLJANKJ-UHFFFAOYSA-N 410.478 2.414 10 20 HECD COc1ccc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1S(N)(=O)=O 811543234 RQOGCUGVHDFHTE-UHFFFAOYSA-N 414.487 2.075 10 20 HECD C[C@](O)(C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CCC1 812676939 PXWBYAUIRNOUKM-HSZRJFAPSA-N 407.422 2.495 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1Nc2ccccc2S(=O)(=O)N1 813685373 WWNAKNSOZNNBCB-CQSZACIVSA-N 402.259 2.045 10 20 HECD CC(=O)N(c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1)C1CC1 815612799 XDVMFTWOPPCJSM-ZDUSSCGKSA-N 411.458 2.299 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](C)CN3CCCC3)CC2)cc1 918198984 XLZQHYRJPAYANG-FQEVSTJZSA-N 417.598 2.238 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCn3cnc4ccccc43)cc2)C1 918674128 WIZXMZWUBXSHSJ-SFHVURJKSA-N 405.502 2.445 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCC(=O)N2CCOCC2)cc1 919654185 FOKSUPJUAQMRRA-UHFFFAOYSA-N 414.506 2.306 10 20 HECD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NCc1ccccc1O 109678067 JEXOWNFNGSUELF-HNNXBMFYSA-N 412.508 2.248 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CC[C@@H](C(=O)N(C)C)O3)ccc21 537128010 PUIUEVUAKFLKMK-PXNSSMCTSA-N 401.507 2.270 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnn(-c4ccccc4)n3)cc2F)CC1 730194589 MNPHQHUGBDGJJX-UHFFFAOYSA-N 408.481 2.478 10 20 HECD C[C@H](NC(=O)NCc1nnnn1-c1ccccc1)c1ccc(N2CCOCC2)cc1 730579697 DYSZLANCAPQMMN-INIZCTEOSA-N 407.478 2.059 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N(C)C)cc2C)n([C@H]2CCS(=O)(=O)C2)n1 734643210 WUDFRQXGRGOQOT-KRWDZBQOSA-N 405.524 2.247 10 20 HECD Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCOc4cc(N(C)C)ccc43)C2=O)cc1 742952629 PILVCTZHGDBQMN-QHCPKHFHSA-N 422.485 2.254 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 743809310 PMJGPYQJHZLKKT-UHFFFAOYSA-N 410.224 2.273 10 20 HECD Cc1oc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N1CCCC1 753637644 XCEBZJGMEVHHBL-GFCCVEGCSA-N 408.476 2.145 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nc(-c4ccccc4)ccc3=O)CC2)cc1F 753733192 WRQYGDJHEQXRHT-UHFFFAOYSA-N 422.460 2.407 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(C(C)C)cn2)cc1OC 753965360 ROLKXPVYBYDIQS-UHFFFAOYSA-N 402.498 2.035 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4c(c3)ncn4C)CC2)cc1F 754210788 DOWKQYOOTFVTTE-UHFFFAOYSA-N 411.437 2.008 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 756094396 KNVDKTQBMGHECP-JYAXBFRTSA-N 424.545 2.480 10 20 HECD CCn1c(=O)n(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 758195664 BTBBVNUYCTYVFG-LJQANCHMSA-N 410.518 2.015 10 20 HECD CCS(=O)(=O)CCN(C)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 759372734 BYWIOVMLWJDQHP-UHFFFAOYSA-N 420.531 2.415 10 20 HECD COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc(OC)c1O 763963955 MGWKDPHFUHXIOK-OAHLLOKOSA-N 413.474 2.041 10 20 HECD C[C@H]1CN(CCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCO1 764572538 HUXWBMXOCMKTIR-IBGZPJMESA-N 404.555 2.166 10 20 HECD COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cccc(Br)c1O 764934829 NKUQARUCMFYOHQ-UHFFFAOYSA-N 415.265 2.201 10 20 HECD C[C@@H](NC1CCN(CC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)cc1Cl 765898515 JAOZFUIOXXNOJN-MRXNPFEDSA-N 408.974 2.380 10 20 HECD COc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnc1Cl 767718174 HNUJJUXVUFMDAW-UHFFFAOYSA-N 415.874 2.198 10 20 HECD CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769724848 LLEVZMIRCBBZKI-UHFFFAOYSA-N 419.547 2.400 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)Cc3ccccc3Cl)cc2)C1 772319707 RNYYRCSTQACBIF-PXNSSMCTSA-N 415.921 2.262 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCN(Cc2cccs2)CC1 774750153 GTRNITODDMGTTK-UHFFFAOYSA-N 400.548 2.357 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(CCO)C1CCOCC1 780506120 DELSANSJXNJQQE-HNNXBMFYSA-N 413.465 2.440 10 20 HECD COc1cccc(COCC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786661007 MCXFWYSLBFGFHV-UHFFFAOYSA-N 411.502 2.197 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@]3(CO)CC(C)C)CC2)cc1 788764815 JJCRICCFNGOGTN-QHCPKHFHSA-N 418.582 2.400 10 20 HECD CC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789840166 GCDNWHOMQXMMLB-INIZCTEOSA-N 405.514 2.442 10 20 HECD O=C(NCCC[C@@H]1CCCCO1)C(=O)NCc1ccc(N2CCSCC2)cc1 789855063 IENUFKQSOHXWPB-IBGZPJMESA-N 405.564 2.322 10 20 HECD O=C(CN1CCc2ccccc2C1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789969117 ZROSVYGEIYIIFX-UHFFFAOYSA-N 411.477 2.102 10 20 HECD COc1ccc(Cn2cc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cn2)cc1 793050853 HDHDUBJZMKIZFL-AWEZNQCLSA-N 424.457 2.037 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(OC)cc2O)c(Br)o1 795358019 JXOCLMDBQAMYJY-UHFFFAOYSA-N 420.237 2.021 10 20 HECD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NCc1cccc(OC)c1O 796392880 CBITUQVLCIGMSN-UHFFFAOYSA-N 422.503 2.433 10 20 HECD CC[C@](C)(OC)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 796397312 IWTPWZFSGASBAQ-PZPWOCDFSA-N 410.486 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 801600378 PJNVTPIBYOLMID-UHFFFAOYSA-N 412.490 2.427 10 20 HECD COc1cc(NS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O 808111608 ONMDGMSGZOBWKG-UHFFFAOYSA-N 415.512 2.389 10 20 HECD COc1ccc(C[C@H](CO)CNCc2ccc(N3CCOCC3)c(F)c2)cc1O 809749222 LJQBZWTVNMZKDR-SFHVURJKSA-N 404.482 2.317 10 20 HECD Cc1cc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(C(=O)O)c1F 871792675 JRSMZCFWWUWYED-UHFFFAOYSA-N 422.478 2.490 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCCC(=O)NC3CC3)cc2F)C[C@H](C)O1 918210488 ZDWKWRWTZSQRMN-GJZGRUSLSA-N 406.502 2.297 10 20 HECD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 918264571 DSWATJNQHVKQMD-UHFFFAOYSA-N 424.501 2.252 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 918463209 JBLDTGPUGXCWIY-GOSISDBHSA-N 408.502 2.260 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CC2)cc1 1320976163 STUVVIILZXVASM-INIZCTEOSA-N 401.429 2.437 10 20 HECD COc1ccccc1CCNC(=O)CNCc1ccc(N2CCN(C)CC2)c(F)c1 1326944171 PQYZTMLOJYOENP-UHFFFAOYSA-N 414.525 2.035 10 20 HECD CCCc1onc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601369 ZGIYOSHPXJDVMC-QDMKHBRRSA-N 414.462 2.307 10 20 HECD Cc1cccc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)n[nH]c12 1801123268 PTXVQEKIBPASNS-QDMKHBRRSA-N 421.457 2.243 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cnc(Cl)nc2)C1 1840975088 DZBBAEQATULYQU-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=C(C1CCC(CO)CC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500733 IBGAEPIDJQNWJS-UHFFFAOYSA-N 422.909 2.367 10 20 HECD CCN1CCN(CCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726625410 HMZXBKXZMOZHMO-UHFFFAOYSA-N 410.509 2.401 10 20 HECD COCCN(Cc1cccnc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 727940796 OKKQSBDEROWGES-UHFFFAOYSA-N 402.470 2.416 10 20 HECD O=C1CCCc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2N1 728760729 HIMMPXVNKZIYBM-UHFFFAOYSA-N 422.485 2.053 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C(C)C)N3CCCCC3)CC2)cc1 741013054 XVVRKSMWHSKTEB-QFIPXVFZSA-N 417.550 2.398 10 20 HECD CCN(CC(=O)N1CCC[C@H](NC(C)=O)C1)Cc1cc(Br)ccc1O 744425715 KXLPDALEKKSJMH-INIZCTEOSA-N 412.328 2.104 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1cccc(C(=O)NC2CC2)c1 746492195 CGNJHAMYVTZRMD-UHFFFAOYSA-N 408.502 2.160 10 20 HECD COC[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(C)o1 746757671 QJHSACTYFWFOLU-PKOBYXMFSA-N 414.506 2.477 10 20 HECD CC(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 746783061 HRONHIIWSOBWNP-HUUCEWRRSA-N 417.485 2.472 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](CO)C(C)(C)C)cc2F)C[C@@H](C)O1 749467423 ZBQLUTBITFBUJR-GQIGUUNPSA-N 409.546 2.394 10 20 HECD Cc1noc2ncc(S(=O)(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc12 751237175 PFPIQMJXHFFERL-UHFFFAOYSA-N 416.503 2.218 10 20 HECD COc1cc(N2CCN(c3ccnc(C(=O)N(C)C)c3)CC2)cc(OC)c1OC 758942258 UDDBIJWSEUMINR-UHFFFAOYSA-N 400.479 2.136 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccn(Cc2ccccn2)n1 759022193 IIUMDTIFHAODRB-UHFFFAOYSA-N 406.490 2.380 10 20 HECD CCC1(CC)[C@@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1OC 759599387 HHLPOEHLTBNUHS-PMACEKPBSA-N 407.530 2.462 10 20 HECD CN(C(=O)/C=C\c1ccc(Cl)nc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 759752637 LAGGVZLTNJEGAX-NTMALXAHSA-N 411.849 2.304 10 20 HECD CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 764341203 DNTOXNZBIHUFMI-UHFFFAOYSA-N 400.460 2.426 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc3c(cc2OC)CCC(=O)N3)c1 768142338 AOJSCBPNJYFGIG-NSHDSACASA-N 413.430 2.110 10 20 HECD NC(=O)COc1ccccc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768913185 WBHVPMRUPDXAGO-INIZCTEOSA-N 417.893 2.304 10 20 HECD Cn1cnc2cc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)ccc21 772925772 BNXLJRLYMYSZOA-UHFFFAOYSA-N 404.467 2.028 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2cccc(S(=O)(=O)NC(C)C)c2)c1O 774976601 HUNVIROQOTXTJT-UHFFFAOYSA-N 409.464 2.286 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCc2cc(OC)c(OC)cc2OC)c1 775370589 WXIANEFCVBWTIM-ZDUSSCGKSA-N 404.463 2.394 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4nc[nH]c4c3)CC2)cc1 778250141 RJQWQEDYYOJBNW-HJWRWDBZSA-N 405.458 2.415 10 20 HECD CCN1CCN(C(=O)Cc2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)cc2)CC1 779529356 PAUFAZABESXADS-UXBLZVDNSA-N 409.486 2.456 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1 782107054 MOGJVPBDUDMJFS-UHFFFAOYSA-N 411.458 2.119 10 20 HECD CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 784651720 QXRBGGRENLQSQN-UHFFFAOYSA-N 415.494 2.040 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NOC[C@H]1CCOC1 788094739 BYWRUGNCFLEUHS-ZDUSSCGKSA-N 403.401 2.309 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCCC3CCCC3)cc2)C1 788225156 OMGFVOWJPRYWGO-LJQANCHMSA-N 414.550 2.091 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CCCc2occc21 788608358 FVXVZUONFYTZRK-QGZVFWFLSA-N 401.438 2.065 10 20 HECD COC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CCCO1 789381740 HUKTVJWFEWNWMR-RBUKOAKNSA-N 408.454 2.184 10 20 HECD CS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799038 MAPWASMRSVHUNE-HZPDHXFCSA-N 409.527 2.069 10 20 HECD CCCCN(CCCO)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789833175 DTZCTIRWJPZIBO-IRXDYDNUSA-N 423.529 2.067 10 20 HECD CCSCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789841417 XFCXFKAXCCXPKT-CQSZACIVSA-N 411.543 2.051 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H]3CC(C)(C)OC3=O)cc2F)C[C@@H](C)O1 795649791 FJKSEVGYMXGDSP-ZRGWGRIASA-N 421.513 2.081 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)c3c(C)noc3C)nc12 797508891 YVLGCUUCYAYEMM-UHFFFAOYSA-N 402.407 2.237 10 20 HECD COc1cc(N2CCN(C(=O)c3[nH]nnc3-c3ccccc3)CC2)cc(OC)c1OC 797751381 JKRRWECQLKODMB-UHFFFAOYSA-N 423.473 2.460 10 20 HECD COc1ccc(N2CCN(Cc3c(C)nn(CCS(C)(=O)=O)c3C)CC2)cc1F 797967500 WYUIBOFPBBZKCO-UHFFFAOYSA-N 424.542 2.014 10 20 HECD CC[C@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCCO1 798353925 DHYWOSLXNKFPAB-FQEVSTJZSA-N 404.555 2.418 10 20 HECD COCc1ncc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)s1 803105258 LHEKLBCHJDQVBB-UHFFFAOYSA-N 407.492 2.278 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](OCC(F)(F)F)C2)cc1F 803663227 LLLKHTAJXWBVPY-ZDUSSCGKSA-N 405.392 2.078 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCCC3(C2)OCCO3)cc1)C1CCCCC1 803676981 YLTHFOWDXRXSLS-UHFFFAOYSA-N 415.534 2.437 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C[C@H](N1CCOCC1)C(F)(F)F 804185095 JUMMAFHVGGXFQK-AWEZNQCLSA-N 421.803 2.073 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)c2ccc(C(F)(F)F)cn2)c1 805424850 PFXKLPILTPUYIT-UHFFFAOYSA-N 418.349 2.217 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(CCc2cccs2)CC1 807097834 PJTHGTKVCHOIDC-UHFFFAOYSA-N 414.575 2.126 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1)c1ccc(N(C)C)cc1 807675051 UBMRFGFSTYAKDB-HOTGVXAUSA-N 418.538 2.398 10 20 HECD COc1ccccc1Cn1c(=O)c2ccccc2n2c(SCC(=O)C(C)=O)nnc12 808013680 LSVUNLGIYZBPKE-UHFFFAOYSA-N 422.466 2.351 10 20 HECD CO[C@@H](CCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C(F)(F)F 808973870 BPROGORCJIUCFI-INIZCTEOSA-N 401.429 2.327 10 20 HECD COCCOCCN(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 809366619 NCXCZGOOTWTKTD-UHFFFAOYSA-N 412.398 2.105 10 20 HECD CCC(CC)NC(=O)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C 809870188 GZRIXLNYCGXVIB-UHFFFAOYSA-N 400.527 2.459 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc4cnn(C)c4c3)CC2)cc1 812880504 NBRQKUSKEIVLLN-UHFFFAOYSA-N 422.533 2.203 10 20 HECD Cc1cc(CCNC(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1 813565618 IBINKFOUADUCOG-HXUWFJFHSA-N 418.563 2.312 10 20 HECD C[C@@H](NC(=O)N(C)CCOc1ccc(S(N)(=O)=O)cc1)c1ccc(N(C)C)cc1 814321986 WFEWUJLDLGRTEV-OAHLLOKOSA-N 420.535 2.181 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(c4ccccc4)=NO3)cc2)C1 917834385 JVWIIQPTDKYWKG-NQIIRXRSSA-N 406.486 2.198 10 20 HECD CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(N3CCN(C)CC3)c(F)c1)CC2 1116754240 ZVXRECNAPPFWPB-UHFFFAOYSA-N 418.538 2.048 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCCO1 1792650458 DZDHWSFSRPIVHH-ALDGSTNNSA-N 416.474 2.024 10 20 HECD CC(C)(C)[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793042703 PITBFCLZCHRLBH-IPJQOSJUSA-N 410.898 2.410 10 20 HECD CC(C)=CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1799991166 CQDCSKJTMUELLI-QDMKHBRRSA-N 409.577 2.231 10 20 HECD CC(=O)Nc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1803707745 VASNNXSAUZBNJN-MUJYYYPQSA-N 424.457 2.017 10 20 HECD Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808580262 LRWMFFORMSIQMF-MGPUTAFESA-N 421.457 2.158 10 20 HECD CC1=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CCO1 1827425834 AWIRBHMZTRJFMS-GOSISDBHSA-N 415.490 2.420 10 20 HECD Cc1ccc(OCCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843248763 LGPSJCIGIACYNL-UHFFFAOYSA-N 411.458 2.087 10 20 HECD O=C(c1cccc(C(F)(F)F)n1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250012 AXBYQNOJQDFVFO-UHFFFAOYSA-N 422.363 2.037 10 20 HECD O=C(CC1Cc2ccccc2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251760 OXAVJGVLCUZJSA-UHFFFAOYSA-N 407.470 2.115 10 20 HECD COc1ccc(N2CCN(CC(=O)N(C)CC(=O)Nc3ccc(C)cc3)CC2)cc1 57547937 VVVMAKACLIFLQX-UHFFFAOYSA-N 410.518 2.223 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4cnnc4)cc3)cc2F)CC1 303282519 JAHQVLPMMRMEAM-UHFFFAOYSA-N 408.481 2.478 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](N4CCCC4)C3)cc2F)C[C@@H](C)O1 727159948 UBCWYJATMWOHAS-QWFCFKBJSA-N 418.557 2.226 10 20 HECD Cc1cc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c(C)c1 728015446 QULOAVZSAMAASK-UHFFFAOYSA-N 412.489 2.482 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)OC(C)(C)C 729228203 BRKXTCCPTGCGLO-UHFFFAOYSA-N 424.517 2.453 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C[C@H]2CCCO2)CC1 734284300 XHXSPGDPVKXLTM-JOCHJYFZSA-N 416.566 2.308 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1 734468481 YAIROXSYFOOUEW-UHFFFAOYSA-N 411.474 2.324 10 20 HECD CS[C@@H](CO)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 740469509 RBHDLQJEGGYUBA-LRDDRELGSA-N 421.485 2.454 10 20 HECD CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 741090797 OQMYIESGMYMTNK-LJQANCHMSA-N 406.552 2.066 10 20 HECD C[C@@H](O)CN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741404168 JVQXIKDAESQTGJ-NQIIRXRSSA-N 424.545 2.481 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCOc2ccc(F)cc2)cc1 742028085 QBIFGRNNHJEHEY-UHFFFAOYSA-N 402.469 2.408 10 20 HECD CN1CCCc2cc(CNC(=O)C3CCN(c4ccc5nncn5n4)CC3)ccc21 746811860 OPUICPRGUGDNGD-UHFFFAOYSA-N 405.506 2.040 10 20 HECD CN(C)c1ncnc2c1cc(C(=O)NCc1ccc(N3CCC(CO)CC3)cc1)n2C 747395511 FILNSSKHOHIAOP-UHFFFAOYSA-N 422.533 2.173 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(F)c(NS(C)(=O)=O)c1 750721299 XDIZEZFJHWPHRA-UHFFFAOYSA-N 421.494 2.306 10 20 HECD CC(C)[C@@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1nc(-c2nc[nH]n2)no1 752674943 YYQCVKYUTZLURL-MRXNPFEDSA-N 408.466 2.427 10 20 HECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(C)(=O)=O)cc1 753200829 NGBDKFACONWHSY-HNNXBMFYSA-N 420.506 2.486 10 20 HECD COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2cccc(Br)c2O)C1 754153403 HHIFNHDCPNELSS-AWEZNQCLSA-N 421.357 2.027 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cn(C)nc3C(F)F)CC2)cc1 754834015 NJPDXSJYAPVTHJ-UHFFFAOYSA-N 407.465 2.308 10 20 HECD COc1cc(N2CCN(CN3C(=O)[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)CC2)cc(OC)c1OC 758965664 SSXQMOIZPICBCK-HZVDNRATSA-N 401.507 2.049 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1O 768725324 PTIMOCLLZOEQQK-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCNc1nc(C)c(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)s1 770071856 WRGOYIDJTMJUSM-UHFFFAOYSA-N 405.436 2.165 10 20 HECD O=C(NCCc1ccc(F)cc1)C(=O)NCc1ccc(N2CCSCC2)cc1 774715021 XEZVRBFXOYFZRD-UHFFFAOYSA-N 401.507 2.354 10 20 HECD CCN(CCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1cccc(C)c1 775032552 FTASPFKCHZLJOU-UHFFFAOYSA-N 400.498 2.459 10 20 HECD Oc1cc2c(cc1CN1CCN(c3nnc(C(F)(F)F)s3)CC1)[C@@H](O)CO2 776776845 HNTQXTWZYWNABC-LBPRGKRZSA-N 402.398 2.011 10 20 HECD COCCO[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 781962933 DYBCOUAUNHJTCG-OAHLLOKOSA-N 408.454 2.138 10 20 HECD CNC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCO1 782086139 RZCPGAPXMRRNTH-KRWDZBQOSA-N 420.307 2.444 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NC2CC2)cc1 784568121 VLXQNCDUNLPNIB-UHFFFAOYSA-N 411.458 2.206 10 20 HECD Cn1nc(Br)cc1CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 785432539 UWOAVCSXXCXFKG-AWEZNQCLSA-N 406.328 2.174 10 20 HECD C[C@H](O)CN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](C)CO 785872666 RTTBSCJJLJHXPN-KGLIPLIRSA-N 401.454 2.030 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCOC2(CCSCC2)C1 788932148 LUPBRZVSBVESOS-SFHVURJKSA-N 417.575 2.464 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 789662404 WEDYOVGOEPUUHY-OAQYLSRUSA-N 408.546 2.458 10 20 HECD CS[C@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799036 MAPWASMRSVHUNE-HOTGVXAUSA-N 409.527 2.069 10 20 HECD C[C@@H]1CSCCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 789818757 KUZDZNJSDQBHJN-ARFHVFGLSA-N 423.554 2.267 10 20 HECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 789877175 DOGBWEWQJORFBT-UHFFFAOYSA-N 411.550 2.345 10 20 HECD CCCCCCn1cc(S(=O)(=O)Nc2ccc(O)cc2OCC)c(O)nc1=O 790409634 SHSWEENCIUQERU-UHFFFAOYSA-N 411.480 2.434 10 20 HECD CN1CCN(Cc2ccc(N3CCOCC3)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 793604154 OSNJGGNZTNXUGP-HXUWFJFHSA-N 404.555 2.164 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)cc2Cl)C1 800719788 NOTQJFALPGAVQU-SUMWQHHRSA-N 419.913 2.022 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)CN1C(=O)c2ccccc2S1(=O)=O 801549657 VBRSTYMKRXVDSX-UHFFFAOYSA-N 402.472 2.366 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCC2([S@@](C)=O)CCC2)cc1)C1CCCCC1 803676241 BXWLTFDHPJTVGD-GDLZYMKVSA-N 419.591 2.489 10 20 HECD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CN1Cc1ccccc1 803688323 OTRSAVSHUDIKOG-PGRDOPGGSA-N 420.557 2.464 10 20 HECD CC[C@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007919 UWRXJZFDLUKYHR-SFHVURJKSA-N 404.530 2.375 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 806166301 QBBUOHMLHYFRGD-QFIPXVFZSA-N 415.497 2.433 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N(CCO)[C@H]1CCc2ccccc21 806282822 VIXKJULJDSHXIG-INIZCTEOSA-N 405.545 2.250 10 20 HECD Cc1noc(C)c1CO[C@@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807672878 JVMHKQJOBDIUCZ-IFXJQAMLSA-N 414.506 2.352 10 20 HECD CC(C)OCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2)no1 811866471 LQBBPWPPLNYLSP-OAHLLOKOSA-N 403.483 2.392 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@]3(O)C[C@H]4CC[C@H]3C4)cc2)C1 813594863 OGHNVYFFAAOXRI-KGYLXKDPSA-N 414.550 2.129 10 20 HECD O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1cc(Cl)cc(Cl)c1O 813684704 NCXVPRYFHCRBGH-UHFFFAOYSA-N 415.254 2.160 10 20 HECD CCOC1(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCCC1 818261091 CXXDGTHWJZWIJS-KHPPLWFESA-N 415.534 2.366 10 20 HECD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CCNS(C)(=O)=O)c2C)c1 914648907 GTKYBUILLHTJCN-UHFFFAOYSA-N 424.544 2.481 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1 918777442 LDGGEQUHYBQARB-UHFFFAOYSA-N 404.448 2.151 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1 921018994 DICVERWYMGUAPI-UHFFFAOYSA-N 406.489 2.435 10 20 HECD Cn1ncc2cc(S(=O)(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cnc21 1116659532 HIYKNADGMHJLOI-INIZCTEOSA-N 402.476 2.044 10 20 HECD CCCNC(=O)[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1355051419 PSGGXLRZQTVLDR-LLVKDONJSA-N 409.398 2.015 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1781071899 LOWZRYBLYKAKFT-OITMNORJSA-N 408.882 2.241 10 20 HECD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)c1 1804335934 MRCJRGVJFWDEOL-MUJYYYPQSA-N 417.556 2.107 10 20 HECD Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805612021 PBBVWGNHJLNDNH-YWZLYKJASA-N 422.441 2.423 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)[C@H](C)N(c4ccccc4)C3=O)CC2)cc1 21931753 IAWZTPHSLUJQSX-KRWDZBQOSA-N 422.485 2.201 10 20 HECD CSc1nnnn1-c1cccc(NS(=O)(=O)c2cccc3nsnc23)c1 31668762 VBSNXGVCUMBADO-UHFFFAOYSA-N 405.490 2.190 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cc(OC)ccc3NC(C)=O)CC2)cc1 63468806 ISGPDAOMENRXAD-UHFFFAOYSA-N 412.490 2.423 10 20 HECD C[C@H](NC(=O)NCCc1nnc2n1CCCCC2)c1ccc(N2CCOCC2)cc1 141016489 WQRFPWRYHGDDFX-KRWDZBQOSA-N 412.538 2.444 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2nccnc2c1)c1ccc(N2CCOCC2)cc1 141699803 GKVVAPZHPUQFQN-OAHLLOKOSA-N 405.458 2.282 10 20 HECD COc1ccc(Cl)cc1/C=C1/SC(=S)N(CCNS(C)(=O)=O)C1=O 727175905 CLGNYKYSAWDUCE-XYOKQWHBSA-N 406.938 2.099 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2Cl)cc1C(=O)O 728017749 ZGTAIVYSSFMTAK-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CCN1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 729542484 IIUINYBTKJQXIS-ROUUACIJSA-N 406.546 2.083 10 20 HECD COc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c1 734018436 RDHPHTSHETXIOE-CQSZACIVSA-N 421.519 2.090 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1 734692846 KHBZPDPUHZYPMD-MHZLTWQESA-N 410.879 2.188 10 20 HECD CC(C)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 735194698 GDVCYTLMMLERJX-UHFFFAOYSA-N 412.490 2.208 10 20 HECD CN(C)CCN1C[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 735877592 ICDGNJXHHOZRCX-LJQANCHMSA-N 400.567 2.482 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cc(C(F)(F)F)cnc1O 749731685 XZFGZGHYVDLLOV-UHFFFAOYSA-N 406.411 2.500 10 20 HECD CN(C)C(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 751137431 RJFPXGACQPEUSY-SFHVURJKSA-N 418.515 2.464 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1F 752010026 LLBYVCMVSXAZCC-YCRPNKLZSA-N 419.501 2.192 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4nc(O)oc34)CC2)cc1 752991649 YAXKLCQGNNWMCK-MDZDMXLPSA-N 422.441 2.386 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)CC2)cc1 753926801 WCRDZMZTVMXQCR-OALUTQOASA-N 415.582 2.132 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@@H](CCO)c3ccccc3)CC2)cc1 754052807 ZRGWJQUSCCLQGR-UPVQGACJSA-N 413.562 2.234 10 20 HECD Cc1noc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 754690005 SNWGONRDHZVXJC-MJBXVCDLSA-N 405.474 2.098 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c2C)cc1C 758489237 NZZNLPFTNFXHRT-HNNXBMFYSA-N 406.504 2.375 10 20 HECD COc1ccc(N2CCC(NC(=O)NCC3(O)CCN(C(C)C)CC3)CC2)cc1 761655274 KYKKGXIPZMAOQX-UHFFFAOYSA-N 404.555 2.199 10 20 HECD CCS(=O)(=O)c1cccc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 763375005 YCOUTKMCIRGBMU-UHFFFAOYSA-N 402.516 2.380 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCc1cccc(Br)c1O 765746065 CPJNFOLTFRMORC-UHFFFAOYSA-N 417.281 2.236 10 20 HECD CCc1nnc(S[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 768398067 HNSYTVISBXINGP-NSHDSACASA-N 421.482 2.449 10 20 HECD O=C(NCCc1cccs1)C1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768438892 ADVGFMHIPKGNOP-LJQANCHMSA-N 402.516 2.450 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)cc1F 768722790 UMQKTKJUXIAWEC-UHFFFAOYSA-N 402.455 2.004 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1nc(COc2ccccc2)n[nH]1 771304139 FJSAMFFVRIBCED-UHFFFAOYSA-N 422.489 2.220 10 20 HECD C[C@H]1Cc2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)ccc2N1S(C)(=O)=O 773739341 FOBCIDGYCJKMPQ-OLZOCXBDSA-N 404.488 2.169 10 20 HECD CC(C)CN(C)S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 777972736 YWVYEJIRJQWGBS-UHFFFAOYSA-N 409.474 2.464 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)OCc3ccccc3)CC2)cc1 778393070 XRFHYLJRGQDFME-SEYXRHQNSA-N 409.486 2.490 10 20 HECD COc1ccc(-c2nnc(S)n2CCC(=O)NCc2ccc(O)c(O)c2)cc1 778919369 BHVWKYFCZOWDGG-UHFFFAOYSA-N 400.460 2.360 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3CN3CCCCC3)CC2)cc1 779223683 POBMTDPJMICXMF-PKTZIBPZSA-N 416.610 2.128 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cccc(CN4CCOCC4)c3)c2)CC1 781276121 NGCIMZSZWCNGRO-UHFFFAOYSA-N 422.529 2.440 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cc1 781604447 OFRMYQZAILNMCM-IBGZPJMESA-N 408.568 2.289 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cn1C 783325842 CZQUMPGVKUDYGX-UHFFFAOYSA-N 400.479 2.253 10 20 HECD O=C(OCC(=O)[C@@H]1CCOC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785413355 PJEOTXAPMFLCCP-LLVKDONJSA-N 411.457 2.017 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(C(=O)NC(C)C)cc3)cc2)CC1 786256249 CARSWXTXVUFWSS-UHFFFAOYSA-N 422.529 2.423 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@H](C)N(C)c1ccccc1)c1ccc(N2CCOCC2)cc1 787635734 GAAUJILHRJTQFD-OALUTQOASA-N 424.545 2.342 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc[nH]1 789956918 ZTITUPJXHWAUFO-CYBMUJFWSA-N 424.423 2.364 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c(O)c1 797389060 NDAJSYRIBSIPRI-GJZGRUSLSA-N 413.474 2.269 10 20 HECD C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 800684113 NOHBQKSHZSWSSS-AWEZNQCLSA-N 419.503 2.055 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N(C)Cc1ccccc1 803664269 IWBDNXGPLHBPQL-INIZCTEOSA-N 400.498 2.145 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CC4)CC3)cc2Cl)C1 807953478 UGGHHBWOPHRRRU-INIZCTEOSA-N 418.969 2.499 10 20 HECD COCc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc(C(=O)OC)c1 815445717 GUAPRCWLBKXKMA-UHFFFAOYSA-N 417.437 2.080 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COc1ccc2c(c1)CCC(=O)N2 863946992 CDXZMNDSCWXHHN-UHFFFAOYSA-N 409.486 2.445 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnnn3C3CC3)cc2F)C[C@H](C)O1 917203864 JIBIKNAUFINKBG-STQMWFEESA-N 420.514 2.169 10 20 HECD CCS(=O)(=O)c1cccc(NC(=O)C2=S=C(NC(=O)c3ccco3)C=C2C)c1 1318927820 BRZKOAKRNOYRTF-UHFFFAOYSA-N 418.496 2.437 10 20 HECD CN1CCN(c2ccc(CN3CCO[C@H](CNC(=O)OC(C)(C)C)C3)cc2F)CC1 1320423756 PHQFSSLKCFAPNM-GOSISDBHSA-N 422.545 2.303 10 20 HECD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1)n1cccc1 1810550642 PNWJRTNADROMCK-INIZCTEOSA-N 412.490 2.400 10 20 HECD Cc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817843862 DWSGYUOPDFOWIB-CQSZACIVSA-N 412.406 2.132 10 20 HECD Cc1cnoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820066944 OWZRHOUFZQNZSQ-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD CCO/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428685 BUEUFJXGBLEVKB-FWVUHSSSSA-N 403.479 2.276 10 20 HECD Cc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c1F 1845500726 GZKZMCSHEKOUEY-UHFFFAOYSA-N 422.844 2.063 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCN(Cc4ccccc4)CC3)CC2)cc1 9996792 SXRHJKXJFXKYMY-UHFFFAOYSA-N 408.546 2.162 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(NC(=O)OC(C)(C)C)CC3)nc12 52926533 KJIIRLVAAWOEPY-UHFFFAOYSA-N 419.482 2.101 10 20 HECD COc1cc(OC)c(CNC(=O)CN(C)c2ccc(OC)c(OC)c2)c(OC)c1 63617690 VPAUGMVWVKOXLH-UHFFFAOYSA-N 404.463 2.482 10 20 HECD CN(c1ccc(CNC(=O)c2cnc3[nH]c(=O)[nH]c(=O)c3c2)cc1)C1CCCCC1 109300026 FXJSPGYKKDBQOK-UHFFFAOYSA-N 407.474 2.310 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1 110464580 AEPAPDPBHFBCAE-UHFFFAOYSA-N 404.488 2.414 10 20 HECD COC(=O)c1ccoc1CSc1ccccc1C(=O)N1CCS(=O)(=O)CC1 111093176 CTXYNFMTOOOHKB-UHFFFAOYSA-N 409.485 2.229 10 20 HECD O=C(CN1C(=O)CCC1=O)N1CCN(Cc2cc3oc4ccccc4c3cc2O)CC1 726962515 ZBIZYZVDSBIQER-UHFFFAOYSA-N 421.453 2.085 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)cc2F)cc1C(=O)O 728015622 SZTSTMDTSVCLJF-UHFFFAOYSA-N 422.843 2.350 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCCCC1 729326195 KBNTZGGRBWWVJA-FQEVSTJZSA-N 407.580 2.048 10 20 HECD Cc1cc(C(=O)CN(C)Cc2ccon2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 739931157 QWIHRVHESXQUFE-UHFFFAOYSA-N 402.476 2.044 10 20 HECD O=C(NCCOc1ncccc1F)NCc1ccc(N2CCC(O)CC2)c(F)c1 746795591 INFSRFWWMFSOIG-UHFFFAOYSA-N 406.433 2.199 10 20 HECD CCc1cnc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 747534015 JDOJHSCOSZBFFB-UHFFFAOYSA-N 406.527 2.429 10 20 HECD Cc1cc(C(=O)CN(C)C[C@@H](O)CN2CCOCC2)c(C)n1-c1cccc(F)c1 751485738 PWJIOGDEYPTFTC-HXUWFJFHSA-N 403.498 2.041 10 20 HECD CC1CCN(c2ccc(CNC(=O)NC[C@H]3CCN(S(C)(=O)=O)C3)cc2)CC1 753070141 DNNYLJHFHDUFKT-GOSISDBHSA-N 408.568 2.004 10 20 HECD COc1ccc(C=O)c(OCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753738676 RBCJWCLDFNTJCE-UHFFFAOYSA-N 402.422 2.383 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cnn(Cc2ccccc2)c1 762427971 YCHDOLDXDMYKLJ-UHFFFAOYSA-N 419.485 2.023 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC3C[C@@H](C)O[C@H](C)C3)CC2)cc1 767316914 FSCUMHMHAPCZFU-QZTJIDSGSA-N 404.555 2.463 10 20 HECD COc1cc(O)c(CN2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc1OC 768441902 LMCFWTBMQLHFRN-CALCHBBNSA-N 405.539 2.032 10 20 HECD CS(=O)(=O)c1cccc(C(=O)N2CCN(Cc3cc(Cl)ccc3O)CC2)c1 769452537 WCGHJZXPIKMURC-UHFFFAOYSA-N 408.907 2.407 10 20 HECD COCCC1(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CCC1 771082559 LRDANKHLJMTZQN-UHFFFAOYSA-N 414.506 2.428 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cc(C)cc(C)n3)cc2F)CC1 773236067 NWDQVJSHQYVNRJ-UHFFFAOYSA-N 413.497 2.234 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](c2nc(-c3nc[nH]n3)no2)C(C)(C)C)c1O 775034526 UJDTWJQCEKOARH-ZDUSSCGKSA-N 403.399 2.354 10 20 HECD COc1ccc(O)c(CN2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1 775638384 BXYOITDRGYSDHP-UHFFFAOYSA-N 421.475 2.124 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3csc(C)n3)CC2)cc1 778223167 JFMWZRFXJWIPSO-FPLPWBNLSA-N 414.531 2.024 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCOc3ccccc3)CC2)cc1 778229345 YMSRHFUWPRTTKP-SEYXRHQNSA-N 423.513 2.485 10 20 HECD CCCc1nnc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 778244630 MCCPTGNMWGYIMP-KTKRTIGZSA-N 415.519 2.343 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N=c3cc[nH]cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 781452391 CYUPMXJOPXDPGH-CHWSQXEVSA-N 403.414 2.486 10 20 HECD COCc1cc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ncn1 782142005 NLGIOKKGWFQSIO-UHFFFAOYSA-N 409.469 2.491 10 20 HECD CO[C@@H](C)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 782433140 FWOCAWVFKRXQQP-AWEZNQCLSA-N 422.503 2.283 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 784644079 RQFFEGXQFSBCRE-CQSZACIVSA-N 418.471 2.387 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765531 AAXMWHZRVLZQAT-OAHLLOKOSA-N 406.870 2.370 10 20 HECD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(-c2ccc(F)cc2)n1 785303938 MWEIBYROGFUXFI-GFCCVEGCSA-N 412.421 2.417 10 20 HECD COC(=O)c1c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)sc(C)c1C 785305341 XJIYDGXYRLGFFR-VIFPVBQESA-N 406.460 2.249 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CCc2ccccc2C1=O 790010772 QELGDDCRCQWWGJ-UHFFFAOYSA-N 416.861 2.246 10 20 HECD COc1ccc(CNC(=O)CCCNS(=O)(=O)c2ccc(C)c(C)c2)c(O)c1 794371157 XKANSPHOCBVBCL-UHFFFAOYSA-N 406.504 2.393 10 20 HECD COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(O)c1 794389562 QUMMEYQTZMWGOK-UHFFFAOYSA-N 418.515 2.426 10 20 HECD CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 798153191 MORGWZRRQRZNOX-IBGZPJMESA-N 402.539 2.042 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687649 OMBWWDJYXASMJB-UHFFFAOYSA-N 416.547 2.125 10 20 HECD COc1cccc2c1OCC[C@H]2NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688697 YZVUHTQIMGTUPQ-GOSISDBHSA-N 409.486 2.334 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1csc(N(C)C)n1 806662474 ZTXLQRRIWUPLND-UHFFFAOYSA-N 403.552 2.329 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1 807099269 PPNURMTWHZXJIL-UHFFFAOYSA-N 410.518 2.019 10 20 HECD C[C@H](NC(=O)C(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 807671670 RXBVOSINVRVUII-HOTGVXAUSA-N 418.538 2.303 10 20 HECD Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 808282709 JJDNIHBIPZVFKM-IBGZPJMESA-N 401.532 2.316 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCC[C@@H]2COC(=O)N[C@@H]2CCOC2)c1O 809707708 MGHAXJMGBRTZBK-HUUCEWRRSA-N 409.439 2.179 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nccnc3N)cc2F)C[C@@H](C)O1 812251539 WOCVRRFCAHEMES-BETUJISGSA-N 405.499 2.220 10 20 HECD CC1CCN(c2ccc(CNC(=O)N(C)[C@@H]3CCN(S(C)(=O)=O)C3)cc2)CC1 813634721 TUUUBDXCMLDQEQ-LJQANCHMSA-N 408.568 2.098 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C1(S(C)(=O)=O)CCOCC1 815797245 HZQNFMCJPVLAOO-UHFFFAOYSA-N 420.325 2.097 10 20 HECD CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1nccn1C(F)F 917052295 ZBUPLPMAMVHGEV-UHFFFAOYSA-N 411.428 2.002 10 20 HECD CCO[C@@H](CC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 920672845 KVGFTVULFONAHQ-KHYOSLBOSA-N 410.486 2.414 10 20 HECD CNS(=O)(=O)c1ccc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 1116577613 UMZYGBUUQREPAO-GOSISDBHSA-N 418.515 2.051 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncc(Br)c1 1320141914 FDZMQKMILCWPCT-ZDUSSCGKSA-N 409.236 2.160 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCN1C(=O)COc2ccccc21 1320551411 MPMPMCJMIPIUEL-UHFFFAOYSA-N 424.501 2.090 10 20 HECD CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796604488 LTZJQAKFIQIVBK-BJWYYQGGSA-N 411.458 2.457 10 20 HECD Cc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)cc2n1 1843138321 RSXOIISOECSDKA-UHFFFAOYSA-N 408.414 2.073 10 20 HECD COc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc2c1OCCO2 7103273 DVYUJNNHEHVTJL-UHFFFAOYSA-N 414.458 2.348 10 20 HECD C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)N(C)Cc3ccccc3O)n(C)c2)C1 730278068 KLISGRVUBOWJJU-OAHLLOKOSA-N 405.520 2.424 10 20 HECD CN(Cc1ccc(N(C)C)cc1)Cn1nc([C@@H]2CCS(=O)(=O)C2)n(C)c1=S 732496628 CSHSQNISNHRAOT-OAHLLOKOSA-N 409.581 2.009 10 20 HECD COCC1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CC1 732811984 YXDBLSLEIXKUQE-UHFFFAOYSA-N 419.547 2.283 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1 744380438 RFZIZLALLFGWCI-UHFFFAOYSA-N 407.467 2.181 10 20 HECD O=C(COC(=O)c1c(F)cc(O)cc1F)NCc1ccc(N2CCOCC2)c(F)c1 746986835 OYOVZSRXVFYZPN-UHFFFAOYSA-N 424.375 2.119 10 20 HECD O=C(N[C@H]1CCN(CC2CC2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748039806 AJBCJQLMZXAHAC-HNNXBMFYSA-N 421.544 2.469 10 20 HECD CCCCn1c(N)c(N(CCOC)Cc2cc(F)cc(C(C)=O)c2O)c(O)nc1=O 750817901 XQNRXOSZNMAVBT-UHFFFAOYSA-N 422.457 2.032 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc1 751268879 BRGXCTVVSDTYLK-UHFFFAOYSA-N 406.489 2.104 10 20 HECD CC[C@H](C)OCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 751875969 RVYPZDVLSRJRKE-JYJNAYRXSA-N 410.486 2.414 10 20 HECD Nc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 753884583 ZILRFIGHBJQFLZ-UHFFFAOYSA-N 401.378 2.235 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cc(F)c(F)c(O)c1F 755144228 VJGUKOHODWCPGH-UHFFFAOYSA-N 400.378 2.297 10 20 HECD C[C@](O)(CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 756326544 MVIVZTVTQYMLDI-QHCPKHFHSA-N 407.422 2.495 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCc2cccnc2N2CCC(C(N)=O)CC2)c1 756534483 KXIOHTSKLVVMDJ-AWEZNQCLSA-N 412.490 2.126 10 20 HECD CCc1noc(C)c1C[S@@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 757530037 PZRHEMOGSFFYEM-MUUNZHRXSA-N 405.520 2.152 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNC(=O)c2ccc(O)cc2)cc1 757769143 VHHUPMFRPWYMGJ-NRFANRHFSA-N 411.502 2.396 10 20 HECD COc1ccc(CCN2C(=O)C(=O)N(CN3CCCc4cc(OC)ccc43)C2=O)cc1 766340988 HPRLOPGPEAEQDA-UHFFFAOYSA-N 423.469 2.447 10 20 HECD C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CN(C)CCO1 770124738 ROQSDQBGQUZCEB-RLFYNMQTSA-N 412.481 2.275 10 20 HECD COC(=O)C1CCC(NC(=O)c2cc(C)n(-c3ccccn3)c2C)(C(=O)OC)CC1 770224977 OOIOKFKSQCAMPR-UHFFFAOYSA-N 413.474 2.494 10 20 HECD CCCCn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1C 772436847 PIIMIVVSYOILME-UHFFFAOYSA-N 404.536 2.156 10 20 HECD C[C@@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 773105287 VIMPTPWLNUJJDJ-CABCVRRESA-N 401.960 2.109 10 20 HECD CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1sc2c(c1C(N)=O)CCC2 774754723 XUNSPHYACLPWOI-UHFFFAOYSA-N 400.504 2.239 10 20 HECD COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NCc1ccc(O)c(O)c1 778926918 HFRANMKQOOMVAG-HNNXBMFYSA-N 404.488 2.274 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 779509159 KSMSEOILHZOQEJ-WAPJZHGLSA-N 408.458 2.203 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CO[C@H](C)C3)cc2F)C[C@@H](C)O1 784281302 FLWYIJIESBMZNQ-AIANPOQGSA-N 408.470 2.024 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1 784703155 VCSDNFKGCNHESI-CYBMUJFWSA-N 424.461 2.451 10 20 HECD COCc1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 787507010 ZQRYWCRZCXALNA-FQEVSTJZSA-N 412.486 2.363 10 20 HECD COc1cc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(OC)c1O 789966501 LINMUUMSNCLRFL-UHFFFAOYSA-N 418.465 2.369 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C 790911856 SMUPILFQBBWMKY-QGZVFWFLSA-N 413.522 2.367 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@@]4(CCO[C@H]4C)C3)cc2F)CC1 792077139 WQACAGOMLMSTEU-JTSKRJEESA-N 420.529 2.057 10 20 HECD COc1cc(C)cnc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 792608812 STRRIPLMSJNVIP-UHFFFAOYSA-N 401.463 2.387 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1C 795172306 DXGKLIVTVOTSHL-CQSZACIVSA-N 411.549 2.009 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c(O)c1 797390881 YAYSPQRQGIBYIX-MUUNZHRXSA-N 416.377 2.283 10 20 HECD CC(C)[C@H](NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1nnc2ccccn12 803685502 CCUBUDWLNSPCKG-FQEVSTJZSA-N 420.517 2.241 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)NCCCSc3nccs3)C2)c1 804117899 IIRZWAGJPJCQCL-AWEZNQCLSA-N 420.560 2.145 10 20 HECD Cc1nc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nc2ccccc12 804289205 QEKPXAVKVKLXSM-UHFFFAOYSA-N 401.470 2.247 10 20 HECD COCCCn1ccc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)n1 807512893 ATGQQNUZXLXYNG-UHFFFAOYSA-N 401.250 2.187 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(S(C)(=O)=O)s1 807694952 NDGYOAFHMHVYCB-UHFFFAOYSA-N 424.544 2.302 10 20 HECD Cn1nncc1CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 809296056 FQTWKWSZSRDREN-MDWZMJQESA-N 407.546 2.174 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1COc2ccccc21 809536219 JAZYQJDNJXZUOH-UTKZUKDTSA-N 423.513 2.163 10 20 HECD CCN1CCN(S(=O)(=O)c2cccc(NCc3cc(OC)ccc3O)c2)CC1 809682664 XZKQHFKZMYYZPQ-UHFFFAOYSA-N 405.520 2.339 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NC[C@@H]2N(C)CCCC2(C)C)C2CC2)cc1 809867390 QCAVCSDPQMQBRH-FQEVSTJZSA-N 400.567 2.480 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 816861743 ICBKSKUEYGQVQZ-NGSVIEPNSA-N 408.570 2.426 10 20 HECD O=C(Nc1cccnc1-n1cccn1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918298104 XVONETVVBAIXDH-QGZVFWFLSA-N 421.457 2.119 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1C[C@H]1c1ccc(F)cc1 918340784 VCSCEGQTBAWURA-PMACEKPBSA-N 402.491 2.480 10 20 HECD C[C@H](NC(=O)[C@H](C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O)c1ccc(N2CCOCC2)cc1 920881996 UHYYLVRMGCGHTD-FVCZOJIISA-N 413.518 2.264 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccc(OC)c(F)c1 1320691933 FKNRFTKGYJLPIM-INIZCTEOSA-N 405.422 2.469 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1CCCCNC1=O 1340795746 WLJAVIPNBSVATQ-LJQANCHMSA-N 405.454 2.001 10 20 HECD O=C(C1=COCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429031 NQZHPQPYDBEFFO-QGZVFWFLSA-N 401.463 2.030 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(=O)c4ccccc4o3)CC2)cc1 23471708 WGPPCEJNCTXJEX-UHFFFAOYSA-N 422.437 2.307 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c1 728979862 OZTPMHLILYUZAE-LBPRGKRZSA-N 420.487 2.341 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@](CC)(C(=O)OC)c3ccccc3)nc12 731843446 RREXRFPJVKOQPU-NRFANRHFSA-N 412.446 2.180 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@@H]3CCCC[C@H]3C)CC2)cc1 733571770 PGROVPPAIUCEKM-YLJYHZDGSA-N 404.507 2.482 10 20 HECD O=C(C[C@H]1C=CS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800337 IXBASKLVOHIRCE-KGLIPLIRSA-N 400.447 2.321 10 20 HECD O=C(CNC(=O)OCc1ccccc1)NCc1ccc(N2CCC(CO)CC2)cc1 742807605 KQQILUCQJQWSIK-UHFFFAOYSA-N 411.502 2.438 10 20 HECD CCc1cc(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n(C)n1 743975440 RODOZFLAOMAEDH-AWEZNQCLSA-N 421.448 2.308 10 20 HECD O=C(NCCN1CCCS1(=O)=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 747317771 YSPXORWTUQBBFL-UHFFFAOYSA-N 415.475 2.192 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(N2CCCNC2=O)c1 749730987 IBVBJZZKXFBQPI-UHFFFAOYSA-N 419.532 2.300 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1O 750819979 LLPKJDQZWADDFE-UHFFFAOYSA-N 410.453 2.027 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Cl)c1 751327044 VYMUHBFPLKFUJD-SNVBAGLBSA-N 419.908 2.497 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CN(C(=O)OC(C)(C)C)C1 751805123 VZNWDBDDWBVAKQ-UHFFFAOYSA-N 404.511 2.284 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)c1 755240401 GUVLCPNWICIHLD-UHFFFAOYSA-N 409.446 2.495 10 20 HECD CC[C@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 760913034 SHEMGLJVSTWPPH-PONJGIIJSA-N 423.529 2.377 10 20 HECD O=C(O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)c1 761259272 LYWYPGLLWIJWMI-UHFFFAOYSA-N 410.879 2.353 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccnc(O)c3)cc2F)C[C@@H](C)O1 762849758 RHSIAWSFDIEOFW-OKILXGFUSA-N 417.437 2.013 10 20 HECD Cc1ccc(NC(=O)NCc2cccc(Br)c2O)cc1S(N)(=O)=O 765294846 UDRVOOBEVYNEGM-UHFFFAOYSA-N 414.281 2.432 10 20 HECD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440189 UCISVULOEJYISO-VLIAUNLRSA-N 415.465 2.102 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773110478 DUUDQOPKSWYVSI-OAHLLOKOSA-N 404.536 2.362 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc(C3CC3)nc21 773740770 PDEWQCBKORNGMT-NSHDSACASA-N 424.457 2.167 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1NS(C)(=O)=O 773847095 NXAXNVSFSCYQKK-CQSZACIVSA-N 418.519 2.248 10 20 HECD O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NCc1ccc(O)c(O)c1 778915772 VDTKIRWYLJMFPS-CQSZACIVSA-N 403.822 2.273 10 20 HECD CC(C)c1nc([C@H]2COCCN2C(=O)NCc2ccc(N3CCOCC3)cc2)no1 780824324 VZVYCGXJNCYPPS-GOSISDBHSA-N 415.494 2.313 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCNc2ncc(Cl)cc2Cl)cc1 785427275 BZPWPZNVTZUXQF-UHFFFAOYSA-N 410.305 2.299 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1 787490369 AQXSEMJQOHQKHI-UHFFFAOYSA-N 413.474 2.445 10 20 HECD COC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CCCO1 789381741 HUKTVJWFEWNWMR-RTBURBONSA-N 408.454 2.184 10 20 HECD O=C(NCCC1CCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950805 QQXPKKVRLWZHCL-UHFFFAOYSA-N 413.440 2.465 10 20 HECD CN(C)c1ccc([C@H](CNS(=O)(=O)[C@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 795249365 RUGZIBKNXSYBLJ-IRXDYDNUSA-N 413.540 2.027 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)cn1 795611849 UPBWJOIBIIBXAH-UHFFFAOYSA-N 401.516 2.471 10 20 HECD C[Si](C)(CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 802012335 KIOMRPGRYVYNGE-LJQANCHMSA-N 424.621 2.342 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2C[C@@H](O)c2ccco2)cc1F 803664205 GOWIJQCTABNHCW-MAUKXSAKSA-N 403.454 2.216 10 20 HECD CN(C[C@H](O)C(F)(F)F)C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803677552 QNTSXGLNARVJKY-KRWDZBQOSA-N 415.456 2.453 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803689784 ZVKGMQHFOUYMMJ-IBGZPJMESA-N 422.529 2.089 10 20 HECD O=C(NC[C@@H]1CCC=CO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 805512602 ZWXIWZXTLDULTK-PBHICJAKSA-N 409.433 2.182 10 20 HECD Cc1nccn1CCCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807383811 NIZYHTIMRVTGNB-IBGZPJMESA-N 414.506 2.001 10 20 HECD O=C(NCCCOC(F)F)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770535 LZTCMEDASVBLKY-LBPRGKRZSA-N 421.391 2.119 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCN(C4CC4)CC3)cc2Cl)C1 807953481 UGGHHBWOPHRRRU-MRXNPFEDSA-N 418.969 2.499 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(OC)n1 811970524 DXZMDDCZBUPXFP-UHFFFAOYSA-N 418.469 2.198 10 20 HECD CN(CC(=O)N1CCN(c2cnccn2)CC1)Cc1ccc(N2CCCCC2)cc1 857757326 DLOHCWUVHQRXKC-UHFFFAOYSA-N 408.550 2.248 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CC(=O)N(CC(F)(F)F)C1 917385956 DXOKJZQDHQMUIG-AWEZNQCLSA-N 401.454 2.267 10 20 HECD Cc1nnc(S[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1N 917768358 LIKUXHKVSKGONQ-JTQLQIEISA-N 407.455 2.195 10 20 HECD Cc1nc2c(cc1C(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)c(C)nn2C 917834664 MULLHSXPZSYGHX-QGZVFWFLSA-N 420.517 2.217 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(CN2C(=O)CCC2=O)cc1 919772465 DQSIQULKSIWWLW-UHFFFAOYSA-N 422.485 2.494 10 20 HECD CCn1cc(-c2nn(C)cc2C(=O)N2CCCc3c2cccc3S(C)(=O)=O)cn1 1321469767 GIWGMXYTQJUWFA-UHFFFAOYSA-N 413.503 2.300 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NC3CCC4(CC3)OCCO4)CC2)cc1 1341189153 WOQMHMXOOPZHDX-UHFFFAOYSA-N 403.523 2.009 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)C1=COCCC1 1804291515 KSDPYXTWRILUSX-BJKLQHCMSA-N 414.458 2.149 10 20 HECD CCc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)no1 1810546319 BSQDXOVLGKXMPV-UHFFFAOYSA-N 414.462 2.202 10 20 HECD Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817419365 RSQPMWUVRVCJNP-LLVKDONJSA-N 414.443 2.390 10 20 HECD CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)CCO2 1839348321 NMAIXNYNZLKODE-HSZRJFAPSA-N 411.502 2.184 10 20 HECD CS(=O)(=O)Nc1cccc(CNCc2ccc(N3CCC(O)CC3)c(F)c2)c1 727468020 FHLFXBCTEGNXJJ-UHFFFAOYSA-N 407.511 2.448 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCOc2ccccc21 728189016 ZAIJHNPFOKEZMT-LJQANCHMSA-N 400.500 2.104 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN(CC(=O)N(C)C3CCCCC3)CC2)cc1 728593343 UZAVZAHZZDRNNL-UHFFFAOYSA-N 415.582 2.371 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(CCCO)CC(C)(C)C)CC2)cc1 730123897 YODIKAKUDXYVSL-UHFFFAOYSA-N 406.571 2.257 10 20 HECD CCN(CC)Cc1ccccc1CNC=C1C(=O)N(CC)C(=S)N(CC)C1=O 730995758 SPDMRFNASCKPID-UHFFFAOYSA-N 402.564 2.497 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)c3ccc(C)cc3)CC2)cc1 742939971 NQSZZMDQGPSHHF-JOCHJYFZSA-N 412.534 2.158 10 20 HECD CNC(=O)[C@@H]1CCCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 744386898 GRYZJRSLHQQWDQ-IBGZPJMESA-N 405.454 2.001 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 750959986 NTOUYTHUXQAVSH-UHFFFAOYSA-N 401.419 2.340 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnnn3C3CCCC3)CC2)cc1F 753739816 VJAUMFCLDFOHDL-UHFFFAOYSA-N 420.514 2.377 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNc2ccccc2C(N)=O)cc1 754295455 WNUGQDSOOXBRCB-LJQANCHMSA-N 410.518 2.471 10 20 HECD C[C@@H](N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc(F)ccc1O 756713008 UGHMZKYPEQQMPA-NVXWUHKLSA-N 401.486 2.478 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 758231331 LLKYIFAZRMCKJB-SFHVURJKSA-N 405.426 2.304 10 20 HECD COc1cc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc(OC)c1OC 760086289 SZBZERNHNNCZRR-UHFFFAOYSA-N 417.418 2.289 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1 765823014 QYOBFQHQVMYIGU-JXFKEZNVSA-N 412.486 2.300 10 20 HECD COc1ccc(O)c(CNC(=O)C2(C(=O)NCc3cc(OC)ccc3O)CCC2)c1 769529778 UNDOMFVGUXJEDR-UHFFFAOYSA-N 414.458 2.218 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccnc1Cl 774145140 IKARMBWWZWNDPC-UHFFFAOYSA-N 402.882 2.199 10 20 HECD CCc1ccc([C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N(C)C)cc1 774952521 YGPAJYAUOVLEPW-OAQYLSRUSA-N 414.525 2.489 10 20 HECD O=C1[C@H]2CSCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1C(F)(F)F 777607082 XEBWDWCDBJYIOY-CQSZACIVSA-N 401.410 2.379 10 20 HECD Cc1nc(Cn2cc(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)nn2)no1 782626797 QESQUYDPYYDZCJ-UHFFFAOYSA-N 414.381 2.046 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CCS(=O)(=O)NC)c2C)cc1 783189160 MKRAIZVBOMMXSL-UHFFFAOYSA-N 422.503 2.158 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc4c(c3)CCC4)cc2)CC1 786122571 UFVNFPZQDJRCMG-UHFFFAOYSA-N 413.543 2.322 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc2c1OCCCO2 788931252 CNFARZRXSROVQQ-UHFFFAOYSA-N 409.486 2.381 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCc3c2cnn3C)cc1F 789587760 JWQDMXOJBBLIOT-QGZVFWFLSA-N 401.486 2.215 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@@H]1C1CCCC1 789800801 OTOIKCVNWLQZIF-LJQANCHMSA-N 403.498 2.460 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC(C)(C)C3)cc2F)C[C@@H](C)O1 789822075 VNPWKXGPBZHIEJ-GASCZTMLSA-N 423.554 2.410 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc1 799763828 HEIRWCREPFXTRZ-UHFFFAOYSA-N 417.531 2.298 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1F 804852141 AJLSZKBNINAYLR-MRXNPFEDSA-N 406.546 2.477 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 806281984 DGWQTXVHTMAZPX-CQSZACIVSA-N 413.565 2.324 10 20 HECD Cn1cc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(-c2ccccc2)n1 806775378 YUZPDEZRJRFVGB-UHFFFAOYSA-N 415.497 2.396 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COCCN1CC(F)F 806951035 ZHFCRMXIBSDSBC-CJNGLKHVSA-N 419.419 2.339 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1(C)C 809127614 RGPSOLIJIYKXHF-TVTNDZMWSA-N 404.507 2.220 10 20 HECD CC(C)N1CCN(c2cccc(NS(=O)(=O)c3ccc(N(C)C)nc3)c2)CC1 811824630 JTVQOMSDVQIFMB-UHFFFAOYSA-N 403.552 2.479 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1 815010947 UJAXLZZIHBNFQQ-UHFFFAOYSA-N 418.441 2.395 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCN(c3ccccn3)CC2)c1 915794943 BBYBNWKORUJHQB-UHFFFAOYSA-N 410.518 2.144 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC(C(=O)NCCCN3CCCC3)CC2)cc1 915927712 ULOCZAOXLHAWDQ-UHFFFAOYSA-N 415.582 2.276 10 20 HECD CC(C)(CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(N)=O 918603405 ZLKPMQTVDHFPNP-XFXZXTDPSA-N 411.574 2.357 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H]3COc4ccc(F)cc4C3)CC2)cc1 1336104822 IXQJDROWPAMGRB-GOSISDBHSA-N 413.493 2.324 10 20 HECD CC/C=C(\C)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509964 DKOFMZMAGLMYMD-OLILSUDDSA-N 416.474 2.003 10 20 HECD Cn1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)c1 1787521306 OVOUGYMWTBKRJS-UHFFFAOYSA-N 407.430 2.288 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CC(N)=O)cc1 1847855901 TZPHATRTKFQGER-JHVJFLLYSA-N 422.529 2.421 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnc4cc(C)ccn4c3=O)cc2F)CC1 303267790 FFBNPUMHRDNFNS-UHFFFAOYSA-N 423.492 2.214 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](C)Cn3cccn3)cc2F)CC1 303291162 KZIONFNMIFHBDL-KRWDZBQOSA-N 402.518 2.300 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OC)c3)cc2F)CC1 730390164 FDWZGQUUCUDGED-UHFFFAOYSA-N 414.481 2.231 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)cc3)cc2F)CC1 730391508 OLAMJIFXFOKIKW-UHFFFAOYSA-N 402.445 2.362 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)c(C(N)=O)c3)cc2)CC1 731131309 JVSLLQBJKLLDOX-UHFFFAOYSA-N 412.465 2.416 10 20 HECD NC(=O)[C@H]1CC(C(=O)NCCCSc2nccs2)=NN1c1ccc(F)cc1 733880166 ANSVKFCYQWNWCC-CQSZACIVSA-N 407.496 2.001 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3[C@@H]4CCO[C@H]4C3(C)C)CC2)cc1 741284656 XUKSRRDHHVEKDZ-PWRODBHTSA-N 416.566 2.320 10 20 HECD CCN(C)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 746054410 RWTMTRXQSCUGHN-UHFFFAOYSA-N 405.448 2.374 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 747929223 NXIJRVYPOBQQFK-UHFFFAOYSA-N 410.224 2.273 10 20 HECD Cc1noc(CCCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 748039279 XDVRZVSCXHSCIP-UHFFFAOYSA-N 422.488 2.309 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)NCCCSc3nccs3)cc21 749730945 HFVUXZHKYBVECR-UHFFFAOYSA-N 419.532 2.376 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3csc([C@@H]4CCCO4)n3)nc12 756461507 JSPIRMNZHQBUAB-ZDUSSCGKSA-N 418.431 2.277 10 20 HECD COc1cc(N2CCN(Cn3cnc(-c4ccccn4)n3)CC2)cc(OC)c1OC 758963958 KBYTXQKNRSGGMI-UHFFFAOYSA-N 410.478 2.146 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1 762000252 LOJXFYURWRNJPP-UHFFFAOYSA-N 418.468 2.491 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3C(C)(C)O)cc2F)C[C@@H](C)O1 764355780 JMVFCKDYDIMLDC-GQIGUUNPSA-N 407.530 2.291 10 20 HECD NS(=O)(=O)c1cc(NCc2cccc(Br)c2O)cc([N+](=O)[O-])c1 764935362 RXNCDNLSDJSWPP-UHFFFAOYSA-N 402.226 2.322 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnc(Cl)c(Br)c1 768225690 VBAZMDBDTHZKHT-UHFFFAOYSA-N 414.643 2.206 10 20 HECD COc1cccc(C[C@H](C(=O)N[C@H](C)c2cc(OC)ccc2O)n2nnnc2C)c1 768912134 WDFJNPSBTQMVIG-BFUOFWGJSA-N 411.462 2.366 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)cc1 778307290 PUEXTIHBSJUUJR-IENJSVCTSA-N 423.513 2.270 10 20 HECD O=C(CN1CCC(O)(C(F)F)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 778309767 WCSYVHACGLRQFV-UHFFFAOYSA-N 414.408 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3ccc(O)cc3)CC2)cc1 778318452 HBOCSPBGMJYNGK-QXMHVHEDSA-N 409.486 2.264 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(Cc3nc(COC)no3)CC2)cc1 780310695 OOQUNIZTRUPEOJ-UHFFFAOYSA-N 416.526 2.090 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3C)c2)CC1 780407962 SAWLCXGZDWDSGR-UHFFFAOYSA-N 418.475 2.373 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(NC(C)=O)ccc3C)nc12 781425634 SPIIAJZLGCAMTC-UHFFFAOYSA-N 412.402 2.235 10 20 HECD CC(C)[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 785444637 SNUPNCVOSGKOCU-QGZVFWFLSA-N 406.527 2.034 10 20 HECD Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 787029774 YEPFZWBXUQFZLZ-UHFFFAOYSA-N 420.557 2.460 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](c3ccc(F)cc3)N(C)C)ccc21 787637016 JKQANWAZMUPZLF-OAQYLSRUSA-N 412.509 2.243 10 20 HECD Cc1nccn1-c1ncccc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933604 QWVOIXNPTOSSFF-UHFFFAOYSA-N 418.501 2.109 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccccn3)cc2F)C[C@@H](C)O1 789816717 FHBSBCCMVOPXPN-IYBDPMFKSA-N 414.481 2.109 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2COC(=O)N[C@@H]2CCOC2)cc1 796623545 LWVHFKMVZONMPM-IEBWSBKVSA-N 404.511 2.332 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](S(N)(=O)=O)C3)cc2Cl)C1 799993990 MTORUXNVYIFTQR-HIFRSBDPSA-N 414.959 2.149 10 20 HECD Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803301531 SOAVFYCSQXHYQV-HUUCEWRRSA-N 414.506 2.225 10 20 HECD Cc1ncsc1CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304561 CFOWXATWYXVKOR-CQSZACIVSA-N 402.520 2.124 10 20 HECD C[C@@H](CO[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803676432 IGZPPICEKOYLEQ-LAUBAEHRSA-N 417.550 2.382 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C[C@@H](N1CCOCC1)C(F)(F)F 804185098 JUMMAFHVGGXFQK-CQSZACIVSA-N 421.803 2.073 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)N3CCC[C@@H](C)C3)CC2)cc1 804318272 GCFHGMYNSBBOGI-QZTJIDSGSA-N 416.566 2.017 10 20 HECD CCOc1ncccc1-c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809464164 ATHKQASWGPAZTM-UHFFFAOYSA-N 423.473 2.430 10 20 HECD CS(=O)(=O)N1CCN(CCN[C@H](CCc2ccccc2)c2ccccc2O)CC1 815576244 MUSKUZPXJQPFPB-OAQYLSRUSA-N 417.575 2.233 10 20 HECD CS(=O)(=O)N1CCN(c2ccc(NCc3cc(Cl)c(F)cc3O)cn2)CC1 816564037 RSRKWZFWOFRHJX-UHFFFAOYSA-N 414.890 2.273 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)cc1 916197217 XONIQEFWTNVPSO-FPOVZHCZSA-N 415.582 2.133 10 20 HECD CC(C)C(=O)N1CCC(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 919969367 WRHMARREFFCIBB-UHFFFAOYSA-N 401.551 2.406 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3ccccc3NS(C)(=O)=O)CC2)cc1F 1252749344 YJIBUJSAHPITTP-UHFFFAOYSA-N 421.494 2.097 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)COc1ccccc1[N+](=O)[O-] 7101072 GPBFHASRUFSVKO-UHFFFAOYSA-N 401.419 2.241 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)c(OCC(=O)N(C)C)c1 57124406 XKTRGOJVBGCBQF-UHFFFAOYSA-N 406.489 2.268 10 20 HECD Cc1c(CNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)n(C)c2ccccc12 471287437 JSXSBWDVOYBUAB-UHFFFAOYSA-N 407.474 2.414 10 20 HECD CN1CCCc2cc(CNS(=O)(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)ccc21 728294375 BYZGKOVEUMSQLL-UHFFFAOYSA-N 419.459 2.227 10 20 HECD NC(=O)[C@@H]1CC(C(=O)NCCCSc2nccs2)=NN1c1ccc(F)cc1 733880162 ANSVKFCYQWNWCC-AWEZNQCLSA-N 407.496 2.001 10 20 HECD CN1CCC(N2CC[C@H](NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)C2)CC1 734281463 KXVGHJKJRDGKHL-FPOVZHCZSA-N 416.566 2.251 10 20 HECD CCNC(=O)c1cccc(NC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)c1 741735825 NFYOANYMLDLZEO-UHFFFAOYSA-N 410.518 2.343 10 20 HECD Cc1cc(C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1-c1ccc(Cl)cc1 742181067 SCWXFMPTUWGDHF-UHFFFAOYSA-N 410.923 2.417 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)cc1F 743599644 VUANXZPFEYPGKN-QGZVFWFLSA-N 416.501 2.319 10 20 HECD CCOC(=O)c1c(NC(=O)C(=O)NCc2cc(OC)ccc2O)sc2c1CCC2 743909497 CYYLTRBQEHNHGM-UHFFFAOYSA-N 418.471 2.383 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC(N(C)CC(F)F)CC3)CC2)cc1 746480894 CGBKQRUZKPRDQB-UHFFFAOYSA-N 410.509 2.005 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(CC)c([N+](=O)[O-])c3)nc12 747013915 VVVBECGPIVUHIW-UHFFFAOYSA-N 414.374 2.439 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3c(CC)noc3CC)nc12 756471270 RXGBYJIAMSDZOY-UHFFFAOYSA-N 402.407 2.010 10 20 HECD CCc1noc(C)c1C[S@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 757530038 PZRHEMOGSFFYEM-NDEPHWFRSA-N 405.520 2.152 10 20 HECD CC1(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)OCCO1 759236519 FFRSIDCCXWROJY-UHFFFAOYSA-N 417.428 2.494 10 20 HECD C[C@H](C[C@H](O)c1ccco1)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 759568346 MSZUNQWRFZYZRT-AYBZRNKSSA-N 414.506 2.293 10 20 HECD COc1cc(N2CCN(CC(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)cc(OC)c1OC 759887808 XILKPXSUGOXVIW-IRXDYDNUSA-N 405.539 2.339 10 20 HECD COCc1nc(SCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n[nH]1 761868177 UZRNETBSGMDZAV-STQMWFEESA-N 423.514 2.112 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)ccc1Br 762264490 ZZUVYNVXTUNNFZ-UHFFFAOYSA-N 414.277 2.236 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 764915077 KOGMEBDPRUHFDZ-GOSISDBHSA-N 421.563 2.492 10 20 HECD C[C@@H](C[S@@](C)=O)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768448959 QIKTVMXYGHZMEC-JPQMIFPKSA-N 416.546 2.094 10 20 HECD CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NCc1ccc(O)c(O)c1)C2=O 768913797 CBHUTZHPORRFMB-UHFFFAOYSA-N 403.479 2.241 10 20 HECD CC[C@H]1CN([C@@H](CC)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCO1 773979987 RDGDWVXNDQAQHV-VXKWHMMOSA-N 403.567 2.401 10 20 HECD CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccc(O)c(O)c1 779488962 KAOIEZDYFIVLIO-YCRREMRBSA-N 411.458 2.045 10 20 HECD CN(CCN1CCN(C(=O)OC(C)(C)C)CC1)C(=O)/C=C\c1ccc(O)c(O)c1 779511759 KGKHTFZHZCTUAE-VURMDHGXSA-N 405.495 2.122 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC([C@@H]4CCCO4)CC3)CC2)cc1 784361106 FQLWSXAJEKDTTQ-GGAORHGYSA-N 403.567 2.069 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)N1CCc2ccc(Br)cc21 785298587 WMOJXTIADZYFTH-NSHDSACASA-N 419.275 2.497 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ccnc(-n3cccn3)c2)cc1 787242220 ODROBNZZHDXSQU-UHFFFAOYSA-N 420.517 2.388 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1 789802466 ZXPXABKXYOHUTB-OAHLLOKOSA-N 417.456 2.338 10 20 HECD CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)ccc2[nH]1 792354748 BQVDBFCNUHQHCH-ZDUSSCGKSA-N 407.474 2.409 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c(O)c1 797387939 QYULSVNRZMANOP-UHFFFAOYSA-N 401.488 2.209 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(Cc1ccsc1)c1cccnc1 799326323 KEIBCWPPQOQFPG-UHFFFAOYSA-N 400.485 2.174 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCCCO1 802017627 UKOIUHCHCGCQFG-UHFFFAOYSA-N 400.458 2.179 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803306312 TZNDHJCDSPQCKV-LZFQIVBZSA-N 403.523 2.020 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(N(C)C)n2)cc1F 804851485 DBWIJDIMXPWPBV-UHFFFAOYSA-N 401.486 2.066 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2csc(N(C)C)n2)cc1F 804852676 LVWMHIGQQHRZHU-UHFFFAOYSA-N 407.515 2.127 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807673026 LSTMICRPQBWYPP-CQSZACIVSA-N 404.536 2.370 10 20 HECD CC[C@]1(C)NC(=O)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1=O 849366242 USYKGHPFMJMOBV-QFIPXVFZSA-N 405.410 2.121 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)[C@@]34CCC(=O)N3CCS4)cc2F)C[C@@H](C)O1 917709820 GEQWHTQMDZSQTP-MNVSYLFESA-N 407.511 2.121 10 20 HECD COc1ccc(N2CCCN(C(=O)c3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 917822154 AIICSVSSRXTCLX-UHFFFAOYSA-N 422.485 2.100 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3C(=O)NC3CC3)cc2F)C[C@@H](C)O1 918220163 HJHKCGJHSWQPIY-QEEYODRMSA-N 418.513 2.392 10 20 HECD CCOc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284636 LMRAVRLKTGBONU-UHFFFAOYSA-N 419.428 2.455 10 20 HECD NC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccs1 919969157 GHWLABRWHFGBLF-INIZCTEOSA-N 420.510 2.264 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N2CCN(c3ccc(OCC)cc3)CC2)C1 1319715413 RROPQSRBNNKJBR-RBUKOAKNSA-N 417.550 2.398 10 20 HECD CN1CCN(c2ccc(CN3CCS(=O)(=O)c4ccccc4C3)cc2F)CC1 1338341265 PXUXRNBKFYZTMA-UHFFFAOYSA-N 403.523 2.367 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)CCCC(=O)N2 1342915656 JLOAPAJNZRWXQX-KRWDZBQOSA-N 412.442 2.277 10 20 HECD C[C@@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1521771528 YOIHICRWWXRKQT-MRXNPFEDSA-N 406.502 2.110 10 20 HECD CCOC(=O)C1=S=c2nc(NC(=O)c3ccc(C(=O)OCC)cc3)sc2=C1C 1527316803 MVMFCJDBVCGBQY-UHFFFAOYSA-N 418.496 2.476 10 20 HECD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c[nH]1 1782005659 TWQNUCZYDCLFMF-HXUWFJFHSA-N 419.865 2.145 10 20 HECD Cc1ccccc1OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1795723794 VHQHGRKDKBOEFS-BJWYYQGGSA-N 411.458 2.132 10 20 HECD C[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)CCCN1 1800004820 SOWLLTGVAKPUIC-MWBIGIAMSA-N 407.898 2.145 10 20 HECD CC(=O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1806250618 SDSNLXXPMQJIBN-DYVFJYSZSA-N 417.849 2.055 10 20 HECD CC(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826299480 QLSRUGHGKYYNAL-DBWMJRBXSA-N 416.474 2.025 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H](O)c2ccccc2)C1 1842792173 IKAPVRXJEQCEHK-KRWDZBQOSA-N 416.861 2.302 10 20 HECD CCN(Cc1ccccc1)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 726236772 RGOPZMMQILLZIQ-UHFFFAOYSA-N 410.518 2.371 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)CCC3CCCC3)cc2)C1 726527689 SHWIMPZIDBMBTR-LJQANCHMSA-N 414.550 2.091 10 20 HECD COc1ccc(N2CCC(NC(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)cc1 726708412 NCRLLRCFKNZKLH-UHFFFAOYSA-N 422.485 2.259 10 20 HECD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 728948500 BJSVMHARTYFMFW-OLZOCXBDSA-N 407.492 2.430 10 20 HECD COc1cccc(CNC(=O)CCCNS(=O)(=O)c2ccc(C)c(C)c2)c1O 729859491 QYFBNUURZBKQBC-UHFFFAOYSA-N 406.504 2.393 10 20 HECD O=C(COC(=O)COC1CCOCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 735357482 BRVKATWHUVMYLU-UHFFFAOYSA-N 423.421 2.139 10 20 HECD O=S(=O)(NCCCSc1nccs1)c1ccc(Cl)c(-c2nn[nH]n2)c1 746404673 MUDFXGJNUJEATL-UHFFFAOYSA-N 416.941 2.437 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C/c3ccccc3)n3nnnc3C)CC2)cc1F 753742119 PGEUGHLEVPTEEE-ZHZULCJRSA-N 422.464 2.476 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@@H]3CCN(C)C[C@H]3C)CC2)cc1 754365164 XGBLXBAMANEUHK-DENIHFKCSA-N 417.598 2.189 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccnc(O[C@@H]4CCOC4)c3)CC2)cc1F 754417883 VKWRVYBJALNFDM-QGZVFWFLSA-N 401.438 2.359 10 20 HECD COc1cc(N2CCN(Cc3cc(=O)n4cc(C)ccc4n3)CC2)cc(OC)c1OC 759871930 DMUBQNJCNKLLCJ-UHFFFAOYSA-N 424.501 2.351 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](N(C)C)CC3)cc2F)C[C@@H](C)O1 759978426 VKKKKQDXTBKLGK-QWFCFKBJSA-N 420.573 2.472 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2cccc(Br)c2O)cc1 766201377 RNZIMGVIQSTDFA-UHFFFAOYSA-N 420.306 2.037 10 20 HECD O=C(NCc1ccc(F)cc1)C1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440019 QYZNNVODIFLSBU-HXUWFJFHSA-N 400.450 2.486 10 20 HECD C[C@@H](O)C[C@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 774176083 AUXHAZQMECHIIW-UTKZUKDTSA-N 417.550 2.070 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@]2(C1)C(=O)Nc1ccccc12 777466246 VNZPDBCTCMPFLM-HSZRJFAPSA-N 406.486 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCOC4(CCC4)C3)CC2)cc1 778390213 YKFICENQEJTSFF-JTHGQSKGSA-N 413.518 2.118 10 20 HECD CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 781476569 DZRUGQJEJRBEAH-UHFFFAOYSA-N 405.401 2.462 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@H](S(=O)(=O)NC4CCCC4)C3)cc2)CC1 781921069 RPFKADCGBYCXIE-QFIPXVFZSA-N 420.623 2.265 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1 785298543 VSZICGHFGBZZDC-CYBMUJFWSA-N 408.414 2.366 10 20 HECD CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785438724 HGVGBJOZPXUHSB-UHFFFAOYSA-N 418.488 2.237 10 20 HECD C[C@H](NC(=O)C(=O)NCCO[C@H]1CCCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 787991191 SYIDNIVFPLIOOH-WFXMLNOXSA-N 417.550 2.412 10 20 HECD CCCCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1(C)C 788314183 ZOUYEHSCDYYQGP-VQTJNVASSA-N 417.550 2.239 10 20 HECD CCCN(CC)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789950257 NABWWEZKGZGFCO-UHFFFAOYSA-N 401.429 2.417 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)NCC1(S(C)(=O)=O)CC1 793267833 XNFVKQZSEIFTOA-UHFFFAOYSA-N 405.314 2.263 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C3=NN(CCO)C(=O)CC3)cc2Cl)C1 800570814 VPNNWZRSJJEOTD-AWEZNQCLSA-N 406.914 2.163 10 20 HECD CCN(CCOCCO)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 800710318 SFNBSPDESNMCEA-HNNXBMFYSA-N 401.454 2.297 10 20 HECD C[C@H](NC(=O)C(=O)NCCc1cc(F)ccc1F)c1ccc(N2CCOCC2)cc1 803296501 DJVXJUIBGAABIH-HNNXBMFYSA-N 417.456 2.338 10 20 HECD CC[C@H]1COCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449209 RJWOPOAXZJSYIH-HNNXBMFYSA-N 411.449 2.010 10 20 HECD CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 803662326 AUZSIOJOAMGNSQ-WBVHZDCISA-N 420.529 2.051 10 20 HECD CC(=O)NCC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457572 OPDJDRXVPPXQLI-QGZVFWFLSA-N 420.529 2.235 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc2nccnc2c1 807387224 DSVMHBPLQVDLQC-UHFFFAOYSA-N 401.220 2.353 10 20 HECD C[C@H](C(=O)NC1CC1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 915227493 YGMNZGJYXLMDKK-QGZVFWFLSA-N 415.538 2.370 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c[nH]nc3-c3ccccc3)nc12 919040691 DTUZENOKBHEWDH-UHFFFAOYSA-N 407.386 2.359 10 20 HECD CCOC(=O)c1c(C)[nH]c(C(=O)N[C@@H](Cc2ccc(O)c(O)c2)C(=O)OCC)c1C 1320274425 SNRUARXGHWVXLK-AWEZNQCLSA-N 418.446 2.124 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)CC2)cc1 1320395321 URVWATMAXMPADD-SFHVURJKSA-N 408.502 2.178 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@@H]1CCCCO1)c1cc(O)nc(O)c1 1798480196 VOTVJCWNFACVDW-NXEZDXNNSA-N 421.519 2.004 10 20 HECD C[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769458 MZZCXMXHQAMFBF-UDUPSFLGSA-N 422.909 2.391 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCS1 1803331921 SMVLDQLLQNKPJP-RGYYZVTFSA-N 418.515 2.350 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccnc(F)c2)C1 1841724703 JEFCXEAHQZRWKH-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COc1ccc(/C=C(\C)C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1 1843250830 SCVKSWKYHVZAMR-XNTDXEJSSA-N 423.469 2.422 10 20 HECD CC(C)N1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502461 ASUHQTQNVHVBMK-INIZCTEOSA-N 421.925 2.441 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)Cc3cccc(F)c3)CC2)cc1 12069052 MIJAJLPQJTWGGB-UHFFFAOYSA-N 421.538 2.466 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 65715839 QATKXDVHRWWOET-OAHLLOKOSA-N 410.474 2.298 10 20 HECD Cn1cc(-c2ncc(/C=C3/CCn4c3nc3cc(C(=O)O)ccc3c4=O)cn2)cn1 530528926 RTBYZVXOYLRMAN-MLPAPPSSSA-N 400.398 2.230 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCN1CCOCC1 733996773 WOGHTLRGSLRRMF-MRXNPFEDSA-N 421.497 2.053 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2c(Cc3ccccc3)nnc2C1 741795001 MYRQUOFLORPIEO-UHFFFAOYSA-N 418.545 2.409 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(Cn2cncn2)cc1 743957869 DYQMEPWIFTXXIC-UHFFFAOYSA-N 405.458 2.166 10 20 HECD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 743958040 INGKGIPDONVIOK-UHFFFAOYSA-N 416.499 2.320 10 20 HECD Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 753340326 CEUFVOVFDQLUBW-INIZCTEOSA-N 422.503 2.365 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)co2)cc1 753964392 OFBSNTJCXJHSHH-UHFFFAOYSA-N 402.450 2.019 10 20 HECD CN1C(=O)CCc2cc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)ccc21 758576160 LCVIQPKXAKIXAR-IBGZPJMESA-N 420.513 2.227 10 20 HECD COc1cc(N2CCN(Cc3nc4ccccc4c(=O)n3C)CC2)cc(OC)c1OC 759887492 VKEJWKYJZCOSKA-UHFFFAOYSA-N 424.501 2.282 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1=Cc2cc(F)ccc2OC1 761373821 ZTOALZGJTHMVTC-UHFFFAOYSA-N 416.474 2.153 10 20 HECD O=C1[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCN1CC(F)(F)F 761735718 IERFYDZPTYTAHO-LBPRGKRZSA-N 419.787 2.363 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(CO)CC3)cc2F)C[C@H](C)O1 762626487 WUYLLTOONKCGPJ-IRXDYDNUSA-N 407.530 2.150 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1 764253493 JDYOUAPDNHVNCP-UHFFFAOYSA-N 415.515 2.118 10 20 HECD CCOC1CC(CNC(=O)NCc2c(O)ccc3c2CCCC3)(N2CCOCC2)C1 767895130 DMFWOSLYZLGMJQ-UHFFFAOYSA-N 417.550 2.340 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1 768723350 XPXUAGWXGSEEHS-UHFFFAOYSA-N 405.336 2.247 10 20 HECD COc1cc(CN(C)Cc2ccccc2O)ccc1OCC(=O)N1CCOCC1 768872981 NUQSVQPXRHBJCJ-UHFFFAOYSA-N 400.475 2.270 10 20 HECD CN1CCN(c2ccc(CN[C@H]3CN(Cc4ccccc4)CC[C@@H]3CO)cc2)CC1 771841815 LPSAJVTYXNGCHD-NOZRDPDXSA-N 408.590 2.411 10 20 HECD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 773747705 FJIMYXWSKHURJM-LBPRGKRZSA-N 410.467 2.285 10 20 HECD Cc1cc(C(=O)CN2CCSC[C@@H]2CO)c(C)n1-c1ccc2c(c1)OCCO2 784241088 LZMJNNLAEIAHGL-KRWDZBQOSA-N 402.516 2.458 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C)nn4c(C)cc(C)nc34)cc2)CC1 786656798 RNZAKYMDDQJYFQ-UHFFFAOYSA-N 420.517 2.253 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCOc2ccccc21 788321040 SHLSAIHOBMBPBT-HXUWFJFHSA-N 409.486 2.170 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(-c2ccoc2)n1 789905629 OPOXPTGINGDZBZ-INIZCTEOSA-N 407.474 2.312 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1 797673365 BIZGFFOGXYGCFR-UHFFFAOYSA-N 403.508 2.254 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C12CCC2 804318380 JESFBEMINZFDPX-WOJBJXKFSA-N 415.534 2.244 10 20 HECD CCNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806457022 BUZQBUSPXVNFFC-QGZVFWFLSA-N 422.501 2.473 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1C(F)F 807387425 JSANDHLLZIJVHE-UHFFFAOYSA-N 403.183 2.081 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN([C@@H](C)c2cccnc2)CC1)c1ccc(N(C)C)cc1 807673007 LLDKOGGKKGDCMO-ROUUACIJSA-N 409.534 2.230 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@H]3CCO[C@@H](C)C3)CC2)cc1 807973774 YWDKADVBDFMLST-ROUUACIJSA-N 403.523 2.055 10 20 HECD COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 914903543 NSNQJFPEJCRDAT-INIZCTEOSA-N 413.474 2.446 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(-n4cncn4)nc3)cc2F)C[C@@H](C)O1 918141039 RLTDXGAGORFATN-GASCZTMLSA-N 410.453 2.345 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC(=O)N(C2CCCC2)C1 919970865 GWFPGSMOLIAWLM-MRXNPFEDSA-N 403.498 2.194 10 20 HECD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC3CCCC3)C[C@@H]21)c1cc(O)nc(O)c1 1787291461 FNUHZKIGGNUZNI-SZMVWBNQSA-N 417.506 2.057 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)C2CCC2)CC1 1826249520 LOVSGLPKYHSEEJ-MRXNPFEDSA-N 423.604 2.267 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 65277594 BOONXOMUAOQSBP-HNNXBMFYSA-N 404.488 2.349 10 20 HECD CNC(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 728520417 DBEVWCRVKJFTJH-UHFFFAOYSA-N 404.417 2.441 10 20 HECD CCN(C)C(=O)c1cccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 729347992 SMHGSGJTHUAGIC-UHFFFAOYSA-N 424.545 2.339 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1 734074894 XPBMICYZGQFNTI-SFHVURJKSA-N 400.431 2.214 10 20 HECD COCCNS(=O)(=O)c1ccc(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 743213419 ZKGKCNLQSUBNQF-ZDUSSCGKSA-N 423.491 2.208 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccnn1C1CCCCC1 743897167 OAGRLQSUSMEKIJ-UHFFFAOYSA-N 411.506 2.480 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)n(C2CCOCC2)n1 746421844 IKBCYUCJXNLVEB-UHFFFAOYSA-N 412.490 2.382 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N(C)C)c(F)c2)n([C@@H]2CCS(=O)(=O)C2)n1 746759242 DHZQKCKKIOCLJX-CQSZACIVSA-N 409.487 2.078 10 20 HECD COc1ccc([C@H](CNC(=O)NCc2ccccc2O)N2CCOCC2)cc1OC 748463514 UKTNGGUJHOBOLF-SFHVURJKSA-N 415.490 2.282 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc(N(C)C(C)=O)cc3)CC2)cc1F 754040069 LFPMPIBNLWQYTL-UHFFFAOYSA-N 421.494 2.328 10 20 HECD CN(CC(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1)c1ccc2c(c1)OCO2 756654816 NCMUBHPDUJUXTD-UHFFFAOYSA-N 409.486 2.131 10 20 HECD COC(C)(C)CN(C)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 758813375 QNCOGAPYHFKWSM-UHFFFAOYSA-N 407.536 2.281 10 20 HECD CO[C@@H]1CCN2C(=O)N(Cc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)C(=O)[C@@H]2C1 761088217 BSFDCGYBEKMCNZ-DZASIIFFSA-N 405.470 2.381 10 20 HECD NS(=O)(=O)c1c(NCc2cccc(Br)c2O)cccc1[N+](=O)[O-] 764934857 ONWLVRGETYLOBI-UHFFFAOYSA-N 402.226 2.322 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765926339 MAYPZRIWAPEVIJ-UHFFFAOYSA-N 406.236 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(C4CCCCC4)CC3)CC2)cc1 766142182 MUKBVLKNFQENIJ-UHFFFAOYSA-N 400.567 2.294 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cnn(-c2ccccc2F)c1 768722491 URBVZFVZKCFMAH-UHFFFAOYSA-N 423.448 2.103 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@@H]3CS(N)(=O)=O)c2C)cc1 769575467 JMDCFGCRAGCAEK-QGZVFWFLSA-N 405.520 2.386 10 20 HECD C[C@@H](NC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O)c1ccc(N(C)C)cc1 773019466 LWFRLWICKMRZKO-QGZVFWFLSA-N 406.486 2.002 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2C[C@H](CO)C[C@@H](OCCOC)C2)cc1F 774849312 DGQWNSWCQNVRKC-QZTJIDSGSA-N 411.518 2.227 10 20 HECD O=C(NCCc1ccccc1F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 775191488 DPZRHXGCSBSEFA-SFHVURJKSA-N 400.450 2.398 10 20 HECD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C\c1cnc(OC)nc1 775825186 AHYAPDHOVGMSHN-TWGQIWQCSA-N 416.503 2.118 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@]3(C)CCCS3)CC2)cc1 778323868 LEFUSHPLKFBHDX-SHBDEGQCSA-N 403.548 2.302 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CCO)c3ccccc3)CC2)cc1 778377925 JIPVOXNAVXOYOC-VDZCTEQFSA-N 423.513 2.140 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCc2ccc(O)c(O)c2)c1 778925985 RXFZHIHIXTYKCW-UHFFFAOYSA-N 408.476 2.067 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CC(C)(C)O)[C@@H](C)C3)CC2)cc1 780387041 GPLLECIXQCUARO-KRWDZBQOSA-N 404.555 2.151 10 20 HECD O=C(C1CCCC1)N1CC(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 781526503 GWVOLNLKTCCDHR-SFHVURJKSA-N 422.547 2.104 10 20 HECD COc1cc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc(OC)c1OC 785434509 ULVLWFTWTUWYNE-CQSZACIVSA-N 415.490 2.272 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1 785439544 QRXUSEYXJIGXGU-KRWDZBQOSA-N 418.538 2.275 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)cc2)CC1 787320889 AAZBCYUYHQWWQN-UHFFFAOYSA-N 422.445 2.070 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)N1CCc2ccccc2C1 788931838 JUHWRSBCJFJHGB-IBGZPJMESA-N 420.557 2.466 10 20 HECD Cc1nc(C)c(CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789854852 FKCNGDPHMJOVMS-UHFFFAOYSA-N 418.588 2.288 10 20 HECD CCc1cc(N)nc(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 790325717 QBKCEZDRNHUVTK-UHFFFAOYSA-N 405.499 2.005 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298240 RQQJIXGPGMVIRJ-AHRSYUTCSA-N 417.550 2.410 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)c3ncc(C)s3)CC2)cc1 804315684 PYGWGIJDJDHBLK-AWEZNQCLSA-N 402.520 2.423 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](OCC(F)(F)F)C1 806281182 PSGPTWHKNUOWSO-NSHDSACASA-N 411.471 2.311 10 20 HECD C[C@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](C)O1 807768461 KFBKGYPGDZYCIC-ZNMIVQPWSA-N 411.449 2.009 10 20 HECD CC(=O)C(=O)COC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1 808484589 FBQKMGNPRFFCGM-OAHLLOKOSA-N 421.450 2.057 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cc(F)c(OC)c(S(N)(=O)=O)c1 915637052 DXHHFOKFDZWXMC-UHFFFAOYSA-N 423.510 2.139 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1 1841834537 XWLDVJAJTOJORH-UHFFFAOYSA-N 419.840 2.345 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(OCC#N)c1)c1ccc(N2CCOCC2)cc1 65715626 SCAGTJCXYMHOIA-MRXNPFEDSA-N 408.458 2.241 10 20 HECD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ncn(C)c3Cl)n2)c[nH]1 727247880 RQKDURHTJNVGQA-UHFFFAOYSA-N 401.857 2.113 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](CCO)C3)cc2F)C[C@@H](C)O1 729544659 KNUKCCNCBBMITL-KURKYZTESA-N 407.530 2.150 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1 734015086 YSRQFKJJYJIXPK-SFHVURJKSA-N 404.488 2.260 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 734702379 ZXDMLMFVZUMNFU-UHFFFAOYSA-N 421.501 2.114 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3nc4c(s3)COCC4)cc2)C1 735576134 DGUGGPGKSDHXGX-AWEZNQCLSA-N 415.519 2.239 10 20 HECD CCc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 740277044 XPJNYXTUJISBSU-KBPBESRZSA-N 419.453 2.463 10 20 HECD CCN1CC[C@@H](N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C 748961870 XHVZXBOWCRETAK-PZJWPPBQSA-N 417.598 2.331 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CC3(O)CCCC3)cc2F)C[C@@H](C)O1 752142838 MGXCTTHNAFHLRJ-IAGOWNOFSA-N 407.530 2.292 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1CN(C(=O)OC(C)(C)C)C1 752244364 GGSGLCRUFIWEAK-UHFFFAOYSA-N 405.495 2.121 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC[C@@H]3c3ccc(C)o3)CC2)cc1 754044001 XGABCQMXXRXSCA-IFMALSPDSA-N 415.534 2.153 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 754772046 KFVKHQOPPPCNTH-XHSDSOJGSA-N 403.502 2.140 10 20 HECD O=C(Nc1ccn(CC(F)F)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 754920140 GMVDUWZXITZEEH-AWEZNQCLSA-N 408.405 2.000 10 20 HECD Cn1ncc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1C(F)F 758970382 SWVRIZYUWNXUMB-UHFFFAOYSA-N 409.462 2.166 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1CC(F)(F)F 762561394 VDWAUOHVWNPCKK-OAHLLOKOSA-N 400.445 2.301 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)c1 764262707 XDVGDRNCIOWNGF-LBPRGKRZSA-N 409.446 2.414 10 20 HECD O=S(=O)(Nc1ccc(OCCO)cc1C(F)(F)F)c1cccc2nonc12 765059129 ABPMSQZBLUNDET-UHFFFAOYSA-N 403.338 2.414 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1F 765111993 ZXSJYZKQXHEMFT-UHFFFAOYSA-N 403.479 2.206 10 20 HECD COc1cc(N2CCN(CC(=O)N3CCCCCC3)CC2)c([N+](=O)[O-])cc1OC 766929179 VQHCNQSZQHVDCA-UHFFFAOYSA-N 406.483 2.137 10 20 HECD COc1cc(O)c(CN2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)cc1OC 768445782 HYRFSIUZGNKQCO-IBGZPJMESA-N 411.502 2.333 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)c1 769539187 AHLWWFKRYLINRP-CQSZACIVSA-N 400.431 2.087 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N(C)C)cc1 773088222 NKPIBYZYFNJWDD-CQSZACIVSA-N 411.549 2.042 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3CCCCCCC3)cc2)C1 774588780 XQHDHXVLOLEPAY-SFHVURJKSA-N 414.550 2.234 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCOc3ccccc3)CC2)cc1 778229344 YMSRHFUWPRTTKP-OUKQBFOZSA-N 423.513 2.485 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)COc3ccccc3)CC2)cc1 778244066 BLCRWUQDWCAWFC-SYGIOELKSA-N 423.513 2.484 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 778296150 ZGUDIKIVOQLFDC-YJAHHDQYSA-N 415.534 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](CCO)CC(C)C)CC2)cc1 778324005 AQQDASWKYBXKJB-QWUACUGRSA-N 417.550 2.061 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NN1CCCNC1=O 783603205 NRJJXPNWXVPTOT-ZRDIBKRKSA-N 410.546 2.176 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(CC(F)(F)F)nc3C)cc2)CC1 786257888 WBWYNIAJPWJEDN-UHFFFAOYSA-N 423.439 2.352 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc4c(c3)OCCCO4)cc2)CC1 786261885 GWAKGQRYKPZKFU-UHFFFAOYSA-N 409.486 2.446 10 20 HECD COC(=O)c1cccc(CC(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786262883 QNEQBLISQFAQJD-UHFFFAOYSA-N 409.486 2.001 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1(N2CCSCC2)CCCC1 789707798 RZAUDGWSIQNTHT-UHFFFAOYSA-N 418.607 2.155 10 20 HECD C[C@@H]1[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC[C@H]1C 789798201 DAYARHDIQSWDHZ-SOLBZPMBSA-N 405.514 2.467 10 20 HECD CC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789813305 SQMRUWJKJSCLGQ-IBGZPJMESA-N 413.493 2.416 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 789863074 OBLBOFAQFRVPIR-UHFFFAOYSA-N 412.446 2.435 10 20 HECD CCCc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(O)c3O)CC2)cc1 790464522 MHUGDQUHWGNNRU-UHFFFAOYSA-N 404.488 2.197 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)c1 792623409 QDOQRUMFJZKCLY-UHFFFAOYSA-N 417.443 2.060 10 20 HECD CC1(C)CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793734968 WERFJPZWAYCPAG-QZTJIDSGSA-N 414.550 2.090 10 20 HECD COc1ccc(CNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(O)c1 794382407 BBVVTKQKJHQKCJ-UHFFFAOYSA-N 418.515 2.434 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCC3CCOCC3)CC2)cc1 804316985 PRXOLBDQZPLRAN-UHFFFAOYSA-N 403.523 2.055 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)c3cnn(C(C)C)c3)CC2)cc1 804318902 FJHNPQLZPSGMOI-MRXNPFEDSA-N 413.522 2.435 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H]3CCC[C@@H]3C)cc2F)CC1 805007960 WGFMASUNEYLZRS-WMZOPIPTSA-N 404.530 2.136 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 806282736 RQDHKBPYQYXSJB-WBVHZDCISA-N 418.588 2.378 10 20 HECD CCOC(=O)C(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)cn1C 808530415 ULUPLSIYLYMDTL-UHFFFAOYSA-N 409.445 2.288 10 20 HECD CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2cc(OC)c(OC)cc2O)CC1 809786075 ODADWBNXZYIMAD-CQSZACIVSA-N 400.541 2.291 10 20 HECD COC[C@@H](C)CS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 809809451 YHNSQAYAXVJIOB-CYBMUJFWSA-N 410.458 2.244 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc4nccnc34)cc2)C1 917837208 VIDMVHCNQZRCFM-OAHLLOKOSA-N 407.449 2.401 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 918703241 UHMJBSYUMMKXDE-OKILXGFUSA-N 421.494 2.017 10 20 HECD CCOCCOCc1cccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 919814207 KBGRKIPXRNTLTQ-UHFFFAOYSA-N 422.503 2.247 10 20 HECD CS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919968348 GADXWVDQFWCLEX-UHFFFAOYSA-N 417.531 2.197 10 20 HECD C[C@]1(CO)CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1323317852 ATAGAHHFJYOLLS-SFHVURJKSA-N 410.517 2.489 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC3(C4CC4)CCOCC3)cc2)C1 1338070220 CFBJMAQLQTZZPX-QGZVFWFLSA-N 400.523 2.147 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC2(CCCN(C(=O)C34CC(F)(C3)C4)C2)CC1 1806120034 GGEYJIIFSLVLHD-UHFFFAOYSA-N 403.454 2.230 10 20 HECD CC(C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496655 NYMIWZRNVFEWNK-ZDUSSCGKSA-N 423.564 2.308 10 20 HECD O=C([C@@H]1C[C@@H]1c1ccc(F)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248778 MIKJHCZKLGOPAZ-IAGOWNOFSA-N 411.433 2.253 10 20 HECD COc1ccc(N2CCN(CC(=O)N(C)Cc3cccc(OC)c3OC)CC2)cc1 58126928 LFFYLCWGXQVEPH-UHFFFAOYSA-N 413.518 2.493 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)CC2)cc1 726726136 NZLFTHQJJDBNPH-UHFFFAOYSA-N 422.485 2.304 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](O)Cc3ccccc3)cc2F)CC1 730133525 XHNZSLNWJGPCTL-HXUWFJFHSA-N 414.525 2.370 10 20 HECD COCCCNC(=O)[C@H](C)N1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1 738169292 HVFVJDXTOOSEJJ-INIZCTEOSA-N 407.555 2.054 10 20 HECD C[C@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)n1nnc(-c2ccccc2)n1 745684938 RPBNXYJAKNSVPX-MRXNPFEDSA-N 422.489 2.169 10 20 HECD COCCN(C[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(OC)c(OC)c1 751484617 ZLODPEOTMFMXMJ-SFHVURJKSA-N 409.504 2.294 10 20 HECD CCOC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 752004897 LWICUPCLFSUMMQ-UHFFFAOYSA-N 405.426 2.431 10 20 HECD C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1cc(Br)ccc1O 756562745 JPSWOIWWYQWXLJ-LBPRGKRZSA-N 405.358 2.314 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3ccnc3[C@@H](O)c3ccccc3)CC2)cc1 758231679 PVHOUDDDUYNTPH-GGAORHGYSA-N 422.529 2.157 10 20 HECD CC1(C)Cc2cc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2O1 759498490 FLVJDZHOPMQXJB-UHFFFAOYSA-N 409.486 2.492 10 20 HECD COc1cc(N2CCN(CC(=O)NOCc3ccccc3)CC2)cc(OC)c1OC 759885232 AUQKRIULULYACW-UHFFFAOYSA-N 415.490 2.082 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CC[C@H](C(N)=O)O2)cc1 760204319 QMEAGDLBXFDAHE-IEBWSBKVSA-N 400.479 2.090 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)NCc2cccc(Br)c2O)cn1 765243057 OSXJSPLLPALTBV-UHFFFAOYSA-N 400.254 2.275 10 20 HECD CCN1C[C@@H](C)N(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C[C@H]1C 766245150 YVVQKBSDYATAGG-WOJBJXKFSA-N 417.598 2.331 10 20 HECD C[C@@H](OC(=O)C1(CCO)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 770547784 WLEUXQVYOCLQHT-CYBMUJFWSA-N 407.422 2.495 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1 785294877 PEZWBMXNJRKWGN-NSHDSACASA-N 419.865 2.139 10 20 HECD COCCOCCOC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785408505 VDQVCHFJFUWEOI-UHFFFAOYSA-N 401.462 2.074 10 20 HECD CC(C)NC(=O)c1cnn2c1C[C@H](CNCc1ccc(N3CCOCC3)cc1)CC2 785563553 NFPUYFIHGIQUBW-LJQANCHMSA-N 411.550 2.210 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 788324881 ZEHRTCKDDMJHRE-FGZHOGPDSA-N 423.513 2.176 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1 788976890 IQRYCCMZVDCDKN-OAQYLSRUSA-N 422.529 2.461 10 20 HECD CC[C@](C)(OC)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 796397304 IWTPWZFSGASBAQ-GXZWQRSESA-N 410.486 2.414 10 20 HECD CCOC(=O)c1cc(NC(=O)NCc2ccc(OC)cc2O)cc(S(C)(=O)=O)c1 797633110 GDCHEYOLOCFVKQ-UHFFFAOYSA-N 422.459 2.303 10 20 HECD Cc1nn(CCS(C)(=O)=O)c(C)c1CN[C@H](C)c1ccc(N2CCOCC2)cc1 797977563 UFFBKVXJPABVQV-MRXNPFEDSA-N 420.579 2.232 10 20 HECD C[C@@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689636 VHRBNBZBNCSQCW-QGZVFWFLSA-N 406.530 2.253 10 20 HECD Cc1c(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cnn1C 805698895 NXCMJAIAUROPCZ-UHFFFAOYSA-N 409.490 2.233 10 20 HECD C[C@H](NC(=O)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1)c1ccc(N(C)C)cc1 807172645 IPPKFHDYNWGOGW-LBPRGKRZSA-N 410.434 2.031 10 20 HECD C[C@@H](CCc1cccn1C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807651421 YZECZROBJZLGQP-PXNSSMCTSA-N 413.518 2.376 10 20 HECD COc1cc2c(cc1S(=O)(=O)Nc1ccc(O)c(COC(C)C)c1)OCC(=O)N2 811704248 YOESVJPKZDFCMP-UHFFFAOYSA-N 422.459 2.458 10 20 HECD COC(=O)c1cc(CNCCCN2CCN(c3ccc(OC)cc3)CC2)n(C)c1C 812746987 OTCIIKODTNEYLQ-UHFFFAOYSA-N 414.550 2.431 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 916676346 IQCFBHUXZYMSNR-UHFFFAOYSA-N 423.878 2.413 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3C(=O)NC3CC3)cc2F)C[C@@H](C)O1 918220164 HJHKCGJHSWQPIY-STXHMFSFSA-N 418.513 2.392 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(N2CCNC2=O)c1 1251956296 UNAFLIAQROFIDQ-UHFFFAOYSA-N 408.502 2.355 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2nnc(-c3ccccc3F)n2N)cc1 7484229 ORCWAFYERDNKCH-UHFFFAOYSA-N 400.483 2.273 10 20 HECD Cc1c(CNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)n(C)c2ccccc12 553798039 ROVSVNIYQZLHSX-AYHJJNSGSA-N 411.550 2.370 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC(=O)Nc2cccc3ccccc23)c1 725901081 INFFWTDYRDNICD-UHFFFAOYSA-N 413.455 2.285 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)[C@@H](C)CS(C)(=O)=O)cc2F)C[C@@H](C)O1 732675209 XLCIPNURJCKOCM-SOUVJXGZSA-N 415.531 2.014 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 737108425 WLQPRDDGKUZSKL-VXGBXAGGSA-N 404.442 2.299 10 20 HECD CCNC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 737166768 RAIJKMCXZIJGRJ-UHFFFAOYSA-N 409.490 2.465 10 20 HECD O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1ccc(N2CCOCC2)c(F)c1 742557987 YIIGOLKPVYJYLE-UHFFFAOYSA-N 410.449 2.190 10 20 HECD COc1ccc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1O 750044775 ACOMBFODISNNIX-UHFFFAOYSA-N 417.481 2.125 10 20 HECD COc1ccc(N2CCN(C(=O)CSCc3nnnn3-c3ccccc3)CC2)cc1 750582007 ORQINQPKYUZWTB-UHFFFAOYSA-N 424.530 2.253 10 20 HECD CCn1c(SC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)nnc1C1CC1 758188503 FWWYAYAPRIOKKW-SFHVURJKSA-N 417.579 2.459 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3c(CCCO)nc4ccccc43)CC2)cc1 758210790 RWHWIKQMAWSUIP-FQEVSTJZSA-N 424.545 2.153 10 20 HECD COc1cc(N2CCN(C(=O)CCNC(=O)OC(C)(C)C)CC2)cc(OC)c1OC 759221378 PLMLXOFKHBYESS-UHFFFAOYSA-N 423.510 2.276 10 20 HECD COc1cc(OC)cc(N2CC[C@H](N(C)Cc3cc4c(cc3O)OCO4)C2=O)c1 769534660 YBTUNZMSFCRPIF-KRWDZBQOSA-N 400.431 2.375 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccc(F)cc3)cc2)C1 770302737 YLHGKXVCMQMTJL-YLJYHZDGSA-N 414.481 2.060 10 20 HECD O=C(CN[C@H](CCCO)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 775461858 SVCHGSFZMDZKTO-OAQYLSRUSA-N 415.509 2.382 10 20 HECD CCO[C@H](CCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 778300490 UHJWHVKAZIUEIS-KUFMOJEASA-N 417.550 2.467 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CCO)c3ccccc3)CC2)cc1 778377922 JIPVOXNAVXOYOC-GJCOWUBNSA-N 423.513 2.140 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@]12CCOC2=O 779254847 YPZKMFHDVPNODX-GOSISDBHSA-N 422.484 2.176 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 779491300 MYBJUMQHKULDQE-ALCCZGGFSA-N 422.890 2.298 10 20 HECD COC[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)O1 784370231 JRTGVMDTGDSULH-GOEBONIOSA-N 408.454 2.136 10 20 HECD CC[C@]1(CO)CCCN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 784462330 FAALONJMYMYYKX-JOCHJYFZSA-N 404.555 2.154 10 20 HECD COc1ccc(OC(F)F)c(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 785438654 DBIXJXIWWLZMPZ-UHFFFAOYSA-N 407.417 2.295 10 20 HECD Cc1cc(C)n(-c2ccc(CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cn2)n1 787497816 AFZPSOPZYSBQIJ-UHFFFAOYSA-N 420.517 2.225 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCCO[C@@H]3CCCC[C@H]3C)CC2)cc1 787988390 NWUHWMNSXCMJMC-DYESRHJHSA-N 417.550 2.492 10 20 HECD COc1ccc(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2)c(O)c1 794376873 CJMSTFPBRAXODP-QGZVFWFLSA-N 424.544 2.117 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cc4c(cc3C)OCO4)CC2)cc1F 795137741 SUMQXRLXMSVOCN-UHFFFAOYSA-N 408.451 2.382 10 20 HECD O=C(Cn1ccnc1C(=O)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 795225893 FWXDLGKFYWFPII-UHFFFAOYSA-N 422.460 2.406 10 20 HECD O=C1N[C@H]2CCN(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C[C@@H]2CO1 798426702 HNYGXJHTXWIPND-CPUCHLNUSA-N 424.448 2.397 10 20 HECD O=C(COC(=O)c1cccc2c1NCC2)NCc1ccc(N2CCOCC2)c(F)c1 801397995 CJCMWVIDXRXMTO-UHFFFAOYSA-N 413.449 2.104 10 20 HECD CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 809235064 SOWKCSRMZCIWOY-FSEXZHDUSA-N 419.591 2.440 10 20 HECD O=C(CNC(=O)NCc1c(O)ccc2c1CCCC2)NCCN1CCCCCC1 814423450 JXJYFCBBCRKMGF-UHFFFAOYSA-N 402.539 2.062 10 20 HECD CCN1CCN(c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc2)CC1 918306339 ZUPDEUUPOVWCJI-UHFFFAOYSA-N 423.561 2.492 10 20 HECD CSc1ncc(Cl)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 918370744 BFZSIKCIQBWHFX-ZDUSSCGKSA-N 419.938 2.484 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1OC 920195393 QYZHNNOFERZUBV-UHFFFAOYSA-N 413.474 2.185 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(F)(C1)C2)C1=NN(c2ccccc2)C(=O)C1 1793653098 QQBGIHHXXYFVOP-CRKWVHSTSA-N 424.476 2.310 10 20 HECD O=C(C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1)c1ccccc1 1808980273 GLWAJGGRILTAKI-UHFFFAOYSA-N 423.469 2.221 10 20 HECD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1826245360 RWNIRVVUPGQSJK-HNNXBMFYSA-N 423.604 2.267 10 20 HECD Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)[nH]1 1827423810 IHWPGAILRGSMKR-KRWDZBQOSA-N 413.478 2.071 10 20 HECD O=C([C@@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428963 MOWRWPFOMVYGHE-SJLPKXTDSA-N 417.506 2.153 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1S(=O)(=O)N(C)C 19107893 QMPHLSGIPPRVAN-UHFFFAOYSA-N 412.518 2.051 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccc(OC(F)F)cc2)SC1=S 727178067 RJDYVCRXFPOAQU-DHZHZOJOSA-N 408.473 2.038 10 20 HECD CC(C)COc1ncccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 728515631 GFJNFCDDDRPAFY-UHFFFAOYSA-N 417.531 2.281 10 20 HECD C[C@@H](c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1)N1CCOCC1 729537371 CBQPVMUFNUHECH-AWEZNQCLSA-N 419.503 2.409 10 20 HECD Cc1cc(CC(=O)N2CCO[C@H](c3nn[nH]n3)C2)c(C)n1-c1ccc(Cl)cc1 732090002 FLIUKUQVLGGHST-KRWDZBQOSA-N 400.870 2.403 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)CC2)cc1 735754028 WDIYVUGOLAAMKC-UHFFFAOYSA-N 404.492 2.005 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1OC 739670324 IGJACAONSNWZGO-BETUJISGSA-N 405.542 2.091 10 20 HECD Cn1c(Cl)nc(Cl)c1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 752260436 CRECCDYYJMBOJP-UHFFFAOYSA-N 403.335 2.252 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 753644461 OBRTYYGUTSALSQ-ZDUSSCGKSA-N 422.478 2.382 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cccc(C(F)(F)F)c3=O)CC2)cc1F 753740139 OGCYCUKFXVKQTP-UHFFFAOYSA-N 413.371 2.364 10 20 HECD COc1ccc(N2CCN(C(=O)NCC(=O)N3CCc4ccccc43)CC2)cc1F 753894345 VELWNKDMIAXKBN-UHFFFAOYSA-N 412.465 2.255 10 20 HECD COc1cc(N2CCN(C(=O)c3cnn(-c4ccccc4)n3)CC2)cc(OC)c1OC 759238834 QZMQUMCGLIWDGY-UHFFFAOYSA-N 423.473 2.256 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3CCCc4c[nH]nc43)CC2)cc(OC)c1OC 760127004 BCBFNMNEQAPAIE-MRXNPFEDSA-N 415.494 2.345 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCN3CCCC3)cc2F)C[C@H](C)O1 760834291 WLBPADNOMNAULG-ROUUACIJSA-N 406.546 2.083 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCN(c2cccnn2)CC1 761600924 WLSSMRPKUCSENU-UHFFFAOYSA-N 401.854 2.269 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 765751536 FWPDHJADOSAIIK-ZDUSSCGKSA-N 404.264 2.215 10 20 HECD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 766330095 RVFLNTMFOOJOOC-RBUKOAKNSA-N 423.579 2.457 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)c3cccc(O)c3)CC2)cc1 768723143 WFZUOADCLBDQDA-MQNTZWLQSA-N 409.486 2.483 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccn(C(C)C)n4)n3)CC2)cc1 771055631 HMEIFVJWHNVRMM-UHFFFAOYSA-N 410.478 2.414 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccccc2CS(=O)(=O)NC(C)C)c1O 775015460 HZLSJIWZYUFLLT-UHFFFAOYSA-N 423.491 2.427 10 20 HECD CCc1ccccc1NC(=O)CNC(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775258204 UEDWTNQAJHHSRN-GOSISDBHSA-N 424.545 2.491 10 20 HECD C[C@H](NCC(=O)Nc1cccc(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 775259181 GIHKRTPOEBZKTN-INIZCTEOSA-N 417.531 2.216 10 20 HECD COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)Nc1cccc(N2CCCC2)c1 777848637 CJTKRNRXISPORC-UHFFFAOYSA-N 405.476 2.204 10 20 HECD Cc1ccccc1-c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(C)n1 785297674 RDUXVDGIOCIGLY-CQSZACIVSA-N 408.458 2.493 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)Cn3nc(C)c(Cl)c3C)cc2)CC1 786655575 FRRRGMVTKMCJKA-UHFFFAOYSA-N 403.914 2.138 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 787191216 QCIWTOGMWJFRBO-UHFFFAOYSA-N 401.486 2.066 10 20 HECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1N1CCNC1=O 787454077 GDGVSURKZBJKOO-UHFFFAOYSA-N 409.490 2.188 10 20 HECD Cc1cccc(OC[C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788310700 LUXBJVYYSFZXEM-GOSISDBHSA-N 411.502 2.032 10 20 HECD CCS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789812201 KJRHYSWUIXPKFH-DLBZAZTESA-N 423.554 2.459 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1(C)C 789847794 VHUGIKKIDWTXHL-DYESRHJHSA-N 405.564 2.176 10 20 HECD CS[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789956016 RPOZDYJNCVHZIE-GFCCVEGCSA-N 419.469 2.026 10 20 HECD Cc1cc2n[nH]cc2cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 792206560 NKOUTRISPFRPFQ-UHFFFAOYSA-N 407.474 2.305 10 20 HECD NS(=O)(=O)c1ccc(F)c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 798334994 AOIIGYOGXCIXFM-AWEZNQCLSA-N 408.451 2.000 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)c2cccc(Cl)c2S1(=O)=O 799316411 DIKBMUNOZZMUNN-UHFFFAOYSA-N 421.906 2.209 10 20 HECD CCCn1ccnc1CCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803663377 XPQAETUSGHEOKQ-UHFFFAOYSA-N 403.502 2.206 10 20 HECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688522 SJYKLONTPYOIMO-OAHLLOKOSA-N 418.538 2.105 10 20 HECD Cc1noc(C)c1C[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807310065 YHYLEGWYIMTZIY-KBXCAEBGSA-N 415.490 2.252 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)nc1 815491878 AAWUGMAZBJFKBJ-UHFFFAOYSA-N 414.481 2.469 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 917356487 VFFYMABBBMEATR-UHFFFAOYSA-N 416.455 2.142 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(-n4ccc(C)n4)cc3)nc12 919182512 COKJYELGOXBNMP-UHFFFAOYSA-N 421.413 2.463 10 20 HECD Cc1c([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1C 1254665871 VBICSDDUABGBSU-JYJNAYRXSA-N 417.529 2.448 10 20 HECD CCN(CC)c1ccc(CNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)cc1F 1319632426 VWNQCVDRGDPFCT-UHFFFAOYSA-N 422.522 2.297 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)c(F)c1)c1cc(O)nc(O)c1 1795712459 RDZUKAHDIRVOMW-QDMKHBRRSA-N 417.412 2.266 10 20 HECD Cc1nocc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426820 ILZYFTNHNSBAMT-QGZVFWFLSA-N 414.462 2.336 10 20 HECD CCN(C)[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1831073711 STIWIIJQNDTAOK-MAUKXSAKSA-N 418.538 2.066 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1 1832867065 BISREYOOOZRVLD-FUHWJXTLSA-N 417.506 2.153 10 20 HECD O=C([C@@H]1CCC(F)(F)C1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847034345 CNZPQZUZFJJDNH-LYKUJDHUSA-N 422.428 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc4sc(C)c(C)c4c3=O)CC2)cc1 2921593 NZCIHVYYCQKTOV-UHFFFAOYSA-N 412.515 2.432 10 20 HECD CNC(=O)[C@@H]1CCCCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 729470122 BFOWURPSFVORFX-SFHVURJKSA-N 405.454 2.001 10 20 HECD O=S(=O)(NCC1CC1)c1ccc(NCc2ccc(N3CCOCC3)cc2)nc1 731905276 YNNFRGWJCKBFBG-UHFFFAOYSA-N 402.520 2.219 10 20 HECD COC(=O)CCc1nc(COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)no1 733385323 JPBBLYXZCJNHGR-UHFFFAOYSA-N 420.377 2.308 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(N2CCOC2=O)cc1 743955945 NLTJDIOUYHUCLZ-UHFFFAOYSA-N 409.442 2.483 10 20 HECD O=C(CN1CCO[C@H]([C@H]2CCCO2)C1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 756898425 LVDBQBBUJAWOLU-RTWAWAEBSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(-c4nnco4)cc3)CC2)cc1 758222051 DQCBKWVGDRTDAX-LJQANCHMSA-N 410.474 2.307 10 20 HECD Cc1cc(C(=O)O)c(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 761260666 YSEBRSJXVZXVNC-UHFFFAOYSA-N 408.451 2.147 10 20 HECD Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1S(=O)(=O)NC(C)(C)C 765089994 NBWZCWCRMPFJCQ-UHFFFAOYSA-N 424.504 2.409 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1 770244860 WAHXPKQFYBYFKP-UHFFFAOYSA-N 402.520 2.156 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(C)C[C@H]1CNC(=O)OC(C)(C)C 775434848 IOGWIUIIBSKTHA-LJQANCHMSA-N 419.570 2.411 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cc(C(C)C)no3)CC2)cc1 778278276 WUVNZQXXCLCOFW-HJWRWDBZSA-N 412.490 2.328 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)O4)cc2F)C[C@@H](C)O1 780313829 ZJMUBRVAUQWVED-HUUCEWRRSA-N 420.485 2.223 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C 785295549 VYDPDMNHPJQOAP-ZDUSSCGKSA-N 413.474 2.312 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(C(=O)NC4CC4)cc3)cc2)CC1 786255273 MLAPNSUWEUEWFK-UHFFFAOYSA-N 420.513 2.177 10 20 HECD CCc1noc2ncc(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)cc12 786257137 XTMSDUOQISCWKW-UHFFFAOYSA-N 407.474 2.384 10 20 HECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 786290045 PLSAPQMPXRWKBW-UHFFFAOYSA-N 415.494 2.040 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c1 787485127 KMHKWMPQUQXRNJ-CYBMUJFWSA-N 412.446 2.055 10 20 HECD Cc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 788313034 OEJPVDQACNJNPQ-SFHVURJKSA-N 411.502 2.032 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(C)ccc3OC)CC2)cc1 789373268 BLEIQBYJSRTXPA-UHFFFAOYSA-N 411.502 2.367 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C[C@@H](C)O1 789825380 LOKWNEOGKLLYRB-LISAXSMJSA-N 421.513 2.081 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c(O)c1 797389237 WMQUQFOLMHKSJY-UHFFFAOYSA-N 417.849 2.436 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccc(N2CCOCC2)cc1 803303972 BJUZDTSWZDALLG-MGPUTAFESA-N 409.486 2.210 10 20 HECD O=C(NC[C@@H]1CCC=CO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449261 UBDAWHNFFIHULI-KRWDZBQOSA-N 409.433 2.182 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H](Cn2cccn2)c2ccccc2)cc1F 803658686 BVCBQINQQGLCDE-LJQANCHMSA-N 409.465 2.262 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC(=O)N1CCCCCC1 804080486 KZAAXLLAGKGUJD-UHFFFAOYSA-N 416.566 2.399 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(Cc2ccccc2)CC1 806275529 JZEOAEWERNWUML-UHFFFAOYSA-N 404.561 2.086 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1cccnc1OCC(F)F 807291150 SWLKLRDBVVLFKO-UHFFFAOYSA-N 416.428 2.034 10 20 HECD CC(C)(NC(=O)c1ccccc1)c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 809507325 LJXZETYWSXJQMP-UHFFFAOYSA-N 416.459 2.479 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNc2nccc(OC)n2)c1 914704500 OSZCXXYNIQMYIP-UHFFFAOYSA-N 424.552 2.138 10 20 HECD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)s1 919729762 HJPYHBBXWARTPZ-AWEZNQCLSA-N 423.560 2.260 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CC[S@](=O)C1 1116279717 ZELJYANLVJFANP-VVRFXJAZSA-N 414.599 2.367 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC(=O)N1CCCC1 1322460014 JNYVKVGVUXEKLK-SDNWHVSQSA-N 423.585 2.468 10 20 HECD O=C(Cc1ncccn1)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788424179 DOZVNQZKKGWJCW-UHFFFAOYSA-N 419.441 2.273 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1 1795018936 YUSPNBCBVWYMBM-KYXSFPASSA-N 409.442 2.164 10 20 HECD Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)o1 1816719935 AQQOILLZIRTAJV-LLVKDONJSA-N 414.443 2.390 10 20 HECD COc1ccccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844871141 NWVZJVBPAUMUOW-CSKARUKUSA-N 424.453 2.342 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C2CCSCC2)C1 1847111440 SENHLIYROMYFIT-HWKANZROSA-N 418.515 2.163 10 20 HECD C[C@@H](OC(=O)c1cnn(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 12852074 QIQYHJFNPCVQTL-GFCCVEGCSA-N 403.394 2.380 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(Cc4cccc(C)c4)CC3)nc12 51656218 ROCZAUJIFIWTSD-UHFFFAOYSA-N 409.490 2.238 10 20 HECD COc1ccc(N2CCCN(C(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)CC2)cc1 108689487 QVPOXIWXTZAYGE-QGZVFWFLSA-N 421.501 2.072 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 727057030 LWZNIZLFFMGHQR-RBUKOAKNSA-N 413.499 2.048 10 20 HECD COc1ccc(N2CCC(NC(=O)CCc3nc(-c4ncccn4)no3)CC2)cc1 727740371 YDEAHCBZPMBLJM-UHFFFAOYSA-N 408.462 2.253 10 20 HECD COCCN(CCN(C)C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 729598133 XQZOZUZIJYJCJR-IRXDYDNUSA-N 410.534 2.159 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)cc2)CC1 731131510 KKOZFLNGELNERG-UHFFFAOYSA-N 419.489 2.154 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CNC3(C(=O)N(CC)CC)CCCCC3)nc12 735872081 XKVZTDUMSUATJN-UHFFFAOYSA-N 417.510 2.273 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(S(N)(=O)=O)c1 740902022 MSFIBSRZGBEDNF-HNNXBMFYSA-N 400.504 2.271 10 20 HECD Cc1cc(CC(=O)NCCOCCS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 741626918 TZAMLWQHAQZDGD-UHFFFAOYSA-N 412.939 2.467 10 20 HECD CNC(=O)C1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1 742751798 WTOLSLVRYPDNFX-KRWDZBQOSA-N 418.538 2.351 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 749420808 NSCILUSXTSCPCK-GASCZTMLSA-N 408.518 2.401 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 753640454 QBYGZJMGMNYNQZ-GFCCVEGCSA-N 412.895 2.119 10 20 HECD COc1ccc(N2CCN(C(=O)NCCCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1F 753835086 ZJSVPUZDXSPOBO-IRXDYDNUSA-N 408.518 2.165 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@H](C)c3nccs3)CC2)cc1 754269188 HNEUGIXHPBZESN-PKOBYXMFSA-N 404.580 2.370 10 20 HECD COc1ccc(N(C)CC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1F 757852792 RDPNACKFPFWHNS-UHFFFAOYSA-N 415.465 2.059 10 20 HECD COc1cc(N2CCN(C(=O)COc3ccccc3O)CC2)cc(OC)c1OC 760089819 NVMMFMMSPHZEGM-UHFFFAOYSA-N 402.447 2.146 10 20 HECD C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 762090561 ADOQWQOOBYGAQQ-UONOGXRCSA-N 419.494 2.379 10 20 HECD CCc1nc([C@H](C)NC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)n[nH]1 763017320 SVLGVRNWNLLVAO-AWEZNQCLSA-N 403.506 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccnc(N(C)C)c4)n3)CC2)cc1 771059165 YAVQPEWYVAYRRA-UHFFFAOYSA-N 422.489 2.098 10 20 HECD CC(C)(C)C(=O)Nc1cnn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772896893 FISRNYGIVGGIMJ-UHFFFAOYSA-N 417.485 2.160 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 773914143 REXLYBUOSLKZHF-QHCPKHFHSA-N 417.550 2.255 10 20 HECD CCS(=O)(=O)c1c(Cl)cccc1/C=C1\SC(N2CCOCC2)=NC1=O 774117496 DJJKZWGJGSGRSE-RAXLEYEMSA-N 400.909 2.436 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCC3(N(C)C)CCCCCC3)ccc21 775222136 MAIUYOGCTTWMQJ-UHFFFAOYSA-N 400.567 2.456 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 776052771 BMNMSPZSQDYXEV-AWEZNQCLSA-N 404.492 2.149 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOc3ccccc3C)CC2)cc1 778246189 RBTJFWUBSJCSSP-QXMHVHEDSA-N 423.513 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CO)c3ccccc3C)CC2)cc1 778422948 OVCYVPREGOVBFP-LEQVUBRHSA-N 423.513 2.058 10 20 HECD O=C(Nc1ccc(F)nc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784766630 IWLVKTGWVQABIR-OAHLLOKOSA-N 406.845 2.299 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(Br)nc3)cc2)CC1 786259958 SWCFPVJVRMKILQ-UHFFFAOYSA-N 417.307 2.443 10 20 HECD Cc1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 788186947 HXECJXXKDPHLNR-INIZCTEOSA-N 418.444 2.393 10 20 HECD CC[C@@]1(C)CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789823022 CFZPETDAWSBBQL-DMPWYTOCSA-N 421.513 2.083 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1C(N)=O 796912659 WSEDTDVMAFGBJD-UHFFFAOYSA-N 422.532 2.266 10 20 HECD C[C@@H](NC(=O)C(=O)NCCC[C@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803303795 AFVIUQJWYXMMKO-YLJYHZDGSA-N 403.523 2.166 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCC2([S@@](C)=O)CC2)cc1)C1CCCCC1 803677413 OMGWZAZVDBZDDX-MUUNZHRXSA-N 405.564 2.099 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C12CCC2 804318379 JESFBEMINZFDPX-VQTJNVASSA-N 415.534 2.244 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 806282427 KRWGAJNZEMWIDB-ZIAGYGMSSA-N 409.533 2.449 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)COc3cc(F)cc(F)c3)cc2)C1 810183063 RJTZHBKKAKZXMJ-HNNXBMFYSA-N 403.429 2.362 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C\c1cn(-c2ccccc2Br)nn1 811687828 JOMVBLNTEWVAGR-ZROIWOOFSA-N 420.292 2.332 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](C)[C@@H](O)c3ccccc3)CC2)cc1 813850920 OYHZMHYPMOJEBO-JNRDKZCZSA-N 423.513 2.138 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CN(c2ccc(Br)cc2)C1=O 817028985 UGJGZBGQCAPEIH-JPFFYJABSA-N 403.232 2.405 10 20 HECD CN(C)S(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 917361360 FALFGAZQBVXLDX-GOSISDBHSA-N 418.515 2.464 10 20 HECD COc1ccc(N2CCCN(CN3C(=O)C(=O)N(Cc4ccccc4)C3=O)CC2)cc1 917487778 UDYUKICBAVQBQW-UHFFFAOYSA-N 422.485 2.156 10 20 HECD COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)CO2 917833922 VSHXJCBFLJUDBR-HKUYNNGSSA-N 423.513 2.264 10 20 HECD CNc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1[N+](=O)[O-] 918373961 HWFLOFZWLSHTFH-INIZCTEOSA-N 411.462 2.268 10 20 HECD C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 919812055 AXAIFWBEQIYGAM-LBPRGKRZSA-N 406.460 2.244 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@](C)(CO)C3)CC2)cc1 1335448960 LNBBJXBVNDQBIJ-QFIPXVFZSA-N 404.555 2.011 10 20 HECD COc1cc(N2CCN([C@H](C)C(=O)NCc3ccco3)CC2)cc(OC)c1OC 1337846393 MSTZOOWAXIGOGR-OAHLLOKOSA-N 403.479 2.132 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cccnn3)CCC2)cc1)c1cc(O)nc(O)c1 1788427108 OHFIRQDBGDDVBY-UHFFFAOYSA-N 405.414 2.344 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C3CCN(C(=O)N(C)C)CC3)cc2F)C[C@@H](C)O1 108287639 UFJXBMPSXLYRRB-IYBDPMFKSA-N 420.529 2.449 10 20 HECD C[S@](=O)CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 735054361 ZLINYWWJQQSQJU-YKATVRGKSA-N 402.588 2.224 10 20 HECD Cc1cc(C)n(-c2ccc(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)nn2)n1 737406690 TUYGEFDKWGUVML-UHFFFAOYSA-N 412.519 2.126 10 20 HECD Cc1noc(C)c1C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 738500203 KWOWMIDHTFQLPT-RDTXWAMCSA-N 413.522 2.424 10 20 HECD CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)cc21 743889403 OSBGRXLJNMBCCZ-UHFFFAOYSA-N 421.501 2.050 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2c(O)nn(C)c2n1 749405578 GXFKSXDEGGAUCY-UHFFFAOYSA-N 413.453 2.013 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 751318224 LPZAAEQTTHQTCI-CYBMUJFWSA-N 409.460 2.382 10 20 HECD COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(C)c(O)c4O)CC3)n2)cc1 751532777 FXKCOIAGRPBGJI-UHFFFAOYSA-N 424.457 2.423 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)N[C@@H](C)c3cc(OC)ccc3O)ccc2O1 752003334 ZSSOJEHONQZHBD-BUXKBTBVSA-N 421.471 2.307 10 20 HECD CCn1cnnc1-c1ccccc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 755235024 HAOCJDAUEAAOHF-ZDUSSCGKSA-N 409.446 2.495 10 20 HECD CCOC(=O)[C@H]1CCCCN1C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 756337337 UDSJHJIDMJKSCI-RBUKOAKNSA-N 404.507 2.317 10 20 HECD COCc1nc2n(n1)C[C@@H](NCc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)CC2 757700587 FBLGBEODLYNLIC-INIZCTEOSA-N 400.483 2.428 10 20 HECD COc1cc(N2CCN(CC(=O)N(C)Cc3ccccc3)CC2)cc(OC)c1OC 759885762 GVPGWFDKOPLVGE-UHFFFAOYSA-N 413.518 2.493 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H](C)C(=O)OC(C)C)CC2)cc(OC)c1OC 760123583 JAXZBLZLOFGMAP-OAHLLOKOSA-N 423.510 2.132 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1noc(-c2ccccc2)n1 764625935 OJIJIAYCCGGPGJ-NSHDSACASA-N 402.432 2.305 10 20 HECD CCN1CCN(C(=O)CC2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)CC1 769338662 TYVOHISLVFZPPX-UHFFFAOYSA-N 414.594 2.289 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3cccc4c3OCO4)cc2)C1 769893359 KCWFNSBAFPMMOT-GOSISDBHSA-N 409.486 2.366 10 20 HECD CCN1CCN(c2ccc(CN[C@@H](C)c3cccc(S(N)(=O)=O)c3)cc2F)CC1 774408358 IHHBOKPNOVFUCY-INIZCTEOSA-N 420.554 2.466 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](c2ccccc2Cl)N(C)C)cc1 775096019 LEZAHUMEICCVCJ-LJQANCHMSA-N 402.926 2.441 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CNC(=O)OCc1ccccc1 777829380 VGCQUGXSGHAUSE-UHFFFAOYSA-N 420.849 2.474 10 20 HECD COC(=O)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 778221920 XUZANILJBZLCPH-QXMHVHEDSA-N 423.469 2.325 10 20 HECD Cc1nc([C@H]2COCCN2C(=O)NCc2ccc(N3CCSCC3)cc2)no1 780821118 QXHGPGVOJZLLMI-QGZVFWFLSA-N 403.508 2.214 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2Cn2cnc3ccccc32)cc1 785423697 GULBSYVNBLVBLK-IBGZPJMESA-N 405.502 2.410 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCC2(c3ccc(F)cc3)CCOCC2)cc1 785439815 WBMVTLVFNCUFEE-UHFFFAOYSA-N 413.493 2.373 10 20 HECD CC[C@@]1(C)CN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)CCO1 785496693 ZRANKSSUHWNSSW-NRFANRHFSA-N 419.547 2.425 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCc2[nH]c3ccccc3c2C1 788321410 VXTNBUXYRAAZRH-UHFFFAOYSA-N 418.497 2.206 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1Cc1ccccc1 788324289 SBUPFQLMVBQTIS-JOCHJYFZSA-N 407.514 2.373 10 20 HECD COC(=O)C(C)(C)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788911746 QPZABHWSVNPHCX-SFHVURJKSA-N 415.534 2.341 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 788913225 VXROLXDCQCSDEH-KNQAVFIVSA-N 410.562 2.378 10 20 HECD COC(=O)COc1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 788969866 YUBMXVMKBPSTSB-UHFFFAOYSA-N 415.446 2.273 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)S1 789828969 ZQQHGYSQPCTYKG-WCVJEAGWSA-N 423.554 2.408 10 20 HECD CN(CCOc1ccccc1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855948 MSIOSUFYQLMGSR-UHFFFAOYSA-N 413.543 2.393 10 20 HECD CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 798169664 LJMPQZJNQIIWED-CRAIPNDOSA-N 404.463 2.386 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](OC)C[C@@H]3C)CC2)cc1 799528897 LCUNPUNJOALHSK-GHTZIAJQSA-N 404.555 2.416 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCc2cc(F)ccc2C1)c1ccc(N2CCOCC2)cc1 803305662 LQPDOGODEBBHSF-MRXNPFEDSA-N 411.477 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCCN3Cc3ccccc3)ccc21 803688330 PBIAJDLPVJTCMA-JOCHJYFZSA-N 420.557 2.466 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@@H]3CCCC(C)(C)C3)CC2)cc1 803746869 ISRMNNOZFMYDTG-GOSISDBHSA-N 416.566 2.018 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[S@@](=O)Cc1ccccc1 805410920 JZPKFIZQDKAOTE-MUUNZHRXSA-N 402.516 2.196 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CC(F)(F)Br)CC2)cc1 805835370 LYAPAIOHLRCNTN-UHFFFAOYSA-N 406.271 2.263 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)O2 806706276 IBRVWEANAUFSHB-PXXUWKPESA-N 403.523 2.368 10 20 HECD Cc1nnc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)o1 813464416 CUISAYRPGFYHDY-INIZCTEOSA-N 403.483 2.369 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1C(C)(C)C 918337036 CDBYJHMIYDDCQA-UHFFFAOYSA-N 404.536 2.111 10 20 HECD CCCc1noc(CCCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 918372619 NKHSBTOKMBDOAT-QGZVFWFLSA-N 413.522 2.363 10 20 HECD C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1)n1cccn1 918444746 WAGWEXZJOJQEQS-HNNXBMFYSA-N 421.457 2.386 10 20 HECD C[C@@H](NC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)c1ccc(N2CCOCC2)cc1 920887552 DWJPEPMBMRNSLA-MRXNPFEDSA-N 422.485 2.066 10 20 HECD C[C@@H]1CN(CCCNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 920921008 OKVQZFMJQRWEHM-GUDVDZBRSA-N 404.555 2.383 10 20 HECD CCOc1ccc(N2CCN(C(=O)CCNS(=O)(=O)c3cccs3)CC2)cc1 1323191752 CVWIWYHRCLDXIW-UHFFFAOYSA-N 423.560 2.164 10 20 HECD CN1CCC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)C1 1799897674 WNMZLSINHJVDIA-DMRZNYOFSA-N 421.925 2.345 10 20 HECD C[C@@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)O1 1818871934 AQMZWGYOOALOQB-BYCMXARLSA-N 415.450 2.089 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C)c3=O)c2C)cc1 17180301 NYNNTWBGKRTJAK-UHFFFAOYSA-N 419.441 2.207 10 20 HECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCc2ccc3c(c2)CCCN3C)C1 726250193 TWBBSKSEVQCLHM-QFBILLFUSA-N 402.539 2.142 10 20 HECD Cc1ccc(C(=O)OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c(O)c1O 727004767 SUAQJYDSIOYSSJ-UHFFFAOYSA-N 400.431 2.034 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCN2CCCS2(=O)=O)cc1 728837074 MFKYOAFBOCIHEN-UHFFFAOYSA-N 407.458 2.069 10 20 HECD C[C@@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1C(=O)NC2(CCCC2)C1=O 735517070 HCPRARXNCIZKPX-DOTOQJQBSA-N 415.490 2.153 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)N3CCCCCC3)CC2)cc1 741028819 IZLACKLHMFLUNK-GOSISDBHSA-N 403.523 2.152 10 20 HECD CCOC(=O)CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 744390439 GQRHIJCZQKNVBI-UHFFFAOYSA-N 406.438 2.428 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H](NC(=O)C2CC2)[C@H](C)O)c(C)n1-c1cccc(F)c1 745748661 TXDKINWBSRBSRI-VBKZILBWSA-N 416.449 2.235 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccnn1Cc1ccccn1 746420765 CORPUSUNROQLMD-UHFFFAOYSA-N 405.458 2.166 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCS3)cc2F)C[C@@H](C)O1 750900763 IAFFNVIWNVCIMB-QWQRMKEZSA-N 410.511 2.494 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)oc1C 751114138 LPSRPTOKTJDTQS-UHFFFAOYSA-N 408.476 2.284 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(C(=O)NC2CC2)cc1 756948889 AXMOXNCMQSQKGL-UHFFFAOYSA-N 413.499 2.066 10 20 HECD CC(C)n1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 757247236 IOXBAMXTJNKVNE-GASCZTMLSA-N 417.485 2.472 10 20 HECD COc1cc(N2CCN(C(=O)CSc3nncs3)CC2)cc(OC)c1OC 759224077 BCSTUWRSUFASDN-UHFFFAOYSA-N 410.521 2.005 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc1CC(=O)O 761285943 BACQYBNKOWFLMZ-UHFFFAOYSA-N 404.488 2.183 10 20 HECD C[C@]1(c2cccc(C(=O)NCc3cccc(Br)c3O)c2)NC(=O)NC1=O 765747090 LIQWFPFOPMGBJQ-GOSISDBHSA-N 418.247 2.139 10 20 HECD COc1cc(OC)cc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 767840936 NDOQLVSOLVQVLQ-UHFFFAOYSA-N 410.467 2.362 10 20 HECD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768914139 CPXPBTUVCLWWMI-HNNXBMFYSA-N 407.858 2.240 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1O 769506972 DBZAKDZGZJVJTI-XHSDSOJGSA-N 420.531 2.314 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1C1CCCC1 772955141 PZRYHKLCVHNJBE-UHFFFAOYSA-N 411.506 2.398 10 20 HECD Cc1cc(C(=O)N2CC(=O)N(C)C(=O)C2)c(C)n1-c1cccc(Br)c1 773677968 RALVXYDPOYFGLD-UHFFFAOYSA-N 404.264 2.297 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCN(Cc2ccccc2)CC1 774539745 FMKUAAIDVIFDCK-UHFFFAOYSA-N 408.546 2.492 10 20 HECD CC[C@H](C)Oc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccn1 777361930 VOINOOCWQQYKDK-INIZCTEOSA-N 417.531 2.424 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccnn2-c2ccncc2)C2CC2)cc1 780048215 OCNLQSKRMGTMLB-UHFFFAOYSA-N 404.474 2.463 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(C[S@@](C)=O)c3)cc2)CC1 786263008 RRYHHAKAUQIGBW-GDLZYMKVSA-N 413.543 2.164 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)c1nnc2n1CCC2 786436458 NBYWRAQWNLZFRF-MRXNPFEDSA-N 424.549 2.487 10 20 HECD Cc1cccc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788312009 AHUPYNSRLYZFLG-OAQYLSRUSA-N 408.502 2.207 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 788910859 DWTAPUQTXZMCLT-UHFFFAOYSA-N 422.529 2.260 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)cc1 788975556 QTZUHUHCVGIEMR-UTKZUKDTSA-N 405.564 2.320 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1nc2c(s1)CCC2 789378968 UPOFKLPZOFTRHA-UHFFFAOYSA-N 414.531 2.095 10 20 HECD CN(C)CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)C(C)(C)C 789860410 LDKVSZVBBMLMGG-LJQANCHMSA-N 420.623 2.339 10 20 HECD COc1cc(Cl)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1C(=O)O 790405322 QFYDACABMWCMLA-UHFFFAOYSA-N 402.768 2.461 10 20 HECD COc1ccc([C@@H](CNC(=O)NCc2ccc(OC)cc2O)N2CCOCC2)cc1 792788411 DMILEIXBCQTJOF-HXUWFJFHSA-N 415.490 2.282 10 20 HECD COc1ccc(CNS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)c(O)c1 795357575 GUIXHXLXZYDAIQ-ZDUSSCGKSA-N 411.451 2.434 10 20 HECD C[C@@H]1COCCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448934 IOPVOZDKYJHCEE-CQSZACIVSA-N 411.449 2.010 10 20 HECD COC1(CO)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 803676366 FUVUUIMGMJEXID-UHFFFAOYSA-N 417.550 2.072 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCOCc3ccccc3)CC2)cc1 804346576 OFMJZQNYVQZHQQ-UHFFFAOYSA-N 411.502 2.067 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H]4CN(C)CC[C@@H]43)cc2)CC1 805025918 ZXEUYRPRLIKHTD-UNMCSNQZSA-N 412.578 2.482 10 20 HECD Cn1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 806636449 NLZXRCODGBBCBR-OAHLLOKOSA-N 406.433 2.028 10 20 HECD COCCN(CCOC)C1CCN(C(=O)NCc2ccc(N(C)C)cc2C)CC1 806822119 WPINDCJZYIHSRG-UHFFFAOYSA-N 406.571 2.330 10 20 HECD O=C(NCCOC1CCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807160388 YZYHBDVLYDSMKK-CQSZACIVSA-N 411.449 2.058 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807653539 DVCFXKNUJDLEPJ-FTRWYGJKSA-N 408.502 2.240 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807674755 QJDSDHWBXBKWBW-INIZCTEOSA-N 418.538 2.399 10 20 HECD COC(=O)c1cccc2c1N(S(=O)(=O)c1cccc3nsnc13)[C@@H](C)C(=O)N2 808584338 YEWBCZBUNLIMSE-VIFPVBQESA-N 418.456 2.014 10 20 HECD CCN(CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C[C@@H](C)OC 812907004 OPWADRXXJVOWJM-OAHLLOKOSA-N 407.536 2.281 10 20 HECD CNC(=O)c1ccc(Cl)cc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 917826260 WZBKXXYYFCHLIS-UHFFFAOYSA-N 416.909 2.469 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccccc3)cc2)C1 917833132 MBIHHWKVOUHUCC-HXUWFJFHSA-N 422.529 2.215 10 20 HECD COc1ccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918338041 KDDNMGQOGBILEW-UHFFFAOYSA-N 402.516 2.179 10 20 HECD O=C(O)[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCOCC2)c(F)c1 1326324254 VWHVEWZHEPUDIO-KRWDZBQOSA-N 403.410 2.356 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccsc1)C2)c1cc(O)c(O)c(Cl)c1 1799767570 YNVUVLNFSOARBT-YWVIFJGQSA-N 422.890 2.330 10 20 HECD Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1805006935 FEZTVFUDCSQTQV-QRWLVFNGSA-N 421.457 2.158 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1 15725985 RWMLEZPFKCNGKG-UHFFFAOYSA-N 415.515 2.436 10 20 HECD O=C(C[C@@H]1CCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565426 MWLBAAVROAJXRQ-ZDUSSCGKSA-N 402.463 2.198 10 20 HECD COc1ccc(N2CCCN(C[C@@H](O)Cn3c(-c4ccccc4)noc3=O)CC2)cc1 731531832 UTNCVKXRTXOCJM-HXUWFJFHSA-N 424.501 2.085 10 20 HECD COC(=O)NCc1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 735394193 KMFCMKYHCWRVCW-GFCCVEGCSA-N 401.419 2.073 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)c[nH]1 743046054 MRTFGRZLNPKXGB-UHFFFAOYSA-N 407.429 2.454 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N[C@H]1CCSC1 743556816 MCRGHSKSFOREEG-INIZCTEOSA-N 416.526 2.247 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(CCN2CCOCC2)C1 745826785 DKGARGLYDORHDV-NRFANRHFSA-N 417.598 2.079 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)C(=O)N(C)c4ccccc43)nc12 745985538 MMXMMZZQEHDEEZ-CYBMUJFWSA-N 409.446 2.231 10 20 HECD O=C(CSc1nnc(S)s1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405085 ASCIXKAUYVPMMB-UHFFFAOYSA-N 414.553 2.336 10 20 HECD COc1ccc(-c2nnc(S)n2CCC(=O)NCCc2ccc(O)c(O)c2)cc1 750794590 IPDXENSSUGUSPO-UHFFFAOYSA-N 414.487 2.403 10 20 HECD COc1ccccc1N1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 756925081 BIDUFYMPHRCCRW-LJQANCHMSA-N 424.501 2.137 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(C)c(S(C)(=O)=O)c1 758966730 XGOLRXHXDQLPJH-UHFFFAOYSA-N 417.531 2.452 10 20 HECD CCN(CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)C(C)C 759265401 GAKMGTQODZAJIT-UHFFFAOYSA-N 408.543 2.274 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@]34CCOC4)cc2F)C[C@@H](C)O1 764642605 LZDCGJSPOWBUFT-WQLIQUDQSA-N 420.481 2.025 10 20 HECD Cc1sc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 767718053 DNKUIVLJEJXHOO-UHFFFAOYSA-N 415.468 2.419 10 20 HECD CS(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)Cc2ccccc21 770378897 FQIAYFWKUKJKME-UHFFFAOYSA-N 401.532 2.305 10 20 HECD O=C(NCCCSc1nccs1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 776055202 HPELUEJVZDTMSF-NSHDSACASA-N 401.539 2.003 10 20 HECD COCc1ccccc1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 778661201 KCJHLPYSHLODTG-UHFFFAOYSA-N 403.504 2.336 10 20 HECD O=C(NCCSc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 785424524 JIGRRXCUYANUIY-UHFFFAOYSA-N 417.506 2.187 10 20 HECD CC1(C)CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC(C)(C)O1 785864002 HKKDPHDWQWPFPU-QGZVFWFLSA-N 402.539 2.487 10 20 HECD CCOc1ccccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 786688887 JBGNDGMDCSVVIE-UHFFFAOYSA-N 411.502 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(Cl)nc3C)CC2)cc1F 789623331 OEBMKFZAJLMDIT-UHFFFAOYSA-N 406.845 2.478 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 792984496 LVGCOURXIRCAAV-UHFFFAOYSA-N 424.207 2.326 10 20 HECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793715746 ABCFVHQAJOPYNV-BHIYHBOVSA-N 414.550 2.090 10 20 HECD NC(=O)CC1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 794280509 HOTSOUPIIQVKDN-JYRVWZFOSA-N 409.558 2.063 10 20 HECD O=C(NCCCSc1nccs1)N1CCC(S(=O)(=O)N2CCCC2)CC1 800711418 GWFYZRSEXHGHMM-UHFFFAOYSA-N 418.610 2.225 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1ccccn1)C1CC1)c1ccc(N2CCOCC2)cc1 803297703 DFYGZNXCIMZMBQ-KRWDZBQOSA-N 408.502 2.287 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H](OCC4CC4)C3)CC2)cc1 804315256 ITHDWFBNNOQBQM-OAQYLSRUSA-N 415.534 2.198 10 20 HECD COC(=O)c1cc(C)c(NC(=O)C(=O)NCc2cc(OC)ccc2O)c(Cl)c1 806897331 HWJSFBDVQZILCV-UHFFFAOYSA-N 406.822 2.404 10 20 HECD C[C@H](NC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1ccc(N(C)C)cc1 807141070 PWTPQMFCFWAYFA-JKSUJKDBSA-N 408.568 2.317 10 20 HECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)cnc1C 813661372 KAJKGOJNEANMOH-UHFFFAOYSA-N 419.503 2.133 10 20 HECD CN(Cc1nccn1C(F)F)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918117483 LMSNKIBTRZMAMT-HNNXBMFYSA-N 420.464 2.322 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cncs3)cc2F)C[C@@H](C)O1 919042767 ZTKKBWJYYWMEGG-CHWSQXEVSA-N 407.467 2.369 10 20 HECD O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1-n1cnnn1 919895606 PHOMAAJBAOLODJ-UHFFFAOYSA-N 403.490 2.447 10 20 HECD C[C@H](NC(=O)N1CCC[C@@H](CS(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1 920872137 OUSZVPKWMAYBSE-DLBZAZTESA-N 409.552 2.050 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3CNc3cccc(C)n3)nc12 1116349915 QBJHYTMNWPIHOM-MRXNPFEDSA-N 410.478 2.392 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cncc(OCC(F)F)c3)cc2)C1 1319287198 PWNINSCRHFHAOT-HNNXBMFYSA-N 418.444 2.357 10 20 HECD Cc1n[nH]cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800716332 CINLODLSDPCJFP-CLLJXQQHSA-N 404.854 2.348 10 20 HECD Cc1cc2cc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)ccc2[nH]1 1843250667 AQQUIDRWFOGYPN-UHFFFAOYSA-N 406.442 2.413 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C12CC(C(F)(F)F)(C1)C2 1847883477 BJQUYAAXYTVBIQ-VCKYCXPWSA-N 411.380 2.041 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C 726597510 RXLUGSHUAJHLPO-LJQANCHMSA-N 415.559 2.347 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cc4c(s3)CCOC4)CC2)cc1 728519181 XOQBDUCZPSVWAP-UHFFFAOYSA-N 401.532 2.381 10 20 HECD CC(C)C[C@@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 733846901 AGFANPCOZHPKJY-UYAOXDASSA-N 402.539 2.345 10 20 HECD Cc1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(C(C)C)n1 734123725 XBOLBXXZVXJVIL-UHFFFAOYSA-N 402.520 2.073 10 20 HECD COc1cc(OC)cc([C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 735679642 AMYBZESESXPCEN-OAQYLSRUSA-N 415.490 2.073 10 20 HECD Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n(C(C)(C)C)n1 737118662 YOGXIODFSIDLMC-UHFFFAOYSA-N 413.522 2.380 10 20 HECD CS[C@H](CO)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 740469507 RBHDLQJEGGYUBA-BLLLJJGKSA-N 421.485 2.454 10 20 HECD COc1ccc(N(CC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)C(C)C)cc1F 744393465 LEMMTUQSMXIHQZ-UHFFFAOYSA-N 420.485 2.031 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@]3(C)CCO[C@@H]3C3CC3)CC2)cc1 753092334 BJAABBVUWDDHJQ-GGAORHGYSA-N 416.566 2.464 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(c4ccccc4C)CC3)CC2)cc1 753995677 RQDVMLMTOARYQL-HSZRJFAPSA-N 424.589 2.309 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C[C@@H](C)O)C3CCCCC3)CC2)cc1 754027400 JLPIVKZTCCSWCG-KNQAVFIVSA-N 405.583 2.194 10 20 HECD COc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(C)c1 754214015 KAWXTDDIOHVRGV-UHFFFAOYSA-N 401.438 2.439 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 756570636 AZFDQVILMCKTPE-OAHLLOKOSA-N 418.515 2.264 10 20 HECD COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NCc2ccccc2O)cc1OC 756766931 CZNKLFOJVAOSPX-UHFFFAOYSA-N 424.457 2.218 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](c3ccsc3)N(C)C)CC2)cc1 758211381 UUFLUEMZGGWSDF-IFMALSPDSA-N 418.607 2.132 10 20 HECD COCC(=O)Nc1ccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)cc1 761554384 UGHCKCMHSFKIOP-UHFFFAOYSA-N 418.431 2.066 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(N2CCCCC2=O)CC1 763596117 VMGPFILIVFPIKF-UHFFFAOYSA-N 400.523 2.210 10 20 HECD O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cs1 768848409 OMCIASRJDNOXKQ-UHFFFAOYSA-N 415.468 2.235 10 20 HECD CCOC(=O)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769733308 UNTZQOKORRJAPY-MRXNPFEDSA-N 406.460 2.188 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 770630158 FYYAOOBCUXQWHF-SXGZJXTBSA-N 410.486 2.270 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(/C=C/C4CCOCC4)n3)CC2)cc1 771064389 AXTKKKQIKYNDAK-FARCUNLSSA-N 412.490 2.409 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4csc(C)n4)n3)CC2)cc1 771069509 WGGIESAZKARSIB-UHFFFAOYSA-N 413.503 2.325 10 20 HECD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 771135715 JBMFLLKOVRBCFR-LJQANCHMSA-N 420.554 2.237 10 20 HECD COc1cc2c(cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)NC(=O)CC2 773847069 NDNRFEFVPDOWJR-ZDUSSCGKSA-N 410.474 2.462 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1c[nH]nc1-c1ccccc1 782777365 YMUJLRGZAONZFW-UHFFFAOYSA-N 423.448 2.307 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(F)n3)cc2F)C[C@@H](C)O1 783207138 PREJNUQFJIAOSA-OKILXGFUSA-N 419.428 2.447 10 20 HECD COC[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)O1 784370233 JRTGVMDTGDSULH-HOCLYGCPSA-N 408.454 2.136 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)cc1 785423636 DSTMGFFAJWSZQX-HNNXBMFYSA-N 402.445 2.042 10 20 HECD CC1(c2ccccc2)CC(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321027 SGEXUNVBSQIWLQ-UHFFFAOYSA-N 407.514 2.376 10 20 HECD C[C@@H]1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 789798199 DAYARHDIQSWDHZ-NUJGCVRESA-N 405.514 2.467 10 20 HECD COc1ccc(CNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)c(O)c1 794378735 COVWUJKEVVWBFK-UHFFFAOYSA-N 410.405 2.190 10 20 HECD COc1cc(N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)ccc1F 801963255 ANCAUJYBPKTXDM-UHFFFAOYSA-N 400.498 2.339 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cnc(C3CC3)nc2)cc1F 804852552 KGXUHQSBAOMSQO-UHFFFAOYSA-N 413.497 2.314 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)cc1 807675738 IUTPOOLGNSKWHW-QFIPXVFZSA-N 422.529 2.037 10 20 HECD COCC1(c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)CCC1 809464545 GXYOOOXIPJKAAG-UHFFFAOYSA-N 400.479 2.038 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)[C@H](O)c3ccccc3)CC2)cc1 812016890 STVFDKPQHHMBPF-GCJKJVERSA-N 412.534 2.239 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C)c4ccccc43)cc2)CC1 1321207637 OUUBBNNREQVEGX-OAQYLSRUSA-N 420.513 2.122 10 20 HECD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1804283602 HOOMVSGUSSJKQZ-NCSHHQJSSA-N 423.469 2.472 10 20 HECD Cc1cc(C)nc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1843165035 VXGVQRQZJSBMSA-FNORWQNLSA-N 423.469 2.346 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(N2C(=O)CCC2=O)c1 728301421 ARAMKJXCYUSZHV-UHFFFAOYSA-N 407.470 2.449 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1 728942984 BICNQCJZFSWYPM-CYBMUJFWSA-N 407.492 2.212 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(=O)Nc1ccccc1 732591349 BZFHRRMHKNSPRL-WMZOPIPTSA-N 423.517 2.215 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[S@](=O)[C@H](C)[C@@H]3C)cc2F)C[C@@H](C)O1 736653539 PRZNNLORADBYFK-MUVMJATBSA-N 411.543 2.490 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC2(C1)OCCO2 741779616 YPUJXRGEPMEOEG-CQSZACIVSA-N 406.438 2.238 10 20 HECD CC1CCN([C@@H](C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 743334142 OOGCBGHJSBSEIN-AZUAARDMSA-N 415.582 2.308 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nnc2ccccc2c1=O 743808876 GEPJOOUUEJLNJX-UHFFFAOYSA-N 417.263 2.308 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H](CCO)C3)CC2)cc1 745349430 HUPFTXQINJVTOW-LJQANCHMSA-N 404.555 2.011 10 20 HECD Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(-c2ccncc2)n1 745861802 MVKHXUSQKZGFAA-GOSISDBHSA-N 418.501 2.114 10 20 HECD COC(=O)CN(CCN1CCOCC1)Cc1c(O)ccc2oc3c(c12)CCCC3 746382204 ZRRDQPLGLKYZHQ-UHFFFAOYSA-N 402.491 2.324 10 20 HECD C[C@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756440052 COOJRRUXFJFUBH-IEBWSBKVSA-N 415.559 2.340 10 20 HECD COC[C@@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 756655956 RMSWROJPZSVXAU-ZDUSSCGKSA-N 422.503 2.140 10 20 HECD COc1cc(N2CCN(C[C@@H](O)COCc3ccco3)CC2)cc(OC)c1OC 759879395 URVVOKHMUGXHSW-QGZVFWFLSA-N 406.479 2.005 10 20 HECD CC(C)c1nc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n[nH]1 763008416 ILNBRRSTGKXSGI-GDBMZVCRSA-N 413.526 2.190 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1F 765633974 JPINNAXFERCNOE-UHFFFAOYSA-N 402.425 2.117 10 20 HECD COc1cc(N2CCN(CC(=O)N3CCCC[C@H]3C)CC2)c([N+](=O)[O-])cc1OC 766934562 YOXAIRAZAUZMTE-OAHLLOKOSA-N 406.483 2.135 10 20 HECD COC(=O)[C@@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 769878369 CYBODPIDNPVOHA-SFHVURJKSA-N 424.500 2.326 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC[C@@]2(C)NC(=O)NC2=O)cc1 771832270 KHZXHCITVPQBLU-XMSQKQJNSA-N 416.522 2.029 10 20 HECD Cc1ncc(CCNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 772020437 IOBFBWUPZVTIQE-INIZCTEOSA-N 401.536 2.195 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H](O)Cc3ccccc3Cl)CC2)cc1 772509934 MJGPYMRVXWNHPW-NRFANRHFSA-N 417.937 2.190 10 20 HECD Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc12 773764038 UERKKASGVKYDKN-ZYHUDNBSSA-N 416.503 2.220 10 20 HECD C[C@H](NC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 773990108 SPBFGAVMXACDPH-AWEZNQCLSA-N 420.491 2.159 10 20 HECD CCC1(CC)CC(=O)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C(=O)C1 774823578 JEFPTVFOIHRGKY-UHFFFAOYSA-N 401.507 2.299 10 20 HECD CC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 778306369 XMNIFOIACUAGKD-SHBDEGQCSA-N 415.534 2.221 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)[C@H]3CCCOC3)CC2)cc1 780044627 PPOMDPQSCYJDHA-OALUTQOASA-N 404.555 2.322 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc(F)c3F)cc2)CC1 786122100 NMJPUBLEKMFGGL-UHFFFAOYSA-N 409.458 2.112 10 20 HECD COc1cc(C)ccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856962 ZJCZQJJFRGJPQQ-UHFFFAOYSA-N 413.543 2.489 10 20 HECD C[C@H](O)[C@@](C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)Cc1ccccc1 791417252 KIBKQECZZHCKJW-VBKZILBWSA-N 406.504 2.123 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCCN3CCCC3)cc2F)C[C@H](C)O1 799174011 IJZBUHUJKXKYPP-OALUTQOASA-N 420.573 2.473 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc2c(n1)CCCC2)c1ccc(N2CCOCC2)cc1 803307691 KNGIRVYEIIJOEN-QGZVFWFLSA-N 422.529 2.291 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CN(C(=O)OC(C)(C)C)C2)cc1F 804748454 LKOATGQNZWCABF-UHFFFAOYSA-N 422.501 2.024 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804853500 ZGGIQPGAMGPPIG-MRXNPFEDSA-N 407.486 2.090 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccoc3C)cc2F)CC1 805007734 ZCVSWISGNILZGM-UHFFFAOYSA-N 416.497 2.144 10 20 HECD C[C@@H]1C[C@H](NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 806953884 KTULCXQCJMGXKO-KFWWJZLASA-N 411.449 2.057 10 20 HECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 807100142 KWVVARGMNJYZFT-AEFFLSMTSA-N 418.538 2.050 10 20 HECD O=C(C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCN(c2ccccc2)CC1 812504188 PHMAQSZNRJTSGB-NRFANRHFSA-N 423.513 2.249 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 918284839 RGRGEIJEUBIVPV-UHFFFAOYSA-N 405.401 2.065 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N2CCN(c3ccc(OCC)cc3)CC2)C1 1319715415 RROPQSRBNNKJBR-RTBURBONSA-N 417.550 2.398 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](Cc4nccn4C)C3)CC2)cc1 1323071082 MIPZYZYEEGETDG-IBGZPJMESA-N 411.550 2.032 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C3CCN(C(=O)N(C)C)CC3)cc2F)C[C@@H](C)O1 108287645 UFJXBMPSXLYRRB-HZPDHXFCSA-N 420.529 2.449 10 20 HECD C[C@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 727137404 QALNFNQBEIWBJD-KRWDZBQOSA-N 401.482 2.166 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCC1 729505948 GLSXDTVPEFXMMJ-GOSISDBHSA-N 401.555 2.062 10 20 HECD COC(=O)c1ccc(CCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 731577406 KIBWPVFOKCCPLZ-HXUWFJFHSA-N 423.513 2.424 10 20 HECD CS(=O)(=O)CCN1CCC(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 731678488 FHRZLUBQRWAYRI-UHFFFAOYSA-N 424.567 2.184 10 20 HECD COC(=O)/C=C1\SCC(=O)N1CCCN(Cc1ccccc1O)C[C@@H]1CCCO1 731844259 FJIZVJHHHBEMTK-BRLDDBHUSA-N 420.531 2.353 10 20 HECD Cc1cc(NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)n[nH]1 733360218 PUDOHEDIXUYOER-UHFFFAOYSA-N 417.403 2.385 10 20 HECD COC(=O)[C@H](C)CSCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 734368992 VWNDLINQCOBIIT-GFCCVEGCSA-N 424.544 2.467 10 20 HECD CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741099509 BJGAPDGWDYOGBX-MRXNPFEDSA-N 422.485 2.291 10 20 HECD CC[C@@]1(C)NC(=O)N(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1=O 744373409 XZUWUQKYFLRTNS-ZUOKHONESA-N 424.448 2.094 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)CC3CCCCC3)cc2)C1 748714639 OKJWVYRCUOEJNN-IBGZPJMESA-N 414.550 2.091 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1O 750819836 NLXXSUKXJAZCHC-UHFFFAOYSA-N 410.442 2.380 10 20 HECD CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)N[C@H](C)c3cc(OC)ccc3O)ccc2O1 752003332 ZSSOJEHONQZHBD-BLVKFPJESA-N 421.471 2.307 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ccc2c(c1)C(=O)NCC2 758385682 WFZJWJXVGWXORD-UHFFFAOYSA-N 422.529 2.181 10 20 HECD CN(C)C1CCN(CCNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 759582909 AGGYENVKMCYMAC-FQEVSTJZSA-N 404.555 2.109 10 20 HECD Nc1ncncc1CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 761987684 ZIXUOFNNBPRXFD-NTUHNPAUSA-N 419.557 2.418 10 20 HECD C[C@@H](C(=O)Nc1cccc(NS(=O)(=O)c2cccc3nonc23)c1)n1cccn1 765050531 ZLGVPFQHBOAHLX-LBPRGKRZSA-N 412.431 2.420 10 20 HECD CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773746169 ZAGMEOMGLQOQRQ-ZFWWWQNUSA-N 421.519 2.138 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cccc2c(C(=O)OC)nccc12 775286926 QLDIXOPMWKKMHO-UHFFFAOYSA-N 416.411 2.314 10 20 HECD Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)c3cccc(O)c3O)C2)cc1 776344207 NZTGDWNFRDVPOS-OAHLLOKOSA-N 404.488 2.237 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccc(NC(=O)C3CCC3)c2)cc1 785434514 UQGJMJZYRQEECA-UHFFFAOYSA-N 408.502 2.424 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccccc3Cn3cccn3)ccc21 785640063 IWCVLWAKZWNFSM-UHFFFAOYSA-N 417.513 2.246 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)N3CCc4ccccc43)cc2)CC1 786686597 XLEBYELLTUIYNR-SFHVURJKSA-N 406.530 2.423 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)cc1 787143204 ILYLFKNUBWAFBF-UHFFFAOYSA-N 423.561 2.325 10 20 HECD COCc1cccc(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 787519214 LLLYNDZRDJVUIN-UHFFFAOYSA-N 411.502 2.197 10 20 HECD O=C(NCc1ccc(Cn2cccn2)cc1)C(=O)NCc1ccc(N2CC=CC2)cc1 788460125 NUKBOWOOFUUAMQ-UHFFFAOYSA-N 415.497 2.240 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(-n2ccnc2)cc1 788933038 OSQDOTZTNZOIIW-UHFFFAOYSA-N 403.486 2.405 10 20 HECD C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@H]1C 789840477 JHVUYKIUFZNCFM-INMHGKMJSA-N 405.514 2.344 10 20 HECD C[C@@H]1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789854806 DOPCZJRAKMMVFU-SJORKVTESA-N 405.564 2.177 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cnc(CC2CC2)nc1)c1ccc(N2CCOCC2)cc1 792969575 FBOPXAMNDDMZBP-HNNXBMFYSA-N 409.490 2.082 10 20 HECD COc1ccc(OCCCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 793861538 HAFLUNFVGSCROX-UHFFFAOYSA-N 403.454 2.102 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N[C@H]2CCc3c[nH]nc3C2)cc1)C1CCCCC1 803676324 DQUNTXKPXXYUNB-SFHVURJKSA-N 409.534 2.469 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 803679672 VEFUIQWGIFJLCW-LEWJYISDSA-N 417.550 2.382 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 806276265 AQHVYLORMKHXGG-HOCLYGCPSA-N 408.593 2.217 10 20 HECD COc1ccc2c(c1)nc(CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)n2C 806667978 QVJPDPUMDNIRLR-CQSZACIVSA-N 409.490 2.142 10 20 HECD Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807672916 KFKLUXPBWHCQKV-UWJYYQICSA-N 422.529 2.156 10 20 HECD Cc1ncc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 807932233 UPNVQPRXNVNIDN-MRXNPFEDSA-N 403.504 2.024 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)CCn3ncn(C)c3=O)c2C)c1 815268428 OHLHIHMJZFVYDI-UHFFFAOYSA-N 410.474 2.422 10 20 HECD COC(=O)C(C)(C)c1csc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 815369923 PPRVIPJFOXIDFX-UHFFFAOYSA-N 418.519 2.257 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 918308045 CXPLWKOYEUPMSL-UHFFFAOYSA-N 413.474 2.138 10 20 HECD CC(C)(C)N1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918782576 SKXLURVQIRCVRS-SFHVURJKSA-N 415.582 2.450 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccn3C)cc2F)C[C@@H](C)O1 918800844 NNPFDLOOFTZTMS-HUUCEWRRSA-N 403.454 2.251 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C1=CCCC1 1816722708 VBOKZKRAVSMYPC-LBPRGKRZSA-N 400.460 2.285 10 20 HECD C/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900823 YETMFEBVRNBUBQ-TYMUOXQOSA-N 423.604 2.433 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccc(F)cc2)CC1 1848047243 SDLASZYGEKKBPY-IRXDYDNUSA-N 411.433 2.179 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CCN(CC(F)F)CC1 64255173 GRJHQLSSRNNZMZ-UHFFFAOYSA-N 410.509 2.424 10 20 HECD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3ccc([N+](=O)[O-])cc3)C=C2)cc1 466306032 HXUBDNPKOHBVDB-UHFFFAOYSA-N 411.439 2.255 10 20 HECD Cc1cc(C(=O)NCCCS(N)(=O)=O)c(C)n1-c1cccc(Br)c1 725888641 NPRAALSEESGOKZ-UHFFFAOYSA-N 414.325 2.265 10 20 HECD COC(=O)[C@@H](C)CN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)C1CC1 726786684 QOMPAUXQRREEFN-HNNXBMFYSA-N 404.507 2.201 10 20 HECD COc1cccc(CNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1O 727762548 PBSXJKUCCLTDEO-UHFFFAOYSA-N 418.515 2.264 10 20 HECD O=C(NCCCN1C(=O)CCC1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 730029546 SMJILVUTWFCLOZ-UHFFFAOYSA-N 424.448 2.095 10 20 HECD CN(Cc1ccc(N(C)C)cc1)Cn1nc([C@H]2CCS(=O)(=O)C2)n(C)c1=S 732496627 CSHSQNISNHRAOT-HNNXBMFYSA-N 409.581 2.009 10 20 HECD Oc1cccc(Cl)c1CN[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1 733326546 KDHPPWJZWZPKDP-HNNXBMFYSA-N 403.914 2.431 10 20 HECD CCOC(=O)Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 739081055 OPGDFUFSTJHGRQ-ZDUSSCGKSA-N 400.431 2.322 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)NC[C@]1(N2CCOCC2)CCSC1 743556488 LJOAQCNZGFMBMA-OAQYLSRUSA-N 405.564 2.278 10 20 HECD CCOC[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 747966864 LBNKLXDTNLMTKM-QGZVFWFLSA-N 419.547 2.283 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc2c(c1)CCCN2C)c1nc(-c2nc[nH]n2)no1 752656965 BGNIEVPVWBONCL-INIZCTEOSA-N 410.482 2.434 10 20 HECD CN(C)C(=O)c1cc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)ccn1 754924217 WHYLOYMCKQVKII-UHFFFAOYSA-N 422.441 2.250 10 20 HECD COC(=O)Cc1csc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)n1 756327733 PYRPUYWSFPQKSD-INIZCTEOSA-N 419.503 2.184 10 20 HECD COC(=O)C[C@@H](C)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759006314 WEXUCTMTZOWFMT-GFCCVEGCSA-N 409.394 2.143 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccc4c(c3)N(C)CCO4)CC2)cc1 763972588 MVIQAMJXAPDPTP-UHFFFAOYSA-N 424.545 2.466 10 20 HECD COCCN(Cc1ccc(N(C)C)cc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N 768139365 DNUHQQRQPVPKKO-UHFFFAOYSA-N 423.517 2.298 10 20 HECD O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(Cc2c(O)cccc2Cl)CC1 768217149 GHGVQULTYZWASY-UHFFFAOYSA-N 422.894 2.134 10 20 HECD O=C(Nc1cnn(-c2ccncc2)c1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 768712181 AASRIBGBTPCEQY-LJQANCHMSA-N 421.457 2.119 10 20 HECD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1ccc(N2CCC(CO)CC2)cc1 769359636 PSJIXQWHVBRMBH-UHFFFAOYSA-N 420.491 2.063 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 773767443 MFKQCQHDAKZTBZ-JTQLQIEISA-N 407.810 2.137 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(O)nc(C(C)C)c3)nc12 775043522 OLYIVRLAUSFVNY-UHFFFAOYSA-N 400.391 2.193 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc4c(c3)COC4)CC2)cc1 778389021 CCZZFICYLOTDFA-HJWRWDBZSA-N 421.497 2.247 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 778627452 OENQYCXHPGCVNE-UHFFFAOYSA-N 403.366 2.229 10 20 HECD CCc1cnccc1CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 779004587 WTONOGFNZYBPQL-HJWRWDBZSA-N 408.502 2.174 10 20 HECD CN(Cc1nccn1Cc1ccccc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785421092 AYVQSLPOHSFZBP-UHFFFAOYSA-N 405.502 2.272 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3NC(=O)O[C@H]3C)c2C)cc1 786072590 QFXGXJCMHQOTMH-SCLBCKFNSA-N 414.414 2.104 10 20 HECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@]2(CCOC2)O1 796557002 SWRAMMTZBKTZNE-OYLFLEFRSA-N 420.465 2.280 10 20 HECD CN(Cc1nccn1CC(F)(F)F)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686909 JQFVXOGSJZRJGH-UHFFFAOYSA-N 423.439 2.103 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccn1 807010271 XTUIZJUDCRGSTD-MRXNPFEDSA-N 418.881 2.169 10 20 HECD COc1cnccc1[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807175894 WNNWRDKUKSGYLW-RDJZCZTQSA-N 413.474 2.181 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 807292431 XQPYCKGLVBFHPV-OAQYLSRUSA-N 409.461 2.418 10 20 HECD CCc1nc(C)c(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)o1 813611358 TUWVRMRSPMGKAI-UHFFFAOYSA-N 401.511 2.175 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\CN(C)CC(F)(F)F)cc2)CC1 816379323 LXXRFJYJJQQWPF-ARJAWSKDSA-N 412.456 2.022 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(Cc2ccco2)CC1 918217738 LEWXSHDDVGGKNO-UHFFFAOYSA-N 402.470 2.283 10 20 HECD Cc1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)n1C 918841841 ANFXBYPXWFMSTI-UHFFFAOYSA-N 403.454 2.091 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1=NO[C@H](c2ccccc2)C1 919818751 SMBAIKJWERFOLL-FQEVSTJZSA-N 413.499 2.055 10 20 HECD CCNC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 920922792 IOVPKGPPQZZTLJ-INIZCTEOSA-N 424.501 2.089 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(=O)N(C)C)C3)cc1 1800513894 ZFCMGQUCQSQZLT-NUZGMZIFSA-N 422.529 2.434 10 20 HECD CO/C=C(\C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819277084 NQJUTVGJDDQIQL-PLSXKVAHSA-N 401.423 2.072 10 20 HECD Cc1cnc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)s1 1847033985 STCPJPVNMFWJBG-GQCTYLIASA-N 415.471 2.099 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1 109981429 WLOYUASOINEKRF-IBGZPJMESA-N 415.559 2.347 10 20 HECD CCS(=O)(=O)N(C)CCCNC(=O)NCc1ccc(N2CCC(C)CC2)cc1 303395601 PPBMQPOCCKPIQK-UHFFFAOYSA-N 410.584 2.394 10 20 HECD Cc1ccc(C(=O)OCC(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c(O)c1O 727004508 WUBBMCXOLFROER-CQSZACIVSA-N 418.490 2.060 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4c(nc3O)CCCC4)cc2)C1 731577556 WUORUKYPMAFCFA-KRWDZBQOSA-N 408.502 2.298 10 20 HECD Cc1sc(=O)n(CCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 740923532 IDTFXNKKIBGDGX-UHFFFAOYSA-N 407.511 2.333 10 20 HECD COc1cc(N(C)CC(=O)N2CCC(C(=O)N3CCCC3)CC2)cc(OC)c1OC 741799283 WJWOLPSSTYZYPQ-UHFFFAOYSA-N 419.522 2.010 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1C 745937650 MYGKCOSRZXJQGO-UHFFFAOYSA-N 422.478 2.236 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)NCCCSc3nccs3)c2)n1C 746433938 WGABDZKBNLUIRD-UHFFFAOYSA-N 416.532 2.484 10 20 HECD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N(C)C)c(F)c1 746805313 QTKMFCBWIKICML-IBGZPJMESA-N 400.433 2.426 10 20 HECD CCCNC(=O)[C@@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 747798300 NAISAEWFBALNHL-GOSISDBHSA-N 417.550 2.165 10 20 HECD COc1cc(OC)cc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)c1 748636865 YGVVIVSBNRNXFJ-HNNXBMFYSA-N 401.463 2.496 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)(F)C(F)F 749355343 KXCQTEGUOUIZOV-UHFFFAOYSA-N 415.366 2.459 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1nc(-c2nc[nH]n2)no1 752674941 YYQCVKYUTZLURL-INIZCTEOSA-N 408.466 2.427 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)c(C)o1 754791731 KPVZTSFXNRAXTK-UHFFFAOYSA-N 410.517 2.406 10 20 HECD CN(CCC1CCOCC1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 757637521 IYYWWKFOSOWNKW-LJQANCHMSA-N 402.539 2.346 10 20 HECD CCn1cc(NC(=S)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cn1 758921000 WEHWTGOIPURMTL-UHFFFAOYSA-N 405.524 2.448 10 20 HECD CCCCS(=O)(=O)NCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 761129476 JJCFPTKWAYENTI-CQSZACIVSA-N 419.494 2.093 10 20 HECD COc1ccc(N2CCN(C(=O)c3cc(Br)c(C)n(C)c3=O)CC2)cc1 764750032 UWICAEHZWWYWQE-UHFFFAOYSA-N 420.307 2.427 10 20 HECD CN1CCCc2cc(CNC(=O)CCC(=O)Nc3ccc4nc(O)[nH]c4n3)ccc21 765478981 BSMHBDBREZTIRS-UHFFFAOYSA-N 408.462 2.081 10 20 HECD COc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1Cl 766435029 WBDOCEYQCCAHDH-AWEZNQCLSA-N 402.882 2.375 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn(CC(C)C)c3C)CC2)cc1F 766576670 FUBIZUGJSHNYDR-UHFFFAOYSA-N 417.485 2.283 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1CC(C)C 766810024 MFAGTQJDYATWPO-UHFFFAOYSA-N 404.536 2.012 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)N(C)C[C@@H]3C)cc2F)C[C@@H](C)O1 768769301 FWEYXHITBMUPRI-XLAORIBOSA-N 406.546 2.080 10 20 HECD COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 772829065 GKOXWZVXKMYTFF-YJBOKZPZSA-N 414.499 2.018 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3ccc4c(c3)ncn4C)CC2)cc1 772920139 CCSWARZDSBWLIH-UHFFFAOYSA-N 400.504 2.483 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2C[C@@H](CO)C[C@H](OCCOC)C2)cc1F 774849313 DGQWNSWCQNVRKC-ROUUACIJSA-N 411.518 2.227 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3ccc(CF)cc3)CC2)cc1 777548939 DNYVEKWMHNOMLY-UHFFFAOYSA-N 420.506 2.428 10 20 HECD CCN(CC)C(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785294025 JWQIEODMLKZNAZ-CQSZACIVSA-N 413.474 2.266 10 20 HECD Cc1ccc2c(c1)CCN(C(=O)C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 789801015 YORMYXUKVRCBTO-UHFFFAOYSA-N 411.477 2.172 10 20 HECD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]2CCCC[C@H]12 789836749 VXOINFAJYWBKBM-ZTNFWEORSA-N 417.525 2.440 10 20 HECD C[C@H]1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789854795 DOPCZJRAKMMVFU-DLBZAZTESA-N 405.564 2.177 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1CC(C)(C)OC1=O 795654108 SQIXABSVAZGBGR-KRWDZBQOSA-N 406.438 2.426 10 20 HECD CO[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)[C@@H](C)C1 799344097 RZGOJJARWHEFQW-KSSFIOAISA-N 419.547 2.424 10 20 HECD COc1cc(O)c(CNCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1OC 802656366 OHHIVGCSCOSYJK-UHFFFAOYSA-N 418.874 2.270 10 20 HECD CCc1noc(CC)c1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803299306 IZUGOXXGPQAVMM-OAHLLOKOSA-N 414.506 2.130 10 20 HECD CC(C)CN1CCC[C@@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803688218 MIWKKQQJFYTCPS-IBGZPJMESA-N 400.567 2.169 10 20 HECD CC(C)Nc1nc(NCCO)nc(N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 804378649 ZVRPFQKNNJFCQV-OAHLLOKOSA-N 401.515 2.106 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(C(=O)NCc1ccc(N(C)C)c(F)c1)C2 806635640 UDQMGWOYEMJNRB-UHFFFAOYSA-N 420.510 2.068 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 809697812 OVOJXDVPUBDPQW-WMZOPIPTSA-N 418.538 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3[C@H]4CC[C@H]3CC(=O)C4)cc2F)C[C@@H](C)O1 809980437 OASBZWATATZFFI-MVJTYMMSSA-N 403.498 2.251 10 20 HECD CCOC(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 810195742 CELKOQUDCZALAE-UHFFFAOYSA-N 402.472 2.350 10 20 HECD Cn1nnc2c1C[C@H](C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 810318988 TVCJFFQVVGPNOF-CYBMUJFWSA-N 405.449 2.307 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)CCC3CCOCC3)cc2F)CC1 814269885 LFARJLBQACHFJI-UHFFFAOYSA-N 413.559 2.204 10 20 HECD CN(CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 918119036 XTOYNMWWRTZWMW-LJQANCHMSA-N 409.534 2.324 10 20 HECD CN1CC(=O)N(c2cccc(NC(=O)NCc3ccc(N4CCOCC4)cc3)c2)C1=O 919776033 LZWAOWCELJMCFY-UHFFFAOYSA-N 423.473 2.243 10 20 HECD CCOc1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 919877815 CKWBAODGZIQHGE-UHFFFAOYSA-N 419.459 2.481 10 20 HECD CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cccc(Br)c1O)C(C)(C)O 1117673333 YUHRUHYNDIHXGL-CYBMUJFWSA-N 417.300 2.435 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)NS(=O)(=O)c3cccs3)CC2)cc1 1320023404 GHEDSNYFMRUREL-HNNXBMFYSA-N 423.560 2.162 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnn(CC(F)F)c3)CC2)cc1 1321476890 CKMIJNRXVXQEIJ-UHFFFAOYSA-N 400.451 2.058 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@H]1CC1(F)F 1796934173 BFHORFLZTJGOPE-SLBVQIDZSA-N 416.428 2.073 10 20 HECD Cn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1800715944 ZIYYEDIIVKXFQS-CLLJXQQHSA-N 404.854 2.050 10 20 HECD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1803780557 IPZJDQVHAQPMSB-FOIQADDNSA-N 422.441 2.423 10 20 HECD COCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811803380 INAYTXQXCIJGKR-ACJLOTCBSA-N 419.865 2.112 10 20 HECD CN(C)c1ccc(CNC(=O)CSc2n[nH]c(=O)n2CCc2ccccc2)cc1 19111900 LRASHGXANRJAEG-UHFFFAOYSA-N 411.531 2.289 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCOC4=O)cc3)ccc21 60749618 QLAADYALVSDWBA-UHFFFAOYSA-N 408.458 2.281 10 20 HECD CCCc1[nH]nc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)c1[N+](=O)[O-] 731826874 NZBLIRCHXGVGBY-UHFFFAOYSA-N 418.473 2.481 10 20 HECD NS(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2O)C2CCCC2)cc1 731846148 VKCJLNUYUMWSEE-UHFFFAOYSA-N 403.504 2.423 10 20 HECD NC(=O)C1CCN(c2cccc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])c2)CC1 740610396 YOLPJMGULDPTOR-UHFFFAOYSA-N 404.448 2.097 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCc3nc(CSC)no3)cc2F)CC1 746840541 POVHRDGADQZJGR-UHFFFAOYSA-N 421.542 2.463 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC(N2CCCNC2=O)CC1 747950729 HYOGHORPOPEJHZ-UHFFFAOYSA-N 417.579 2.329 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(nc1O)CCCC2=O 749405796 JFLMQILCRAPGSV-UHFFFAOYSA-N 413.449 2.336 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3cc(Cl)cn3C)CC2)cc1 754060763 ILFQNIPSQXUCPG-HXUWFJFHSA-N 406.958 2.302 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1 755962242 IQDOJIYOVZHRIM-UHFFFAOYSA-N 423.516 2.479 10 20 HECD COc1ccc(O)c([C@@H](C)NCc2ccccc2S(=O)(=O)N2CCN(C)CC2)c1 756593410 YXONWCTYQXIQMD-MRXNPFEDSA-N 419.547 2.188 10 20 HECD COc1cc(N2CCN(C(=O)CCn3cc(Cl)cn3)CC2)cc(OC)c1OC 759221380 PRAJGPQWPMRRED-UHFFFAOYSA-N 408.886 2.301 10 20 HECD CCCCN(C)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759281374 FGGBMFLYJWIJGX-UHFFFAOYSA-N 408.543 2.276 10 20 HECD C[C@@H](Nc1cnn(CCO)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 762538773 NXJOYECEDDZWJA-CYBMUJFWSA-N 404.426 2.090 10 20 HECD O=[N+]([O-])c1cc(CNCCNS(=O)(=O)c2cccnc2)ccc1N1CCCCC1 772956213 JIEZZTZRSVMDGU-UHFFFAOYSA-N 419.507 2.048 10 20 HECD COCC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(N)=O 775977708 UOBXJVRIIDPRDW-MRXNPFEDSA-N 408.296 2.477 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CN3C(=O)N[C@H](Cc4ccccc4)C3=O)cc2)C1 777610388 JSSBWSDVNFSOEG-UYAOXDASSA-N 406.486 2.051 10 20 HECD Cc1ccc(C(=O)N2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c(O)c1O 780893294 UZMHHOACODJMES-CQSZACIVSA-N 401.438 2.330 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCOCC2)cc1)[C@H](C)C(=O)OC(C)(C)C 781529451 OATIKLMVBYBCBZ-QGZVFWFLSA-N 405.539 2.192 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(OC)c(-n4cnnn4)c3)CC2)cc1 781625613 AUNFZOQRFIFBOE-UHFFFAOYSA-N 408.462 2.078 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CC(F)(F)C1 782855174 OSPNXRHOPYAQAS-UHFFFAOYSA-N 413.358 2.192 10 20 HECD C[C@H]1CCCCN1C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785423288 VPYWLJXYVIRHRR-ICSRJNTNSA-N 400.567 2.482 10 20 HECD CC[S@@](=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 787951119 WNDKCRNVCOTGHU-MUUNZHRXSA-N 405.472 2.375 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)C2CC2)cc1 789383388 XGXYMHAHZVAECP-IBGZPJMESA-N 411.506 2.467 10 20 HECD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1(C)C 789841439 XXNWHAQGCAPYNH-OAHLLOKOSA-N 405.514 2.298 10 20 HECD COC[C@@H]1CCCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789856208 QHLVOTPQULVCBZ-GOSISDBHSA-N 405.564 2.131 10 20 HECD CS(=O)(=O)N1CCN(c2ccc(NCc3c(O)ccc(Cl)c3F)cn2)CC1 790240549 HUWTVCRVLSBUJL-UHFFFAOYSA-N 414.890 2.273 10 20 HECD C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 793822859 FGORDYTXKZYVFM-JXFKEZNVSA-N 412.486 2.353 10 20 HECD COc1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c(O)c1 794376263 DPBPKYABEWGKTF-FQEVSTJZSA-N 405.454 2.453 10 20 HECD CN(CCCN1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 798383646 WGBJCAKYRPZNCJ-IBGZPJMESA-N 401.555 2.016 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C(C)C 803307647 JSTFJWCLSBCIMH-XLIONFOSSA-N 405.539 2.268 10 20 HECD CC(C)[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N(C)C 803497794 XNZUXQKICOSKRQ-WHSLLNHNSA-N 423.529 2.185 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCC23CCN(C)CC3)cc1F 804851825 QHGMSIMLQQPSCV-UHFFFAOYSA-N 404.530 2.375 10 20 HECD O=C(NCc1ccc(F)cn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806722919 VCOJEMCIWNXVMQ-HNNXBMFYSA-N 422.407 2.224 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCCNCc2cc(Cl)c(F)cc2O)cc1 816541739 TVQTZBKFYWFLIF-UHFFFAOYSA-N 403.819 2.161 10 20 HECD O=C(NCCc1ccc(O)nc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816600012 HLNMHGMBUFDOKA-UHFFFAOYSA-N 419.484 2.328 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCN([C@@H]2CCSC2)CC1 816891432 SBHYTAXHEILZJY-GOSISDBHSA-N 407.555 2.496 10 20 HECD CCN(CC)S(=O)(=O)N1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 836378389 GJONSPBDYHHMHK-UHFFFAOYSA-N 413.584 2.403 10 20 HECD O=C(CCn1cnc2ccccc2c1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919970383 YPKRCASMKKSLMJ-UHFFFAOYSA-N 420.513 2.312 10 20 HECD CCO[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 920290478 GEJVVDUEELVDPH-HXUWFJFHSA-N 402.516 2.315 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@H](CO)CC3CCOCC3)CC2)cc1 1320962841 ULJBJPYWCOSSMK-GOSISDBHSA-N 405.539 2.388 10 20 HECD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccsc1 1794639268 IXRZVXHICPNHEQ-YWVIFJGQSA-N 422.890 2.330 10 20 HECD C[C@H](Cn1cccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500825 SRLCNHFJYHJKSN-CYBMUJFWSA-N 418.881 2.101 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3Oc4ccccc4O[C@@H]3C)CC2)cc1 106213099 JWNCZEZKMCZATK-VGOFRKELSA-N 411.502 2.162 10 20 HECD O=C(CSc1ccccc1C(=O)N1CCS(=O)(=O)CC1)NCC1CCCCC1 110955729 AKBUMBORDQRMHI-UHFFFAOYSA-N 424.588 2.346 10 20 HECD CC(=O)N(C)C1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 143753654 UUPHDXHVXSDZAM-UHFFFAOYSA-N 419.481 2.343 10 20 HECD CN(C)C1CCN(c2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2F)CC1 728405365 WVBHGDFNGUIINZ-UHFFFAOYSA-N 414.481 2.317 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN(C(=O)CC3CCCC3)CC2)c1 730841124 BOCWLYTZQLLSFK-UHFFFAOYSA-N 423.535 2.019 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3ccc(C(=O)OC)o3)cc2F)CC1 734170716 PSLHNKPMWVRIRW-UHFFFAOYSA-N 418.469 2.347 10 20 HECD Cc1cc(C(=O)CN2CCCOC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749515682 OCYRRSGPEOOMCW-OAHLLOKOSA-N 405.520 2.035 10 20 HECD COC(=O)c1ccc(F)cc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751042183 CELUQVLYTQREDQ-CQSZACIVSA-N 422.478 2.488 10 20 HECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 751227386 IAJYCGCFKQTEQM-UHFFFAOYSA-N 423.466 2.482 10 20 HECD NS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 752149962 QBKBUCJEGJDXIV-HNNXBMFYSA-N 408.451 2.000 10 20 HECD O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCOCC2)cc1 752960919 FICAVQKRSFWHOI-BQYQJAHWSA-N 405.458 2.211 10 20 HECD C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 755128570 YMGSCDRAYGSCQV-IBGZPJMESA-N 413.566 2.125 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(OC)c3ccccc3F)nc12 759281679 PVXVKQNTQSLJMS-HXUWFJFHSA-N 417.393 2.356 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@]12CCCO2 759318199 HMTXLGHMQYLPJD-TUNNFDKTSA-N 421.513 2.313 10 20 HECD CC[C@@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 760913033 SHEMGLJVSTWPPH-DMPWYTOCSA-N 423.529 2.377 10 20 HECD C[C@H]1CN(CCCNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCO1 764227695 GYGQVFVBMOLRDL-KRWDZBQOSA-N 422.545 2.087 10 20 HECD C[C@@H]1CN(CCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCCO1 764572540 HUXWBMXOCMKTIR-LJQANCHMSA-N 404.555 2.166 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 767382722 GHHYBSXCZOUZHH-UHFFFAOYSA-N 416.547 2.377 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1O 768085817 JBBALGJOGIHAPU-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCOC(=O)c1ccc(N2CCN(Cc3cc(OC)c(OC)cc3O)CC2)nc1 768440136 DHCKFALCRJDGKK-UHFFFAOYSA-N 401.463 2.303 10 20 HECD CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C[C@H](O)C(F)(F)F 774770323 BPSFFXZDLDEIQR-HNNXBMFYSA-N 406.360 2.256 10 20 HECD COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(Cl)c2)c(C(=O)OC)s1 776748943 RMRVWYQWSFDACN-UHFFFAOYSA-N 405.837 2.481 10 20 HECD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NCc3ccc(O)c(O)c3)cc(C3CC3)nc21 778916315 CVHWOGKUMOLBHC-UHFFFAOYSA-N 424.457 2.372 10 20 HECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C(C)C)cc1 781583881 LVKXOENVZGOMPV-IBGZPJMESA-N 421.471 2.135 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCCOC(C)C)CC2)cc1 783636733 CEQOWLWZSZFLNG-ZHACJKMWSA-N 403.523 2.221 10 20 HECD CO[C@@H](CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 786659165 XSUGOBDFQCELRU-FPOVZHCZSA-N 412.486 2.404 10 20 HECD CN(C)C(=O)c1cccc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 787862412 JNZCYEQPLIEGOK-UHFFFAOYSA-N 422.529 2.262 10 20 HECD C[C@H]1CCCN([C@@H](C)CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864178 MYXKFSFDGWHGLP-ROUUACIJSA-N 418.607 2.093 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(c4cccnc4)=NO3)cc2F)CC1 790593905 MYLHYTZRTUCPPE-NRFANRHFSA-N 411.481 2.172 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C)O[C@H](C4CC4)C3)CC2)cc1 792010578 ZFQYOGXOIABTJG-AVRDEDQJSA-N 416.566 2.416 10 20 HECD COc1ccc(-c2nnc(S)n2CC(=O)NCc2ccc(OC)cc2O)cc1 794378266 TYSWKXAOFZFCJE-UHFFFAOYSA-N 400.460 2.273 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 795835737 OILOWGVGAPPRBM-MNVSYLFESA-N 408.470 2.024 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNc2cccc(S(=O)(=O)N3CCC(CO)CC3)c2)c1 796441666 CPBSSLLOUHXNQI-UHFFFAOYSA-N 421.475 2.306 10 20 HECD Cc1cc(C(=O)NC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1ccccn1 804498713 RROCXTZZYSXSPI-AEFFLSMTSA-N 404.536 2.327 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCn2cncc2C1 812294501 ORNFUKQVCKIGGO-UHFFFAOYSA-N 404.473 2.107 10 20 HECD C[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)Cc2ccccc2C(=O)O1 917833448 NWCFSAVTEYKZCZ-HOYKHHGWSA-N 421.497 2.176 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(Cn2cncn2)c1 918307059 KYVCMFDAYAMCPI-UHFFFAOYSA-N 406.490 2.380 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc1 918430298 WFCBIKXADIQDLK-UHFFFAOYSA-N 408.458 2.014 10 20 HECD O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968700 HQLCPQMFEWSZPR-UHFFFAOYSA-N 423.435 2.392 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CNC3(c4noc(C)n4)CCCCC3)nc12 921191705 DIZQBTQQAFZZNX-UHFFFAOYSA-N 400.439 2.252 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(Cl)nc2ccccn12 1320436731 NSVYFXPUMSVMLP-LBPRGKRZSA-N 403.822 2.303 10 20 HECD CNC(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1793503074 ZKKSEYMWCUOGDO-NUZGMZIFSA-N 422.529 2.482 10 20 HECD CO[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1795807077 VHKYXDVBQPUCQC-CLWJZODNSA-N 411.458 2.132 10 20 HECD Cc1cc2nc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)[nH]c2cc1C 1844216289 ABLPFTULHVORDS-UHFFFAOYSA-N 421.457 2.117 10 20 HECD C=C1c2ccccc2C(=O)N1CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 11581179 LDSUWJVMCQVXED-UHFFFAOYSA-N 407.470 2.381 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1 115733302 SEBFPQLDQUHNMB-QGZVFWFLSA-N 403.504 2.158 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1 238080694 ZDQJPJCQUKJYPJ-UHFFFAOYSA-N 405.476 2.491 10 20 HECD Cc1c(CNC(=O)C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)n(C)c2ccccc12 550202713 SXZQZQBCRHSYQI-HOTGVXAUSA-N 414.550 2.107 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c(F)cc1F 729065354 DIXPVXJTTIAZQG-VIFPVBQESA-N 408.357 2.282 10 20 HECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NCCCSc1nccs1 733878670 CPJNGEKYUFMTAY-IBGZPJMESA-N 416.528 2.135 10 20 HECD COCCOc1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1Cl 734073754 BSRAZHQUAPAQTL-UHFFFAOYSA-N 408.838 2.334 10 20 HECD COC(=O)Cn1ccc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 743165817 RUKMBYULMPXEDB-CYBMUJFWSA-N 423.420 2.448 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1F 743598528 LMVXUSCDWQQLIT-RDTXWAMCSA-N 416.501 2.399 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1 743890969 HUSTWZNZZVZQTD-UHFFFAOYSA-N 410.474 2.143 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@@H]3C[C@@H](C)O)CC2)cc1 752640135 FYGQXQJXWRAVML-UYAOXDASSA-N 404.555 2.152 10 20 HECD COc1ccc(N2CCN(C(=O)CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1F 753740127 NTDCVXRXRJLYMF-UHFFFAOYSA-N 410.449 2.394 10 20 HECD Cc1cc(C(=O)CN(C)C[C@H]2CCC[C@@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 755060048 VXOFSLZAINALAE-UZLBHIALSA-N 419.547 2.017 10 20 HECD COC(=O)c1cc(C)ccc1OC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758225066 SDPRLUYKWMZQEB-LJQANCHMSA-N 414.502 2.352 10 20 HECD CNc1snc(C)c1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760085026 CYCNYPBNIMYSPX-UHFFFAOYSA-N 406.508 2.481 10 20 HECD COCc1nc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n[nH]1 761864374 FLTCGKWFHVSSCQ-UHFFFAOYSA-N 408.439 2.457 10 20 HECD CN(C)CCCOc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 765404811 XLRHUMMLOHBKLL-UHFFFAOYSA-N 407.492 2.347 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C(=O)OC)c3ccc(F)c(C)c3)nc12 767885779 UXUAZTHYGXUWCD-QGZVFWFLSA-N 416.409 2.063 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)c(F)c3)CC2)cc1 768156594 OLYZLQPKDNQZPD-UHFFFAOYSA-N 407.511 2.407 10 20 HECD COCCOCCS(=O)(=O)NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 768214237 VCWOQBWODCZXTO-UHFFFAOYSA-N 414.911 2.470 10 20 HECD C[C@H](N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccc(N2CCOCC2)cc1Cl 772999468 LLIZVHBJEXMDLD-LIRRHRJNSA-N 403.914 2.366 10 20 HECD CCN1CCC(n2nccc2NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1 775141975 GFERYGMZCWUELR-AWEZNQCLSA-N 415.494 2.070 10 20 HECD CCCc1nnc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)s1 778244633 MCCPTGNMWGYIMP-MDZDMXLPSA-N 415.519 2.343 10 20 HECD CS(=O)(=O)c1ccc(N2CCN(Cc3cc(F)ccc3O)CC2)c([N+](=O)[O-])c1 778995321 UMDNOLJMTSMASH-UHFFFAOYSA-N 409.439 2.165 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)c2)CC1 781272276 AUHBSCQUJJNHJG-UHFFFAOYSA-N 412.402 2.244 10 20 HECD COc1ccc(OC)c(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 786684654 QXLBQZONQHVJFY-UHFFFAOYSA-N 411.502 2.061 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(Cl)n1 788599840 NRNCBCJLYVFXCP-OAHLLOKOSA-N 422.938 2.224 10 20 HECD C[C@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 789836597 TVQGGMQKIZCOLF-DOTOQJQBSA-N 405.514 2.488 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 792703325 UHPRCKMDFVIRLQ-UHFFFAOYSA-N 406.482 2.426 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCSC[C@H]3C(=O)O)cc2F)C[C@@H](C)O1 797710460 YYOZVXGBWLWMDC-XNJGSVPQSA-N 411.499 2.151 10 20 HECD CN(Cc1ccc([S@](C)=O)cc1)C(=O)C(=O)NCCCSc1nccs1 806280591 RRZHXFXGNBASQT-SANMLTNESA-N 411.574 2.138 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3nnc(C4CC4)o3)cc2F)CC1 806749887 HVLRDLNZGOLDJG-UHFFFAOYSA-N 402.474 2.227 10 20 HECD CN1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916631101 CGRSVQWPXFOUAV-UHFFFAOYSA-N 400.445 2.389 10 20 HECD COc1ccc([C@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918211333 JSTASDGKPDJHNT-OAQYLSRUSA-N 417.481 2.328 10 20 HECD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 919863356 HRFJLWWPMKVVEX-NRFANRHFSA-N 424.480 2.057 10 20 HECD Cc1nocc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1795211644 ZTQXVKHXJZRAIO-ACHSLPGTSA-N 421.457 2.028 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(OC)cccc3OC)CC2)cc1 5402122 KQLHMYYVCCDFCT-UHFFFAOYSA-N 414.458 2.218 10 20 HECD C[C@H](NC(=O)CNC(=O)NCc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 109190687 WINBZDHDTKTDEW-INIZCTEOSA-N 414.481 2.339 10 20 HECD C[C@H](NCc1nnc2n(C)c(=O)c3ccccc3n12)c1ccc(N2CCOCC2)cc1 140205237 GVBIBOMBXSYOEM-INIZCTEOSA-N 418.501 2.269 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)NC(=O)C3CCCC3)CC2)cc1 727104236 PUJZBSLFAVPBEK-GOSISDBHSA-N 416.566 2.018 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)o1 735518204 HHSXAGOHQDYJAZ-HNNXBMFYSA-N 408.476 2.057 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 739765296 GSSFXBSGECWEFI-UHFFFAOYSA-N 415.515 2.353 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 741144117 FOULIJJUNVUIKB-HXUWFJFHSA-N 421.497 2.001 10 20 HECD O=C(CNC(=O)OCc1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 742341445 IXLZHPPMDVPCET-UHFFFAOYSA-N 401.438 2.205 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3c(C)nn(C)c3C)cc2F)CC1 745808020 JDJLPHWHFUNWRB-UHFFFAOYSA-N 402.518 2.317 10 20 HECD CCNC(=O)COc1cccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)c1 746721572 DNMSLLYWIYEGFX-UHFFFAOYSA-N 402.470 2.406 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1 747360940 CKCUULYHEKPUJD-UHFFFAOYSA-N 422.415 2.489 10 20 HECD COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 751269934 LOGFRDYBCTWHGO-UHFFFAOYSA-N 418.880 2.299 10 20 HECD CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NCc2ccc(N(C)C)cc2C)cn1 753521455 FRUUTZVQERAXHO-VKGTZQKMSA-N 403.552 2.293 10 20 HECD COc1ccc(N2CCN(C(=O)NCCNC(=O)c3cccs3)CC2)cc1F 753865251 IGMGLSOZKVWAEU-UHFFFAOYSA-N 406.483 2.157 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H](C)c3c(C)noc3C)nc12 754290459 RTZCYETVMVGPNT-SNVBAGLBSA-N 402.407 2.453 10 20 HECD COc1cc(N2CCN(C(=O)NCCC3CCN(C)CC3)CC2)cc(OC)c1OC 759284336 URMRRQLDEMXAOX-UHFFFAOYSA-N 420.554 2.276 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3cccc(F)c3)CC2)cc(OC)c1OC 759410799 VZEZMUGYBAVFRY-UHFFFAOYSA-N 417.437 2.139 10 20 HECD COc1cc(N2CCN(C(=O)Cn3cnc4ccccc43)CC2)cc(OC)c1OC 760085332 PNZUZFFGRKIELR-UHFFFAOYSA-N 410.474 2.411 10 20 HECD O=C(Cn1c(S)nc2ccccc2c1=O)NCc1cccc(Br)c1O 765944039 OPARPTIJAOGWER-UHFFFAOYSA-N 420.288 2.470 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H](C[C@@H]4CCOC4)C3)CC2)cc1 773704183 XMRNIQXTCYEXEN-PMACEKPBSA-N 401.551 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C[S@](C)=O)c3ccccc3)CC2)cc1 775616457 BRZOBXCWFVHKEA-LGGPFLRQSA-N 415.559 2.053 10 20 HECD NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)N(CC3CCCC3)c3ccc(N)cc3)cc12 784108244 GUSJTHNYERFQJJ-UHFFFAOYSA-N 420.473 2.406 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CCN(C2CC2)CC1 786091528 ZEWKKZRAQQZRAS-UHFFFAOYSA-N 424.339 2.246 10 20 HECD O=C(NCc1nnc(C2CC2)o1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 788157370 WFPCARIVNDVDCK-UHFFFAOYSA-N 420.472 2.445 10 20 HECD O=C([C@H](CNCc1cc2c(cc1O)OCO2)Cc1cccc(F)c1)N1CCOCC1 788533415 YLNYGDGPHKWFCR-KRWDZBQOSA-N 416.449 2.067 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cn(C)nc2C(F)(F)F)cc1 788953931 FUPMESACBMZJIU-UHFFFAOYSA-N 411.428 2.218 10 20 HECD CCN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789951695 YUUJWDXCDXUQLH-UHFFFAOYSA-N 413.440 2.417 10 20 HECD C[C@]1(C(N)=O)CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 794363899 QQSPMYWSKJDANC-HGZMWJMZSA-N 423.585 2.453 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@H]3CCC[C@H](OC)C3)CC2)cc1 796059500 BRFARWAYMODFJX-PXNSSMCTSA-N 404.507 2.482 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c(O)c1 797389306 AAGHQRNOQZKSII-UHFFFAOYSA-N 414.458 2.461 10 20 HECD CCn1ncc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C(F)(F)F 799262942 NGNCVXSRMWEBKB-SECBINFHSA-N 400.357 2.019 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)CCS(=O)(=O)N(C)C)cc2Cl)C1 800571416 JHYNHSBLRXVNHJ-AWEZNQCLSA-N 401.960 2.474 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3)ccc21 803688533 SPTXTSKBYOLQDL-QFIPXVFZSA-N 420.557 2.418 10 20 HECD CC(C)N1CC[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1=O 806261018 OLGFYJNVOIZYEQ-SFHVURJKSA-N 401.507 2.179 10 20 HECD CC(C)(O)CN(Cc1ccccc1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289378 RSIQGQQKWJCRPX-UHFFFAOYSA-N 407.514 2.479 10 20 HECD C[C@H](NC(=O)C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)c1ccc(N(C)C)cc1 807678101 FRPLWLKVCHPZFA-HNNXBMFYSA-N 418.538 2.493 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H](C)[C@@H]3CO)cc2Cl)C1 807952718 KCTJRNXJOQTTRG-CLCXKQKWSA-N 407.942 2.422 10 20 HECD CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 808039445 BGKVDMKTKKVQRH-FUHWJXTLSA-N 418.538 2.084 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(O)n3)cc2F)C[C@@H](C)O1 814476216 PBUDZJACZLYDQU-ZIAGYGMSSA-N 417.437 2.013 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(-n2cnnn2)c(C)c1 918304380 PHKOUVHKDBMSRE-UHFFFAOYSA-N 407.478 2.024 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 918306170 UYGJEUIZQXINCV-UHFFFAOYSA-N 419.485 2.006 10 20 HECD CCc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[nH]c(C)c1C(C)=O 918338145 VFSGZIULDAWJMM-UHFFFAOYSA-N 417.531 2.253 10 20 HECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 919913112 GQMPRMYTZLYGOD-WSTZPKSXSA-N 415.582 2.308 10 20 HECD CCOc1ccc(N2CCN(CC(=O)NCCCN3CCCCCC3=O)CC2)cc1 1319611443 MVXBBFOPCWNGER-UHFFFAOYSA-N 416.566 2.116 10 20 HECD C[C@@H](c1ccccc1)N(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 1319814776 XHPXCUBXSBUNGQ-QFBILLFUSA-N 402.516 2.259 10 20 HECD C[C@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CC1(F)F 1816729194 XYIBANWFWRTLGH-VVVCHXIZSA-N 424.429 2.220 10 20 HECD O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1 19108105 JEOFQBCDCFUSGW-UHFFFAOYSA-N 405.461 2.110 10 20 HECD COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC=C(c2c[nH]c3ncccc23)CC1 42632683 IKWAJNXHEHDCNP-UHFFFAOYSA-N 412.471 2.291 10 20 HECD CS(=O)(=O)N1CCC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 726242588 TUOYNCHSNYLEBS-INIZCTEOSA-N 407.492 2.121 10 20 HECD Cc1ccccc1CS(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 732216958 CLQAZJVVVBYOHB-SFHVURJKSA-N 401.532 2.316 10 20 HECD CNS(=O)(=O)[C@@H]1CCCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 733311950 ZHZKARUTWUNGAB-GOSISDBHSA-N 407.511 2.430 10 20 HECD COc1cc(C(=O)NCC(=O)NCc2ccc(N(C)C)cc2C)cc(OC)c1OC 734557262 CSTCUSBSQVZEBI-UHFFFAOYSA-N 415.490 2.133 10 20 HECD CC(=O)c1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 740609987 QIKKYXKTWVAFSB-UHFFFAOYSA-N 401.488 2.392 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)n1nnc(-c2ccccc2)n1 742556836 LGIKOFJARXVNSD-HNNXBMFYSA-N 410.453 2.193 10 20 HECD CNC(=O)CC1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 746669713 JRKHPTQXIKVOCX-UHFFFAOYSA-N 419.481 2.249 10 20 HECD O=S(=O)(CC[C@H]1CCCO1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751373512 UIEYNWARVMZHCM-DLBZAZTESA-N 402.944 2.499 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnccc3SC)CC2)cc1F 754213776 UPAWZHRDSGTCLS-UHFFFAOYSA-N 404.467 2.239 10 20 HECD CC(C)n1cc([C@H](C)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 754804900 FHAFAEZXLOGQND-INIZCTEOSA-N 403.502 2.407 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(NC(C)=O)cc3F)CC2)cc1 758231880 ORBFGEKZNBPXSX-LJQANCHMSA-N 417.481 2.355 10 20 HECD Cc1cc(S(C)(=O)=O)cc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 758650989 ADXUAKUEDRGANK-UHFFFAOYSA-N 402.516 2.474 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)[C@H](C)c3ccccc3)nc12 759553568 DVGYNXDTUUQSIQ-LRTDBIEQSA-N 413.430 2.210 10 20 HECD CCCCn1c(N)c(N(CCOC)C(=O)/C=C\c2ccc(Cl)nc2)c(O)nc1=O 759752867 OXDCECXLWPPYEY-VURMDHGXSA-N 421.885 2.072 10 20 HECD Cc1cc(=O)c(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c[nH]1 762900441 ICLRHWDZGIFPDF-UHFFFAOYSA-N 416.389 2.254 10 20 HECD CN(C)S(=O)(=O)c1cccc(C(=O)NCc2cccc(Br)c2O)c1 765727380 NFEUHNSHSGVHMH-UHFFFAOYSA-N 413.293 2.335 10 20 HECD CCN1C[C@H](C)N(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@@H]1C 766250375 LCMOJYGIYWONEM-JENIJYKNSA-N 401.555 2.012 10 20 HECD COC(=O)C1(NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCCC1 767505351 DIIBKGHQDLQQPH-IYBDPMFKSA-N 421.513 2.131 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3cc4c(cc3O)OCO4)C2=O)c1 769534663 YBTUNZMSFCRPIF-QGZVFWFLSA-N 400.431 2.375 10 20 HECD O=C(NC[C@H]1COC2(CCOCC2)O1)N(Cc1ccccc1O)C[C@H]1CCCO1 777757320 YSVQUKUXULQVOH-MSOLQXFVSA-N 406.479 2.005 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(S(C)(=O)=O)cc3)c2)CC1 781046614 IBBIJWZKYJIYQR-UHFFFAOYSA-N 401.488 2.011 10 20 HECD O=C(Nc1c[nH]nc1-c1ccccn1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 782780777 IDZZLFVNUJDLFQ-INIZCTEOSA-N 421.457 2.324 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)ccc1N1CCOCC1 783327167 NUXJGCOHVAOFAI-UHFFFAOYSA-N 420.513 2.463 10 20 HECD CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 785293711 IBHJUSPTOURMSN-OIOXUXFSSA-N 412.442 2.360 10 20 HECD CC1(COC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2O)COC1 785399644 UCXMOHKKYSVZCL-UHFFFAOYSA-N 422.415 2.295 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1 785526655 GJAUDISZIRYMMR-RBUKOAKNSA-N 416.566 2.018 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 788759638 VIBCRLISEPHZGJ-CQSZACIVSA-N 401.429 2.131 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)[C@H]2CCCN(C(=O)OC)C2)cc1 788979626 ZNRMREODPZKVFG-AEFFLSMTSA-N 418.538 2.132 10 20 HECD CCOc1ccc(CN[C@@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c(O)c1 793245958 FOHXFNMGMJNURV-HXUWFJFHSA-N 401.511 2.101 10 20 HECD C[C@@]1(C(N)=O)CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 794363901 QQSPMYWSKJDANC-LVMGUKCRSA-N 423.585 2.453 10 20 HECD COc1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)c(O)c1 794379707 VJEZTCVOFZGKCQ-CQSZACIVSA-N 400.431 2.087 10 20 HECD O=C(CN1CCOC[C@@H]1[C@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 796340597 MNSPSBXZLYNWFV-WOJBJXKFSA-N 420.465 2.280 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(C(=O)NC)cc3)C3CC3)nc12 917096220 SDUUENOWJPAGLM-UHFFFAOYSA-N 423.473 2.136 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOc4ccccc4C3)cc2)C1 918122466 LGINBYZPJWWCMK-LJQANCHMSA-N 408.502 2.493 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1 918308689 BLZVOLPHEKCTQP-UHFFFAOYSA-N 407.478 2.106 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](CN1CCOCC1)c1ccccc1 919791217 ZGVRCGPXSBMINH-HSZRJFAPSA-N 424.545 2.396 10 20 HECD C[C@H](NS(=O)(=O)c1cccs1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920887053 YRNUUWJMDWKZIS-CABCVRRESA-N 423.560 2.129 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(NC(=O)CC)c1 1116571554 YRPDPXNXOIQMBJ-INIZCTEOSA-N 400.431 2.351 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(OCC(F)F)ccn1 1116669123 GUHRPTFMEBOXBI-AWEZNQCLSA-N 410.373 2.041 10 20 HECD Cc1noc(C)c1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1808219193 GUMRWFVDYRZRQG-UHFFFAOYSA-N 414.462 2.256 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccccc2F)C1 1844853775 GGZMTAJTEMSEFE-VQHVLOKHSA-N 412.417 2.473 10 20 HECD COC(=O)c1scc(C)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 327531720 OLXKPZFOGGIJKY-UHFFFAOYSA-N 404.491 2.015 10 20 HECD CC1CCN(c2cccc(NS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)c2)CC1 740609993 QNTRVVRKXWRKCT-UHFFFAOYSA-N 409.533 2.371 10 20 HECD CCN(C)C[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 744424079 SHNKCZNCPVHHAU-WSTZPKSXSA-N 420.573 2.329 10 20 HECD O=C(NCCNS(=O)(=O)c1ccccc1)NCc1c(O)ccc2c1CCCC2 745435214 FCEJALIGSOUJQB-UHFFFAOYSA-N 403.504 2.049 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3Cc3ccccn3)cc2)C1 746147453 PBKAYZAABRKPMT-SIKLNZKXSA-N 421.545 2.064 10 20 HECD Cc1cc(C(=O)Cn2ccnc2S(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 747809773 AIZYYJHBFAYXJW-UHFFFAOYSA-N 415.471 2.348 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COC1CN(C(=O)OC(C)(C)C)C1 748015086 OZFSPBKAOYXURE-UHFFFAOYSA-N 419.522 2.118 10 20 HECD Cc1cc(C(=O)COC(=O)C(=O)c2cnn(C)c2)c(C)n1-c1ccc2c(c1)OCCO2 748432278 LNSGRTFHZZXJEA-UHFFFAOYSA-N 423.425 2.208 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CC(=O)N(c2cn[nH]c2)C1 748848703 TUMLUPJMJMGDJF-ZDUSSCGKSA-N 419.432 2.149 10 20 HECD O=C(NCCCNC(=O)C1CCC1)NCc1ccc(N2CCC(CO)CC2)cc1 749118083 XDKWMXZAIINDMT-UHFFFAOYSA-N 402.539 2.001 10 20 HECD CCOC(=O)c1ccc(-n2ccnc2)c(NS(=O)(=O)c2cccc3nonc23)c1 753924534 UYVZHMJUQJQLQD-UHFFFAOYSA-N 413.415 2.386 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cccc([N+](=O)[O-])c3C)CC2)cc1 758222689 HOROIMQZLSOFRX-GOSISDBHSA-N 401.463 2.474 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)[C@@]12CCCO2 759319702 PPLYOFFWKCRSLU-SJBKTWHCSA-N 403.523 2.391 10 20 HECD Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)OC(=O)/C=C/c1ccc(O)c(O)c1 759595771 LYIOSFRGRQUCOT-TUPIDYKKSA-N 412.442 2.414 10 20 HECD C[C@@H](NCC(=O)NCCCN1CCCCCC1=O)c1ccc(N2CCOCC2)cc1 775259013 DVEOIEAJNLLLQP-LJQANCHMSA-N 416.566 2.083 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCSC(F)(F)F)CC2)cc1 778231672 HUFIAWHWTISLOJ-SREVYHEPSA-N 417.453 2.269 10 20 HECD C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785433941 QAUVTDNRDVBNHD-LJQANCHMSA-N 408.546 2.492 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)CCC3CCCC3)cc2)CC1 786258323 FXXSWVDQMKVJOH-UHFFFAOYSA-N 414.550 2.058 10 20 HECD COCCOc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 786258507 YKWNIIXIEMJNGS-UHFFFAOYSA-N 411.502 2.310 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1Cl 786683831 NOBUSXVGGRNABO-GOSISDBHSA-N 416.909 2.038 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)N2CCCCCC2)cc1 788954919 OJJHTHBWPURSNK-UHFFFAOYSA-N 402.539 2.058 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCC2(CCCC2)C1 789813296 SGOGWPOVMRWYED-UHFFFAOYSA-N 403.498 2.461 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 789826671 QCCGVHDNPNQBPY-KLHDSHLOSA-N 423.554 2.408 10 20 HECD CC(=O)N1CCC[C@H](CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 792836192 UIAQOLGDIGYVPX-GPMSIDNRSA-N 420.529 2.497 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1O 792984122 WVOQIVBYYMCTSO-UHFFFAOYSA-N 424.207 2.326 10 20 HECD COc1ccc(CNS(=O)(=O)c2ccc(I)cc2)c(O)c1 795363397 XCRKQPDAKOTBAX-UHFFFAOYSA-N 419.240 2.484 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@]2(CCCOC2)O1 797432516 GZARKDLOXRZANQ-ZHRRBRCNSA-N 421.513 2.266 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCc3nccn3C)cc2Cl)C1 804624862 CBZJGICJFMQZOE-CQSZACIVSA-N 403.914 2.242 10 20 HECD COCc1cnc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 806601455 LPXHLNDRVTWFIS-UHFFFAOYSA-N 405.524 2.242 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 807842568 UFDXNTFJLNEVAF-LJQANCHMSA-N 415.534 2.428 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H](C)C[S@@](C)=O)cc2Cl)C1 807954032 GSJUUQDIBWVJCI-QOHXFFFDSA-N 413.971 2.076 10 20 HECD CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(COC(C)C)c2)cc1 811704917 HGIDOXMCPXOKOV-UHFFFAOYSA-N 414.505 2.026 10 20 HECD CCOCC(C)(C)CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 813881470 YIEKVWWMVWPNBH-ZHACJKMWSA-N 403.523 2.079 10 20 HECD Cc1cccc(-n2c(C)cc(-c3nc(-c4cn(CCO)c(=O)nc4O)no3)c2C)c1 904858615 HARFVTFFNTXKHV-UHFFFAOYSA-N 407.430 2.374 10 20 HECD C[C@H](NS(=O)(=O)c1cc(C(=O)O)ccc1F)c1ccc(N2CCOCC2)cc1 920865622 HSPSEXBEVPCXLB-ZDUSSCGKSA-N 408.451 2.400 10 20 HECD COCCN1C(=O)/C(=C/Nc2cc(-c3cc(C)c(C)cc3C)[nH]n2)C(=O)NC1=S 920978755 PCVYFNDAHAHIAH-XNTDXEJSSA-N 413.503 2.187 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CC(=O)N(c2ccccc2)C1 921076028 ANJUSUUBYDZHQZ-QGZVFWFLSA-N 412.465 2.267 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC3(C4CC4)CCOCC3)CC2)cc1 1254989881 GSHDIXHBCLZCDM-UHFFFAOYSA-N 416.566 2.466 10 20 HECD CC(C)(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1795096066 MNYYIKZDPSQOAR-FVCICTRLSA-N 410.898 2.391 10 20 HECD CC(=O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811799809 YYZQLRMVMAZTBL-SUMWQHHRSA-N 417.849 2.055 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cncs2)CC1 1826132687 ZBLSSBVZDSAHFB-HNNXBMFYSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2)C1 1845377737 IIXLRBREXZBKKH-UHFFFAOYSA-N 419.384 2.225 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc(OC)c1OC 60763702 OZALFMBMTRFALV-UHFFFAOYSA-N 413.474 2.350 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC(=O)N(Cc2ccco2)C1 302963207 GVCHGWFRRNZJAJ-MRXNPFEDSA-N 415.465 2.045 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](c4ccc(F)c(F)c4)C3)nc12 727436206 AWAZVMKMEFXTBZ-KRWDZBQOSA-N 418.400 2.463 10 20 HECD COCC(=O)Nc1ccc(OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 733306812 FBRYUGVWXXUOQT-UHFFFAOYSA-N 413.474 2.008 10 20 HECD CCn1cc(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cn1 734043343 FTZVBHQKVWPCNC-UHFFFAOYSA-N 403.394 2.474 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1 734523526 FOMCZCYEKUPUIE-UHFFFAOYSA-N 411.550 2.352 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735517408 ARAGMOMUNDXAGB-KRWDZBQOSA-N 424.501 2.334 10 20 HECD COc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(OC)c1 738884100 FLMAMTBOYFJPIQ-UHFFFAOYSA-N 419.503 2.260 10 20 HECD COC(=O)c1c(NC(=O)C(=O)NCc2cccc(OC)c2O)sc2c1CCCC2 746038940 WQOXIQPXVWFYAP-UHFFFAOYSA-N 418.471 2.383 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)cc3)cc2)C1 746371977 CTIWJNFPZYDEMM-HXUWFJFHSA-N 422.529 2.155 10 20 HECD COc1ccc(C(=O)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 747597915 ZZQGCPTVUUVIGD-UHFFFAOYSA-N 400.435 2.058 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CCc2ccc(F)cc21 751436130 FETQGXGJNPDVNB-UHFFFAOYSA-N 403.479 2.333 10 20 HECD Cc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1S(N)(=O)=O 752151478 IMCYPRZETQMADL-QGZVFWFLSA-N 404.488 2.169 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3cc(OC)ccc3O)CC2)cc1 754139100 BJKXRDKQTLGRKU-MJGOQNOKSA-N 415.534 2.243 10 20 HECD COCCOc1cc(C)ccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 755864642 WOEVCVYNWWMHQT-UHFFFAOYSA-N 408.476 2.027 10 20 HECD C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2=O 756888442 CMBABTXFEYFSAI-HOTGVXAUSA-N 400.523 2.458 10 20 HECD COC(=O)c1ccsc1N1CC[C@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 759589923 VGCSNWOIMHVNSY-QTLSWZBMSA-N 403.412 2.308 10 20 HECD CCc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)O 761260220 PPLCWJBXQPGVCU-UHFFFAOYSA-N 404.488 2.262 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cccc4nonc34)cc2F)C[C@H](C)O1 765166690 KMEPYLJBQBPKQI-STQMWFEESA-N 420.466 2.454 10 20 HECD CCOc1cccc(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c1O 768549451 QMEBWRKKTWDLKP-UHFFFAOYSA-N 411.568 2.418 10 20 HECD CN(CCNCc1cc(Cl)cc([N+](=O)[O-])c1O)S(=O)(=O)c1cccs1 771979098 KAXBOLFKUVRGFB-UHFFFAOYSA-N 405.885 2.426 10 20 HECD CC(C)NS(=O)(=O)c1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1F 773740361 KSGXJEZVZNDEBK-LBPRGKRZSA-N 410.467 2.285 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Oc3ccc(NC(C)=O)cc3)CC2)cc1 778226673 ICDQJJNYSFUSDO-QXMHVHEDSA-N 423.469 2.464 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@@H]3CCO)CC2)cc(OC)c1OC 779710230 AAUKHGYCSZCNFV-WBVHZDCISA-N 407.511 2.095 10 20 HECD C[C@@H](NS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc(N(C)C)cc1 780849941 WJUUECJAYACFDO-CQSZACIVSA-N 423.560 2.233 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)cc1 785439766 VKUVSKXVXSYNLC-OAQYLSRUSA-N 408.546 2.050 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccnc(N4CCCCC4)c3)ccc21 786467337 FTVJLSKGZWENNT-UHFFFAOYSA-N 421.545 2.387 10 20 HECD Cc1nnsc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 787995573 BZBDXXUXQLDXLL-UHFFFAOYSA-N 413.482 2.032 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)CN1CCCCC1 789863071 DIJOADGOPZPVCQ-SFHVURJKSA-N 418.607 2.094 10 20 HECD CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 789909804 HVQLWVUQZPRFPA-CJNGLKHVSA-N 401.429 2.404 10 20 HECD COc1cc(CN2CCN(C(=O)c3cccc(O)c3O)CC2)cc(OC)c1OC 790864092 JLXSIBGCPKIFKN-UHFFFAOYSA-N 402.447 2.082 10 20 HECD O=C(COC(=O)CCc1cncnc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796182147 SHMGUEBIBTUFDF-UHFFFAOYSA-N 415.405 2.367 10 20 HECD Cc1cc(C)nc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 801445365 ICNYBCHAUQNSRP-UHFFFAOYSA-N 401.438 2.147 10 20 HECD COC(=O)N1CCC(CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989558 OPZLWJZRJQCNOL-MRXNPFEDSA-N 404.511 2.362 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769417 UHEXUBVEIDLGJN-GOEBONIOSA-N 411.449 2.010 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CCSC1 808130099 XEPRQRHCJYENGQ-NSHDSACASA-N 401.326 2.373 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC(C)(C)[C@H]3CCCCO3)CC2)cc1 809422916 IVLBPFJUHIZDNG-HXUWFJFHSA-N 417.550 2.445 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)[C@@H](O)c3ccccc3)CC2)cc1 812016891 STVFDKPQHHMBPF-PGRDOPGGSA-N 412.534 2.239 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cc(C)c4nccn4c3)CC2)cc1 815458763 DNJPFFOODZPULP-UHFFFAOYSA-N 407.474 2.375 10 20 HECD COc1cc(N2CCN(Cc3ccc4c(c3)oc(=O)n4C)CC2)cc(OC)c1OC 816569738 VERISTKOWZHBAH-UHFFFAOYSA-N 413.474 2.480 10 20 HECD CN(Cc1ccccc1O)C(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1 917310068 KTRVUUVVFVASNC-UHFFFAOYSA-N 423.922 2.500 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1 918430218 UGOZBPRUIUHIHT-UHFFFAOYSA-N 403.504 2.191 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 920867507 UATIWEWJKLMATR-ZWKOTPCHSA-N 417.550 2.364 10 20 HECD COc1ccc(CNC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 920994804 HWTSZISFITUACR-UHFFFAOYSA-N 419.572 2.094 10 20 HECD O=C(COc1ccc(Cl)cc1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 921048603 DMXYCXICBPGADD-UHFFFAOYSA-N 404.850 2.498 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(O)nn4)c3C)CC2)cc1 1320023461 HROBCKIPKTTYCW-UHFFFAOYSA-N 408.462 2.037 10 20 HECD CN1CCN(c2ccc(CNc3ccc(F)c(N4C(=O)CNC4=O)c3)cc2F)CC1 1321102097 ZCSKLNZGTLOEOA-UHFFFAOYSA-N 415.444 2.385 10 20 HECD CC(=O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1793412238 SMRHXFGVYAOJGD-VBUUOAMHSA-N 424.501 2.033 10 20 HECD CC1=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)CCO1 1796407493 WVVMWDHVBHZUMN-NCSLWMNCSA-N 414.458 2.149 10 20 HECD CC1(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CCC1 1807992206 MAXNAGNLFOZPPR-HNAYVOBHSA-N 410.474 2.398 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3ccccc3O)CC2)C1 1810542897 DMTLMEXLBSOBAY-UHFFFAOYSA-N 411.458 2.357 10 20 HECD O=C(COc1cccc(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847415750 PADMOQXQUVLBMV-HOTGVXAUSA-N 417.849 2.041 10 20 HECD Cc1cccc(C)c1OC[C@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 150044070 FFVRBTCJXWWXOB-OAQYLSRUSA-N 413.518 2.379 10 20 HECD COC(=O)N1CCC[C@@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 726611770 SRGYEHUMADKKQB-HLLBOEOZSA-N 422.501 2.469 10 20 HECD CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 727990896 BYUIEUNOGZWJJQ-GOSISDBHSA-N 409.527 2.370 10 20 HECD COc1cccc(OC)c1OC[C@@H](O)CN(C)Cc1ccc(N2CCOCC2)cc1 730080765 JQLFFYRYMNHPSF-FQEVSTJZSA-N 416.518 2.412 10 20 HECD Cc1nc(COc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)no1 731055489 WJWZWVMLKYQONF-UHFFFAOYSA-N 418.431 2.286 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1 734669967 BTCSUPNJGPUKFL-UHFFFAOYSA-N 418.510 2.125 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 734687725 SVFLXVSLYVWGAY-UHFFFAOYSA-N 424.501 2.457 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1 735518158 IPZXRIJCLYTNBI-SJORKVTESA-N 413.522 2.367 10 20 HECD Cc1nccn1CCCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 743632065 XQUZEFXYNCOAER-IBGZPJMESA-N 412.538 2.173 10 20 HECD O=C(NCCN1CCCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748027399 LRRBBJDJFXYDKN-UHFFFAOYSA-N 409.533 2.470 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCCCSc1nccs1 749730884 YPGAHEYVIFXYMD-UHFFFAOYSA-N 413.546 2.092 10 20 HECD CNS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1F 752801517 ZQKSMFCQJZIKNE-INIZCTEOSA-N 422.478 2.261 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 767939044 QBGVYSZNSNDYSV-FCHUYYIVSA-N 416.566 2.090 10 20 HECD CS(=O)(=O)NC[C@@H]1CCCCN1Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 768342931 UKKZCNUHYARCOP-KRWDZBQOSA-N 410.540 2.489 10 20 HECD Oc1cc2c(cc1CN1CCN(c3cc(N4CCOCC4)ncn3)CC1)CCCC2 768448170 SLSDUTSCDTVNIB-UHFFFAOYSA-N 409.534 2.220 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1sccc1-n1cnnn1 768914590 FPDNGTQYUZDXKY-AWEZNQCLSA-N 418.910 2.477 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCOC2(CCOCC2)C1 769031766 BINODMZRSBXNNQ-FQEVSTJZSA-N 417.550 2.423 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)c1 769689582 SDEZXYXFQIQPCH-UHFFFAOYSA-N 411.823 2.000 10 20 HECD CCOc1ccc(O)c(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)c1 770396173 YHZJIUWXYVFBRU-UHFFFAOYSA-N 405.520 2.485 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNS(=O)(=O)/C=C/c1ccccc1 771534957 GCGALMKZLCVTDA-RVDMUPIBSA-N 415.515 2.458 10 20 HECD NS(=O)(=O)c1cccc(NCc2ccc(N3CCC(CO)CC3)cc2)c1[N+](=O)[O-] 779428316 KZUXEHUJFSHWPC-UHFFFAOYSA-N 420.491 2.063 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])c2)CC1 780408050 UAVCTDJCGRYYOV-UHFFFAOYSA-N 422.438 2.203 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(=O)O 780443007 KIZMJBBOQXQISL-HNNXBMFYSA-N 403.401 2.450 10 20 HECD CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)OC(=O)c1cccc(O)c1O 784788625 VIJCDBBZINSIFI-ZDUSSCGKSA-N 400.431 2.303 10 20 HECD COc1ccc(C(C)(C)CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc1OC 785433529 MRLDMLDNFSVLCO-UHFFFAOYSA-N 413.518 2.480 10 20 HECD NC(=O)[C@@H]1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 786789318 QURDMNFWSXKFPA-KGLIPLIRSA-N 413.440 2.450 10 20 HECD COCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CC[C@H](C)C1 792466534 XUKUCNSGMIDNAH-PKOBYXMFSA-N 407.530 2.416 10 20 HECD COc1ccc(CNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c(O)c1 792852550 LZVBBSZDIKBUIQ-UHFFFAOYSA-N 415.490 2.111 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)nc12 797530499 UXSLTGKFAOSIHW-OAHLLOKOSA-N 423.473 2.097 10 20 HECD CCO[C@H]1C[C@@H](NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C12CCC2 804318378 JESFBEMINZFDPX-UXHICEINSA-N 415.534 2.244 10 20 HECD O=C(NCCOc1ccc(F)cc1F)C(=O)NCc1ccc(N2CC=CC2)cc1 804917108 MHWUCGFGLQSHMZ-UHFFFAOYSA-N 401.413 2.152 10 20 HECD O=S(=O)(Nc1cc(Cl)c(O)cc1F)c1ccc(S(=O)(=O)NC2CC2)cc1 808115213 SRFPLFWGPLTINU-UHFFFAOYSA-N 420.871 2.426 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC1CCN(c2cc(C)[nH]n2)CC1 809681278 UMKWHFZZQJYHPC-UHFFFAOYSA-N 413.522 2.338 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 1116722059 DGPHFNGFVQTUEU-UHFFFAOYSA-N 407.448 2.268 10 20 HECD C[C@@H](NC(=O)NCCN1C(=O)COc2ccccc21)c1ccc(N2CCOCC2)cc1 1320543678 KODFSARTYXMDJZ-QGZVFWFLSA-N 424.501 2.309 10 20 HECD CC(C)CCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783126225 UYUGRCYCYKXCRX-PABBZOGXSA-N 418.490 2.083 10 20 HECD CCc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)s1 1798631931 LFDHSXCZNQJEOT-CLLJXQQHSA-N 402.476 2.077 10 20 HECD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)no1 1817843843 DKKBPFUFQKOKER-AWEZNQCLSA-N 412.406 2.132 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=CCCS1 1847849099 XRCZQDXYVRAOKT-HHAVJRIZSA-N 402.472 2.039 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c1 728980979 RILDIXUDAJQZQM-RCDICMHDSA-N 411.458 2.354 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@@H]2CCN(c3ccccc3Cl)C2=O)c1 732331800 JRMSGBXXFGLQAE-MRXNPFEDSA-N 424.862 2.379 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(O[C@H]4CCOC4)cc3)ccc21 740496816 ZXOKNGPFYRIANH-FQEVSTJZSA-N 409.486 2.492 10 20 HECD CC(=O)N(C)c1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 746037529 HBJDSQBXBZTRCV-MRXNPFEDSA-N 424.501 2.322 10 20 HECD CC(C)(C)N1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 746952145 MLJTVUXOXDPHMX-IBGZPJMESA-N 415.582 2.404 10 20 HECD COc1c(C)cc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C 751213598 YFWDIKBTPDSKBG-UHFFFAOYSA-N 424.544 2.348 10 20 HECD CS[C@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 752152059 UCFBYSQLJLNKIQ-OAHLLOKOSA-N 418.542 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)NCCNC(=O)c3ccc(C)cc3)CC2)cc1F 753912752 XFOUOEMAARCRAB-UHFFFAOYSA-N 414.481 2.404 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCN(c4ccc(C)cc4)CC3)CC2)cc1 754270482 LXWRVRLXAKDULY-XMMPIXPASA-N 424.589 2.309 10 20 HECD C[C@@H](OC(=O)CCc1nc[nH]n1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 756758506 KQDZBRJJLQHYPE-GFCCVEGCSA-N 418.409 2.083 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)Nc1ccc(CN2CCOCC2)cc1 759590314 WOBWDRMAFSWUIV-YWEYNIOJSA-N 412.442 2.125 10 20 HECD C[C@@H](OC(=O)CCc1nc[nH]n1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 764011253 IDIXIHRSJRBBLV-GFCCVEGCSA-N 418.409 2.083 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc2C1 765903329 JDDSVRKUGKEURD-UHFFFAOYSA-N 404.264 2.355 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)Nc3ccc(O)c(C(=O)O)c3)cccc12 766321303 MDHRVJWNDVGHMO-UHFFFAOYSA-N 402.384 2.226 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c1 769540731 OGEMIMLLTOVTRH-UHFFFAOYSA-N 408.451 2.254 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O 773745046 ISVNRRUBPYDUCQ-LRTDBIEQSA-N 403.479 2.036 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCc1c(C)noc1C 774153019 GROGFERZUWIRBJ-UHFFFAOYSA-N 410.268 2.424 10 20 HECD Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1C 779476909 YFYWHDRDYIJELH-VMPITWQZSA-N 416.499 2.261 10 20 HECD CN1C[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccccc2C1=O 787378489 NZMYXBVKERYHFD-JOCHJYFZSA-N 407.514 2.381 10 20 HECD CN1CCN(c2ccc(CNc3cccc(C(=O)N4CCC[C@@H]4CO)n3)cc2)CC1 788744695 YRUWSXLWFKZELR-HXUWFJFHSA-N 409.534 2.042 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@H](C3(C)OCCO3)C2)cc1 788938122 BAIQWKCVZJVOIH-SFHVURJKSA-N 403.523 2.151 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC4CC4)C3)cc2F)C[C@@H](C)O1 789830321 NXIGUDPWZXZPGO-GASCZTMLSA-N 404.486 2.161 10 20 HECD CC(C)(C)N1CCCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 789864813 RYAQBVFRDFWDNW-UHFFFAOYSA-N 418.607 2.189 10 20 HECD Cn1nccc1[C@H]1CCC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 790486161 MRUUHDFTVBFYPC-OALUTQOASA-N 402.564 2.471 10 20 HECD CC(C)OC(=O)CC[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 792043441 FHKUMHVOGYUKIL-WMZOPIPTSA-N 418.538 2.308 10 20 HECD COC1(C(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCOCC1 792718941 QBKGALWXSAIQBP-UHFFFAOYSA-N 423.421 2.139 10 20 HECD CC(=O)N1CCC[C@H](CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 792836196 UIAQOLGDIGYVPX-TXPKVOOTSA-N 420.529 2.497 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H](C)C1 796315474 MKDILVGSYQXZNZ-SQNIBIBYSA-N 406.546 2.082 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 796792472 XRXGIJZMGSMFCK-ZDUSSCGKSA-N 414.462 2.382 10 20 HECD CNC(=O)COc1ccc(N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c(C)c1 804252840 ATDSOKPLDLPXAN-UHFFFAOYSA-N 417.849 2.448 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCOC[C@@H]3CC(C)C)CC2)cc1 804318726 RVKRDNKYEBPDNZ-IBGZPJMESA-N 403.523 2.054 10 20 HECD COC(OC)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 806539195 JQVSYYRTLICVAM-HNNXBMFYSA-N 401.463 2.203 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccnc1OCC(F)F)c1ccc(N(C)C)cc1 807676353 FFVGDSUJKBMIKC-ZDUSSCGKSA-N 406.433 2.285 10 20 HECD O=C(N[C@@H]1CCc2ccccc2OC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 807695372 NKGHNAVWWDIXAW-WOJBJXKFSA-N 424.497 2.410 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCc3ccnn3C)cc2Cl)C1 807955417 WGZHPHQGLDLFIY-HNNXBMFYSA-N 417.941 2.285 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C4(CCC4)[C@H]3[C@H]3CCCO3)CC2)cc1F 811754894 LUMKXDRATBBDNW-WOJBJXKFSA-N 403.498 2.474 10 20 HECD CCOCc1nc([C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 812007568 YCMIEUVOSXJDDW-CYBMUJFWSA-N 407.446 2.142 10 20 HECD CCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 918224972 XZUMKPHTYXWLTH-UHFFFAOYSA-N 406.502 2.110 10 20 HECD CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846045 GLMCPCLZDRDUPX-IUODEOHRSA-N 417.466 2.335 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CC1(F)F 1818836429 MRYGXGLVHGRSFM-CMPLNLGQSA-N 407.377 2.177 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3ncsc23)C1 1844101732 GNSDHGXWFDYVQA-UHFFFAOYSA-N 410.455 2.233 10 20 HECD COc1cc(CNCc2ccc(N(C)C)cc2)ccc1OCC(=O)N1CCOCC1 17318021 ZBLYTNOIRMCGNR-UHFFFAOYSA-N 413.518 2.289 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)cc1 326694940 SODAEHIJWJHUGS-UHFFFAOYSA-N 404.853 2.211 10 20 HECD CCN(CC)c1ccc(CNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1F 731347002 HEUTYJZNIYFZHS-HXUWFJFHSA-N 411.481 2.408 10 20 HECD CN(C)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1c(F)cccc1F 734551086 HBDFFFWSCGSLLE-HNNXBMFYSA-N 413.446 2.075 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 741743157 AHGQAOWAXOEZTN-IBGZPJMESA-N 409.490 2.094 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1 742564191 XQYLOBSNJOLZDB-UHFFFAOYSA-N 417.531 2.062 10 20 HECD CC(C)N1C[C@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1=O 750639739 WURUWOBLLHSTFY-HLLBOEOZSA-N 406.502 2.248 10 20 HECD Cc1cc(C(=O)COC(=O)C(C)(C)C(N)=O)c(C)n1-c1ccc2c(c1)OCCO2 769683086 RUCSQSVZOUHEEZ-UHFFFAOYSA-N 400.431 2.103 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](O)Cc3ccccc3Cl)cc2)C1 772319706 RNYYRCSTQACBIF-FXAWDEMLSA-N 415.921 2.262 10 20 HECD COc1ccc(/C=C\C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1O 772320577 TVAXYLXCAMHLFO-VTSXBNNFSA-N 409.486 2.432 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1CN1CCOCC1)c1ccc(N(C)C)cc1 773846585 MSZWZQCBDWXANV-KRWDZBQOSA-N 410.518 2.401 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3Cc4ccccc4C3)CC2)cc1 778286173 VUQBBDAQOKHKIL-ZHACJKMWSA-N 419.525 2.431 10 20 HECD COC[C@@H]1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)O1 784069731 GHLUJFVFKGPDJE-HPFXQQBRSA-N 409.502 2.385 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C)CC3)cc2F)C[C@@H](C)O1 789822958 XJVSDYVYBPWOJL-BZUAXINKSA-N 423.554 2.410 10 20 HECD COc1cc(N2CCN(C(=O)c3ccnn3CC(F)F)CC2)cc(OC)c1OC 790024183 PITFWZOTHSINIO-UHFFFAOYSA-N 410.421 2.136 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)OC)cc(C(=O)OC)c1 790408624 AYRHRJUZMQKMRK-UHFFFAOYSA-N 409.416 2.165 10 20 HECD Cc1c(S(N)(=O)=O)sc(C(=O)N2CCOc3cc(N(C)C)ccc32)c1Cl 791376339 VNHQYJPXWBWUEG-UHFFFAOYSA-N 415.924 2.463 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3Cc4ccccc4O[C@@H](C)C3)CC2)cc1 795411091 AGZNXNGNINADED-UGKGYDQZSA-N 411.546 2.461 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 803451257 IATWDXKZHDCWHA-DZGCQCFKSA-N 411.449 2.057 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(F)(F)Br)CC2)cc1 805837449 HTHUBWUFPFGBIM-HNNXBMFYSA-N 422.314 2.098 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCc3noc4c3CCCC4)cc2)C1 806495513 HTTBOPBXSRSETH-INIZCTEOSA-N 411.506 2.255 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(C)cc(Cl)n3)CC2)cc1 807555240 ACEYLGWXWQBXSD-UHFFFAOYSA-N 416.909 2.407 10 20 HECD O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C2CCOCC2)nn1 810630691 BKDKLSXDDNQIJJ-MRXNPFEDSA-N 419.913 2.383 10 20 HECD Cc1cc(Cl)cnc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 812956854 GBWMLMNESBWJDE-UHFFFAOYSA-N 406.845 2.274 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC[C@@]3(O)C[C@H]4CC[C@H]3C4)CC2)cc1 813609254 CFVLUYZXXAUBCL-SFYKDHMMSA-N 416.566 2.058 10 20 HECD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(OC)c1OC 919840747 OGFDWJAGPMQHIV-UHFFFAOYSA-N 420.487 2.200 10 20 HECD CS(=O)(=O)Cc1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919969217 ZBAXRNSYZSMGCG-UHFFFAOYSA-N 416.543 2.370 10 20 HECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCC[C@@H](C)C1 920636288 QKNFJVQOBOZELO-CXAGYDPISA-N 412.508 2.204 10 20 HECD CN1CCN(c2ccc(CN3CCC[C@H](CNC(=O)C(F)(F)F)C3)cc2F)CC1 1261206174 DDQBJKRVYCEIKE-MRXNPFEDSA-N 416.463 2.468 10 20 HECD COC(=O)CC(C)(C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1340963284 UUOUUYKGQXKLCP-HOTGVXAUSA-N 423.529 2.329 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNc1cc(Cl)ccc1OC 1342433516 ABLCKRMIRPJWNK-HNNXBMFYSA-N 422.865 2.462 10 20 HECD CCCCC[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1783225443 OJQZLVOSZDOEKV-YCRPNKLZSA-N 405.495 2.153 10 20 HECD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc1F 1803591749 UYRJZRSAMGJPKE-QDMKHBRRSA-N 415.421 2.206 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)c3cc(F)c[nH]3)CC2)C1 1810550923 YUOHOCZDRZVKGI-UHFFFAOYSA-N 402.426 2.119 10 20 HECD CCCC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 726237646 YSTXRGFSYIWCDF-LJQANCHMSA-N 402.539 2.361 10 20 HECD COc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c1O 729859811 ZYBZFJWTYFVPMQ-KRWDZBQOSA-N 418.515 2.426 10 20 HECD COC(=O)C1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 730119839 SBWDXGHYGQZCQI-UHFFFAOYSA-N 407.486 2.318 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3c4c(sc3=O)C[C@@H](C)CC4)CC2)cc1 731836875 LZXFTLYZPMXLCX-HNNXBMFYSA-N 401.532 2.392 10 20 HECD O=C(NCCCNC(=O)c1ccc(F)cc1)NCc1ccc(N2CCOCC2)cc1 732242857 PGHIBTZASOAYNH-UHFFFAOYSA-N 414.481 2.282 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2O1 732478651 IATYKVOURMTYTM-HNNXBMFYSA-N 413.449 2.093 10 20 HECD COc1ccc(O)c(CNC(=O)CNC(=O)c2ccc(OC(F)F)c(OC)c2)c1 734016694 ZDCFLZNCZULJDU-UHFFFAOYSA-N 410.373 2.057 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1 735193837 BEKADIAXNAICRO-ZDUSSCGKSA-N 420.487 2.070 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)cc1F 735512714 KCCRBUSXSBXONS-KRWDZBQOSA-N 402.474 2.010 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1nnc2n(C)c(=O)c3ccccc3n12 741733908 ANZRSMJWTMOPMN-UHFFFAOYSA-N 418.501 2.050 10 20 HECD Cc1ncc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 743975200 OCKHBNDBBPFIPY-CYBMUJFWSA-N 405.405 2.110 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)oc2C)cc1C 746055470 NDSPUEJOZBOYQI-UHFFFAOYSA-N 402.450 2.157 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(Cl)ccc(OC)c3N)nc12 750237028 HFAJKEOCXXHOOQ-UHFFFAOYSA-N 420.809 2.213 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)c(OC)c1 751536180 WFTZXLWFBVLTPP-UHFFFAOYSA-N 400.431 2.022 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCCS3)CC2)cc1 752797106 LSTYUOAKUCEBPW-YXBWYFRISA-N 403.548 2.302 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@H](c4ccccc4)C3)CC2)cc1 754010311 OURHIOKPAIBGHQ-UPVQGACJSA-N 411.546 2.252 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOc4cc(F)ccc43)CC2)cc1 754043389 RKQRTAOWONHQPG-LJQANCHMSA-N 401.482 2.216 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@@H]1C 754388871 WMZSTBXDWISQGY-OKZBNKHCSA-N 406.546 2.082 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058682 APXKIKWOXCLBRV-AEFFLSMTSA-N 417.554 2.209 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](C)c2cc(F)cc(F)c2O)c1 756705586 KYUGXTCUOKWGRM-GHMZBOCLSA-N 413.446 2.256 10 20 HECD CC(=O)O[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 765075090 JIRQTTSODCAQQD-CQSZACIVSA-N 424.500 2.422 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(S(C)(=O)=O)cc1 765979119 INSQUKLOTHLEBE-INIZCTEOSA-N 422.572 2.176 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1 774363658 UZIPQMAIZZUBFV-UHFFFAOYSA-N 420.425 2.043 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccc(Cl)cc1 774432520 JICCQTZYRBMKNK-UHFFFAOYSA-N 401.894 2.451 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3OCCO4)CC2)cc1 778246102 PZNMXVYZGWENLL-KTKRTIGZSA-N 423.469 2.310 10 20 HECD COC(=O)c1cnc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 779671125 OZSQXKUYVZIONQ-GFCCVEGCSA-N 406.389 2.263 10 20 HECD Cc1cccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)c1F 781563088 YTJYSTKPBLPVTJ-UHFFFAOYSA-N 402.425 2.005 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3C[C@@H](O)C[C@H]3C(=O)OC)c2C)cc1 788602540 QSAHHTCVBQXYPU-PXNSSMCTSA-N 400.475 2.284 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1 788974126 CSOJOIXUKDDGIF-IBGZPJMESA-N 414.550 2.056 10 20 HECD COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc1 797390824 UTNXKNTUVWXHOQ-CYBMUJFWSA-N 400.431 2.007 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1 797431692 WAVNMQDGFVFHGV-UHFFFAOYSA-N 423.438 2.468 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1 797630693 MNLLMLLCPQCFSE-GFCCVEGCSA-N 405.476 2.291 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)Cc3ccccc3)cc2)C1 799557124 TUAMKHAYQDYGEB-RTWAWAEBSA-N 424.545 2.181 10 20 HECD CN(C)C(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 799773615 OFRYAUAKWLAKOJ-SFHVURJKSA-N 418.515 2.464 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@H]3[C@H]3CCCO3)CC2)cc1 803599978 NKWTWTWMLNJKDN-XUGGCNTGSA-N 413.518 2.070 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCC[C@H](CC(N)=O)C2)cc1)C1CCCCC1 803677158 HEVCUMQZSITTIK-GOSISDBHSA-N 414.550 2.186 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@H](Cn3cccn3)c3ccccc3)ccc21 803686047 UKBOQOSNXPLDPB-OAQYLSRUSA-N 417.513 2.439 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc(-c2ncon2)cc1 807386678 DVKHAVPLKVQSOK-UHFFFAOYSA-N 417.219 2.460 10 20 HECD CCOC(=O)[C@]1(C(C)C)CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 807672313 XNOYBCPIDQBZQD-OPAMFIHVSA-N 403.523 2.368 10 20 HECD CN(C[C@@H]1CCCO1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769353 TXHNSQLNPCZRNQ-PBHICJAKSA-N 411.449 2.010 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc2[nH]ccc12 808922617 RQYMVWNSROXPPZ-UHFFFAOYSA-N 412.421 2.415 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cc(C(C)=O)ccc3OC)CC2)cc1 811823878 YMHWXUQSTUJXTL-FQEVSTJZSA-N 414.502 2.468 10 20 HECD CCN(CC)c1ccc(CN(C)[C@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc1 857757926 WNEJNRNCXSRHSZ-LJQANCHMSA-N 410.566 2.492 10 20 HECD CCO[C@@H]1C[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 917305918 UTBREQTZDSFENT-IWKLRQMXSA-N 408.470 2.024 10 20 HECD CN(C)c1ccc(CN(CC(=O)Nc2cccc(S(N)(=O)=O)c2)C2CC2)cc1 917418032 VSLRDXDGNAAIIH-UHFFFAOYSA-N 402.520 2.003 10 20 HECD COCCOc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1OC 918305090 AKAGFOHIOJISRN-UHFFFAOYSA-N 415.490 2.384 10 20 HECD CC(C)[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1C(=O)c2ccccc2C1=O 919860051 MEJVIEQZLUGJAS-NRFANRHFSA-N 421.497 2.460 10 20 HECD C[C@@H](NC(=O)Cn1cc(C(N)=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 920882789 ZBTOZHFNRYIECB-MRXNPFEDSA-N 406.486 2.454 10 20 HECD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c[nH]1 1804285776 DBETUZVSXMSARP-ZURAMSNBSA-N 411.458 2.405 10 20 HECD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)on1 1816471108 GNOCPBWOZVFVEC-ZDUSSCGKSA-N 412.406 2.132 10 20 HECD C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727110 DTPQWTBXZLLABD-UYKLKCEZSA-N 402.476 2.221 10 20 HECD Cc1cc(C(=O)CN2CCN(CC(=O)N(C)C)CC2)c(C)n1-c1cccc(F)c1 28729682 QUAYBFRFNHOZBH-UHFFFAOYSA-N 400.498 2.122 10 20 HECD Cc1cc(C(=O)CN2CCC[C@H](NS(C)(=O)=O)C2)c(C)n1-c1cccc(F)c1 725796802 XWFRFXRKSVLNAV-KRWDZBQOSA-N 407.511 2.430 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 726561235 HJEYZIVDEYHKEY-UHFFFAOYSA-N 417.531 2.311 10 20 HECD CCN(CC)Cc1ccc(CN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1 730990360 GSQMALIMNNTLNN-LDADJPATSA-N 402.564 2.401 10 20 HECD CCN(CC)c1ccc(CNC(=O)CCNS(=O)(=O)c2cccnc2)cc1F 731345725 HPOUWSCQVLGNPA-UHFFFAOYSA-N 408.499 2.052 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)OC(=O)c2cc(O)cs2)c1 732354309 JLGSUTYGDXTPFG-SECBINFHSA-N 407.400 2.211 10 20 HECD CCn1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 734048342 QNXAMFNFTNGBJM-GJZGRUSLSA-N 418.469 2.129 10 20 HECD CC(C)(CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(=O)O 734506235 MMECDCJHCMKSLF-UHFFFAOYSA-N 415.469 2.059 10 20 HECD CCc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)no1 740491273 KKFYTXPKBNLZCG-CHWSQXEVSA-N 404.442 2.245 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743957853 DHOWOFWPTVXOQB-UHFFFAOYSA-N 416.499 2.238 10 20 HECD O=C(NC[C@]1(O)CCSC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 747587020 RPQYOZDONPFLQL-GOSISDBHSA-N 401.479 2.424 10 20 HECD CN1CCC[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1=O 748582249 QXEOWEJLPPGRBR-UROBUVALSA-N 423.585 2.467 10 20 HECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 752095431 UYTMDYRALHDKBG-VQTJNVASSA-N 416.566 2.065 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(C(C)(C)C)nc3C)nc12 752168153 VVFCNWSFHIPEGB-UHFFFAOYSA-N 401.423 2.229 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@]4(CCc5ccccc54)C3)nc12 753272656 PSHRHKWKTKOZTI-QFIPXVFZSA-N 408.458 2.286 10 20 HECD COc1cc(Br)cc(CNC2CCN(S(=O)(=O)C3CC3)CC2)c1O 754045132 ABGXCPROYXVPPY-UHFFFAOYSA-N 419.341 2.210 10 20 HECD COc1ccc(C[C@@H](C)CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 763224861 WJNDRKTUOVMELH-CYBMUJFWSA-N 422.503 2.390 10 20 HECD C[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763878647 SQARIDZJZAQNGR-ONSXPEOJSA-N 410.495 2.101 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C3=NN(CC(C)C)C(=O)CC3)cc2F)CC1 766387779 NHDJRLWEGUBKGP-UHFFFAOYSA-N 417.529 2.218 10 20 HECD COc1cc(O)c(CN2CCCN(Cc3nc([C@H](C)OC)no3)CC2)cc1OC 768463806 MOCKTMZAVSDLJH-AWEZNQCLSA-N 406.483 2.208 10 20 HECD COc1ccc(O)c(CNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)c1 769542653 JUHQXNXODARPLK-UHFFFAOYSA-N 410.405 2.190 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@H]3CS(N)(=O)=O)ccc21 769578578 AOFHQXYIJCVOMT-KRWDZBQOSA-N 407.536 2.188 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4c(C)noc4C)n3)CC2)cc1 771067957 PWTJJVGJBOWYSV-UHFFFAOYSA-N 411.462 2.165 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1 774726506 PTCRPBZMMPJQRO-UHFFFAOYSA-N 406.534 2.063 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3cnc(O)c([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 776341661 TUZASKQCUGRLOJ-VXGBXAGGSA-N 404.398 2.378 10 20 HECD CC[C@H]1C[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 780142217 LRBQCGBOZXCUQU-IRXDYDNUSA-N 408.470 2.027 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(O)cc(OC)c3)CC2)cc1 781024020 IRJGJJHQGOPUFM-BQYQJAHWSA-N 411.458 2.253 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cc1 785439246 NBXDBJYTNREFOD-FQEVSTJZSA-N 408.502 2.023 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)nc4[nH]nc(C)c34)cc2)CC1 786660447 XNASYJFTSJSRIR-UHFFFAOYSA-N 406.490 2.173 10 20 HECD CC(C)OCC[C@H](O)CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 788065211 BVCYARBRJAXEMJ-IBGZPJMESA-N 417.529 2.208 10 20 HECD C[C@H](CN1CCOCC1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 789339295 BOTKPMMPJFESIQ-MRXNPFEDSA-N 421.497 2.053 10 20 HECD CC[C@@H](CSC)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789842688 GIPGZJGYNOSMMK-HNNXBMFYSA-N 411.543 2.003 10 20 HECD Cc1cc(C(=O)CN2CCC[C@](C)(O)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 791632098 MCWMFGUWZODWNY-NRFANRHFSA-N 419.547 2.161 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c(O)c1 797387590 LWIPPFZVDMTVGF-UHFFFAOYSA-N 411.458 2.328 10 20 HECD Cc1cc(C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1-c1cccc(Cl)c1 798270715 UEBZNZTUVZUOPB-UHFFFAOYSA-N 400.870 2.384 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@@H]2c2nccs2)cc1F 803663022 RDJCNOJBMLRESE-OAHLLOKOSA-N 408.524 2.281 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC(CNS(C)(=O)=O)CC3)cc2)CC1 806765990 KKXOOFHAVUVWRY-UHFFFAOYSA-N 422.595 2.394 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC[C@@H]([S@](=O)CC)C1 809234540 NCRFGOSUQPEUJB-CMHSWVJJSA-N 407.580 2.297 10 20 HECD COc1ccc(N2CCN(CCNCc3cc(OC)c(O)c(OC)c3)CC2)cc1 809610548 WPOCJEWQUWVGQQ-UHFFFAOYSA-N 401.507 2.330 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ncc(Cl)cc3C)CC2)cc1F 812972622 KYQPWQWOWQFOJC-UHFFFAOYSA-N 406.845 2.478 10 20 HECD O=S(=O)(CC[C@@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 814992241 HGWHNCJCYDZGMH-AWEZNQCLSA-N 422.469 2.388 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(CC(N)=O)CC1 917131879 GYZIYQGMYSWBJP-CQSZACIVSA-N 419.481 2.376 10 20 HECD CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917708899 LTZHBCWHKSJUQI-UHFFFAOYSA-N 406.479 2.386 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3CCOCC3)cc2F)C[C@@H](C)O1 918996972 NIMKNTSHAZENHC-GASCZTMLSA-N 408.470 2.025 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1oc2c(c1C)C(=O)CCC2 1116647084 VGQAUPMCBGDNHU-ZDUSSCGKSA-N 401.415 2.422 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2c(Cl)ccc3nonc23)n(C)c1 1117546655 AHBLBICNQGOYNO-UHFFFAOYSA-N 411.871 2.498 10 20 HECD Cc1cc[nH]c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816720894 CECZSZZDEJKVBQ-NSHDSACASA-N 413.459 2.125 10 20 HECD CNC(=O)NC(=O)COC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 11486815 MZERNFCMNUCTRC-UHFFFAOYSA-N 408.252 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 116705333 AYQHIYGYLTYFMH-UHFFFAOYSA-N 422.445 2.211 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)NCc2ccco2)cc1 302981463 DEKVFFLDHJIKMO-HXUWFJFHSA-N 414.506 2.353 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCC(NC(=O)C4CC4)CC3)CC2)cc1 726715382 PRILGQIGLWLXIM-UHFFFAOYSA-N 400.523 2.364 10 20 HECD Cc1nc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)no1 729817708 PFAZTGOOALZIFH-ZIAGYGMSSA-N 419.501 2.272 10 20 HECD CC1CCN(c2ccc(CNC(=O)Cc3ccc(S(N)(=O)=O)s3)cc2)CC1 731014966 NFLIOABLCJVEAN-UHFFFAOYSA-N 407.561 2.491 10 20 HECD COC(=O)CN(CCC(=O)Nc1ccc(C(N)=O)cc1)Cc1cc(Cl)ccc1O 731844705 HZGSTQSBYANGRV-UHFFFAOYSA-N 419.865 2.148 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@H](N2CCCC2=O)C1 732447368 CFZYBQMHCZGHNM-KRWDZBQOSA-N 418.513 2.083 10 20 HECD O=C(CNc1cccc(Cl)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 733950886 MYLDZBRZLKYARF-UHFFFAOYSA-N 407.923 2.303 10 20 HECD Cc1cc(C(=O)CN2CCCOC(C)(C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 735311886 XQLLJEZQRSLLQM-UHFFFAOYSA-N 419.547 2.425 10 20 HECD CCc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n(C)n1 737174860 USDQDXRSJZICJL-UHFFFAOYSA-N 421.448 2.308 10 20 HECD NC(=O)CS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCCC3)c2)cc1 742576494 TYIBFDHLUGVXHK-UHFFFAOYSA-N 401.488 2.188 10 20 HECD COc1ccc(N(CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)CC(C)C)cc1 746170343 PQHOLLLVYJOLRW-UHFFFAOYSA-N 417.531 2.394 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(O[C@@H]2CCOC2)CC1 748618676 PEAXDJNDBGMCNM-GOSISDBHSA-N 407.486 2.142 10 20 HECD Cc1noc(C)c1[C@H](C)C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 750268188 HKTHZZKQSSUFFR-ZDUSSCGKSA-N 419.453 2.230 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)cc1F 753738764 UPXRJDFYBLRFIK-BHYGNILZSA-N 417.481 2.047 10 20 HECD CCCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 756079706 KYVCMEYZTIUFRV-UHFFFAOYSA-N 420.510 2.451 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)C2CC2)cc1 756094406 KUXVIWPXSUAJLU-IDPBPBMLSA-N 422.529 2.234 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc4c(c3)OCCO4)CC2)cc1 758221353 BSVGSPAVIDNZMI-SFHVURJKSA-N 400.475 2.028 10 20 HECD NC(=O)c1ccc(N2CCN(C(=O)NCCCSc3nccs3)CC2)cc1 759591081 PSVDUZMTBBWEAT-UHFFFAOYSA-N 405.549 2.256 10 20 HECD C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C2=O 763283386 JMENLCYSBDYGES-XDEPDNQISA-N 417.506 2.282 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)nc12 763400783 GNDBJTUXCSWUQQ-LLVKDONJSA-N 414.374 2.367 10 20 HECD CN(CC(F)F)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 764149610 KQTOYIXKAODRDI-UHFFFAOYSA-N 415.374 2.438 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 764864522 OJXIXJOLIBZHEW-FQEVSTJZSA-N 401.463 2.303 10 20 HECD CN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c1 765925502 GYILLCZGTRFVEB-UHFFFAOYSA-N 420.263 2.111 10 20 HECD C[C@@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1Cl 766021838 DUOLATKNRRPMKK-MOPGFXCFSA-N 423.001 2.234 10 20 HECD O=S1(=O)CCN(c2ccc(CNCc3cncc(Br)c3)cc2)CC1 767180952 FIIVKAVVXDSZTQ-UHFFFAOYSA-N 410.337 2.369 10 20 HECD COc1cc(Br)cc(CNc2cccc(C(=O)NCCC(N)=O)c2)c1O 770559901 JSCJRAMEORMIMI-UHFFFAOYSA-N 422.279 2.381 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCO[C@]4(CCOC4)C3)cc2F)CC1 771435752 XYWWWMIUGOUWPA-PGRDOPGGSA-N 420.529 2.105 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCc4ccccc4C3)CC2)cc1 775124476 YFNFYAOVQFQYPJ-HXUWFJFHSA-N 407.514 2.408 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC(N4CCCCC4)CC3)CC2)cc1 779221678 MFBCYAUUKMIAPE-HSZRJFAPSA-N 416.610 2.128 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CC(=O)NCC(F)(F)F)cc1 779661234 QPGRVNXHAPMDJD-INIZCTEOSA-N 401.429 2.329 10 20 HECD Cc1nnc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)s1 780282280 GXUPGEAMANIBRZ-UHFFFAOYSA-N 408.395 2.460 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCc2nc(-c3ccccc3F)no2)c1 781168788 CDDHVHHAMXRBDS-UHFFFAOYSA-N 407.379 2.310 10 20 HECD C[C@H](CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1nccs1 784576958 WQQKIURLLUZIFL-OAHLLOKOSA-N 406.527 2.471 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1 785424428 PKJSAVJZTMOUPP-OAQYLSRUSA-N 408.546 2.397 10 20 HECD CC(=O)N1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 785505354 MFYYDYCBUBULSQ-UHFFFAOYSA-N 401.507 2.181 10 20 HECD Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 786111019 ICEMDKVNMOSTIJ-LJQANCHMSA-N 401.482 2.374 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3ccc(C)c(C)c3)cc2)CC1 786121218 DZFIPPPWZJLNJT-UHFFFAOYSA-N 401.532 2.450 10 20 HECD C[C@@H](OC(=O)CCn1ccnn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787623715 KPSAQNICFUZICV-CYBMUJFWSA-N 418.409 2.014 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCn1ccnc1C 787652222 IBWNLQDMVNFABM-UHFFFAOYSA-N 423.311 2.215 10 20 HECD CCCNC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 787833748 QQNUWHZUDYGACF-UHFFFAOYSA-N 422.529 2.359 10 20 HECD CCS[C@H]1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799144 JLRAEMMSTICCBD-IRXDYDNUSA-N 423.554 2.411 10 20 HECD Cc1cc(C(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)c(C)n1-c1ccccn1 790221156 FGHUNNIQXVQBIM-KRWDZBQOSA-N 402.520 2.129 10 20 HECD COC(=O)Cc1cccc(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)n1 792409111 GTFMLKJEKXDBMO-UHFFFAOYSA-N 402.426 2.299 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 792691561 AJGMFVHDIDJSEC-HOTGVXAUSA-N 422.497 2.415 10 20 HECD COc1ccc(CNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c(O)c1 792789322 YBVRNVDKQIIOPI-UHFFFAOYSA-N 407.492 2.087 10 20 HECD O=C(COc1ccc2oc(=O)oc2c1)NCc1ccc(N2CCOCC2)c(F)c1 799588719 FNZJIMIVWVJIGO-UHFFFAOYSA-N 402.378 2.057 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1cccc(N2CCCC2)c1 802757272 VDSNRQIACUVZCX-UHFFFAOYSA-N 410.517 2.500 10 20 HECD CS[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 803306583 WJCGBEBOWNZKLS-HHXXYDBFSA-N 405.564 2.491 10 20 HECD COC(=O)c1cc(C(C)(C)NC(=O)NCc2ccc(N3CCOCC3)cc2)no1 812011924 KCOYMHYBFCKHKK-UHFFFAOYSA-N 402.451 2.032 10 20 HECD COC[C@H](C)[C@@H](C)c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 812811646 YTMBXCMYUIEOTE-JKSUJKDBSA-N 402.495 2.356 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3c4ccccc4C[C@H]3O)CC2)cc1 916196819 PVDRVCLHUUFQRK-DHIUTWEWSA-N 424.545 2.165 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(F)c(F)c1 1796604868 SHJCBPNTRYOQKI-BTTYYORXSA-N 403.385 2.337 10 20 HECD CCO/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804291563 MZZFRJFZBJXFDD-JNZMVSHCSA-N 402.447 2.005 10 20 HECD CO/C=C(\C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846356 TZGMTAIWZVFUSP-PLSXKVAHSA-N 401.423 2.072 10 20 HECD COc1ccc([C@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847779547 XWGCTLKRBFMTDB-XWSJACJDSA-N 423.469 2.121 10 20 HECD O=C(Cc1cc(F)ccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848015851 PDVTVSWSMNGUPS-HOTGVXAUSA-N 419.840 2.343 10 20 HECD Cc1nc2n(n1)C[C@@H](NC(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 727226622 DPPGXXNQCROBPD-HNNXBMFYSA-N 420.464 2.471 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)C1 730134033 KFSPQMDWXGDXSM-SFHVURJKSA-N 420.529 2.452 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(N(C)S(C)(=O)=O)CC2)cc1F 731363865 OCJFQBSWFWSUNC-UHFFFAOYSA-N 414.547 2.237 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCOC[C@@H]3CCCO3)cc2F)C[C@@H](C)O1 734525445 HMDPNEMSRLJWGU-JZXOWHBKSA-N 409.502 2.434 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C 734702358 YOLTWZCCOMOIGX-UHFFFAOYSA-N 410.518 2.461 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)OCCNS(=O)(=O)c3cnn(C)c3)c2C)c1 744481893 LDMCGZOMSNBGSE-UHFFFAOYSA-N 416.503 2.271 10 20 HECD O=C(NC[C@H](O)COCC1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903006 AUEJYSGGPGAUJN-RDJZCZTQSA-N 413.465 2.344 10 20 HECD CSc1nc(O)nc(C)c1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405129 CEHQZPMNVLVHLJ-UHFFFAOYSA-N 406.483 2.243 10 20 HECD CC(C)CNC(=O)NC(=O)[C@@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1 751930915 KBDCJHCYHVHCHT-GFCCVEGCSA-N 404.492 2.343 10 20 HECD COc1ccc(N2CCN(CCOc3ccc(S(C)(=O)=O)cc3)CC2)cc1F 753857035 IQJGJQSFTVOQPZ-UHFFFAOYSA-N 408.495 2.439 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](C)N3CCCC[C@H]3C)CC2)cc1 758207578 ATYOKSMJPCLPTQ-KCZVDYSFSA-N 404.599 2.031 10 20 HECD CCC[C@@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 759230396 AIHWUAXTSWIEGV-OAQYLSRUSA-N 404.555 2.418 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)NC4(CCCCC4)C3=O)CC2)cc1 760949833 KBJRJYNZCLKKJO-UHFFFAOYSA-N 400.523 2.462 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@](C)(c4ccccc4)C3=O)CC2)cc1 763356561 UULYVLVXSFMLQP-XMMPIXPASA-N 421.497 2.061 10 20 HECD O=C1C[C@H](Cc2ccc(C(=O)NCc3cccc(Br)c3O)cc2)C(=O)N1 765734976 AXNSGYRAVNYMMM-AWEZNQCLSA-N 417.259 2.290 10 20 HECD CC(C)Cn1c(N)c(C(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)c(O)nc1=O 771790312 BATHTSQKZDGRFQ-UHFFFAOYSA-N 415.538 2.346 10 20 HECD CN1CCN(c2ccc(CNCCCN3C(=O)NC4(CCCCC4)C3=O)cc2)CC1 771823716 OMHUEVICRKYSAJ-UHFFFAOYSA-N 413.566 2.173 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F)c1ccc(N(C)C)cc1 773847135 ODZXTNJSSGPHAZ-LBPRGKRZSA-N 407.467 2.111 10 20 HECD COc1c([N+](=O)[O-])ccc(CN(C)CCNS(=O)(=O)c2ccc(C)cc2)c1O 774906654 CPBQESPUESPEKV-UHFFFAOYSA-N 409.464 2.028 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 776052772 BMNMSPZSQDYXEV-CQSZACIVSA-N 404.492 2.149 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(CCO)cc3)CC2)cc1 778317669 DQONRRIXEQNYDR-KHPPLWFESA-N 409.486 2.074 10 20 HECD COc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1F 782091560 JUPARQOWKSDGGS-UHFFFAOYSA-N 407.467 2.391 10 20 HECD CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)OC(=O)c1cccc(O)c1O 784788623 VIJCDBBZINSIFI-CYBMUJFWSA-N 400.431 2.303 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cccc(C(N)=O)c1 785193231 UPMDWFXMDCIGLI-UHFFFAOYSA-N 420.263 2.241 10 20 HECD COCc1ncsc1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 785724015 NNUVVEXWAYEFAV-UHFFFAOYSA-N 404.536 2.240 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1 788975579 RAIBBSMIVCPXQY-NRFANRHFSA-N 422.529 2.379 10 20 HECD C[C@H]1COC(C)(C)CN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789820422 QSEVOUJFFBJKMV-ARFHVFGLSA-N 421.513 2.081 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CC[C@H](C4CC4)C3)cc2F)C[C@@H](C)O1 789825466 LWIYZYUBEYKURW-DAYGRLMNSA-N 403.498 2.314 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@H]4[C@@H]5C[C@@H]6[C@@H]7C[C@@H]([C@@H]4[C@@H]75)[C@@H]63)cc2)C1 793133902 YQIUOBXPAAYTSM-YRHQKNBMSA-N 405.542 2.399 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](C(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797710276 WNHHLKDZKYXVEP-BIENJYKASA-N 423.485 2.118 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCN(Cc4ccsc4)CC3)ccc21 803685169 BHMBQKCZSAPPJM-UHFFFAOYSA-N 412.559 2.091 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCOC[C@H]3C)CC2)cc(OC)c1OC 805820907 AGNLRZHOCGHGLB-CVEARBPZSA-N 407.511 2.217 10 20 HECD COc1ccc(N2CCCN(C(=O)NCC3(S(C)(=O)=O)CCCC3)CC2)cc1 805838731 GBXINGSUQLCGIM-UHFFFAOYSA-N 409.552 2.274 10 20 HECD COc1cc(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccn1 806918982 LFBDLUSZNOLCCN-CQSZACIVSA-N 420.416 2.415 10 20 HECD CN(C)Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1 807289840 KLSLVCFVLRPMQX-UHFFFAOYSA-N 406.530 2.399 10 20 HECD CS(=O)(=O)c1ccc(N(CCN)Cc2c(O)ccc(Cl)c2F)c([N+](=O)[O-])c1 809728094 KGIFBGZGWAEKMG-UHFFFAOYSA-N 417.846 2.462 10 20 HECD COc1ccc(N2CCC(NC[C@H](O)CS(=O)(=O)c3cccs3)CC2)cc1 812839653 FIIKABWXGJVGRI-KRWDZBQOSA-N 410.561 2.150 10 20 HECD CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)ccc21 817997332 ZFSOIMUBCWSIQV-UHFFFAOYSA-N 423.516 2.158 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)CN1CCOCC1 819518734 BTFJJJDTEXMOBM-KRWDZBQOSA-N 405.539 2.343 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cn(Cc2ccccc2)nn1 914901943 CWQQATGJLXAZTB-UHFFFAOYSA-N 407.474 2.208 10 20 HECD O=C(CCOc1cccc(F)c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918645713 XBOJCLIUABNEKG-UHFFFAOYSA-N 406.479 2.146 10 20 HECD Cc1cc(C(=O)COC(=O)[C@H](C)S(C)(=O)=O)c(C)n1-c1ccc2c(c1)OCCO2 919346771 CFDVRNKCLLIIKB-AWEZNQCLSA-N 421.471 2.024 10 20 HECD CCC[C@@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1=O 919971247 NHHWKBBIDRFXRA-WBVHZDCISA-N 405.514 2.440 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)c1ccc(OC)c(Cl)c1 1320392966 DOAVBZPHHCFEIH-AWEZNQCLSA-N 421.833 2.233 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)C2CCC(O)CC2)C1 1846470643 KNLWFGQMKUEKDR-UHFFFAOYSA-N 408.882 2.119 10 20 HECD CC(=O)N1CCN(C(=O)COC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 7706452 KNVKSRHACADMFK-UHFFFAOYSA-N 401.438 2.081 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccoc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 16158407 CEFBEZUDNOMSNI-UHFFFAOYSA-N 402.428 2.374 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccnn3C)cc2)cc1 727353685 JYAXFQHVQVOVHW-UHFFFAOYSA-N 406.489 2.330 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3cn4ccc(C)cc4n3)CC2)cc1 742940433 UKTJAZZVBPQLMR-UHFFFAOYSA-N 422.533 2.273 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(=O)n(CCOC)n1 743807496 GBTVPKYORBDMCK-UHFFFAOYSA-N 410.268 2.020 10 20 HECD COCCN(CCN(C)C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745906339 YWURTLAJMXZIGQ-MRXNPFEDSA-N 414.497 2.476 10 20 HECD C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1)n1cccn1 748481713 LZVMFIJTLFYZBP-CQSZACIVSA-N 407.430 2.043 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(CC(F)F)n3)cc2)C1 748950092 XSWWWOGYYRCFER-AWEZNQCLSA-N 406.437 2.172 10 20 HECD CCOC(=O)c1c(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)n[nH]c1C 751043568 IMPNEYNEFRLPHA-UHFFFAOYSA-N 406.508 2.364 10 20 HECD CCOC(=O)CCCS(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751371882 LSRHEKONNSEXRW-MRXNPFEDSA-N 418.943 2.273 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cn(-c4cccc(C)c4)nn3)CC2)cc1 751385185 IJJOQQWFHAGEGS-UHFFFAOYSA-N 420.517 2.136 10 20 HECD CCOC(=O)c1ccc(N2CC(NC(=O)NCCCSc3nccs3)C2)nc1 753222153 PPZIHSPLNIULCJ-UHFFFAOYSA-N 421.548 2.385 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(OC(C)C)nc3)CC2)cc1F 754213879 WWCYOPNKJAFIGY-UHFFFAOYSA-N 416.453 2.304 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](CCc4ccccc4)C3)nc12 755271755 OHOQKAOFWQZPHT-GOSISDBHSA-N 410.474 2.445 10 20 HECD COc1ccc(N2CCN(C[C@H](O)Cn3nc(C)c(Br)c3C)CC2)cc1 758222812 KNLFZGWDKCKAMR-KRWDZBQOSA-N 423.355 2.454 10 20 HECD CCS(=O)(=O)c1cccc(S(=O)(=O)NCCCSc2nccs2)c1 760576472 XNEKSMZNVHQSQC-UHFFFAOYSA-N 406.576 2.397 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCN1C(=O)c2ccccc2C1=O 761121568 IBJSBXNASZDXFW-UHFFFAOYSA-N 413.817 2.106 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(C)nn1-c1ncccn1 768016852 RJMQNAHTBHBOBO-UHFFFAOYSA-N 407.478 2.024 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C4(O)CCCCC4)n3)CC2)cc1 771066034 HWKXLWYALOFOJA-UHFFFAOYSA-N 400.479 2.121 10 20 HECD O=C(CSc1ccc([N+](=O)[O-])cn1)NCc1ccc(N2CCOCC2)c(F)c1 772858479 QPKPPIUBXMLIAU-UHFFFAOYSA-N 406.439 2.374 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773089202 STOCOKIUKQETCA-CYBMUJFWSA-N 420.487 2.365 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCNS(=O)(=O)c1cccc(Cl)c1 773769190 QKMRCMJVPVEXKX-LBPRGKRZSA-N 412.895 2.167 10 20 HECD CC(=O)c1cc(CN(C)Cc2ncc(Cl)n2C)c(O)c(CN2CCOCC2)c1 778582420 RIDBZBKBPSUWAH-UHFFFAOYSA-N 406.914 2.446 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)cc1 778637339 QONYPVKSJOTGPM-IBGZPJMESA-N 404.555 2.463 10 20 HECD Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 781365526 TTWYWTUCIDADQZ-LJQANCHMSA-N 417.485 2.285 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1nnc2n1CCCCC2 786055925 VHSQVMFQSPBCOS-MRXNPFEDSA-N 410.522 2.098 10 20 HECD COC(=O)Nc1cccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1 786256180 ATHTYXASGFKXFG-UHFFFAOYSA-N 410.474 2.463 10 20 HECD CCc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 789800911 WPJVBAVRESWUIR-UHFFFAOYSA-N 413.493 2.500 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)S1 789828966 ZQQHGYSQPCTYKG-FPCVCCKLSA-N 423.554 2.408 10 20 HECD CCOC(=O)N1CCC(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 789902589 FTORVROORJSEOZ-UHFFFAOYSA-N 404.511 2.286 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1F 802553231 FCBQLISGUOTHDE-UHFFFAOYSA-N 417.412 2.389 10 20 HECD Nc1nnc(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)o1 803149518 KCEJODLFJFHRPS-PKNBQFBNSA-N 423.545 2.054 10 20 HECD COCCC1(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCC1 804316822 KNQQZZNWQYTGNY-UHFFFAOYSA-N 403.523 2.103 10 20 HECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 807610874 MUTVVLKLJLKTSU-XEYPJELSSA-N 416.518 2.220 10 20 HECD CC(C)[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852379 TWMGGIVNZNVCEF-JOCHJYFZSA-N 412.578 2.482 10 20 HECD COCCC1(C)CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)C1 811994538 CKABEKXAOGTAJR-UHFFFAOYSA-N 404.555 2.275 10 20 HECD O=[N+]([O-])c1cccc(S(=O)(=O)NCCNCc2cc(Cl)c(F)cc2O)c1 816541248 HEOIREGBOWEJAH-UHFFFAOYSA-N 403.819 2.161 10 20 HECD CCc1cc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nn1C 1319972415 GLOXRMMNJAMLBZ-UHFFFAOYSA-N 423.496 2.168 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3c(cnn3C)c2)cc1 1338373339 KZXQOBUYEYZHIZ-UHFFFAOYSA-N 423.520 2.311 10 20 HECD Cc1nc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C)s1 1796598980 SVDFGSPCZQTAAG-QDMKHBRRSA-N 416.503 2.061 10 20 HECD CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826395915 AJGVKKMFCSRVHN-HNNXBMFYSA-N 411.593 2.267 10 20 HECD C[C@@H](Cn1cccn1)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842121513 GBOHCHANQYIRQD-ZDUSSCGKSA-N 418.881 2.101 10 20 HECD CCN(C(=O)CN(C)Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCS(=O)(=O)C1 15571658 YEGZKAKRHHZRDS-HXUWFJFHSA-N 407.580 2.144 10 20 HECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cc1 18215035 GFJLQZGVBPTSDL-SFHVURJKSA-N 407.470 2.458 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCNC(=O)c3ccco3)cc2F)C[C@@H](C)O1 55529432 LSLSNGIXSXCZEW-GASCZTMLSA-N 403.454 2.469 10 20 HECD COc1cc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)ccc1OCC(=O)O 96505557 ZIYWYCXOMFUOMK-MDWZMJQESA-N 411.457 2.225 10 20 HECD Cc1c(CNC(=O)N[C@H]2CCCN(Cc3nccn3C)C2=O)n(C)c2ccccc12 472148733 AHKIEVOQMSJTAG-KRWDZBQOSA-N 408.506 2.211 10 20 HECD Cc1cc(C(=O)N2CCOCC2)ccc1NS(=O)(=O)c1cccc2nsnc12 535767161 UZRWILOHCJIGRO-UHFFFAOYSA-N 418.500 2.273 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C12CCOCC2 673314926 BPDNKUSESCRNBH-VQTJNVASSA-N 413.518 2.193 10 20 HECD C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)C(=O)N1CCCC[C@@H]1C 726616171 ZWBVTWQWHOQBAX-ROUUACIJSA-N 402.539 2.454 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3OCC(C)C)nc12 728670557 KURMTNBJHXBQSC-UHFFFAOYSA-N 414.418 2.398 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1Cl 729061906 LIPLFUFDYZABLH-SNVBAGLBSA-N 405.838 2.230 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cc2c(nc1O)CCC2 733647407 QFPHIIODEJPACU-UHFFFAOYSA-N 414.481 2.376 10 20 HECD CCOC(=O)CCCS(=O)(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 734842002 DAIRRARLTDCBTO-HUUCEWRRSA-N 416.515 2.202 10 20 HECD CC(C)(C)OC(=O)N1CC[C@@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 744855256 VSMVQGQKMQHEHW-GFCCVEGCSA-N 414.480 2.178 10 20 HECD Nc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1 746479347 UMCZJYCLNNVAJK-UHFFFAOYSA-N 417.487 2.079 10 20 HECD COCCCS(=O)(=O)NCCOC(=O)c1sccc1-n1c(C)ccc1C 746968185 YEBQHZHLXVYQSZ-UHFFFAOYSA-N 400.522 2.268 10 20 HECD COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 753871268 IEANEGIUUROTMS-RTBURBONSA-N 410.536 2.017 10 20 HECD COc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 755676748 KPDJNCMWPMQPRZ-UHFFFAOYSA-N 401.419 2.485 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 756190257 QJRPFLLPCCSGHM-UHFFFAOYSA-N 416.503 2.078 10 20 HECD O=C(COC(=O)Cc1c(F)cccc1F)NCc1ccc(N2CCOCC2)c(F)c1 756633679 VGZYXDKCVZXDJK-UHFFFAOYSA-N 422.403 2.343 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 759163981 LGRYWIDSHZQWJF-UHFFFAOYSA-N 415.449 2.166 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccnc3OCC(F)F)cc2)C1 760389098 ILDQKIXZGROQSQ-OAHLLOKOSA-N 418.444 2.357 10 20 HECD C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2ccccc2)no1 760931712 GWXITNOEIATCAB-GFCCVEGCSA-N 416.459 2.347 10 20 HECD COC(=O)c1cc(S(=O)(=O)NCc2cccc(Br)c2O)c(C)o1 766199320 CNTKWECNXOSPOP-UHFFFAOYSA-N 404.238 2.321 10 20 HECD CCCN1C(=O)CCc2cc(NC(=O)C(=O)NCc3cccc(OC)c3O)ccc21 774262584 RNLRHMZMJKYDHF-UHFFFAOYSA-N 411.458 2.345 10 20 HECD COc1ccc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 774541184 URTWYUXQXGYIFM-HXUWFJFHSA-N 412.486 2.267 10 20 HECD O=C(CN[C@@H](CCCO)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 775461857 SVCHGSFZMDZKTO-NRFANRHFSA-N 415.509 2.382 10 20 HECD Cc1n[nH]c(C)c1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 775466834 SJGUPGNVFCQJTQ-UHFFFAOYSA-N 418.441 2.360 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3([C@H](O)C(C)C)CC3)CC2)cc1 776038777 JLTQTRPOEWAVIB-OAQYLSRUSA-N 418.582 2.304 10 20 HECD CCC1(O)CCC(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 778418980 JGTJQACSCILSFY-HJWRWDBZSA-N 415.534 2.100 10 20 HECD CCOC(=O)C1CCN(C(=O)[C@H](C)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 781976171 DDXLYMRNUKVFMK-SFHVURJKSA-N 417.550 2.145 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2 783317402 RGXPANVFXZNPON-UHFFFAOYSA-N 410.474 2.459 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1noc(Cc2ccccc2)n1 785424555 PRPDHBGCTCCDKX-HNNXBMFYSA-N 407.474 2.220 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 789823779 GJDDNLFJTYODDX-GASCZTMLSA-N 423.554 2.457 10 20 HECD O=C(O)c1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c(OC(F)(F)F)c1 792697648 KPDXTAZUZYLXSF-UHFFFAOYSA-N 421.305 2.488 10 20 HECD COc1ccc(CNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c(O)c1 794370542 OZLFMOABBVQCLK-UHFFFAOYSA-N 418.515 2.434 10 20 HECD CCCN(C)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C1 804853476 QODFVNOMOJDIBY-GOSISDBHSA-N 406.546 2.478 10 20 HECD CC(C)(O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 806842135 FMFRWXLMPQXTNW-UHFFFAOYSA-N 415.465 2.145 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 807653541 DVCFXKNUJDLEPJ-GQIGUUNPSA-N 408.502 2.240 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(c2ccc(Cl)cn2)CC1)c1ccc(N(C)C)cc1 807674310 JVTGRSVPDIQUGO-HNNXBMFYSA-N 415.925 2.327 10 20 HECD Cc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)cc1C 810112072 HWKRWUSADDXBHR-UHFFFAOYSA-N 401.532 2.498 10 20 HECD COCC(C)(C)CCCNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 813631668 YATRPDCYJFHPQP-ZHACJKMWSA-N 417.550 2.469 10 20 HECD Cc1c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cnn1C 813653469 ZWFZLSUAYHNKIJ-UHFFFAOYSA-N 418.441 2.062 10 20 HECD CCC(=O)N[C@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 914672583 UNWPLUGAFVUDSF-OLZOCXBDSA-N 422.437 2.247 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c2OC(C)(C)C3)cc1 1344596197 WSPSRGHSDSKLIH-UHFFFAOYSA-N 411.505 2.077 10 20 HECD CO[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1795564159 VHKYXDVBQPUCQC-AXVVYFOYSA-N 411.458 2.132 10 20 HECD O=C(c1ccon1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426837 JVHIPKRQSBWTNX-INIZCTEOSA-N 400.435 2.028 10 20 HECD O=C(c1cccc2cccnc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249446 KLAGSEVFMOFIFU-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(/C=C/c1ccco1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033743 AWQRBRNFTUGVHD-XVYDYJIPSA-N 410.426 2.326 10 20 HECD CCc1nnc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 5580953 ZEPMIWQGLRXWGU-UHFFFAOYSA-N 407.455 2.061 10 20 HECD Cc1c(CNC(=O)C(=O)NCc2ccccc2N2CCOCC2)n(C)c2ccccc12 556207422 NPLCNAZJWZWCLE-UHFFFAOYSA-N 420.513 2.256 10 20 HECD COc1ccc(N2CCC(NC(=O)c3cc(S(N)(=O)=O)ccc3C)CC2)cc1 726562798 PZGVJCFZNDIYPY-UHFFFAOYSA-N 403.504 2.050 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCCN2CCN(c3ccncc3)CC2)c1 728951418 ATLMMAKZWQMOTJ-QGZVFWFLSA-N 413.522 2.368 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3cccc(OC)c3)CC2)cc1 729876203 UEPSNCNRFAKRHX-MUUNZHRXSA-N 402.516 2.301 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 731216406 YNTXATBOQYUOLT-UHFFFAOYSA-N 422.478 2.236 10 20 HECD CC1(C)C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 732071130 HFQALNRCKRKWCS-QBFSEMIESA-N 423.585 2.467 10 20 HECD COCCN1CC[C@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 736664820 KIEUINCVQMZIGZ-INIZCTEOSA-N 412.481 2.277 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 741144116 FOULIJJUNVUIKB-FQEVSTJZSA-N 421.497 2.001 10 20 HECD CNc1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1[N+](=O)[O-] 742927637 WMZBQUIWUIJWIM-UHFFFAOYSA-N 413.478 2.197 10 20 HECD O=C(Cn1sc2ccccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 746653004 BBMJVXVWHMNDBM-UHFFFAOYSA-N 401.463 2.355 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1 759034386 YPBPIBKAHVMACD-CQSZACIVSA-N 409.446 2.051 10 20 HECD O=C(O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc([N+](=O)[O-])c1 766878703 QDLMLAZEGRDWMC-UHFFFAOYSA-N 413.430 2.432 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCO[C@@H](COC(C)C)C2)c1 769804475 JBXJXAZBSPMKNI-OAQYLSRUSA-N 406.523 2.053 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCN(C)C3=O)c2C)cc1 772505325 CNWKMGUOQKCUJM-KRWDZBQOSA-N 412.442 2.085 10 20 HECD CC[C@H](C)n1nc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 776040959 GUGDXNQMIUVRNP-AWEZNQCLSA-N 417.485 2.393 10 20 HECD C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 777237211 ZNUZTKJYNNXPQN-AWEZNQCLSA-N 408.518 2.231 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CC3(N(C)C)CCC3)cc2F)C[C@@H](C)O1 782643006 BBJQVZZGTGMKPP-QZTJIDSGSA-N 420.573 2.472 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 785295593 WYTUVSXZIXBQMZ-KDOFPFPSSA-N 414.458 2.342 10 20 HECD CCn1c(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)nc2ccccc21 785474736 SAXBRDWGVGQLSE-UHFFFAOYSA-N 405.502 2.371 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCOC2(CCCCC2)C1 788313718 VDJNOZUENUPJMM-IBGZPJMESA-N 415.534 2.138 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CCN(CC(F)(F)F)C3)cc2F)CC1 791572076 FRZQTVKRTQWZCK-INIZCTEOSA-N 416.463 2.468 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1 797531666 CKRFQJFFHOCIGU-UHFFFAOYSA-N 417.893 2.475 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCc2c(O)cccc21)c1ccc(N2CCOCC2)cc1 803303973 BJUZDTSWZDALLG-QRWLVFNGSA-N 409.486 2.210 10 20 HECD COC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@H](C)O1 803677430 OZNYNZILBSLBBD-LAUBAEHRSA-N 417.550 2.334 10 20 HECD CCCCN1CCC(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 803995837 ODBMGIZLRKVBDF-UHFFFAOYSA-N 416.566 2.161 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H](C)N3CCCCC3)CC2)cc1 804319070 XJTDSHVIFGQNHA-SFHVURJKSA-N 416.566 2.161 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3cnn4ccccc34)CC2)cc1 805780543 MAKQLAZHNHNJCF-UHFFFAOYSA-N 422.533 2.354 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1csc(N2CCCC2)n1 806332958 JZHYGKIEOFVHDL-UHFFFAOYSA-N 415.563 2.127 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCCc1ccccc1F 807314660 ILRAXFCBORHDKH-UHFFFAOYSA-N 413.493 2.370 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ccc(-n2ccnn2)cc1 807677549 QEXKYEBALNVTCF-CVEARBPZSA-N 406.490 2.388 10 20 HECD CCOC1(C)CCN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 816787982 OFUFCBFHVBXVKK-KTKRTIGZSA-N 415.534 2.318 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 918461372 VZLNHPMMFKLDMR-UHFFFAOYSA-N 411.458 2.144 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C(C)(C)C)nn3C)CC2)cc1 919498495 NVIJKBLNHHWPHF-UHFFFAOYSA-N 414.506 2.232 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])cn3)cc2F)C[C@@H](C)O1 919850554 YTLGRDHCAIMQQA-ZIAGYGMSSA-N 405.430 2.251 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)c1 1319625967 QRROVPGRWBICNG-UHFFFAOYSA-N 417.531 2.346 10 20 HECD CN(C)C(=O)OCCOC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1321042139 BDADGNICCXVFJB-UHFFFAOYSA-N 414.461 2.110 10 20 HECD O=C(CCC1CCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334198 IEXXBPDFTGCLTC-QDMKHBRRSA-N 409.577 2.065 10 20 HECD CC(C)(C)c1ncccc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843150090 QRGDOKJZCHVXTC-UHFFFAOYSA-N 410.474 2.316 10 20 HECD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NCc1ccc(N(C)C)cc1 8171395 KHHYNNNVJCIHOW-LJQANCHMSA-N 421.588 2.469 10 20 HECD COc1ccc(N2CCC(NC(=O)c3ccc(N4NC(=O)CCC4=O)cc3)CC2)cc1 110354047 GKXLAYQJBMPNLU-UHFFFAOYSA-N 422.485 2.252 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)Nc3nc(CC)c(C)s3)nnc2n1 117612283 CICAAPWCLYBQGY-UHFFFAOYSA-N 421.556 2.441 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](N4[C@H](C)CC[C@H]4C)C3)nc12 729265316 FWCRRKPXZQOFMQ-INMHGKMJSA-N 401.511 2.449 10 20 HECD COCCN1C(=O)/C(=C/N[C@@H](c2ccc(F)cc2)c2cccs2)C(=O)NC1=S 730971313 QERHGHODZDLBPU-UKYUDJEDSA-N 419.503 2.340 10 20 HECD CC(C)C[C@H]1COCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 733846898 AGFANPCOZHPKJY-ICSRJNTNSA-N 402.539 2.345 10 20 HECD O=C(CNS(=O)(=O)c1ccc(Cl)s1)NCCCSc1nccs1 733974824 MJXNHOKBDSSNIP-UHFFFAOYSA-N 411.983 2.435 10 20 HECD Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccc(N(C)C)cc3C)C2=O)cc1 734403159 XHEZPCHTDXZVCL-HSZRJFAPSA-N 408.502 2.453 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H](O)C3CCOCC3)cc2F)C[C@@H](C)O1 736653248 LUZZDAQKSJYWRS-SXGZJXTBSA-N 409.502 2.026 10 20 HECD C[C@H](NC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1ccc(N2CCOCC2)cc1 740037704 DZAQOZAKSXCAMV-ZDUSSCGKSA-N 424.427 2.420 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C1CCN(c2ccc3nncn3n2)CC1 743719231 VFOZRTNLGRTLHH-UHFFFAOYSA-N 406.490 2.242 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccccc3CS(C)(=O)=O)CC2)cc1 746690057 IUXPIGMAFOUVAT-UHFFFAOYSA-N 417.531 2.001 10 20 HECD CN(C)c1ccc(CNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1F 746864876 ZYHUWUNOHKBOBB-HKUYNNGSSA-N 419.497 2.490 10 20 HECD CO[C@]1(C)C[C@@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 752074223 DWBZHAGWVOGKKM-DENIHFKCSA-N 407.530 2.414 10 20 HECD COC[C@@H]1CCCN1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 752327535 VDYVZRNEEZFXAU-KRWDZBQOSA-N 405.520 2.035 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc4c(cnn4C)c3=O)c2C)cc1 753796259 ROLUAFUHVKMGPK-UHFFFAOYSA-N 406.446 2.214 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C(C)(C)CN(C)C)CC2)cc1 754357786 XMURBMCZGFGQQM-IBGZPJMESA-N 419.614 2.483 10 20 HECD C[C@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cc(F)ccc1O 756713009 UGHMZKYPEQQMPA-RDJZCZTQSA-N 401.486 2.478 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CCN(c2cccnn2)CC1 758366142 KHOREDUNRULKKC-UHFFFAOYSA-N 412.563 2.498 10 20 HECD COCC1(O)CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 759313266 HZHZSAKYCYJQAE-OAHLLOKOSA-N 422.481 2.262 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc(Cl)c(C)c3)CC2)cc1F 760119173 AOJANCWTPXCEJD-UHFFFAOYSA-N 406.845 2.478 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3cccc(N(C)C)n3)CC2)cc1 764728012 MQVRBEMGTJTHSQ-UHFFFAOYSA-N 412.538 2.490 10 20 HECD CNc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cccc1[N+](=O)[O-] 765386850 QFPFTXQDYLXMTH-HNNXBMFYSA-N 411.462 2.268 10 20 HECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCc1cccc(Br)c1O 765770256 NOQADTXXPXTRIJ-JTQLQIEISA-N 417.263 2.466 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3c3nncn3C)cc2F)CC1 768066938 AINUQRWAVSBODL-LJQANCHMSA-N 415.517 2.143 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)ccnc3OCC)nc12 769079320 ZNOXDSVGORNOHN-UHFFFAOYSA-N 400.391 2.071 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 769385723 SQOZVSQXAUZTLG-ROUUACIJSA-N 402.539 2.487 10 20 HECD COCCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(OC)c(OC)c1 769912974 LEMQOPJZILLMJV-UHFFFAOYSA-N 424.475 2.074 10 20 HECD CCSCc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)no1 771234249 LOMCTTDWDSQJIG-UHFFFAOYSA-N 409.533 2.093 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCn2ncnc2C1 771626219 HZXMXTPAECQAHM-LCYFTJDESA-N 419.557 2.363 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1S(C)(=O)=O 773856557 JBVNMKYEYYEJTR-CQSZACIVSA-N 403.504 2.280 10 20 HECD COCCNS(=O)(=O)c1cccc(CNCc2cc(Cl)cc(F)c2O)c1 776207582 LLAVLHCXKYQRBZ-UHFFFAOYSA-N 402.875 2.399 10 20 HECD O=C1CN(c2ccnc(C(=O)N(Cc3ccco3)Cc3ccccc3O)c2)CCN1 787119877 FFTPQTBOSKVSIH-UHFFFAOYSA-N 406.442 2.159 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 788893473 RGAQKRVDINUHNB-OAHLLOKOSA-N 406.527 2.303 10 20 HECD CC(C)CN(CC(C)C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793715802 AXJQTKWPHRNBSS-LJQANCHMSA-N 416.566 2.145 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC[C@@](C)(OC)CC3)CC2)cc1 794186280 ZBNBBDVQELZZEK-DJYGDJEFSA-N 415.534 2.318 10 20 HECD CNC(=O)[C@]1(C)CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 797525220 FTUATLPEALUJDA-LFPIHBKWSA-N 419.481 2.247 10 20 HECD COCCO[C@@H]1CCCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)C1 800849854 ITVASOALQOJCLT-OAQYLSRUSA-N 406.523 2.054 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccccn3)C2)cc1F 804851858 QUBXGKZAQFTIAU-KRWDZBQOSA-N 413.497 2.078 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@H](c2cccc(O)c2)C1 806276445 DIZYHSVOHHWJHX-OAHLLOKOSA-N 407.517 2.047 10 20 HECD C[C@H]1CSCCN1C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807768172 DNSITPLNXUFHHL-KBPBESRZSA-N 413.490 2.337 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)cc3)cc2)C1 813419943 GXXHFMRVHBYMII-VQIMIIECSA-N 401.894 2.392 10 20 HECD CCOC(=O)[C@H]1CCCN(S(=O)(=O)N(C)Cc2ccc(N(CC)CC)cc2)C1 914791059 GWQOYLFKOWKATA-SFHVURJKSA-N 411.568 2.485 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4CN(c5ccccc5)C[C@H]4C3)nc12 917189243 BJXGETPXIXDTLO-IYBDPMFKSA-N 407.474 2.180 10 20 HECD CNC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918204862 ADFCNWYQCSCQLO-UHFFFAOYSA-N 414.481 2.146 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCc3nnc4n3CCCC4)cc2F)C[C@H](C)O1 918216070 LRZOSJXZPHYZGD-GJZGRUSLSA-N 416.501 2.367 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(-c2nnco2)c1 918309924 GSYSVIALCKBYFL-UHFFFAOYSA-N 421.457 2.170 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)CC2)cc1 1319398416 DWDLVFKIHHUAFD-IBGZPJMESA-N 421.497 2.253 10 20 HECD Cc1cc[nH]c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005013 SRPIGUKEOIOHQL-FQEVSTJZSA-N 419.865 2.145 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3ccnnc3O)cc2)CCC1)c1cc(O)nc(O)c1 1789969507 KVNRIYQGCSOBEH-UHFFFAOYSA-N 421.413 2.050 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2occc12)c1cc(O)nc(O)c1 1796435638 RQIWPXWJEHJTJN-BTTYYORXSA-N 408.414 2.200 10 20 HECD CC(C)(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770769 FEXWAPCHLOYWPC-FVCICTRLSA-N 410.898 2.391 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1cc(O)nc(O)c1 1817844573 DYJAIRYGSXGDRE-INIZCTEOSA-N 422.445 2.160 10 20 HECD C[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821294898 VKZLNSKFPQNWJF-ZANVPECISA-N 408.842 2.161 10 20 HECD CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 108564361 HIOSTAPVMQPKPW-UHFFFAOYSA-N 403.504 2.382 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1 195565123 HGHBPUNGHLDDQV-UHFFFAOYSA-N 422.537 2.241 10 20 HECD O=S(=O)(NC[C@@H]1CCCO1)c1ccc(CNCc2ccc3c(c2)CCO3)cc1 238051747 UURQREGEZDMVSP-IBGZPJMESA-N 402.516 2.369 10 20 HECD CCN(Cc1ccccc1)c1ccc(CNCCS(=O)(=O)N2CCOCC2)cc1 729684086 JUUOTRQGKQIBKA-UHFFFAOYSA-N 417.575 2.465 10 20 HECD CNC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 732207007 KANKKKRSNAJIIF-CABCVRRESA-N 419.481 2.247 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 734017032 XWIBCJWEBGNRRK-FGTMMUONSA-N 400.475 2.383 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1n[nH]cc1Br 738478198 YUXONMUPVIATEN-UHFFFAOYSA-N 408.300 2.350 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1 745795323 FIUPZYLSTZBALH-LJQANCHMSA-N 417.598 2.237 10 20 HECD Cc1cc(N2CC[C@@H](NC(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)C2=O)n(C)n1 745906482 QHTRDZYFJRVYAM-LJQANCHMSA-N 410.522 2.274 10 20 HECD Cc1nnc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)n1C 746363284 QORXPCIUHVOLJS-UHFFFAOYSA-N 406.490 2.454 10 20 HECD Fc1cc(CNc2ncnc3c2cnn3-c2ncccn2)ccc1N1CCOCC1 752631317 GJMCBDJLQZFOHA-UHFFFAOYSA-N 406.425 2.193 10 20 HECD COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NCc1cccc(OC)c1O 753556065 CFCPEZQDANQRSM-UHFFFAOYSA-N 404.444 2.381 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3nnc(-c4ccc(C)cc4)n3)CC2)cc1F 753738754 UFGGNJIOJHRVJH-UHFFFAOYSA-N 410.453 2.145 10 20 HECD O=C(Nc1cnn(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 755191913 KXVNJMWJMOTESG-SFHVURJKSA-N 421.457 2.119 10 20 HECD COc1cc(N2CCN(C(=O)CN3CCCCCCC3=O)CC2)cc(OC)c1OC 759240884 CQLAGPAUJOHCGK-UHFFFAOYSA-N 419.522 2.154 10 20 HECD CCNS(=O)(=O)c1ccc(CC(=O)NCc2c(O)ccc3c2CCCC3)cc1 759962463 KELBRVQHJUCIAK-UHFFFAOYSA-N 402.516 2.428 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(-n4cnnc4)cc3)CC2)cc(OC)c1OC 760085372 QHIRZAKXBDOICC-UHFFFAOYSA-N 423.473 2.256 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(C)CCO[C@H]3C3CC3)CC2)cc1 767325768 YGSRGWYNIRVHFL-GMAHTHKFSA-N 416.566 2.322 10 20 HECD CC(C)c1ccnc(N2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)n1 767889151 DBTQVASHDHPSQI-UHFFFAOYSA-N 410.566 2.447 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1 767958295 NANJDJKOBWCTQU-INIZCTEOSA-N 412.490 2.102 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 775045048 RZIGIAOBFZUVIH-MRXNPFEDSA-N 404.561 2.132 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3([C@H](C)CCO)CCC3)CC2)cc1 775734651 VEWXGYZFXLADRD-LJQANCHMSA-N 418.582 2.305 10 20 HECD CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)/C=C/c1ccc(O)c(O)c1 779514834 NVPQGTCYCNBUIS-UXBLZVDNSA-N 405.476 2.066 10 20 HECD Cc1nn(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 779645979 RFWLPSXKVAFRSX-CHWSQXEVSA-N 405.430 2.169 10 20 HECD CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 781715143 DSHVRDNCKZQKPI-UHFFFAOYSA-N 409.483 2.059 10 20 HECD CO[C@H](C)CCC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 782437061 LAMOCJFWIMEWRZ-OAGGEKHMSA-N 410.486 2.414 10 20 HECD CC1CCN(CCCNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 785521158 TWVLXJBLXRUXKB-UHFFFAOYSA-N 400.567 2.482 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C 785601982 DJLDQCYYOAJYNT-FQEVSTJZSA-N 423.492 2.489 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C3CCN(C)CC3)C2)cc1 788955595 UFRYIHFNDJALTH-HXUWFJFHSA-N 400.567 2.339 10 20 HECD COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)c1cccc(O)c1O 790514602 XOLWMROXVQGQCO-HNNXBMFYSA-N 401.415 2.418 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc(Cl)c1F 792295412 ONEXUHVCBLFUGD-SECBINFHSA-N 424.812 2.363 10 20 HECD C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 793722517 UBQCLURHLFCMQX-IMFGXOCKSA-N 414.550 2.042 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@H](C(N)=O)O3)cc2Cl)C1 799949888 CAPXXMDUFPMSTL-QIIPPGSGSA-N 408.930 2.408 10 20 HECD C[C@@H](CCc1cccn1C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803303573 PTZSSPGLEYNARF-ZWKOTPCHSA-N 412.534 2.176 10 20 HECD COCCN(C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CC[C@H](C)C1 804316370 CKEKMINZKATASN-FXAWDEMLSA-N 417.550 2.444 10 20 HECD CC(C)n1ncc2c1C[C@H](NC(=O)C(=O)NCCCSc1nccs1)CC2 806278807 YEOYQJBRZCJRAR-CQSZACIVSA-N 407.565 2.193 10 20 HECD CC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 806841950 BRTYLZFSFSEVBO-UHFFFAOYSA-N 417.412 2.259 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)N1C[C@@H]2CCCC[C@H]2C1 808851303 BIIRBAUPDVBHKP-VXKWHMMOSA-N 424.589 2.483 10 20 HECD O=C(N[C@@H]1CCOC2(CCC2)C1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 809458812 XZDRLSMCTVEABH-MSOLQXFVSA-N 402.491 2.118 10 20 HECD Cc1onc(N)c1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 809821412 RYGOFPJNYYJILF-NSHDSACASA-N 402.423 2.114 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1c[nH]nc1C(F)(F)F 820781677 DZOVFUDCZMONRY-UHFFFAOYSA-N 404.414 2.086 10 20 HECD O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(N2CCSCC2)cc1 917383729 JZHIIHHHIJLHLB-OALUTQOASA-N 415.559 2.421 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)CN3CCCS3(=O)=O)c2C)c1 919359931 WBNKUCMVZKAWRA-UHFFFAOYSA-N 418.515 2.472 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1 1784947715 COYOXLFBRODOHH-QHCPKHFHSA-N 423.469 2.128 10 20 HECD CN(C)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1799625722 NFILGUIMTCRUIH-VBUUOAMHSA-N 410.474 2.124 10 20 HECD CNS(=O)(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)o1 109701185 HMWJLOOFAZQQFN-QGZVFWFLSA-N 421.519 2.075 10 20 HECD Cc1c(CNC(=O)C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)n(C)c2ccccc12 576732098 NAWALQGQDUBBNR-VBURHUQHSA-N 413.518 2.288 10 20 HECD CCN(CC)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 727057405 FOMDPUARZKXEFO-MHWRWJLKSA-N 421.544 2.075 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCc2nc3c(s2)CCCC3)c1 727176223 NOVSZMDIFGUUSK-UHFFFAOYSA-N 409.533 2.462 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1C(=O)O 728014514 BZOWQAOUWQTFTH-UHFFFAOYSA-N 410.882 2.272 10 20 HECD CCN1C(=O)C(=CNCc2cc(Cl)c3c(c2)OCCCO3)C(=O)N(CC)C1=S 730969993 BCQBRWUINHZZMR-UHFFFAOYSA-N 423.922 2.470 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC[C@H](N3CCCC3=O)C2)c1 732186095 JFJGULPRFLLNGM-NRFANRHFSA-N 415.534 2.014 10 20 HECD CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2CCCN(C(=O)c3cc(O)cs3)C2)CC1 732276189 WHTYYYPTDNFEQQ-AWEZNQCLSA-N 423.535 2.385 10 20 HECD COC(=O)CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 733613528 AKXLJFRFKHXYQM-CALCHBBNSA-N 423.529 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(-n4cccn4)c3)CC2)cc1 735154788 MQCLJRDOHCOUMC-UHFFFAOYSA-N 420.469 2.387 10 20 HECD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N(C)C)c(F)c2)cc1OC 740782493 DIEJUZXIVMXAOT-UHFFFAOYSA-N 424.494 2.389 10 20 HECD COC(=O)CCOc1ccc(S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 751318226 LPZAAEQTTHQTCI-ZDUSSCGKSA-N 409.460 2.382 10 20 HECD O=S(=O)(NCCNCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)s1 752104761 USDXQPPWHPSJJP-UHFFFAOYSA-N 415.968 2.306 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](C[C@H]4CCOC4)C3)CC2)cc1 754115257 SQIUUQQGFZISAU-XJUOHMSHSA-N 417.594 2.317 10 20 HECD C[C@@H](N[C@H]1CCN(CCN2CCOCC2)C1)c1cc(Br)cc(F)c1O 756583659 PUQQQPWJKFECSK-HIFRSBDPSA-N 416.335 2.351 10 20 HECD Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)[C@@H](C)NS(C)(=O)=O)c2C)c1 758487225 PUMOOVLAYJAKMY-OAHLLOKOSA-N 406.504 2.375 10 20 HECD O=C(COC(=O)[C@@H]1C[C@]12CCOC2)Nc1cccc2c1C(=O)c1ccccc1C2=O 764634612 GJXNFVKRCUCGQX-HJPURHCSSA-N 405.406 2.370 10 20 HECD COc1cc(Br)cc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 765867221 YUIBSBOMDKWQFU-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3c(F)cccc3[N+](=O)[O-])CC2)cc1 767366366 FEEXXJREVDJPSP-MRXNPFEDSA-N 405.426 2.304 10 20 HECD C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 768385947 WDFHWLWAGFBPCX-ZOBUZTSGSA-N 413.465 2.438 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 772775725 OCVFIHWMTGEJKX-OQFOIZHKSA-N 412.442 2.012 10 20 HECD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1 777961556 QWWOSDNIHNZRQI-UHFFFAOYSA-N 407.404 2.078 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4nsnc4c3)CC2)cc1 779125694 JSAFGYAUWHNAME-UHFFFAOYSA-N 412.471 2.206 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 779513255 GCGVIZRHJWGZDH-MNDMWVCDSA-N 420.462 2.220 10 20 HECD Cc1ccc(-n2nccc2NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)nn1 783315444 DWOFBHVJRFLIMK-UHFFFAOYSA-N 421.505 2.412 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1 784025098 XVGUTWQQLNWJOT-UHFFFAOYSA-N 412.490 2.270 10 20 HECD COCC[C@@]1(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCOC1 785405497 UNZKOFQEVRHYME-JOCHJYFZSA-N 424.409 2.296 10 20 HECD CC[C@@]1(C)CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 785861650 DZYMLUHFHQHEBL-QFIPXVFZSA-N 404.555 2.418 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1N1CCNC1=O 787558614 JYVIIEYYGOZDRH-HNNXBMFYSA-N 409.490 2.407 10 20 HECD COC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)s1 788066029 HBPBQWQLXFOHQN-UHFFFAOYSA-N 401.422 2.061 10 20 HECD CCCNc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788311463 VUDAMEJKFRQWPK-UHFFFAOYSA-N 410.518 2.278 10 20 HECD CCC(CC)[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 788318572 FDIDPLQSAHWIJB-PZJWPPBQSA-N 417.550 2.239 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(OC)cc1O)c1ccccc1OCC(=O)NC 792887954 TYNLJGRQGMLXHX-QGZVFWFLSA-N 401.463 2.476 10 20 HECD CCN(C)Cc1cccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 793871999 VZPKYUMRTNXDNI-UHFFFAOYSA-N 406.530 2.447 10 20 HECD CCN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)[C@@H](C)C1 796315473 MKDILVGSYQXZNZ-OKZBNKHCSA-N 406.546 2.082 10 20 HECD CC(C)COC(=O)N1CCC(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1 796758721 FUENWGMOSUXGST-UHFFFAOYSA-N 423.579 2.268 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@](C)(O)CCc3ccccc3)cc2)CC1 801220676 MDFMPGOOYWJGLP-XMMPIXPASA-N 409.530 2.355 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N2CCO[C@]3(CCOC3)C2)cc1)C1CCCCC1 803677761 SFAHXXKRQCEIQA-HSZRJFAPSA-N 415.534 2.090 10 20 HECD COc1ccc(CN2CC[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2=O)c(OC)c1 805442259 RVOIZISOHBUZBH-AUNFYEFLSA-N 412.442 2.046 10 20 HECD CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NCc2cccc(OC)c2O)s1 807565536 MYZAOUIJMMPZAD-WDEREUQCSA-N 407.496 2.277 10 20 HECD CCN1CCN(c2ccc(CNC(=O)Nc3cc(N(C)C)ncn3)cc2F)CC1 810219732 LVNMHHKFBRSZOG-UHFFFAOYSA-N 401.490 2.145 10 20 HECD CS(=O)(=O)C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 816891412 RTQQCKHHEZUBMN-SFHVURJKSA-N 420.506 2.107 10 20 HECD CC(C)NC(=O)CN(C)CC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 914533109 SOZLOIZVXNOEMZ-UHFFFAOYSA-N 400.523 2.331 10 20 HECD CC(C)C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 917355971 PPKUQKOMRAFJCK-BRWVUGGUSA-N 400.475 2.122 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1=NN(Cc2ccccc2)C(=O)CC1 917709458 XUEKAIIVUDFNFL-UHFFFAOYSA-N 424.476 2.457 10 20 HECD Cc1cc(C(=O)NC2CCN(Cc3ccc(N4CCN(C)CC4)c(F)c3)CC2)no1 1324732250 HEZPJUYEEQQDMM-UHFFFAOYSA-N 415.513 2.268 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3COc4ccc(F)cc4C3)cc2)CC1 1326849835 UQRUPIUBULAOGL-IBGZPJMESA-N 411.477 2.362 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)C3(F)CCC3)C2)C1 1784879088 VYMYQCXBFWYSCH-SFHVURJKSA-N 412.845 2.087 10 20 HECD CC(C)/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770062 DNNHTJSIRDVLNQ-HLUIXWDSSA-N 408.882 2.167 10 20 HECD CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1846005279 HPHIZUWPXPRKKR-GOSISDBHSA-N 422.529 2.436 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)cc1 18215299 OSJKVGOULYJSMB-UHFFFAOYSA-N 416.275 2.428 10 20 HECD CCc1nc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 63604691 FZPDVNDQNPZVDC-UHFFFAOYSA-N 406.527 2.429 10 20 HECD Cc1c(CNC(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)n(C)c2ccccc12 559902632 RBRUDYFORNQFHE-AWEZNQCLSA-N 410.440 2.103 10 20 HECD O=C(NCCN1C(=O)Cc2ccccc21)NCc1ccc(N2CCC(CO)CC2)cc1 725875832 WFXHBXBGBZBEOT-UHFFFAOYSA-N 422.529 2.284 10 20 HECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)cc1 731051851 SBRWOCLUHFNMAQ-UHFFFAOYSA-N 401.516 2.320 10 20 HECD COCCNS(=O)(=O)c1c[nH]c(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 742245889 TXGOXTNKNSACNN-UHFFFAOYSA-N 422.551 2.056 10 20 HECD CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 743649413 UKSPSHJZRHTGJT-NBYUQASBSA-N 414.550 2.391 10 20 HECD COc1cccc(CNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1O 745783432 RKFIVQUYRCUXIJ-GOSISDBHSA-N 403.454 2.413 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccnn1C1CCCC1 746784516 ZCJPNYKGBWTSLY-UHFFFAOYSA-N 411.506 2.432 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CC2(CS(C)(=O)=O)CC2)cc1 746840821 APWHFBVDVCQRDH-IBGZPJMESA-N 408.564 2.475 10 20 HECD COc1ccc(O)c(CNS(=O)(=O)c2ccc(I)cc2)c1 751414800 HCZPDYSOOFTZQP-UHFFFAOYSA-N 419.240 2.484 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)CO[C@H]3CCOC3)cc2F)C[C@@H](C)O1 753857632 NRAIJDCOPVTJMG-CBZIJGRNSA-N 409.502 2.433 10 20 HECD COCCCN1CCC(NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 753918251 ANVKRVCGRMZTBK-UHFFFAOYSA-N 408.518 2.167 10 20 HECD Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H](C)NS(C)(=O)=O)c2C)cc1F 758470295 DZTYFZNYBPHMBY-ZDUSSCGKSA-N 410.467 2.205 10 20 HECD COc1cc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)cc(OC)c1OC 758965036 QLOYQOFRLLEOKY-UHFFFAOYSA-N 402.447 2.469 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(Cc4ccc(O)cc4)n3)CC2)cc1 771083291 RIAZRJNMLIAODO-UHFFFAOYSA-N 408.458 2.266 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCc3ccc(O)cc3)CC2)cc1 778286175 VWHSAMNAJHNOMG-SEYXRHQNSA-N 423.513 2.355 10 20 HECD Cc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 783186350 TYGRRFRRKNQEBA-OAQYLSRUSA-N 424.545 2.401 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 783328192 SCKYNSQPZAZXKG-UHFFFAOYSA-N 424.501 2.484 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CSC[C@H]3CCCCO3)cc2)CC1 786261396 DMARWKKERVGSAT-HXUWFJFHSA-N 405.564 2.274 10 20 HECD O=C(NCCSC(F)(F)F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788527830 LJRPASKXHZJETP-CYBMUJFWSA-N 406.426 2.269 10 20 HECD CN1CCCC(C)(C)[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789859707 FHOYFXZIZVQWOA-LJQANCHMSA-N 418.607 2.093 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCCCC1 793717326 FRLWMJYPQQGSMH-GOSISDBHSA-N 414.550 2.186 10 20 HECD COC(=O)c1cc(F)cc(NC(=O)C(=O)NCCCSc2nccs2)c1F 796910343 MMFDEXONMJYIMS-UHFFFAOYSA-N 415.443 2.445 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)ccc3-n3cnnc3)cc2)CC1 797998805 KBLOGXDIBYKOBL-UHFFFAOYSA-N 418.501 2.174 10 20 HECD CCn1ncc2cc(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)c(C)nc21 799413047 KKIYPIQLVWYTPM-UHFFFAOYSA-N 422.533 2.320 10 20 HECD CCn1c([C@H](C)OCCOC)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801830186 PWKGPGLDQABZLX-KRWDZBQOSA-N 403.527 2.495 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1cc(Cl)cn1C)c1ccc(N2CCOCC2)cc1 803310530 LEGYTIHUFWKCNI-OAHLLOKOSA-N 418.925 2.351 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H](C)c3nccs3)CC2)cc1 804318523 MUHAKNBQJBCXCZ-AWEZNQCLSA-N 402.520 2.157 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cccc(-n3cncn3)c2)cc1F 804851593 IEOFMWGLMDAXCY-UHFFFAOYSA-N 424.480 2.185 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H]2C[C@]2(C)NC(=O)NC2=O)cc1 806464958 PBPLJLSONGTBJW-UWJYYQICSA-N 401.511 2.195 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc21 807387813 YLDOANDBNFJNFH-UHFFFAOYSA-N 404.264 2.402 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](N3CCCC3)[C@H]2C)c1 808193798 XNUDVRQTZSUOBT-VGSWGCGISA-N 401.551 2.486 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c1 815496497 KJERDHMILCGETK-DJJJIMSYSA-N 411.458 2.417 10 20 HECD CN(CCOc1ccccc1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917003701 HEMCTTCQXXXIAE-UHFFFAOYSA-N 401.482 2.289 10 20 HECD COc1ccc(OCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918336079 VABJOTGFKKUHTA-UHFFFAOYSA-N 418.515 2.015 10 20 HECD Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)no1 1786844506 OAPIRBVOZKQUDN-UHFFFAOYSA-N 423.429 2.175 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)ncn3)CCC2)cc1)c1cc(O)nc(O)c1 1788425483 UGFBSQPXUYVMBY-UHFFFAOYSA-N 421.413 2.050 10 20 HECD O=C(CCCc1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796603263 HIXWMCWWVOACOQ-BCDXTJNWSA-N 410.474 2.163 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)c1ccccn1 1804283566 DKHOHPVGXRVWCY-BEVBHUTCSA-N 409.442 2.164 10 20 HECD Cc1ncsc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039138 OYHJULQZJZIERQ-GQCTYLIASA-N 415.471 2.099 10 20 HECD Nc1cc(N)nc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 6757319 HUFZNQMCIPOLFG-UHFFFAOYSA-N 405.439 2.147 10 20 HECD COCCn1cnnc1SCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 25023850 XCDKLOXAFGKAAV-UHFFFAOYSA-N 422.466 2.431 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 140125538 BOONXOMUAOQSBP-OAHLLOKOSA-N 404.488 2.349 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4nc(N)ns4)CC3)ccc21 469357872 BKIXBUCXZGWVLF-UHFFFAOYSA-N 414.535 2.301 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)cn3)cc2)C1 727308940 WHPSQQYWIJIDDH-AWEZNQCLSA-N 417.307 2.476 10 20 HECD CN(CC(=O)NC(=O)NCc1cccs1)Cc1ccc(N2CCOCC2)cc1 741737364 YPPNAUGMTRNCOL-UHFFFAOYSA-N 402.520 2.043 10 20 HECD O=C1CC[C@]2(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)SCCN12 742800429 KAPJTYFSJNFJGW-BFUOFWGJSA-N 411.474 2.439 10 20 HECD O=C(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)NC1CCCC1 751059993 DJNXPRGZAOSKAL-UHFFFAOYSA-N 423.516 2.043 10 20 HECD COc1ccc(N2CCN(C(=O)CSCC(=O)Nc3cc(C)on3)CC2)cc1F 753738246 NKEXYGQUZGDKOG-UHFFFAOYSA-N 422.482 2.151 10 20 HECD COc1ccc(N2CCN(C(=O)NCc3n[nH]cc3Br)CC2)cc1F 753919242 KBYWYMLJVRIHGO-UHFFFAOYSA-N 412.263 2.352 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cn(-c2ccccc2)nn1 755217071 GFTLUNIPEZGNRA-UHFFFAOYSA-N 424.480 2.367 10 20 HECD C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NCCCSc1nccs1)C2=O 756991233 YZFNKSKSAWCFGL-CHWSQXEVSA-N 410.565 2.488 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(-n4cccn4)cc3)CC2)cc1 758228829 CLZSBMDTUQWSOO-OAQYLSRUSA-N 408.502 2.443 10 20 HECD COc1cc(N2CCN(Cc3nnnn3Cc3ccccc3)CC2)cc(OC)c1OC 759885804 HIHLEONLSOIEJB-UHFFFAOYSA-N 424.505 2.069 10 20 HECD CS(=O)(=O)N1CCC(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC1 765995637 WDJPYVGZWHZQQS-KRWDZBQOSA-N 401.960 2.024 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CS(=O)(=O)C(C)(C)C)cc2F)C[C@@H](C)O1 767302298 QTLLZMNYFORCJO-ZIAGYGMSSA-N 400.516 2.269 10 20 HECD COc1cccc(S(C)(=O)=O)c1NNC(=S)Nc1ccc2c(c1)OCCO2 767423310 HSXKJEAAXTYARG-UHFFFAOYSA-N 409.489 2.183 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)cnc3Cl)CC2)cc1 767743082 OEPSGIHOLVSQSH-UHFFFAOYSA-N 407.829 2.388 10 20 HECD COc1cccc(C[C@@H](C(=O)N[C@H](C)c2cc(OC)ccc2O)n2nnnc2C)c1 768912140 WDFJNPSBTQMVIG-YJYMSZOUSA-N 411.462 2.366 10 20 HECD CCOc1cccc(CNc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)c1O 770525323 UNCXNPHQDPHKMD-UHFFFAOYSA-N 412.446 2.283 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1[N+](=O)[O-] 771185630 MZZAUVPQEXMPMX-UHFFFAOYSA-N 418.475 2.460 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@]4(CCOC4)C3)cc2F)CC1 771435747 XYWWWMIUGOUWPA-AVRDEDQJSA-N 420.529 2.105 10 20 HECD CC(C)(C)n1nccc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772210047 AMGPVRIPFGLGQX-UHFFFAOYSA-N 413.522 2.102 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2cccc(Cl)c2)c1O 774984152 RUADTDMOQPRIGR-UHFFFAOYSA-N 415.855 2.031 10 20 HECD C[C@]1(CCCO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 776123826 NGFUHTOEMPXAKN-PGRDOPGGSA-N 402.539 2.225 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1 779510155 ISKVWFACFFRRRQ-ALCCZGGFSA-N 415.877 2.229 10 20 HECD CO[C@H](C)CCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 782248623 DHKOUMOZSPWPSJ-MRXNPFEDSA-N 401.486 2.374 10 20 HECD CCc1ncc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 784762091 CQNRSZKXBNEKKD-OAHLLOKOSA-N 417.897 2.117 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](CC3CCC3)NC(C)=O)CC2)cc(OC)c1OC 784799639 ZEGWHDWLWUDPRB-GOSISDBHSA-N 419.522 2.056 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2nnn(Cc3noc(C)n3)c2C)cc1F 785076450 BDEDPEMFOBBTHW-UHFFFAOYSA-N 401.446 2.242 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1ccc(F)c(F)c1 786683385 MCTIHEABQYUMPE-UHFFFAOYSA-N 405.470 2.451 10 20 HECD COC(=O)CN(CCN1CCOCC1)Cc1ccc(N(C)C)cc1C(F)(F)F 792821573 XTPOGUKZTGVOSB-UHFFFAOYSA-N 403.445 2.079 10 20 HECD COc1ccc(CNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c(O)c1 794380675 GRWXQYVPDZIKJE-ASSNKEHSSA-N 403.479 2.154 10 20 HECD COc1cc(Br)cc(CNC[C@H]2CCCC[C@H]2NS(C)(=O)=O)c1O 796480348 CZNZWAVINUWCNG-BXUZGUMPSA-N 421.357 2.361 10 20 HECD CN(C)c1nccc(CNC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 803676691 BRANJISXVWJRSP-UHFFFAOYSA-N 424.549 2.244 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NOC1CCCCC1 808851891 LCPQQSFGSDTKTE-UHFFFAOYSA-N 414.550 2.215 10 20 HECD NC(=O)C[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 809318231 NGPHGUYQKLTHHD-XTCQQWIJSA-N 423.585 2.453 10 20 HECD COCCN(Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 809762992 GSQPGGKEZQRFFY-KRWDZBQOSA-N 411.524 2.221 10 20 HECD O=C(Cn1ccc2ccc(F)cc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 810009431 YISAIERBYKDANH-UHFFFAOYSA-N 413.424 2.433 10 20 HECD CN(Cc1ccccc1O)c1nnc([C@@H]2CCS(=O)(=O)C2)n1C[C@@H]1CCCCO1 812439069 UHKZXUBKRUGLBB-SJORKVTESA-N 420.535 2.091 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1C 815062563 MLUXVTPCGXUAEO-OKILXGFUSA-N 403.454 2.494 10 20 HECD COC(=O)N1CCN(c2ccc(NCc3ccc(N4CCOCC4)cc3)cn2)CC1 815158872 VOUNSBMPTCTUSE-UHFFFAOYSA-N 411.506 2.419 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCCN(S(C)(=O)=O)CC3)c2C)cc1 914847286 DHUORWSUJNOBFT-UHFFFAOYSA-N 405.520 2.210 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(F)cc4nccnc34)CC2)cc1 917984393 JBXNWATYGVLAPS-UHFFFAOYSA-N 424.432 2.283 10 20 HECD CC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918442337 JWQSMBSBYBYQNJ-UHFFFAOYSA-N 409.486 2.353 10 20 HECD CS(=O)(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919968669 NMRXJXGCXNLOAZ-UHFFFAOYSA-N 417.531 2.197 10 20 HECD Cc1ccc2ncc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c(=O)n2c1 919969338 VVIWJIWKZGRSKR-UHFFFAOYSA-N 406.486 2.142 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1ccc(N2CCOCC2)cc1 920865864 POIDJABCFNBSMV-CQSZACIVSA-N 402.472 2.233 10 20 HECD CCOC(=O)c1ccn(-c2cccc(NS(=O)(=O)c3cccc4nonc34)c2)n1 1319750783 QNQOHLMILLOVTE-UHFFFAOYSA-N 413.415 2.386 10 20 HECD CC1(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)CCCCC1 1847055892 BBDUAPVYVSUXSJ-UHFFFAOYSA-N 409.577 2.021 10 20 HECD CCc1c(-c2ccncc2)n[nH]c1NC(=O)C1=S=C(C)C(CS(C)(=O)=O)=C1 471777371 AIMDGKMQBSNJTK-UHFFFAOYSA-N 404.517 2.055 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 727903007 CYGSGHRJUBFEEY-HLLBOEOZSA-N 408.470 2.025 10 20 HECD COC(=O)C1(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CCCCC1 732202205 IXTGHYMSLXFVNC-SFHVURJKSA-N 404.507 2.365 10 20 HECD O=C(CN1CCC[C@H](N2CCCC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 738336181 ZOGTYAHZSXZLKP-FQEVSTJZSA-N 418.557 2.229 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1 741092984 MDFWIWLDROHSSN-QFBILLFUSA-N 409.552 2.273 10 20 HECD CCC(=O)N[C@@H](C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742752992 IEYFPUBZBSTSCF-YOEHRIQHSA-N 406.527 2.349 10 20 HECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)cc1F 743599643 VUANXZPFEYPGKN-KRWDZBQOSA-N 416.501 2.319 10 20 HECD CC[C@H](NC(=O)NCc1cccc(OC)c1O)c1ccccc1OCC(=O)NC 745648908 IMRDGEHDLIVYMX-INIZCTEOSA-N 401.463 2.476 10 20 HECD Cn1c(CO)cnc1SCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 746140310 UTCDIVAIDFHPEB-UHFFFAOYSA-N 407.451 2.419 10 20 HECD O=C(CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCCCC1 746978767 LVQGJXYRIHGOMJ-UHFFFAOYSA-N 406.502 2.035 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](c1ccccc1)n1cccn1 748713462 YUNSBVLVRIWBIZ-NRFANRHFSA-N 424.526 2.024 10 20 HECD CC(=O)NCc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 751136625 JLAJAOTXSFLDJJ-INIZCTEOSA-N 424.544 2.460 10 20 HECD CN1CCc2cc(/C=C3/N=C(c4cccc(S(=O)(=O)N(C)C)c4)OC3=O)ccc21 751522713 IBUWHZMELWKKBS-LDADJPATSA-N 411.483 2.274 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)c(C)cc2F)cc1 753776094 QQEGOWGFQCRVAM-UHFFFAOYSA-N 416.452 2.395 10 20 HECD COC(=O)c1ccc(CS(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 754039709 DHGPGEPXSBVNQM-UHFFFAOYSA-N 422.478 2.273 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 754450166 IGQSTZVMQYCSMA-OAHLLOKOSA-N 401.467 2.470 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(c2ncccc2F)C1 755128274 UZLTVHUYABPLLV-MRXNPFEDSA-N 417.460 2.275 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)CC2)cc1 756811577 FGPGHKTUFLVWNJ-XMMPIXPASA-N 423.513 2.141 10 20 HECD COC(=O)c1cc(F)ccc1S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 758284359 NBZRJGWESMIVQC-UHFFFAOYSA-N 408.451 2.132 10 20 HECD CCCN(CC)CCNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759294853 YXFWJMGVXYHKKE-UHFFFAOYSA-N 408.543 2.276 10 20 HECD C[C@@H](NC(=O)NCCNS(=O)(=O)Cc1ccccc1)c1ccc(N(C)C)cc1 773612368 MGURVLREWLXDIL-MRXNPFEDSA-N 404.536 2.232 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 774871379 QGGQLUQFPVBSIJ-FQEVSTJZSA-N 410.518 2.449 10 20 HECD COc1c([N+](=O)[O-])ccc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1O 775089190 KSQNONSQCZPIAD-NRFANRHFSA-N 401.463 2.378 10 20 HECD CS[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H]1N(C)C 776002085 RTQMVIRVSYDRSV-UXHICEINSA-N 423.538 2.378 10 20 HECD Cc1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc1-n1cnnn1 783326850 ITJHBUZLOQFOGZ-UHFFFAOYSA-N 421.505 2.412 10 20 HECD Cn1cc(C(=O)COC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 785407007 BAHMKWIXHNTWRK-UHFFFAOYSA-N 421.456 2.028 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCC3(CC2)OCCO3)cc1F 787399134 IVAMWEXYXBPOSB-UHFFFAOYSA-N 407.486 2.090 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CCC1 789950375 PNHLQHSXKUAMEI-CYBMUJFWSA-N 413.440 2.463 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3C[C@@H](C)O)CC2)cc1 791166643 ZVYMWTPBYXCXRY-FKDVYQRFSA-N 415.534 2.052 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@]2(CCCOC2)O1 796523533 FAVQJPRHCMXAKP-IERDGZPVSA-N 407.486 2.142 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CC(C)(C)OC1(C)C)c1ccc(N2CCOCC2)cc1 803307895 PATHHGIYPZFVIT-CRAIPNDOSA-N 403.523 2.163 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCc4c(O)cccc43)CC2)cc1 804316659 HLSKBJUUTZYICZ-FQEVSTJZSA-N 409.486 2.290 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCOC[C@@H]3C)CC2)cc(OC)c1OC 805820908 AGNLRZHOCGHGLB-HOTGVXAUSA-N 407.511 2.217 10 20 HECD COCCC1(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCCC1 807910665 UZMGCANMLHBJDB-UHFFFAOYSA-N 417.550 2.447 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NOC/C=C/Cl 811866148 JWFJIZFXIGZOSN-ORCRQEGFSA-N 420.876 2.426 10 20 HECD CC(C)N1CCN(c2cccc(NC(=O)c3ccc4c(c3)NC(=O)CNC4=O)c2)CC1 815902272 WUEGEDFEYAMEJW-UHFFFAOYSA-N 421.501 2.151 10 20 HECD COC(=O)[C@H](CC(C)C)NC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 914907217 SSKPYZXTQWVUPH-KRWDZBQOSA-N 401.463 2.350 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)cc2)C1 917833968 FDRRUHYRBVJUCY-KXBFYZLASA-N 424.476 2.270 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1cn2ccsc2n1 918198719 YYMLPXLHPLEBRP-UHFFFAOYSA-N 403.483 2.495 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3)cc2F)C[C@H](C)O1 918853037 UGSAQLSJUXQTNH-GJZGRUSLSA-N 401.438 2.308 10 20 HECD CCOc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)cc1 1324626711 GEQTUFSLDBVULP-PWIZWCRZSA-N 413.518 2.298 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1F)c1cc(O)nc(O)c1 1799735073 BIOZXKAWTZQNBR-BTTYYORXSA-N 417.412 2.266 10 20 HECD O=C(c1cnoc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428050 YKMNVBSNOPVUIN-MRXNPFEDSA-N 400.435 2.028 10 20 HECD OC[C@H]1CCCCN1c1cc(NCc2ccc(N3CCOCC3)c(F)c2)ncn1 302106091 NQOFNGVAEMHQRR-QGZVFWFLSA-N 401.486 2.416 10 20 HECD O=C(CCn1c(=O)nc(O)c2ccccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 731858718 MMEQEFWHDNMJFL-QGZVFWFLSA-N 423.469 2.406 10 20 HECD O=C1CCCN1C[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 732452640 HSNBTLZQZCFNAR-HXUWFJFHSA-N 400.523 2.210 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1 734704029 WYOKMLRPVGTRFI-UHFFFAOYSA-N 414.481 2.292 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C(C)C)N3CCCCC3)CC2)cc1 741013053 XVVRKSMWHSKTEB-JOCHJYFZSA-N 417.550 2.398 10 20 HECD Cc1cc(C(=O)N(CCN(C)C)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(F)cc1 750188539 YVZSWUSLYHQKHR-LJQANCHMSA-N 421.538 2.424 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 753640276 NEXUSQWJFBASNJ-SMNXXWJPSA-N 418.490 2.127 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 753640944 VDYIWNNKUHUACL-RYUDHWBXSA-N 412.895 2.165 10 20 HECD CCCO[C@H]1CCCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 754028696 BQPGYVWBCOTVLC-GGAORHGYSA-N 405.583 2.459 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)Cn3nc(C)c(Br)c3C)CC2)cc1 758222813 KNLFZGWDKCKAMR-QGZVFWFLSA-N 423.355 2.454 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3cc([N+](=O)[O-])ccc3C)CC2)cc1 758222936 JCAJGCLBGRHQFB-LJQANCHMSA-N 401.463 2.474 10 20 HECD COc1cc(N2CCN(C(=O)Cc3c[nH]c4ncccc34)CC2)cc(OC)c1OC 759222133 GWYSZJGGXSIUST-UHFFFAOYSA-N 410.474 2.480 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)N1CCN(c2ccccn2)CC1 764631229 XNZUINCQLYLWLI-UHFFFAOYSA-N 409.534 2.235 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1c1cccc(Br)c1 768466261 XBKOEIBVNXWUJJ-SJLPKXTDSA-N 419.275 2.254 10 20 HECD COC(=O)c1c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)sc2c1CCCC2 774362095 KPPVLTODNSUDKO-UHFFFAOYSA-N 418.471 2.122 10 20 HECD COc1c([N+](=O)[O-])ccc(CN(C)CCN2CCN(C(=O)OC(C)(C)C)CC2)c1O 774878549 SVQPUZJUTMFWKU-UHFFFAOYSA-N 424.498 2.294 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)cc1 778307293 PUEXTIHBSJUUJR-YUIUBULTSA-N 423.513 2.270 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3CN3CCCCC3)CC2)cc1 779223686 POBMTDPJMICXMF-XZOQPEGZSA-N 416.610 2.128 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](OCCO)C3)cc2F)C[C@@H](C)O1 780311109 FCWAWCAHLCAQBX-JFIYKMOQSA-N 409.502 2.122 10 20 HECD Cc1cc(C(=O)CN(C[C@@H](C)O)[C@@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 785533777 DVADZXRFHXENTM-JKSUJKDBSA-N 402.491 2.112 10 20 HECD COc1ccc2c(c1)C=C(C(=O)NCc1ccc(N3CCN(C(C)=O)CC3)cc1)CO2 786262746 PJZXFESKYMDCJQ-UHFFFAOYSA-N 421.497 2.456 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3Oc4ccccc4O[C@H]3C)cc2)CC1 786660521 ZDXPHVHEVMUVQK-AOMKIAJQSA-N 409.486 2.200 10 20 HECD O=C(NCc1ccc(F)c(F)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 786683842 NTEOORGZEYPKRL-INIZCTEOSA-N 404.413 2.494 10 20 HECD CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788321076 SJTRTDMFBCWBIN-RTBURBONSA-N 405.564 2.272 10 20 HECD COC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H]1CCCO1 788882360 CDNJLIHMZYLBDV-OFVDUGFESA-N 409.502 2.433 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)/C=C/c2ccccc2Cl)ccc1O 790405511 KSNNJVBTTWKYTK-CMDGGOBGSA-N 402.881 2.366 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccc(Cn2cccn2)c1 793814471 SNTLHQGRIYALKQ-UHFFFAOYSA-N 405.502 2.238 10 20 HECD Cc1ccc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)N(C)C 797607139 DLZKLFOBHOEJDV-CYBMUJFWSA-N 407.492 2.409 10 20 HECD COC(=O)c1ccc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1 799231414 LIDAOENVKHSJPR-CHWSQXEVSA-N 417.441 2.338 10 20 HECD CNC(=O)C1CCC(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 803147208 JRQSKGPUJLJGPO-UHFFFAOYSA-N 415.534 2.475 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](Oc3cccc(F)c3)C2)cc1F 803663422 OVQWEWIHHLYXRR-QGZVFWFLSA-N 403.429 2.327 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 804269034 SVGKDQPGMBDUAY-CRAIPNDOSA-N 418.538 2.446 10 20 HECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806385563 ADWAMDKFBPQSEF-CXAGYDPISA-N 401.463 2.382 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C 807514054 ICFIISQRFZWESB-VCSGRIEYSA-N 415.582 2.368 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)Cc3ccccc3N(C)C)CC2)cc1 808785846 XCRAXZWYNLCFQA-JOCHJYFZSA-N 412.578 2.376 10 20 HECD Cc1occc1CN(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851979 NDOJUYPOXJVMQA-UHFFFAOYSA-N 424.545 2.395 10 20 HECD CN1C(=O)NC2(CCN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)CC2)C1=O 809749075 BCWBLEPXTZAQPM-UHFFFAOYSA-N 401.467 2.101 10 20 HECD CC(C)(C)n1ncnc1CNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 809928800 QTRXSFUXCKONSF-UHFFFAOYSA-N 411.462 2.177 10 20 HECD CCOC(=O)N1CCC(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 919970207 UANZCAFHCYYKCN-UHFFFAOYSA-N 403.523 2.380 10 20 HECD C[C@H](OC(=O)c1cnccn1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 5469821 PHDBMYMRDCCCRE-LBPRGKRZSA-N 401.378 2.436 10 20 HECD C[C@H]1CN(c2ccc(CNc3ncc(S(N)(=O)=O)s3)cc2F)C[C@H](C)O1 725787313 DZXVLJNACOLAFQ-QWRGUYRKSA-N 400.501 2.155 10 20 HECD O=S(=O)(C[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 725823800 FRRKTKYEGAUWRZ-HNNXBMFYSA-N 408.442 2.140 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCCC4)nc3)cc2)C1 727103391 CZIMZILVSBTUCV-LJQANCHMSA-N 407.518 2.314 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc(C(N)=O)c(F)c3)cc2)CC1 731131815 NEJUVOPVIUJBFF-UHFFFAOYSA-N 412.465 2.416 10 20 HECD O=C1c2ccccc2C(=O)N1C[C@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 732203394 RYOKBLPDELUVTM-QZTJIDSGSA-N 410.470 2.030 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCN(c2ccccc2F)C1=O 732824159 HDCKODJCUNUIFC-LJQANCHMSA-N 412.465 2.267 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCOc3cccnc3)cc2F)CC1 734014004 PKGPSGAIRSKJSP-UHFFFAOYSA-N 401.486 2.241 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCCOC[C@@H]3CCCO3)cc2F)C[C@@H](C)O1 734525447 HMDPNEMSRLJWGU-NUJGCVRESA-N 409.502 2.434 10 20 HECD C[C@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1C(=O)NC2(CCCC2)C1=O 735517071 HCPRARXNCIZKPX-NVXWUHKLSA-N 415.490 2.153 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CCO1 736720281 ADMPIVOKEGHURF-CYBMUJFWSA-N 405.476 2.241 10 20 HECD Cc1ncc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 737174796 SWSMVEVTGCSQGQ-UHFFFAOYSA-N 405.405 2.110 10 20 HECD O=C(NCc1ccccc1O)C(F)(F)C(F)(F)C(=O)NCc1ccccc1O 743328402 UAHKWOOZPTXQTB-UHFFFAOYSA-N 400.328 2.301 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc(CN2CCCC2=O)o1 749549540 LYNKPFOHXKSEBA-UHFFFAOYSA-N 403.508 2.009 10 20 HECD CCNC(=O)C1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCC1 753295464 JFPZCEBHKIEBLK-UHFFFAOYSA-N 402.539 2.001 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2F)cc1 758169696 YCXKCNMWUMLOPI-UHFFFAOYSA-N 402.469 2.363 10 20 HECD C[C@]1(c2ccc(CNC(=O)NCCCSc3nccs3)cc2)NC(=O)NC1=O 759571869 ASYJPKPGZUDVAM-GOSISDBHSA-N 419.532 2.179 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc4c(c3)C(=O)N(C)CC4)CC2)cc1 760461801 XGTXFHYWGKVYKS-UHFFFAOYSA-N 408.502 2.084 10 20 HECD CCS(=O)(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c1 760559590 HHYCAHLFSKTNNW-UHFFFAOYSA-N 408.545 2.341 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 761973976 SAUOPAQVQKFOSZ-AWEZNQCLSA-N 414.458 2.366 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1 765823019 QYOBFQHQVMYIGU-OXQOHEQNSA-N 412.486 2.300 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCCC34CCN(C)CC4)CC2)cc1 768937574 URMUBURPOYPSMO-UHFFFAOYSA-N 415.582 2.087 10 20 HECD Cc1cc(C(=O)NCC2(O)CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 773308385 YRLSARGRZWUTTG-UHFFFAOYSA-N 400.479 2.201 10 20 HECD COCCO[C@H]1C[C@@H](CO)CN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 775205279 RTIPZMACBMITLH-MOPGFXCFSA-N 407.511 2.431 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(CO)ccc3C)CC2)cc1 778389766 PCNUAEURKHNVSO-MDZDMXLPSA-N 409.486 2.339 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2ccc(-n3cncn3)nc2)cc1 784113975 VADFKZXMTLHKSM-UHFFFAOYSA-N 405.462 2.406 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)n1 784765260 OJOVULMCJGURAT-OAHLLOKOSA-N 418.881 2.174 10 20 HECD CC1CCN(CCCNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 785519825 IGJLCFJGRCWKKZ-HXUWFJFHSA-N 417.550 2.138 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(N(C)C)cc1 785572739 AAXVXSWHSHASJG-AVRDEDQJSA-N 424.545 2.120 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCc1cc(F)ccc1F 787040511 PBASZCOCUFMECW-UHFFFAOYSA-N 405.470 2.451 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C2CCC(NC(C)=O)CC2)cc1 788939123 IXLKATIPIYIPIC-UHFFFAOYSA-N 402.539 2.055 10 20 HECD C[C@H](Cc1ccsc1)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789844341 RCODRCCUQWPSDY-CQSZACIVSA-N 419.522 2.212 10 20 HECD NS(=O)(=O)c1ccc(F)c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 798334995 AOIIGYOGXCIXFM-CQSZACIVSA-N 408.451 2.000 10 20 HECD C[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(C(N)=O)n(C)c3)cc2Cl)C1 800149330 YPESGXFUFIGHMI-CYBMUJFWSA-N 424.954 2.492 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@@H]2CCS(=O)(=O)C2)n1C 800767369 YPTAZQXQXMXYMV-QGZVFWFLSA-N 403.552 2.344 10 20 HECD COc1cc(C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803301024 XIYFVSZEPIZNMY-QGZVFWFLSA-N 411.502 2.334 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1F 804852232 CYYMKGVHVDMFPR-ATZDWAIDSA-N 403.498 2.362 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3cccc(N(C)C)n3)cc2)CC1 805024203 GESQMNKCRSAPLV-UHFFFAOYSA-N 409.534 2.317 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290000 AWDDQRWWXPDCRE-CVDCTZTESA-N 418.541 2.316 10 20 HECD COC(=O)c1ccsc1NC(=O)C(=O)NCc1cc(Br)ccc1O 807385989 ZFKANTUNLKJICP-UHFFFAOYSA-N 413.249 2.258 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2cc(Cl)cc(Cl)c2O)ccc1-n1cnnn1 807512628 ASUIBZRNRCAVKG-UHFFFAOYSA-N 421.244 2.238 10 20 HECD CC(=O)N1C[C@H]2[C@@H](NC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)CCC[C@H]2C1 808353889 BBHZOZFOVVNAND-NNWRFLSQSA-N 414.550 2.312 10 20 HECD O=C(CNS(=O)(=O)c1ccccc1F)NCc1ccc(N2CCCCC2)cc1 810245760 GWNRFMJZUFJSBT-UHFFFAOYSA-N 405.495 2.411 10 20 HECD COC(=O)C1(CS(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)CCCC1 811678314 CJUPIBJEXCILGG-UHFFFAOYSA-N 424.928 2.187 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC(CC(N)=O)CC3)cc2F)C[C@@H](C)O1 918210928 ZGKMZDQFZCRECI-HUUCEWRRSA-N 406.502 2.236 10 20 HECD CS(=O)(=O)Cc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919968329 DGIJFLKGHFERFQ-UHFFFAOYSA-N 416.543 2.370 10 20 HECD CC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1 920258262 KSQODUHTOUEWST-UHFFFAOYSA-N 401.532 2.462 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920925033 GVWSCZBTSVNURX-INIZCTEOSA-N 424.501 2.007 10 20 HECD CC(C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283539 BBYJGGCYOFPWRV-BEVBHUTCSA-N 418.490 2.270 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1ccnc1 1845500448 CSWBQLSYTOWLDE-GFCCVEGCSA-N 404.854 2.026 10 20 HECD Cc1cc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cnc1C 1847033721 ALAOGXINFOLCGC-FNORWQNLSA-N 423.469 2.346 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCN(c4cccc(C)c4)CC3)CC2)cc1 105326865 SIILWSSRDMFVES-UHFFFAOYSA-N 408.546 2.474 10 20 HECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1cccc2c1OCCO2 725824115 MDTJGQWOOYDNEQ-UHFFFAOYSA-N 406.529 2.490 10 20 HECD C[C@H](OC(=O)Cc1cnn(C)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 726000337 GXSXGLNNORHGEO-ZDUSSCGKSA-N 417.421 2.308 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1O 727761210 NVSTUFYHDCWJCP-OAHLLOKOSA-N 422.478 2.257 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)N3CCC[C@H](CNS(N)(=O)=O)C3)c2C)c1 739696672 NSYOSPVLIRTXBL-QGZVFWFLSA-N 404.536 2.048 10 20 HECD O=C(NCCCOCC1CCOCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 740918627 KQNGLILIEKEAIW-UHFFFAOYSA-N 423.529 2.419 10 20 HECD CC(=O)N(C)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 742271421 LMIKKDWULBTLJY-UHFFFAOYSA-N 417.531 2.327 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)c1nc2ncc(Br)cn2n1 743717312 LUXDQXMOMAPWNY-UHFFFAOYSA-N 402.252 2.401 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CC[C@H](CN4CCCCC4)C3)CC2)cc1 743851221 AMDRCCSBEQKFDN-HXUWFJFHSA-N 400.567 2.152 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3c(C(F)(F)F)csc3=O)CC2)cc1 746155664 XMDWEDOETKMYEO-UHFFFAOYSA-N 401.410 2.286 10 20 HECD CN1CCCc2cc(CNC(=O)c3ccc(CCNS(C)(=O)=O)s3)ccc21 746812151 YNNBSNFHXHWPAA-UHFFFAOYSA-N 407.561 2.152 10 20 HECD COC(=O)[C@H](O)C1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 747402270 IIMONROEOBGTKY-HXUWFJFHSA-N 403.523 2.378 10 20 HECD COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)oc1C 751137679 UHUHFHAAAQVREP-HNNXBMFYSA-N 409.460 2.450 10 20 HECD C[S@](=O)Cc1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 762533954 MQDYEIVAGNTSCI-LJAQVGFWSA-N 419.522 2.269 10 20 HECD COc1ccc(N2CCC(NC(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)CC2)cc1 769153501 HWBNZYYHFRPYAC-FGZHOGPDSA-N 416.566 2.341 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)c2)CC1 770287214 WEEOUNXJMSQQQY-UHFFFAOYSA-N 421.501 2.133 10 20 HECD CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NCCc2ccc(O)c(O)c2)c1 770631090 QIDYKWLDOSCWFU-UHFFFAOYSA-N 406.504 2.409 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 771404365 AAEMJGHAIROJAQ-UHFFFAOYSA-N 415.471 2.473 10 20 HECD CNS(=O)(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 773494984 DIQSRXTVJNFEDO-UHFFFAOYSA-N 418.563 2.440 10 20 HECD Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773740608 RPTWJJAPVMZKDW-CQSZACIVSA-N 404.488 2.307 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC3([C@@H](O)C(C)C)CC3)CC2)cc1 776038776 JLTQTRPOEWAVIB-NRFANRHFSA-N 418.582 2.304 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](C)S[C@H](C)C3)CC2)cc1 778287698 CRUZFUWHOUTNDC-CWNHSUMWSA-N 403.548 2.252 10 20 HECD COc1cccc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 786768522 KTPJSNVDHLJJDE-QGZVFWFLSA-N 411.502 2.368 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3cccnc3)cc2F)C[C@@H](C)O1 789828633 XSFWBMPURUGOKB-IYBDPMFKSA-N 414.481 2.109 10 20 HECD CN1Cc2ccccc2[C@H](NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789864581 QJMCEJRYXZJDQZ-OAQYLSRUSA-N 424.570 2.159 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H]3N(C)CCCC3(C)C)CC2)cc1 790505747 XJPZKBUPUAWWGJ-OAQYLSRUSA-N 417.598 2.237 10 20 HECD C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 793647263 USLJIWRSFRCNPR-SJORKVTESA-N 411.502 2.070 10 20 HECD C[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3cc(C(N)=O)n(C)c3)cc2Cl)C1 800149331 YPESGXFUFIGHMI-ZDUSSCGKSA-N 424.954 2.492 10 20 HECD COC(=O)c1cnc(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nc1 804373666 XHUNGUQCBPKMCX-UHFFFAOYSA-N 423.452 2.131 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOC3(CCOCC3)CC2)cc1F 804853174 MJOXURWDXUQCDW-UHFFFAOYSA-N 421.513 2.086 10 20 HECD CCCN1CCC[C@H]1CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 806333410 JAEVRLLWQCDRSI-NRFANRHFSA-N 417.598 2.381 10 20 HECD COc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1 807287559 KKJZUHDVOWDUEK-UHFFFAOYSA-N 409.486 2.355 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1 807690819 FRGSRQZASKPTLB-LJQANCHMSA-N 409.534 2.280 10 20 HECD CSc1nnc(CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)s1 809606790 DRIHUAMVPNHSBK-UHFFFAOYSA-N 407.565 2.379 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnn(C)c3C)ccc21 813954647 JJMQTFCTWYROKG-UHFFFAOYSA-N 404.492 2.065 10 20 HECD COC(=O)Cc1csc(NC(=O)CN2CCCN(c3ccc(OC)cc3)CC2)n1 917211028 IUBUEQFGGYDPGU-UHFFFAOYSA-N 418.519 2.018 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1ccc2cc(OC)ccc21 1325763653 NXKFOODHJURYFI-KRWDZBQOSA-N 412.442 2.352 10 20 HECD CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NCc2ccc(N3CCCC3)cc2)C1=O 1342420567 MNIHAJFTNDCHTE-UHFFFAOYSA-N 421.501 2.392 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccn1)c1cc(O)c(O)c(Cl)c1 1794993607 SGMNBHFVEOEMTE-CLLJXQQHSA-N 402.838 2.107 10 20 HECD Cc1nc2ccccn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601306 RWRYZYCBSKCUSL-MUJYYYPQSA-N 421.457 2.015 10 20 HECD CC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c1 1803726055 JZBSJRWLYXBYGQ-BCDXTJNWSA-N 424.457 2.017 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccccn2)CC1 1825809447 ZSLUFVJNEKRZDJ-GOSISDBHSA-N 410.474 2.435 10 20 HECD Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)on1 17992890 LNCPRESDQMRGEP-UHFFFAOYSA-N 417.443 2.078 10 20 HECD CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1 147122015 FQXNKIRARHLXAD-UHFFFAOYSA-N 410.474 2.045 10 20 HECD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N(Cc1cccnc1)c1ccc(F)cc1 195701977 IQLQTTNMVFBBGC-UHFFFAOYSA-N 412.446 2.252 10 20 HECD CNS(=O)(=O)c1ccc(CCC(=O)N2CCOc3cc(N(C)C)ccc32)cc1 437007778 LDVMVYUBLKZNGX-UHFFFAOYSA-N 403.504 2.019 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)n(C)c2ccccc12 673314452 QLSXMRGAVWJNAI-HXUWFJFHSA-N 418.497 2.367 10 20 HECD COCC[C@@H](C)NC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237193 PCUGEZHOQSFNDF-MRXNPFEDSA-N 416.501 2.167 10 20 HECD Cc1ccc(-c2nnn(CC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)n2)cc1 728301508 CXXWTFSVYWYTMJ-UHFFFAOYSA-N 406.490 2.144 10 20 HECD CC[C@H](C)NC(=O)CCNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730118731 BVCTWQSGPIKUHT-INIZCTEOSA-N 407.534 2.072 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1 734073020 ZWJBJTNLTUCLKQ-UHFFFAOYSA-N 405.838 2.011 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1OC 734513354 LEWJOAOBGIUXGQ-UHFFFAOYSA-N 409.464 2.232 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1C(=O)O 734743345 PDJHJCKGUVYUNI-UHFFFAOYSA-N 421.456 2.105 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3CCCCCC3)CC2)cc1 741028820 IZLACKLHMFLUNK-SFHVURJKSA-N 403.523 2.152 10 20 HECD CC(C)NC(=O)CNC(=S)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743015740 MZEVHBCVCCNBHL-ZDUSSCGKSA-N 400.495 2.246 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(CC(C)C)c3)CC2)cc1 743222624 XXHMJTOCQFUZME-UHFFFAOYSA-N 400.527 2.491 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cn1 747750074 GOEODIRNXHRCDH-UHFFFAOYSA-N 406.489 2.389 10 20 HECD CN1CCCc2cc(CNC(=O)NCC(=O)N3CCN(c4ccccc4)CC3)ccc21 750322504 GWBYXLHTJXGZFE-UHFFFAOYSA-N 421.545 2.217 10 20 HECD C[C@H](CC[S@](C)=O)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069281 HLALANIYAOTSEV-NDHGSNPTSA-N 416.546 2.141 10 20 HECD CSc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc1 752843047 SWRHSBSCFOXPBW-UHFFFAOYSA-N 406.533 2.360 10 20 HECD COC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754040002 IEJJECLCISTKKA-UHFFFAOYSA-N 408.451 2.132 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 754450154 IFDCYAIMWMGABG-CQSZACIVSA-N 400.483 2.271 10 20 HECD COCCCOc1cc(C)ccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 755859954 JPZAZGCEPLBTRD-UHFFFAOYSA-N 422.503 2.417 10 20 HECD Cn1cc(-n2cc(C(=O)NCc3ccc(N4CCSCC4)cc3)ccc2=O)cn1 760798710 HXIFMINROZLKCO-UHFFFAOYSA-N 409.515 2.054 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCN2C(=O)CC[C@H]2C1 766268649 FJVRDLNYMFRCRR-ZBFHGGJFSA-N 417.465 2.096 10 20 HECD CC(C)NC(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 767321103 NFSSKJIWPFZROL-UHFFFAOYSA-N 415.515 2.312 10 20 HECD COc1cc(O)c(CN2CCN(Cc3ccc4c(c3)OCCO4)CC2)cc1OC 768441429 HVQAQZZOHXFHPP-UHFFFAOYSA-N 400.475 2.498 10 20 HECD COc1cc(O)c(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1OC 768447621 AJCPQAZPBJXVAY-MRXNPFEDSA-N 424.494 2.491 10 20 HECD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NCc1ccccc1O 769365040 MRJKQTRVUHPONS-UHFFFAOYSA-N 403.504 2.441 10 20 HECD COC(=O)CC(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769908248 NCKQKQCFEHNEEU-UHFFFAOYSA-N 412.489 2.326 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772110850 HBUGRLQFKZMZLW-UHFFFAOYSA-N 415.538 2.199 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1)c1ccc(N(C)C)cc1 773847617 RGAVMJHIGMRCKF-GOSISDBHSA-N 424.545 2.443 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCc2ccccc2CN2CCOCC2)c1 775365550 WHIGXWQRJFMJEL-QGZVFWFLSA-N 413.518 2.200 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccc(C[C@@H]4NC(=O)NC4=O)cc3)ccc21 775708532 OXPLHLOHVWZXDB-SFHVURJKSA-N 407.474 2.141 10 20 HECD C[C@@H](CCO)C1(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC1 776041470 JIUMCWLJUHPUDT-HKUYNNGSSA-N 416.566 2.376 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](O)c3cccc(C)c3)CC2)cc1 778389603 MMZQIEBCDJPHDS-NELJVSICSA-N 423.513 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(OC)c3O)CC2)cc1 779061239 LEXHDLZSWSYHBC-ZHACJKMWSA-N 411.458 2.253 10 20 HECD Cc1cc(Br)cc(CN[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 779432530 UHUMEEDTXGPTAS-HOCLYGCPSA-N 404.326 2.289 10 20 HECD Cc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C2CC2)o1 789802407 XZUULZFAWHJKLP-UHFFFAOYSA-N 415.465 2.371 10 20 HECD C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793932014 QVFGTCROFDSBKF-VQIMIIECSA-N 412.509 2.460 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)[C@H]3OCCc4sccc43)nc12 795481870 RJXYUBMUSOWSLF-APPDUMDISA-N 402.476 2.465 10 20 HECD COCC[C@H](CO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 799086452 BFYPKMLMIBCBLT-HLVNSREUSA-N 414.574 2.243 10 20 HECD COCCOc1cccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 800871700 DRQZZDGGGWELTB-UHFFFAOYSA-N 418.465 2.383 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 802609459 AYSCOZNZLLKENP-UHFFFAOYSA-N 410.474 2.350 10 20 HECD CC[C@@H](C)Oc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ccn1 803661528 FLPXZWFLGSQCEG-CQSZACIVSA-N 402.470 2.397 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)cc1F 803662797 NESWJHRTFZOKNR-CQSZACIVSA-N 420.435 2.181 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCOC4(CCCC4)C3)CC2)cc1 804315891 UPIWMXOSOSPRKT-GOSISDBHSA-N 415.534 2.388 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)cc1F 804853419 XMZMYKDVGARDIB-KKSFZXQISA-N 423.554 2.459 10 20 HECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 806913475 XHNXWQNLGUYFKG-UHFFFAOYSA-N 406.486 2.410 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COCCN1CC(F)F 807107831 LZJYNBWWQPNDQR-JKSUJKDBSA-N 417.884 2.092 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12 807288494 VOLDXQHVUVCELY-DEOSSOPVSA-N 403.482 2.337 10 20 HECD CN(Cc1nccs1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807771822 XDVQIWYOVMGJAT-ZDUSSCGKSA-N 424.473 2.488 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCc2ncnn2-c2ccccc2)cc1 809867002 CVPWYGANAFXOTN-UHFFFAOYSA-N 420.517 2.388 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)COc3cc(F)cc(F)c3)nc12 811361323 YTFLCAXKFVUMMJ-UHFFFAOYSA-N 407.329 2.012 10 20 HECD COc1cc(N2CCN(Cc3ccc4c(c3)NC(=O)CO4)CC2)cc(OC)c1OC 816569453 MJQGFIFAQXCXMZ-UHFFFAOYSA-N 413.474 2.366 10 20 HECD O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(N2CCCC2)cc1 915713668 XEAIXUFKDHNCAL-UHFFFAOYSA-N 402.520 2.065 10 20 HECD C[C@@H](NC(=O)CCn1c(=O)nc(O)c2ccccc21)c1ccc(N2CCOCC2)cc1 920888640 URFBLVNDPASQTB-MRXNPFEDSA-N 422.485 2.206 10 20 HECD COc1ccc(/C=C2/SC(=S)N(c3cccnc3)C2=O)cc1OCC(N)=O 1317702890 HFKNNBWXNPGCFU-OVCLIPMQSA-N 401.469 2.360 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cnsn3)cc2)CCC1)c1cc(O)nc(O)c1 1787097414 OKIOUMRRWOIYAR-UHFFFAOYSA-N 411.443 2.406 10 20 HECD CC1(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1807992208 MAXNAGNLFOZPPR-KXBFYZLASA-N 410.474 2.398 10 20 HECD Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)co1 1825953703 JBLADFAZTZVTSQ-QGZVFWFLSA-N 414.462 2.336 10 20 HECD Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)s1 1842017522 AHCUVEVHLVPDEU-UHFFFAOYSA-N 401.488 2.313 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC4(CC3)NC(=O)N(C)C4=O)ccc21 485563526 TUMAZSDZTKUHAE-UHFFFAOYSA-N 412.490 2.061 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)n(C)c2ccccc12 581091647 KEVQCVKJEWESFL-HXUWFJFHSA-N 418.497 2.193 10 20 HECD NC(=O)c1ccc(NC(=S)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1 726457755 VGYYBAXHRZYENK-UHFFFAOYSA-N 418.422 2.393 10 20 HECD NC(=O)CN1C(=O)/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)SC1=S 733370070 SYGPKJUXKXQNMG-WZUFQYTHSA-N 406.470 2.405 10 20 HECD CC[C@H](NC(=O)NCc1cc(OC)ccc1O)c1ccccc1OCC(=O)NC 734065838 JKXMGRFQNUJGJI-KRWDZBQOSA-N 401.463 2.476 10 20 HECD COCCOC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 735185902 DEZGYLKTZDXECU-UHFFFAOYSA-N 409.502 2.124 10 20 HECD C[C@@H](Sc1nnnn1C1CC1)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 735828230 KWAOBRXEMMXBTA-CQSZACIVSA-N 416.551 2.014 10 20 HECD COCCn1ncc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cc21 737210329 ZFYXTEYOMSKSRV-UHFFFAOYSA-N 409.490 2.312 10 20 HECD C[C@H](CN1CCOCC1)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743536428 KMLPPWCBQIFWMU-CVEARBPZSA-N 412.481 2.277 10 20 HECD COc1ccncc1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743974677 DGINQPPVSFIMCT-CYBMUJFWSA-N 420.416 2.415 10 20 HECD NC(=O)CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CCCC1 744388164 NEYPMOJGONEVNU-UHFFFAOYSA-N 405.454 2.130 10 20 HECD CCN1CCO[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)C1 746315753 DAPDVNQUZDDOJR-RTBURBONSA-N 420.554 2.155 10 20 HECD COc1ccc(C(=O)N2CCN(C(=O)c3cc(O)cs3)CC2)c(OC)c1OC 747515830 UMJNOPXKSHMNRH-UHFFFAOYSA-N 406.460 2.078 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(C(=O)COc2ccccc2)CC1 753644862 OJGQUGZEGMCALK-INIZCTEOSA-N 412.486 2.463 10 20 HECD C[C@@]12CCCN1C(=O)N(Cc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)C2=O 761124277 RROYEFBYDOARFP-QFIPXVFZSA-N 424.480 2.259 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3coc(C4CCOCC4)n3)cc2)C1 767692665 JIQAQBFXYOYMSI-QGZVFWFLSA-N 412.490 2.200 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3cccc4c3COC4=O)c2)CC1 769848312 NPWGXKAKXFEPRY-UHFFFAOYSA-N 401.488 2.300 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)cc1 770397004 SUVZWDDEZBBXTG-UHFFFAOYSA-N 414.462 2.251 10 20 HECD Cc1conc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 772473417 FNHXLQRWIIQXIT-UHFFFAOYSA-N 412.368 2.093 10 20 HECD COc1cc2c(cc1OC)CN(C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1)CC2 772768896 LHEHNZDPWCMNQN-GQCTYLIASA-N 413.426 2.256 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCOCC4(CCCC4)C3)CC2)cc1 775847578 AOIJPCALJDLQPA-OAQYLSRUSA-N 403.567 2.071 10 20 HECD CC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CCOCC1 778306367 XMNIFOIACUAGKD-HEDKFQSOSA-N 415.534 2.221 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 779089299 ZPXGHZZIRMZUDM-UHFFFAOYSA-N 409.439 2.042 10 20 HECD COC[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)OC 781362499 JEFWGSCMKJUEGN-OAHLLOKOSA-N 405.417 2.003 10 20 HECD COc1cc(OC)c(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785295993 AFBQRXLDZSESCD-JTQLQIEISA-N 408.838 2.454 10 20 HECD CSc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788309252 DNGUIWNMXNXINY-UHFFFAOYSA-N 413.543 2.220 10 20 HECD C[C@@H]1C[C@]2(CCO1)CN(C(=O)C(=O)NCc1ccc(N3CCCC3)cc1)C[C@@H](C)O2 788940665 YEHOCNPEEPVYQS-PMAPCBKXSA-N 415.534 2.088 10 20 HECD CCCO[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 789799529 ISNPNRMHYWUWOC-GOSISDBHSA-N 421.513 2.086 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C)c3nnnn3C3CC3)cc2F)C[C@@H](C)O1 790220132 UAPMLWHDKXQOSR-HZSPNIEDSA-N 417.489 2.321 10 20 HECD CCN(CC)c1ccc(CNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)cc1 797652522 KBMUGJDXMOQZQW-UHFFFAOYSA-N 405.524 2.500 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)ccc3-n3cnnc3)c2)CC1 797995747 BGVAPGCPXMZYOB-UHFFFAOYSA-N 404.474 2.497 10 20 HECD CCCN(Cc1ccccc1O)C(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F 806565994 WCKDGFQWUXMVCJ-CQSZACIVSA-N 411.446 2.136 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc2c(c1)C(=O)OC2 808941339 VOWHJUCJMAIRQK-UHFFFAOYSA-N 405.204 2.080 10 20 HECD COCc1cc(C(=O)OC)cc(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c1 813667293 OHFLKYUHJYEABL-UHFFFAOYSA-N 406.504 2.473 10 20 HECD Cc1cc(C(=O)N2CC(=O)N(C)C(=O)C2)c(C)n1-c1ccccc1Br 819727428 FDPWDUKHVKXTQV-UHFFFAOYSA-N 404.264 2.297 10 20 HECD Cc1cc(C(=O)N2CCN(CC(N)=O)CC2)c(C)n1-c1ccc(Br)cc1 914878704 PSYMDTHMUIZVFJ-UHFFFAOYSA-N 419.323 2.100 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCCC4=O)cc3)cc2)C1 917832221 OHHQVCBNVLQVLK-IBGZPJMESA-N 420.513 2.445 10 20 HECD O=C(NCCc1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 918169287 JXXDGXJMOXMVRJ-UHFFFAOYSA-N 415.465 2.475 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1CCc2cc(F)c(F)cc21 918311440 RBIASBWDHUZZJG-UHFFFAOYSA-N 415.440 2.349 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1C(C)(C)C 918337881 QQCQABUVHPZZGH-UHFFFAOYSA-N 404.536 2.111 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2OC)cc1 918433542 CSCZOAJWEKRRTD-UHFFFAOYSA-N 412.490 2.156 10 20 HECD CCOc1ccc(N2CCN([C@H](C)C(=O)N3CCC(C(=O)OC)CC3)CC2)cc1 1253831553 FNMRRUHOVUBNGR-QGZVFWFLSA-N 403.523 2.007 10 20 HECD O=C(Cc1ccncc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804288716 BMCYOIZRGQAZAE-YBXVHQAYSA-N 423.469 2.093 10 20 HECD O=C(C[C@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1806591675 GBUZHNOLCOHPSI-QGZVFWFLSA-N 417.506 2.297 10 20 HECD C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)CC1(F)F 1828046817 IPKJOADHHGTPDM-XYZCENFISA-N 424.429 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccncc4)n3C)CC2)cc1 10477550 NXBCCGVYKFSWHT-UHFFFAOYSA-N 424.530 2.327 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](C)C(=O)NC(C)(C)C)cc2F)CC1 303333663 USXWTAWQOIUDRQ-OAHLLOKOSA-N 407.534 2.070 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc1 726601232 LFLUGARRCQLYEG-UHFFFAOYSA-N 417.531 2.344 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C[C@H]2CCCN2CC)C1 729628352 SCHLFMQYRXZFRP-PZJWPPBQSA-N 400.567 2.434 10 20 HECD CNC(=O)CCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 733167076 SOWRTQJEBLJHOK-ACCUITESSA-N 411.574 2.372 10 20 HECD CN1CC[C@@H](N(C)C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1=O 737676893 CBEIIJRFKQTSDE-MBFWDRTGSA-N 423.585 2.419 10 20 HECD CN(C)C(=O)Nc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 739706743 UEBLYQCTSXHFCT-UHFFFAOYSA-N 416.503 2.267 10 20 HECD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 740610389 XXJNUULKKDRMTR-UHFFFAOYSA-N 418.475 2.406 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H]3CCCN3c3ncccn3)cc2F)CC1 747384603 YHBJNGYNMJIBOR-HXUWFJFHSA-N 412.513 2.043 10 20 HECD CN1CCCc2cc(CNC(=O)NCCCN3CCN(c4ccncc4)CC3)ccc21 748343444 HNZBTIARBQWPNJ-UHFFFAOYSA-N 422.577 2.476 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@H]([C@H]4CCOC4)C3)CC2)cc1 750241257 DMLHKVROYRMATC-PMACEKPBSA-N 416.566 2.275 10 20 HECD C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(C)C1CC1 751060320 JZCLPZPYXAPNJJ-GFCCVEGCSA-N 409.533 2.467 10 20 HECD O=C(COC(=O)Cc1ccc(F)c(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 756624374 SFYADICRZCBBRD-UHFFFAOYSA-N 422.403 2.343 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCc1ccc(N2CCCC2=O)cc1 759594977 OVIKRTKKCIVUKF-UXBLZVDNSA-N 410.426 2.097 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)c(O)cc1C 768439157 ZYEOIEHFKPQGEK-UHFFFAOYSA-N 412.458 2.494 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1O 775024750 RHBBCLQODXXITE-OAHLLOKOSA-N 401.419 2.079 10 20 HECD CCn1nccc1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 775025900 ZBIQHIGUUZBKIQ-GASCZTMLSA-N 418.469 2.129 10 20 HECD CC(C)[C@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 778241333 JTCGEEZJVMUPKA-LLGFUMIMSA-N 407.530 2.412 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)/C=C/c3ccc(O)c(O)c3)CC2)cc1 779476287 ZCBQQVHMHQLAHW-WEVVVXLNSA-N 416.499 2.389 10 20 HECD COc1cccc(CNS(=O)(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c1O 779627676 OMNACWCMCGSOJH-KRWDZBQOSA-N 404.488 2.125 10 20 HECD Cc1cc(C(=O)NCCN2CCNC(=O)C2)c(C)n1-c1ccccc1Br 781412775 QITMZHFPYPUFPQ-UHFFFAOYSA-N 419.323 2.018 10 20 HECD O=C(C1CCCC1)N1CC(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 781526502 GWVOLNLKTCCDHR-GOSISDBHSA-N 422.547 2.104 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)COc3ccc(-c4ncn(C)n4)cc3)CC2)cc1 787251119 DMZPWKIJEOFYQD-HXUWFJFHSA-N 423.517 2.053 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCc3ccc(N(C)C)nc3)cc2)CC1 787636642 WKYCYQMOZUUSBI-UHFFFAOYSA-N 409.534 2.317 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(CC(F)(F)F)CC2)cc1 788953927 FRGIBQUVUCJHPW-UHFFFAOYSA-N 414.472 2.246 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cccc(N4CCC4=O)c3)CC2)cc1 790922560 QUDZNHSBKPZRAU-UHFFFAOYSA-N 422.485 2.156 10 20 HECD C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 793822861 FGORDYTXKZYVFM-OXJNMPFZSA-N 412.486 2.353 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)cc1F 793860560 BIUKAMWQYHAMEE-MRXNPFEDSA-N 416.472 2.290 10 20 HECD C[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)NCCF 800705673 ZBHWJFKNSWWLBP-LBPRGKRZSA-N 402.417 2.030 10 20 HECD COc1ccccc1CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807104044 ZJPFOGSWYQPENC-UHFFFAOYSA-N 424.545 2.030 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(CCc2ccccc2)CC1 807292788 YRPHSJVMPOIIFP-UHFFFAOYSA-N 418.541 2.066 10 20 HECD Cc1cc(C(=O)NCCNS(=O)(=O)N(C)C)c(C)n1-c1ccc(C(C)C)cc1 808110316 IFFNOAYSGVMOSK-UHFFFAOYSA-N 406.552 2.343 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](C)CN(C)C(C)C)CC2)cc1 811954096 OEHYXXAXJZBKKX-LJQANCHMSA-N 405.587 2.235 10 20 HECD Oc1cc(F)c(Cl)cc1CN1CCN(Cc2nnnn2-c2ccccc2)CC1 816502574 HTMQCFMERNMTIO-UHFFFAOYSA-N 402.861 2.478 10 20 HECD Cc1cc(CC(=O)N2CCC3(CC2)NC(=O)NC3=O)c(C)n1-c1ccc(Cl)cc1 823624808 GOLCBIXKZNNFPQ-UHFFFAOYSA-N 414.893 2.491 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1c[nH]c2ccccc2c1=O 916148422 IUYBVMCGFJCLFM-UHFFFAOYSA-N 406.486 2.373 10 20 HECD Cc1cc(C(=O)N2CCCN(CC(=O)N3CCCC3)CC2)c(C)n1-c1ccccn1 302974029 GUYCTGQPIRIDDY-UHFFFAOYSA-N 409.534 2.259 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1c(C)c2ccccc2n1C 472815533 ZVTAYWNKJFMCER-UHFFFAOYSA-N 422.485 2.452 10 20 HECD CCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 727168618 SBYOSIYTUWVTRX-UHFFFAOYSA-N 408.476 2.059 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCCn3ccnc3)cc2F)CC1 730121626 VSSCMBMXKCXFJN-UHFFFAOYSA-N 402.518 2.444 10 20 HECD CCN(C1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1)S(C)(=O)=O 731403640 QQQUVCILZTYKPS-UHFFFAOYSA-N 408.568 2.025 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1F 731759349 YJNVAKCWIJAEOL-UHFFFAOYSA-N 407.534 2.024 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCN(C4CCC4)CC3)cc2F)C[C@@H](C)O1 733614288 JYYNJKGMURKESL-QZTJIDSGSA-N 418.557 2.226 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1 734061360 NRHVXSMVELVQDI-UHFFFAOYSA-N 422.507 2.039 10 20 HECD CCOC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1 734702357 YOJBPEVYKVJJCP-UHFFFAOYSA-N 413.474 2.258 10 20 HECD CS(=O)(=O)Cc1ccc(S(=O)(=O)NCCCSc2nccs2)cc1 735315271 KZEYJTXRBPZBMC-UHFFFAOYSA-N 406.576 2.148 10 20 HECD C[C@@H](O)CN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 741404171 JVQXIKDAESQTGJ-WIYYLYMNSA-N 424.545 2.481 10 20 HECD CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NCc2cc(OC)ccc2O)cc1 743220588 HYNZUMRSUGACMB-ZDUSSCGKSA-N 415.446 2.404 10 20 HECD CCN1CCN(C[C@H](C)CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 745863109 RAIMKVRNNJGDRU-CTNGQTDRSA-N 418.582 2.356 10 20 HECD Cc1ccc(-n2[nH]c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2=O)cc1 746133881 LZOMWWLOAVJLPW-UHFFFAOYSA-N 410.449 2.380 10 20 HECD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)cc1 748675325 VLNUQOOLSMWUJJ-UHFFFAOYSA-N 423.497 2.151 10 20 HECD CNC(=O)c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1Cl 749730175 KLFQGANLJZZUEI-UHFFFAOYSA-N 412.924 2.393 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c1 751070387 UBUJNKYAHWSRRM-CQSZACIVSA-N 409.895 2.426 10 20 HECD COc1ccc(N2CCN(C(=O)CSCC(=O)N3CCCCC3)CC2)cc1F 753741478 GPRGVQUTMSMRHB-UHFFFAOYSA-N 409.527 2.229 10 20 HECD COC[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C)o1 754347897 NDWAPXBNPCXWQJ-GOSISDBHSA-N 405.470 2.157 10 20 HECD COc1cc(N2CCN(C(=O)c3ccc(NC(N)=O)cc3)CC2)cc(OC)c1OC 759406964 ZLHKOZLBJDOASR-UHFFFAOYSA-N 414.462 2.165 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)C[C@H](O)c3ccco3)CC2)cc1 759575875 QJVLNWROOSIWMQ-XLIONFOSSA-N 416.522 2.222 10 20 HECD CCCCn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1CC 760148746 LCOARJNDFVZGQL-UHFFFAOYSA-N 418.563 2.410 10 20 HECD CN(C)c1ccc(CNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1F 768481443 PNKQQCRSLGVNEE-UHFFFAOYSA-N 402.451 2.017 10 20 HECD Cc1cncc(NC(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 769022995 HQTLENRYHIREOW-UHFFFAOYSA-N 407.518 2.177 10 20 HECD O=Cc1ccc(OCCn2cc(C(=O)NCc3ccccc3O)nn2)c(Cl)c1 769362379 JCKBZSUKPGYMPG-UHFFFAOYSA-N 400.822 2.459 10 20 HECD CN1CCN(CCC(C)(C)NC(=O)NCc2ccc(N3CCSCC3)cc2)CC1 771290933 JGKBPGFLCHYHTC-UHFFFAOYSA-N 419.639 2.455 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773859034 UPHXPAWDIXDGGC-ZDUSSCGKSA-N 421.494 2.252 10 20 HECD CCc1nn(C)cc1NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 774113463 AJWLLPOWFUVIRZ-UHFFFAOYSA-N 400.527 2.325 10 20 HECD Cc1cn2cc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)ccc2n1 774147601 UUPRQZBWRBGPDM-UHFFFAOYSA-N 409.515 2.451 10 20 HECD O=[N+]([O-])c1ccc(S(=O)(=O)NCCNCc2cc(Cl)cc(F)c2O)cc1 776078046 SIGQFCXFGPJPIB-UHFFFAOYSA-N 403.819 2.161 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccccc1Cn1cccn1 785641956 UBZIMNPAGPOXGE-UHFFFAOYSA-N 415.497 2.240 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 788418008 DGKSZEURWMEGSP-UHFFFAOYSA-N 418.538 2.193 10 20 HECD CCC[C@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCO1 789819953 PICFJUXHDYATNT-JZXOWHBKSA-N 421.513 2.083 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N(C)Cc3ccco3)cc2F)C[C@@H](C)O1 789821351 SEXRBMRHPTYXNC-HUUCEWRRSA-N 403.454 2.307 10 20 HECD COCn1nc(C)c(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 790023190 VHJFNFVDPJNVQK-QGZVFWFLSA-N 409.508 2.179 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCC(=O)c4ccccc43)nc12 792647183 RORHAYWHKHKCHO-OAHLLOKOSA-N 409.398 2.415 10 20 HECD CN(CCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)Cc1ccccc1 793838154 HUONXAHWMSWPCC-UHFFFAOYSA-N 408.546 2.492 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(OC)cc3O)cc(C(C)C)nc21 794389409 MXJDSGKWBLWADF-UHFFFAOYSA-N 412.446 2.285 10 20 HECD COC(=O)c1nccc2c(S(=O)(=O)NCc3ccc(OC)cc3O)cccc12 795357438 OZZKEHSZXIAZCD-UHFFFAOYSA-N 402.428 2.214 10 20 HECD C[C@H](NC(=O)C(=O)NCc1nc(C2CC2)cs1)c1ccc(N2CCOCC2)cc1 803300053 FBAFJXWLMZDRGW-AWEZNQCLSA-N 414.531 2.351 10 20 HECD CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803685805 LNNZONPAUOZATB-QHCPKHFHSA-N 415.534 2.123 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)NCc2cccc(Br)c2O)s1 805081932 ZUHVKGRIDOEUIL-UHFFFAOYSA-N 406.283 2.048 10 20 HECD Cc1cc([N+](=O)[O-])ccc1NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1 806591319 XYOUPTREAJLJGM-UHFFFAOYSA-N 409.493 2.467 10 20 HECD Cn1ccc(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 806636447 NLZXRCODGBBCBR-HNNXBMFYSA-N 406.433 2.028 10 20 HECD O=C1COc2c(cccc2NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)N1 810258749 ZACIBLMQNYNGLE-UHFFFAOYSA-N 400.410 2.315 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](CO)C3CCCC3)CC2)cc1 811994893 IHUIVFYRWBOXDN-NRFANRHFSA-N 404.555 2.058 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@H](CO)c3ccccc3)CC2)cc1 916196421 FMXIPLHHHIIMJD-JOCHJYFZSA-N 412.534 2.240 10 20 HECD CCO[C@@H]1C[C@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917305919 UTBREQTZDSFENT-QHHYFVSCSA-N 408.470 2.024 10 20 HECD CC(C)(C)c1cc(O)c(O)c(CN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)c1 917449187 KEWSCEPLEVNPON-UHFFFAOYSA-N 419.547 2.365 10 20 HECD Cc1ccc(O[C@@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918338442 UXSOLELLGJDKSU-KRWDZBQOSA-N 402.516 2.314 10 20 HECD O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(S(=O)(=O)NC2CC2)c1 918374483 HLGGXGDWFZSLEP-UHFFFAOYSA-N 401.488 2.216 10 20 HECD CCN1CCN(c2ccc(CNc3ccc(S(=O)(=O)N(C)C)cn3)cc2F)CC1 1318368149 GDICPQBYVBKHHO-UHFFFAOYSA-N 421.542 2.225 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](CC(N)=O)C1 1322787347 XIXKHQLMHODBOX-LSDHHAIUSA-N 419.481 2.376 10 20 HECD O=C(/C=C/C1CCCCC1)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1781283560 FORWWSCAYPSNKD-XYXUZSOXSA-N 415.490 2.073 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCC=C1F)c1cc(O)nc(O)c1 1804561931 OWOPLCHHABRLRJ-PSUSHLJKSA-N 407.417 2.490 10 20 HECD Cc1ncccc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1842404148 ZEHNDGJTUPXIGC-SOFGYWHQSA-N 409.442 2.037 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc([N+](=O)[O-])o1 1847171399 OFLFQDFDZONNRT-RYUDHWBXSA-N 421.793 2.382 10 20 HECD CCc1ccccc1NC(=O)CN(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 7494186 RPAKJTWUTLRACI-UHFFFAOYSA-N 424.545 2.477 10 20 HECD CC(=O)NC1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 51278727 PMDRZODAJQELJG-GJZGRUSLSA-N 406.502 2.249 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)c1ccc(N2CCOCC2)cc1 65715655 CSAQRLPKCPWFBE-QGZVFWFLSA-N 410.518 2.401 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1 728979357 FIOSRWWIEMIPPJ-LAJNKCICSA-N 415.421 2.184 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1 729064142 PWRVOPMLAIWYLA-ZDUSSCGKSA-N 411.458 2.417 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(N(C)C(C)=O)CC3)cc2F)CC1 730133362 PHSFNRNBFMSOIA-UHFFFAOYSA-N 419.545 2.120 10 20 HECD COc1ccc(O)c(CNC(=O)CCCNS(=O)(=O)c2ccc(C)c(C)c2)c1 734016272 NXALMOIFDCRJDL-UHFFFAOYSA-N 406.504 2.393 10 20 HECD COC(=O)c1cccc(CS(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 736329814 MVUCZZRJXTUKNT-UHFFFAOYSA-N 422.478 2.069 10 20 HECD CC(C)(C)c1nsc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 738928706 RLGCLCGIRAUFDW-UHFFFAOYSA-N 423.564 2.392 10 20 HECD COC(=O)c1cc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(F)cc1F 743049301 NZAUDEPVQZRGOC-UHFFFAOYSA-N 412.414 2.405 10 20 HECD Cc1cc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nn1C 748763406 ZCLLJQBOAWKNTG-UHFFFAOYSA-N 407.421 2.054 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C(=O)N(C)OC)cc2)cc1 749632097 IHDVHHODJKYTKE-UHFFFAOYSA-N 412.490 2.421 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)c(F)cc3N)CC2)cc1 751613721 ANBGSJNNXRCVRA-UHFFFAOYSA-N 401.438 2.231 10 20 HECD Cc1oc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1S(=O)(=O)N(C)C 753580538 CDKLDRYDKBDLAA-UHFFFAOYSA-N 423.560 2.322 10 20 HECD CCc1cnc(CN(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1 754048821 GPQCVAWNEFRCPF-GOSISDBHSA-N 404.580 2.329 10 20 HECD CN1C(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C(=O)C1(C)C 761116427 CKNQFCBSYMTWHW-UHFFFAOYSA-N 412.469 2.115 10 20 HECD CN(C)c1ncnc2c1cc(C(=O)NCc1cccc(Br)c1O)n2C 765763616 FLUXWKMRDYOCCZ-UHFFFAOYSA-N 404.268 2.432 10 20 HECD COc1cc(NC(=O)C(=O)NCc2cccc(Br)c2O)cc(OC)c1 765902819 DVVZIOCKWMDAIV-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1cc(Br)cc(CN2CCC(C(=O)NCCN(C)C)CC2)c1O 769159312 AHCIXEYCQZOTLR-UHFFFAOYSA-N 414.344 2.053 10 20 HECD CN1CCC(N(Cc2ccco2)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 769842914 QVIDXNPZZJHBBW-UHFFFAOYSA-N 407.492 2.093 10 20 HECD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(-n2cccn2)c1 769934194 PKFGOMWTFUNDCL-CYBMUJFWSA-N 400.460 2.440 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCSC2(CCOCC2)C1 770345589 QCICKAUPOSQPFH-UHFFFAOYSA-N 409.527 2.470 10 20 HECD CN(C)C(=O)c1ccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 772901295 GFBOTLYBMGHISL-UHFFFAOYSA-N 414.481 2.092 10 20 HECD Cc1noc(C)c1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774155152 QDBUHKKQWWHVBF-CQSZACIVSA-N 422.432 2.294 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 776078102 ZNHOEOZZCOMEQB-YLJYHZDGSA-N 409.552 2.020 10 20 HECD C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 778528273 DHYNRVMGFSYZHQ-AWEZNQCLSA-N 415.469 2.085 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@@H]7[C@H]5[C@H]3[C@@H]7C[C@H]64)nc12 796322708 LRWMPCGDSBUDSE-LNRMPXDISA-N 409.442 2.049 10 20 HECD CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 796862843 OHIMLOMWDOXMCH-UHFFFAOYSA-N 421.501 2.483 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC[C@@H](OC)C[C@H]3C)CC2)cc1 799528900 LCUNPUNJOALHSK-WIYYLYMNSA-N 404.555 2.416 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(Br)cc(C(N)=O)c1 799541918 MCMHSTVCPPCWRY-UHFFFAOYSA-N 413.249 2.257 10 20 HECD CN(c1ccc(CNC(=O)N2CCC(S(N)(=O)=O)CC2)cc1)C1CCCCC1 799895818 AOHCREYKKQBDOG-UHFFFAOYSA-N 408.568 2.418 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(CC3CCOCC3)OC)cc2F)CC1 802126665 UHPQQSNVHNQSEO-UHFFFAOYSA-N 408.518 2.467 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 808298549 VGUSISWNTSVGCH-CYBMUJFWSA-N 420.478 2.375 10 20 HECD CC[C@@H]1CCC[C@@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808736613 WSANCWYIPGNQPI-WBVHZDCISA-N 419.522 2.056 10 20 HECD COc1ccc(N2CCN(CCCN=c3nn[nH]n3-c3ccc(C)cc3)CC2)cc1 917387708 HRQYZTDRIHQAMM-UHFFFAOYSA-N 407.522 2.025 10 20 HECD O=C(NCCc1cn2c(n1)CCCC2)NCc1ccc(N2CCC(CO)CC2)cc1 918208713 IPFSQYFGHUCUFL-UHFFFAOYSA-N 411.550 2.470 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cc(F)ccc1F 918442501 NAXPWALULPOIQV-UHFFFAOYSA-N 403.429 2.428 10 20 HECD COc1cccc([C@H](C)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 919749950 JTIBIWTUHBOJRF-INIZCTEOSA-N 402.516 2.350 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H](O)COc1ccc(F)cc1 919907160 BFUKPLJEHKEVGC-KRWDZBQOSA-N 421.444 2.041 10 20 HECD CCO[C@H](CC)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 920672847 KVGFTVULFONAHQ-SPYBWZPUSA-N 410.486 2.414 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCCC3=O)cc2)C1 1321857200 LMWWNABDKJAKGH-GOSISDBHSA-N 420.513 2.445 10 20 HECD Cn1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)n1 1788426854 XQBBQAGIRAISAM-UHFFFAOYSA-N 421.457 2.217 10 20 HECD CC(C)(C)n1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cn1 1794656529 HIIPJSIEQNAMPH-MUJYYYPQSA-N 413.478 2.010 10 20 HECD O=C(c1cc(O)nc(O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(O)cc3)CC1)C2 1796600803 FEWKUJLYXASIDT-BJWYYQGGSA-N 423.469 2.182 10 20 HECD Cc1ccn2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(O)nc(O)c3)C4)cnc2c1 1801133872 PTONKPJAPJEOIR-MUJYYYPQSA-N 421.457 2.015 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@H]1C[C@@]1(F)Cl 1822502396 RCGSGLGXWRNQLU-MYFIVHGGSA-N 423.832 2.446 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cccc(F)c2)C1 1844899216 SLUZFSXFVSIJNF-SOFGYWHQSA-N 412.417 2.473 10 20 HECD Cc1cc(CN2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)no1 139939908 XUSVPNXFBSYGNC-SFHVURJKSA-N 413.522 2.408 10 20 HECD CC(C)NS(=O)(=O)c1cccc(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 437008105 MZUWADVQNGJNHA-UHFFFAOYSA-N 403.504 2.479 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CSCc1cc(=O)n2ccsc2n1 437014529 CIWHAEJDDLRLBC-UHFFFAOYSA-N 416.528 2.481 10 20 HECD COC(=O)CN(CC(=O)Nc1ccccc1C(=O)OC)Cc1cc(Cl)ccc1O 731844850 KFCQRPTUXPTZIF-UHFFFAOYSA-N 420.849 2.446 10 20 HECD C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 739082298 VOXBYDWGTNPMFL-HNNXBMFYSA-N 414.481 2.372 10 20 HECD COC[C@@H]1CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 741796212 XLAFENOFTKZYGJ-HOCLYGCPSA-N 408.454 2.136 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)ccc21 743892491 GIDDOWYHWCQTRP-UHFFFAOYSA-N 421.501 2.037 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cnn(CC(=O)N(C)C)c1 747554862 UYHWWNLDNQFYOS-UHFFFAOYSA-N 424.299 2.493 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H]([C@@H]4CCOC4)C3)cc2F)C[C@@H](C)O1 750263088 RFQIZQHXMURZIZ-KVPLUYHFSA-N 419.541 2.414 10 20 HECD CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1 752005166 NXEHCLLIZSOAKV-KKSFZXQISA-N 401.511 2.053 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 752097940 DFCVEUIDTYLUST-UHFFFAOYSA-N 422.485 2.028 10 20 HECD CCn1nc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1C1CC1 759039203 HTSSZJGWLIAVJD-UHFFFAOYSA-N 415.469 2.215 10 20 HECD COc1cc(N2CCN(CCS(=O)(=O)c3ccccc3)CC2)cc(OC)c1OC 759885303 BTQMXEWMPKFUCA-UHFFFAOYSA-N 420.531 2.308 10 20 HECD CC1(C)C(=O)Nc2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3)cc21 760542239 GEPJKAYPBACVAR-UHFFFAOYSA-N 415.515 2.231 10 20 HECD CCS(=O)(=O)NCC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 767390270 RRLJMPJCUQHIRC-UHFFFAOYSA-N 410.467 2.207 10 20 HECD Cc1ccc(C)c(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 768289423 ZDHAPHUWEKUODU-UHFFFAOYSA-N 403.504 2.343 10 20 HECD CCc1ccc2c(c1)[C@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N2 769807000 XRUZNTGTHVJXAC-AWEZNQCLSA-N 417.487 2.182 10 20 HECD C[C@@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(N2CCOCC2)c(F)c1 773046084 ZUEXGLDXJHRKBS-OAHLLOKOSA-N 411.543 2.270 10 20 HECD Cc1cn2cc(NC(=O)C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc2n1 774165528 OTBLCXLZKFZXID-MRXNPFEDSA-N 407.474 2.295 10 20 HECD CNC(=O)[C@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCO1 782087102 ZHTZQJPBSVMHJW-QGZVFWFLSA-N 420.307 2.444 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnc4c(c3)CCCC4)CC2)cc1F 782819239 OHAPPPYDEXUIER-UHFFFAOYSA-N 412.465 2.395 10 20 HECD COC(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1F 785294805 NOVIZVVDYUMFAZ-SNVBAGLBSA-N 405.382 2.101 10 20 HECD CCN1C[C@@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)Oc2ccccc21 785424677 KXMIAGGSPLTKAZ-LJQANCHMSA-N 410.518 2.115 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(N(C)C)cc1 785572740 AAXVXSWHSHASJG-GCJKJVERSA-N 424.545 2.120 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4ccccc43)cc2)CC1 786657427 XWCMTDVONJTJMI-FQEVSTJZSA-N 406.486 2.097 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 788327210 BRPNHZQJZINYNQ-UHFFFAOYSA-N 423.922 2.373 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)N1CCc2sccc2C1 789726436 ZFYXMPYYGLXQMC-CQSZACIVSA-N 418.538 2.132 10 20 HECD C[C@H](O)C[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790666242 PMYINDIDAIKLPH-XKGZKEIXSA-N 402.539 2.223 10 20 HECD CC(C)[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)Cc1nnc2n1CCC2 794829791 GXOVREHONKLYHS-ORAYPTAESA-N 416.482 2.172 10 20 HECD COc1ccc(N2CCN(C(=O)c3nnn(Cc4ccncc4)c3C)CC2)cc1F 797073480 AAAUSBRWDUZNPH-UHFFFAOYSA-N 410.453 2.140 10 20 HECD C[C@@H](NC(=O)C(=O)NCC(C)(C)[C@@H]1CCCCO1)c1ccc(N2CCOCC2)cc1 803305350 LLGJTGOOCRJPSE-XLIONFOSSA-N 417.550 2.412 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCc3c(ncn3-c3ccccc3)C2)cc1F 803664620 LQZAUDVBLBUUIW-UHFFFAOYSA-N 421.476 2.279 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)N1CCc2ccccc2C1 803688213 MDXSPMMHDZJCDU-GOSISDBHSA-N 420.557 2.248 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)NCc2nccn2CC(F)(F)F)C2CC2)cc1 804565795 UCGDZQBZNSPFBZ-UHFFFAOYSA-N 423.439 2.319 10 20 HECD CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)CC1 804761093 VUOAPYMDWFRIIR-QQOXCAACSA-N 417.506 2.265 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H]3CCCC3(C)C)CC2)cc(OC)c1OC 806897345 SEHMZGMQMKRNQG-GOSISDBHSA-N 419.522 2.056 10 20 HECD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCO1 807952044 CTBABFNYMSZALV-WBVHZDCISA-N 423.941 2.066 10 20 HECD COc1cc(O)c(CNc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC 809652769 YMZRIFGBBSNJDI-UHFFFAOYSA-N 408.476 2.042 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 810056251 JRQKQIWMJYNBCI-UHFFFAOYSA-N 422.478 2.061 10 20 HECD CC[C@H]1CN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@H](C)S1(=O)=O 813058713 MEDYQHJHKBELMK-KXBFYZLASA-N 409.552 2.271 10 20 HECD COc1ccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1F 918340756 STJLGWLFPTZHLH-UHFFFAOYSA-N 420.506 2.318 10 20 HECD CC(C)(CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(N)=O 918603404 ZLKPMQTVDHFPNP-FMIVXFBMSA-N 411.574 2.357 10 20 HECD CC(C)CN1C(=O)/C(=C\NC2CCN(Cc3ccccc3)CC2)C(=O)NC1=S 920976573 LBRAUEJIHMSHFG-PDGQHHTCSA-N 400.548 2.024 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(CC(=O)N2CCOCC2)CCCC1 1320514642 XRFLKUMQBKIJPK-INIZCTEOSA-N 404.507 2.344 10 20 HECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2=NN(c3ccccc3)C(=O)C2)co1 1796932537 HOEYFSFTINNXRZ-ACHSLPGTSA-N 421.457 2.028 10 20 HECD O=C(Cc1ccncc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1820717866 YSUHYRZEAJLOFB-INIZCTEOSA-N 422.445 2.160 10 20 HECD Cc1cc(F)c(F)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1 1843250721 HMQYJABKRUIXEL-UHFFFAOYSA-N 403.385 2.210 10 20 HECD COc1cc(OC)c(OC)cc1CNC(=O)CN(C)c1ccc(OC)c(OC)c1 63616943 OVRFVJUWZZYLOJ-UHFFFAOYSA-N 404.463 2.482 10 20 HECD COc1ccc(N(CC(=O)NCCCN(C(C)C)S(C)(=O)=O)C(C)C)cc1F 725815883 CPDJJHIEMDDCAO-UHFFFAOYSA-N 417.547 2.225 10 20 HECD CCOc1ccc(CNCc2ccccc2CS(=O)(=O)N2CCOCC2)c(O)c1 725847395 KMJWNDJDQHVPGD-UHFFFAOYSA-N 420.531 2.243 10 20 HECD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 726277609 OQQRSXRZYAASFJ-OAQYLSRUSA-N 415.582 2.369 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(n4ccnc4)CC3)cc2)C1 728746366 CHXADPRRWOTLEA-GOSISDBHSA-N 410.522 2.132 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCn3cnc4ccccc43)CC2)cc1 732592480 MKCSQZCZCNRYDU-UHFFFAOYSA-N 422.533 2.166 10 20 HECD CC(C)[C@H]1C(=O)NCCN1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 734276757 RQSKHWAEYCEAMB-KRWDZBQOSA-N 410.465 2.423 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(OC)c1 738884102 FOIBFFLHCDXLCU-UHFFFAOYSA-N 419.503 2.260 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)n(C)c1 742952290 KCPQPURHTNSTMO-UHFFFAOYSA-N 420.535 2.161 10 20 HECD COc1ccc(N2CCC(NC(=O)N3CCN(CCOC(C)C)CC3)CC2)cc1 746417107 KMVDCSNCAJTEIC-UHFFFAOYSA-N 404.555 2.416 10 20 HECD COc1cc(N2CCN(C(=O)NC3C[C@@H](C)O[C@H](C)C3)CC2)cc(OC)c1OC 759296276 CPANCTHIYMRITA-HUUCEWRRSA-N 407.511 2.500 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccnn3[C@H](C)C3CC3)CC2)cc1F 760257523 VNRLEXWUQMHZOA-CQSZACIVSA-N 415.469 2.289 10 20 HECD O=C(NCc1ccccc1O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1 769366407 ZJGQKYGNOAGVPZ-UHFFFAOYSA-N 410.442 2.388 10 20 HECD C[C@H]1CN(Cc2cccc(Br)c2O)CCN1c1nccn2cnnc12 770279878 IDDHILNBIICOBQ-LBPRGKRZSA-N 403.284 2.303 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCc4cc(O)ccc4C3)cc2)C1 770302482 WSABABMMIBKWCX-PMACEKPBSA-N 422.529 2.451 10 20 HECD Cc1nc(O)nc(O)c1CCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771063985 GJQIDOZZOCKCRE-HNNXBMFYSA-N 420.897 2.269 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H](C)Cc3c(C)n[nH]c3C)CC2)cc1 772079190 GXMQUOGFQRNEFO-HNNXBMFYSA-N 414.506 2.106 10 20 HECD COCCOc1cccc(NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 772904279 PANFIRZTYLVVDG-UHFFFAOYSA-N 417.481 2.416 10 20 HECD CCN(C)c1ccc([C@@H](C)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1 773014002 HNVFFSWCSKWRSA-MRXNPFEDSA-N 405.568 2.380 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 775031646 BOVLFHPJPGWZKP-OAQYLSRUSA-N 406.530 2.294 10 20 HECD C[C@@H](NCC(=O)Nc1cccc(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 775259182 GIHKRTPOEBZKTN-MRXNPFEDSA-N 417.531 2.216 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2c(c1)NC(=O)CO2 777825881 AOXGOZZRBDZMFF-UHFFFAOYSA-N 404.806 2.192 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 781477114 PKORMNYMNJKREL-UHFFFAOYSA-N 409.364 2.211 10 20 HECD COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 781507264 PGGPLAAORWMQTD-VIFPVBQESA-N 408.357 2.282 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](CO)c3ccccc3)cc2F)C[C@@H](C)O1 782053644 TZHQNEWOOKRSPA-LZJOCLMNSA-N 415.509 2.379 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CO[C@H](C)Cc3ncc[nH]3)cc2F)C[C@@H](C)O1 782914093 ZCQNNQWGFBAQPJ-OAGGEKHMSA-N 404.486 2.426 10 20 HECD COCn1nc(C)c(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1C 788612086 ILZMEXFQPWPQFV-UHFFFAOYSA-N 408.524 2.060 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2Br)cc1 797430996 FFNGYILRAMDKEJ-UHFFFAOYSA-N 420.310 2.126 10 20 HECD COc1cccc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 803297299 PXYDKKWRJJOGNB-QGZVFWFLSA-N 411.502 2.368 10 20 HECD CO[C@@H](C)CN(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 804977725 XNWUBFAJUNZITC-INIZCTEOSA-N 416.501 2.119 10 20 HECD CCN(C)C(=O)c1cccc(NC(=O)C(=O)NCCCSc2nccs2)c1 806928957 FCKGWVOTSFCRPI-UHFFFAOYSA-N 406.533 2.472 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(N(C)C)Cc2ccccc2C1 807297831 MXEGKKIIHUOJDH-UHFFFAOYSA-N 422.573 2.317 10 20 HECD Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807672915 KFKLUXPBWHCQKV-UTKZUKDTSA-N 422.529 2.156 10 20 HECD C[C@H]1CC[C@H](C)N(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808853907 KEGVNSVPSZTJLY-OALUTQOASA-N 412.578 2.482 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc3nc(O)nc(O)c3c2)cc1 917916483 MSHDPHGIKLVLTD-UHFFFAOYSA-N 402.476 2.366 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)Nc1cccc(-n2cnnn2)c1 918308221 HGJLIUJHDQGFHM-UHFFFAOYSA-N 419.489 2.250 10 20 HECD CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C 920194790 HFASMEUCRUEPLQ-UHFFFAOYSA-N 424.501 2.353 10 20 HECD COc1cc(OCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 921023960 RYULFEJENLOHTQ-UHFFFAOYSA-N 415.446 2.477 10 20 HECD CCCCN(C(=O)CN(CC)c1ccc(OC)c(OC)c1)[C@@H]1CCS(=O)(=O)C1 921061631 IWXBRGSKNWCIQO-QGZVFWFLSA-N 412.552 2.346 10 20 HECD CCOC(=O)[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 1318368758 GSYDCLBKKIOZHP-QGZVFWFLSA-N 422.393 2.442 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995013 WUUVABVPXLRVEE-YVEFUNNKSA-N 424.379 2.160 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)c3ncn(C)n3)C2)cc1 1842354690 BNTDMULDAJNMRN-UHFFFAOYSA-N 418.501 2.353 10 20 HECD Cc1ncc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1843595932 OYVTYWQNCWNMSW-GQCTYLIASA-N 415.471 2.099 10 20 HECD C[C@@H](NC(=O)c1cccc(NS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 148446889 YFCGVKFTTNCEKF-OAHLLOKOSA-N 403.504 2.386 10 20 HECD CNC(=O)c1cccc(NC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1C 726725781 HMZDQSKYFADYDY-UHFFFAOYSA-N 424.501 2.087 10 20 HECD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NCc1ccc2c(c1)CCCN2C 729261567 AHHNNXLNTAIAOT-UHFFFAOYSA-N 404.474 2.189 10 20 HECD O=C(Nc1ccn(-c2ccncc2)n1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 733851026 VZEFVAJMGYMJES-GOSISDBHSA-N 421.457 2.119 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1 734072644 LOWGCIAUVCZBCQ-MRXNPFEDSA-N 418.421 2.353 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCOC[C@H]3CCCO3)cc2F)C[C@@H](C)O1 734525448 HMDPNEMSRLJWGU-SOLBZPMBSA-N 409.502 2.434 10 20 HECD O=C1N[C@H](C(F)(F)F)CC[C@H]1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520113 WCBKDTMRCFMOQP-LZWOXQAQSA-N 400.397 2.357 10 20 HECD COC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCO1 743554591 IOJCYZZPQAXQSD-INIZCTEOSA-N 417.428 2.099 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@H](C)N3CCc4ccccc43)CC2)cc1 747164825 PMKZWPBACQCYDX-IBGZPJMESA-N 408.546 2.385 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4ccccc43)cc2)C1 748626127 LMBOSTYLSBJZMW-APWZRJJASA-N 406.486 2.131 10 20 HECD Cc1nn(C)c2ncc(S(=O)(=O)NCc3cccc(Br)c3O)cc12 766206688 IHAIQZFMWVQRIS-UHFFFAOYSA-N 411.281 2.223 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)Nc1ccncn1 770768901 PHXYUYNWNICBRL-UHFFFAOYSA-N 408.441 2.054 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 773843892 BDXNCUVVBGLMRM-CQSZACIVSA-N 418.519 2.330 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3Cc4ccccc43)CC2)cc1 778242762 XLRSOEUBDJHQSR-VYENPZKTSA-N 405.498 2.356 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)CC34CCCCC4)CC2)cc1 779223032 YZICIWFRFWYWJI-JOCHJYFZSA-N 416.610 2.128 10 20 HECD COc1c(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cccc1C(N)=O 782801465 SVOUQXDKNJNHKY-UHFFFAOYSA-N 424.501 2.285 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCCCSc2nccs2)c(OC)c1 785493708 WBIPTYKYNRDMSL-UHFFFAOYSA-N 402.519 2.399 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)OC)[C@H]3C)cc2F)CC1 786754424 UJOURMDNNXTUGB-NVXWUHKLSA-N 406.502 2.061 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCS1 789822959 XJVSDYVYBPWOJL-OAGGEKHMSA-N 423.554 2.410 10 20 HECD CSC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 789949388 HVVKYYIPYBHZPO-GFCCVEGCSA-N 419.469 2.026 10 20 HECD CN(C)S(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCCC3)cc2)nc1 797653372 QJMUPKOOYDQKSQ-UHFFFAOYSA-N 403.508 2.254 10 20 HECD CC(C)(C)OC(=O)C1=NO[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 798169668 LJMPQZJNQIIWED-QAPCUYQASA-N 404.463 2.386 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)cc1F 802554472 YMAFLPXEOBKPGU-SECBINFHSA-N 408.357 2.282 10 20 HECD Cc1cnccc1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803448226 LKUCSEVENQLUIG-UHFFFAOYSA-N 418.444 2.393 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc4oc(O)nc4c3)CC2)cc1 805655146 GYSFXPMONZYHSE-UHFFFAOYSA-N 411.414 2.048 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H](c3nncn3C)C(C)C)cc2F)CC1 805767612 YHMMZSOUHZVVCI-IBGZPJMESA-N 417.533 2.293 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](OCc2c(C)noc2C)C1 807098964 HCLYAJLSTUFLDI-LJQANCHMSA-N 414.506 2.100 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccnc(C(F)(F)F)c3)nc12 808666976 NHNBENWZHMZWIK-UHFFFAOYSA-N 410.308 2.382 10 20 HECD O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccc2c(c1)C(=O)OC2 808944905 YBRZHYJGLXSNEC-UHFFFAOYSA-N 405.204 2.080 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(C4(OC)CCCC4)n3)CC2)cc1 809465179 SNWNYAZRMUGEIJ-UHFFFAOYSA-N 400.479 2.385 10 20 HECD COc1ccc(S(=O)(=O)NC2CC2)cc1NCc1ccc([N+](=O)[O-])c(OC)c1O 809682677 YIWJPSFPUFTMCZ-UHFFFAOYSA-N 423.447 2.370 10 20 HECD COC(=O)Cc1cccc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 810043394 UEZSERJTECXCHI-UHFFFAOYSA-N 418.515 2.312 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@](C)(OC)C3CC3)CC2)cc1 812921472 KTZNDGJHSXRTOA-QFIPXVFZSA-N 404.555 2.322 10 20 HECD Cc1cc(C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c(C)n1-c1ccc(F)cc1 816206009 WAKBHPDTTYUHIJ-UHFFFAOYSA-N 418.450 2.331 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNCc1cc(Cl)c(F)cc1O 816550481 SBMVKCCTAUSKGE-UHFFFAOYSA-N 403.819 2.161 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 918193838 HLVXIUXOKWNKEK-UHFFFAOYSA-N 409.439 2.391 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)[C@@H](C)c1ccccc1 1320397046 CEDVLNHDHIKYQI-ICSGCJEQSA-N 401.459 2.243 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)C3(F)CCC3)C2)C1 1784879087 VYMYQCXBFWYSCH-GOSISDBHSA-N 412.845 2.087 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 108790274 NUSUWTFENGGXOY-FQEVSTJZSA-N 423.579 2.076 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cc2F)CC1 303333660 USXWTAWQOIUDRQ-HNNXBMFYSA-N 407.534 2.070 10 20 HECD Cc1nn(C)c(=O)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 728164756 KBLLUHOQPUSJOG-CHWSQXEVSA-N 402.470 2.080 10 20 HECD COCCN(CCN(C)C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 729598132 XQZOZUZIJYJCJR-IAGOWNOFSA-N 410.534 2.159 10 20 HECD Cc1cc(C(=O)CN(C)CCN2CCOCC2)c(C)n1-c1ccc2c(c1)OCCO2 733894679 KCHTYQGGSBSNRK-UHFFFAOYSA-N 413.518 2.312 10 20 HECD Cc1cc(C)c(O)c(CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1 754723760 UNGYMDYJDZNMHO-UHFFFAOYSA-N 400.504 2.392 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3cnn(C(C)C)c3)CC2)cc1 754803794 WBAVWSJZQWHONR-RXVVDRJESA-N 401.555 2.306 10 20 HECD O=C(Nc1cnn(-c2ccccn2)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 754923942 UETABKBKDVDJAL-SFHVURJKSA-N 421.457 2.119 10 20 HECD CC(C)CN1CC[C@@H](CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 756988653 ZENKBTKBTFAXFM-PMACEKPBSA-N 415.582 2.165 10 20 HECD O=C(COC(=O)c1ccnc(O)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 762848956 NCAUHJRMRVPINE-UHFFFAOYSA-N 402.362 2.358 10 20 HECD CN(C)CCS(=O)(=O)c1ccccc1C(=O)NCCCSc1nccs1 767169865 CLIZMLSULPIKMA-UHFFFAOYSA-N 413.590 2.391 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1c1cccc(Br)c1 768466260 XBKOEIBVNXWUJJ-FUHWJXTLSA-N 419.275 2.254 10 20 HECD Cn1ccnc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1F 769647878 UBBNFGJGQGSMLL-QGZVFWFLSA-N 418.450 2.156 10 20 HECD C[C@@H]1CN(Cc2cc(Br)ccc2O)CCN1c1nccn2cnnc12 770280806 MMSQHHSUTCDXTI-GFCCVEGCSA-N 403.284 2.303 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1 772529253 IPDJODAYCQKKQN-BXUZGUMPSA-N 422.507 2.456 10 20 HECD COCC[C@]1(NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCOC1 773953404 FVQCTBFOMPYGSC-QHCPKHFHSA-N 408.454 2.186 10 20 HECD CCCCCOC1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 774179338 NGWCMYXUQIFYGO-SFHVURJKSA-N 402.539 2.489 10 20 HECD O=C(NCCc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 774653126 HZZQLJMLDIRNBX-UHFFFAOYSA-N 401.894 2.152 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCCN(Cc3nc([C@H](C)OC)no3)CC2)c1O 774911901 HZWYDWSVZWUVFS-ZDUSSCGKSA-N 421.454 2.107 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1 779513248 GCGVIZRHJWGZDH-DYLHUKMJSA-N 420.462 2.220 10 20 HECD CCO[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C1CCCC1 788313031 OEDFGEIXJPGUPS-NRFANRHFSA-N 417.550 2.241 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccc(-n2cccn2)cc1 788381606 XKKPTZBIOUVUQH-UHFFFAOYSA-N 401.470 2.181 10 20 HECD CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)sc2c1CCCC2 790930317 VGDQUIUQQRJWFT-ZDUSSCGKSA-N 407.536 2.152 10 20 HECD C[C@@]1(C(N)=O)CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 794363888 QQSPMYWSKJDANC-ADYSOMBNSA-N 423.585 2.453 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2ccc(OC)cc2O)ccc1OC 794376226 DWCHPCFGMMSREO-UHFFFAOYSA-N 422.503 2.370 10 20 HECD COc1ccccc1CONC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 798382823 ALJFWGPQQZUEGO-KRWDZBQOSA-N 412.490 2.328 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1 806278843 XKKXCXPOEIEMGJ-CABCVRRESA-N 424.592 2.039 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 806420892 KFCMRLBDEMLLEA-IBGZPJMESA-N 409.486 2.443 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1nc(C)c(C(=O)OCC)s1 808824409 CVTQGQVSIDCWHZ-UHFFFAOYSA-N 419.503 2.389 10 20 HECD CCc1nnsc1-c1nc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 809465084 RDOPQUIULWLSFJ-UHFFFAOYSA-N 414.491 2.050 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)SCC(=O)N4)cc2)C1 810182286 AYAOXLCENBDURK-INIZCTEOSA-N 424.526 2.363 10 20 HECD O=C(NC1CC1)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 812012449 YOEMBBDSSOUXTE-HXUWFJFHSA-N 416.522 2.476 10 20 HECD Cc1ccc(-n2cnnn2)cc1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 915686247 PMXKUDRNWWGBOZ-UHFFFAOYSA-N 407.478 2.471 10 20 HECD C[C@@H]1CN(c2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cn2)C[C@@H](C)O1 918246517 QIMQLTUAGHWZNH-HZPDHXFCSA-N 411.506 2.016 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCc2ccc(F)cc21 918284924 VDJQBVZYCZDZKX-UHFFFAOYSA-N 415.440 2.397 10 20 HECD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 918436772 CEIQQZHWLCLQIP-UHFFFAOYSA-N 412.515 2.453 10 20 HECD CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918463611 LNEBTHRZAOHQIK-KRWDZBQOSA-N 424.501 2.042 10 20 HECD CCn1c(S)nc2cc(C(=O)NCc3ccc(N4CCOCC4)cc3)ccc2c1=O 919767006 HSYKGLPVCBLHCF-UHFFFAOYSA-N 424.526 2.472 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CCN(CCc3ccccc3)CC2)c1 919812584 GORVILQJWOCRJU-UHFFFAOYSA-N 417.531 2.201 10 20 HECD CCOc1ccc(N2CCN(C(=O)COC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1 1253852936 ILWQQZUQVZNJEA-UHFFFAOYSA-N 419.522 2.370 10 20 HECD CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)CCC1 1816720238 HSSLRWLOQGGCKM-LLVKDONJSA-N 402.476 2.365 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(F)cc(Cl)c2)C1 1846822537 FAONYOPPMSDXBM-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1 10907108 VIFVGCBTUFCUPJ-UHFFFAOYSA-N 417.531 2.046 10 20 HECD CC(C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3nsnc23)cc1 19108588 SGSDOZGULIHOKE-UHFFFAOYSA-N 412.518 2.179 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1nnc2n1CCCCC2 195561308 URECGUUFRWGVPA-UHFFFAOYSA-N 412.538 2.213 10 20 HECD CCN1CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 729542482 IIUINYBTKJQXIS-HDICACEKSA-N 406.546 2.083 10 20 HECD COC(=O)NCCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 730746824 VJRBPYWZDQXKLP-UHFFFAOYSA-N 403.401 2.294 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCOc3cccc(C=O)c3)CC2)cc1 731619713 IYUBRSBSYBKRMS-UHFFFAOYSA-N 411.502 2.215 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@H](OC)C(F)(F)F)CC2)cc1 733354044 CTTGJFZONCXQRW-KRWDZBQOSA-N 418.460 2.084 10 20 HECD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCCCSc1nccs1 733884312 QLJUAEQUZPKOCS-OBJOEFQTSA-N 400.595 2.467 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccncc3F)cc2F)C[C@H](C)O1 741380778 VUZQGSGVEKJXED-KBPBESRZSA-N 419.428 2.447 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1 742920439 PUQMSXNHKQSGFA-UHFFFAOYSA-N 420.517 2.136 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(S(C)(=O)=O)CC1 745788794 ZFJNXURARNXHHV-UHFFFAOYSA-N 410.584 2.344 10 20 HECD O=S(=O)(CC[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751373515 UIEYNWARVMZHCM-SJORKVTESA-N 402.944 2.499 10 20 HECD COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(N2CCCC2)cc1 752645310 BTBAAGWNIGWEIR-QFIPXVFZSA-N 424.545 2.460 10 20 HECD C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 755226927 PEGMXOMMDSBQJY-MRXNPFEDSA-N 420.506 2.389 10 20 HECD CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 755315786 FGRTWLUTKIBNGX-UHFFFAOYSA-N 409.446 2.235 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccn(-c4ncccc4F)n3)CC2)cc1 759123491 HOPHAXQZMNTXDS-UHFFFAOYSA-N 410.453 2.176 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCN(C(=O)C2CCCC2)C1 762273914 JELKGYXTQHBABO-IBGZPJMESA-N 400.523 2.114 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 763282583 GIJFBLIUYOPPFO-QAPCUYQASA-N 418.515 2.388 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)NCc2cccc(Br)c2O)c1 765752706 ZCBCNAYSZYUGIF-UHFFFAOYSA-N 413.293 2.301 10 20 HECD CCS(=O)(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 767780729 JRUVMBLGSXNUSU-INIZCTEOSA-N 409.552 2.193 10 20 HECD Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NCCc1ccc(O)c(O)c1 768899642 KUHIWMQAKWZJEP-UHFFFAOYSA-N 414.487 2.213 10 20 HECD CS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1Br 770035095 GCQJKJAGLHPHLF-UHFFFAOYSA-N 414.277 2.236 10 20 HECD CCC1(O)CCC(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 772084299 ZGPOYKDFAZSPFP-LYGNXSNRSA-N 402.539 2.271 10 20 HECD COC(=O)c1c(F)cccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 772908877 GHDYVBAKXWZJCB-UHFFFAOYSA-N 419.428 2.316 10 20 HECD CN1CC=C(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 775961635 RTMQNMCWWUSREI-UHFFFAOYSA-N 407.517 2.246 10 20 HECD C[C@](O)(CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 777747523 FCPFYGYOLOTDQP-CYFREDJKSA-N 424.545 2.485 10 20 HECD O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NCc1ccc(O)c(O)c1 778918113 LFZFECROBKZQGO-UHFFFAOYSA-N 403.378 2.293 10 20 HECD COc1cc(N2CCN(C(=O)NCc3ccncc3C)CC2)cc(OC)c1OC 779699952 YIOVSDHNUJQFAM-UHFFFAOYSA-N 400.479 2.448 10 20 HECD CCN(C(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCCCC1 783153316 VMBYJZGHRKEERC-ZDUSSCGKSA-N 412.508 2.490 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)Cc4ccccc4C(=O)O3)cc2)CC1 786654998 BHONEDXZHANEMD-XMMPIXPASA-N 421.497 2.143 10 20 HECD COc1cccc2c1OC[C@@H](NC(=O)C(=O)NCc1ccc(N3CCCC3)cc1)C2 788935176 BMBKBVFFLSIQJB-SFHVURJKSA-N 409.486 2.032 10 20 HECD COC(C)(C)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789816276 CPKPMXANEWQYFA-HRCADAONSA-N 423.529 2.375 10 20 HECD COC(=O)c1cnc(NCCN2CCN(c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 790101581 PSKIEAPKUXTSOB-UHFFFAOYSA-N 415.450 2.019 10 20 HECD Cc1ccc2c(c1)CN(CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)CCO2 796428690 GGAGCBAWOSGWCO-UHFFFAOYSA-N 413.493 2.482 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN4C(=O)NC[C@@H]4C3)cc2Cl)C1 800721232 YRRJIASRECFJNB-GDBMZVCRSA-N 405.930 2.495 10 20 HECD CSC[C@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449298 VEUDDHNHNFJPTE-LBPRGKRZSA-N 401.479 2.241 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nccn1-c1ccccc1 807810359 QUYUVGYFURNULQ-ZDUSSCGKSA-N 400.460 2.440 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCOc1ccc2c(c1)OCO2 916647044 GASQIJNBVMDPLJ-UHFFFAOYSA-N 413.474 2.472 10 20 HECD O=C(Nc1ccc(-n2nccn2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294329 FSZYWIRCEKIWDM-LJQANCHMSA-N 421.457 2.119 10 20 HECD Cc1cc(C)n([C@H](C)CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 918337517 LUTIDHOJYRZASP-QGZVFWFLSA-N 404.536 2.002 10 20 HECD Cc1ccc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918464776 ZVATXPCSVJUADE-MRXNPFEDSA-N 412.465 2.091 10 20 HECD COC(=O)CC1CCN(Cc2cc(C(C)=O)cc(CN3CCOCC3)c2O)CC1 918734078 UHTVDZKCUYKOGU-UHFFFAOYSA-N 404.507 2.202 10 20 HECD COc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 919792289 UUBREVLXHZKTNK-UHFFFAOYSA-N 400.435 2.439 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)C2CCCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807990896 KSECUKQMXFYCHY-JXFKEZNVSA-N 410.474 2.398 10 20 HECD CCn1nccc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500955 IJBYJTUDGOTKMW-UHFFFAOYSA-N 404.854 2.098 10 20 HECD O=C(C1CCC(O)CC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502381 RESAVNDZWBGANZ-UHFFFAOYSA-N 408.882 2.119 10 20 HECD Cc1cc(C(=O)Nc2ccccc2C(=O)NCCC(N)=O)c(C)n1-c1ccccn1 111181565 RETYNEIDKRVYOZ-UHFFFAOYSA-N 405.458 2.347 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 525212893 WRBVTQOKYUQYPP-UHFFFAOYSA-N 421.431 2.020 10 20 HECD COc1ccc(N2CCC(NC(=O)CNC(=O)c3cc(F)cc(F)c3)CC2)cc1 726627399 JCWLXZGJWIALDX-UHFFFAOYSA-N 403.429 2.488 10 20 HECD COC(=O)c1ccc(F)cc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 727443654 BVJBQQQTRUUJOX-UHFFFAOYSA-N 422.478 2.270 10 20 HECD CC(C)(C)CN(CCCO)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 730121137 HWRUPQZYRPXWOA-SFHVURJKSA-N 404.555 2.328 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H](O)C(C)(C)C)cc2F)C[C@@H](C)O1 732715847 LBULGJJJXNWTHL-LPMFXHHGSA-N 410.486 2.006 10 20 HECD CN(C)S(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)o1 735518205 HHSXAGOHQDYJAZ-OAHLLOKOSA-N 408.476 2.057 10 20 HECD Cc1ccnc2nc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nn12 742799906 NJMPFHDDGSTTFN-CYBMUJFWSA-N 402.405 2.433 10 20 HECD CNC(=O)[C@H](C)CN(C)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 748282389 MMJKSPFDTVRXLB-SSDOTTSWSA-N 405.205 2.092 10 20 HECD CCN1CCN(CCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 750872481 MUZXUSWIUPKTOC-QZTJIDSGSA-N 406.546 2.083 10 20 HECD NS(=O)(=O)c1ccc(CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 751294967 VCVLBMCCAJSJOF-SFHVURJKSA-N 418.515 2.180 10 20 HECD CCN1CCN(c2ccc(NS(=O)(=O)c3cccc4nonc34)c(C)c2)CC1 753923352 GSOWLIJAOSYYSP-UHFFFAOYSA-N 401.492 2.474 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@@H]3CCO[C@H](C)C3)CC2)cc(OC)c1OC 759296841 GATPXSOECYGHFG-HZPDHXFCSA-N 407.511 2.359 10 20 HECD COC(=O)c1ccsc1N1CC[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 759589929 VGCSNWOIMHVNSY-UJAVWCLSSA-N 403.412 2.308 10 20 HECD CCN1CCC[C@@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 760124147 WITMTUNRAIXUTO-MRXNPFEDSA-N 406.527 2.028 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H]3[C@@H](CCCN3C)C2)c1 765105762 KUUDMXIDLWEAHE-AVRDEDQJSA-N 401.551 2.343 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1CC(C)C 766575755 GJEDRRNCZVQLIA-UHFFFAOYSA-N 417.485 2.078 10 20 HECD COc1ccc(N2CCC(Nc3cc([N+](=O)[O-])ccc3S(N)(=O)=O)CC2)cc1 769355451 AOFPPZUTMSGENF-UHFFFAOYSA-N 406.464 2.332 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3cnc(Cl)n3C)cc2F)C[C@@H](C)O1 769394221 CXPUPNKGUNULNV-VXGBXAGGSA-N 416.906 2.305 10 20 HECD COC(=O)CC[C@H](Cc1ccccc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 770151513 VPDKODGZLFMHEV-OAHLLOKOSA-N 420.487 2.058 10 20 HECD C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 771404437 JBFRSNQCTIBNEF-OLZOCXBDSA-N 409.533 2.419 10 20 HECD C[C@@H](NC(=O)NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(N(C)C)cc1 773615946 ZXDQSRXJSRMUCG-CJNGLKHVSA-N 411.549 2.009 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@@H](CNC(=O)OC(C)(C)C)C1 776150702 SEXNKTHLVSRPPA-SFHVURJKSA-N 406.527 2.496 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc(N(C)C)cc1 785401220 WYOOXWHDDLNXPF-HOTGVXAUSA-N 406.490 2.388 10 20 HECD C[C@H]1OCC[C@]12CN(CC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CCO2 791584505 HKSRRPMVOWIWQQ-MYYSRTQBSA-N 420.465 2.280 10 20 HECD Cc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nnn1Cc1ccncc1 795592458 KJWVXWRLZCQQPN-MRXNPFEDSA-N 406.490 2.357 10 20 HECD C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@]2(CCOC2)O1 796559900 FZVSVMAZPQWMDP-MYYSRTQBSA-N 420.465 2.280 10 20 HECD COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 801687396 RBYISUPAAFCQCC-UHFFFAOYSA-N 424.544 2.177 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](Cn2cccn2)c2ccccc2)cc1F 803658685 BVCBQINQQGLCDE-IBGZPJMESA-N 409.465 2.262 10 20 HECD C[C@H](NC(=O)C(=O)N1CCC([C@@](C)(O)C(F)(F)F)CC1)c1ccc(N(C)C)cc1 807673552 VORGMLUZWXKMLR-ORAYPTAESA-N 415.456 2.482 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C 810400394 JBYCSLVVTCAEEE-JTQLQIEISA-N 404.394 2.018 10 20 HECD CN(C)c1noc(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 812024936 XSWMLNXDZWFODK-UHFFFAOYSA-N 410.425 2.205 10 20 HECD CC(C)OCCONC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 812805235 YNECJRGBMIKCPS-UHFFFAOYSA-N 400.478 2.341 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCCn2nc3n(c2=O)CCCC3)cc1 916649821 JQMKVKPIXYHCSY-UHFFFAOYSA-N 414.554 2.459 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(Cn2cncn2)c1 918264299 AYXKVWVAQTXYKW-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cn(Cc2ccccc2)nn1 919968544 FEBZJTFUPPZWQK-UHFFFAOYSA-N 405.502 2.465 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1 920482816 ZHMOFDLEIMTUCU-UHFFFAOYSA-N 416.452 2.476 10 20 HECD CC1=S=C(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)C=C1CS(C)(=O)=O 471902106 XQXWPPAJGJAVGO-UHFFFAOYSA-N 405.457 2.164 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(c4cnn(C)c4)C3=O)ccc21 522737349 JLDMGIAIYYETLB-IBGZPJMESA-N 409.490 2.173 10 20 HECD NC(=O)[C@H]1CC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NN1c1ccccc1 731858010 INAGFSJYEPLTBT-AZUAARDMSA-N 422.485 2.020 10 20 HECD CCCNC(=O)CCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 732352829 PJVXEUROAMFFJX-UHFFFAOYSA-N 422.437 2.250 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H](O)C(C)(C)C)cc2F)C[C@@H](C)O1 732715843 LBULGJJJXNWTHL-BIENJYKASA-N 410.486 2.006 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2)c1 734016423 PXRJBGUQBWRQBB-QGZVFWFLSA-N 424.544 2.117 10 20 HECD NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)cc1 735509585 BZISROFXTVWEKT-UHFFFAOYSA-N 407.518 2.418 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(N2CCNC2=O)ccc1F 737779259 BCEXOVYULMNWPE-UHFFFAOYSA-N 412.465 2.464 10 20 HECD O=S1(=O)CCN(c2cccc(NS(=O)(=O)c3cc(F)c(F)cc3F)c2)CC1 751213097 OOXUAMUQQGZXRX-UHFFFAOYSA-N 420.434 2.140 10 20 HECD CNC(=O)C1(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCCC1 751239563 UGFLBXLMZNOMBP-UHFFFAOYSA-N 421.409 2.159 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 752096928 MODBUEXZXNOVLH-UHFFFAOYSA-N 424.501 2.034 10 20 HECD COC(=O)c1csc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 770257692 QWHNIRBCSSACPD-UHFFFAOYSA-N 417.487 2.221 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2cnnn2)cc1 771057391 ITLMHMMYXBAYOI-KRWDZBQOSA-N 412.881 2.416 10 20 HECD COc1ccc(N2CCN(Cn3nnc4sc(C)c(C)c4c3=O)CC2)cc1F 771168342 CQPAZSHNFONNOE-UHFFFAOYSA-N 403.483 2.397 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)cc1 772471580 LBURLOPZVOLNTD-SFHVURJKSA-N 408.502 2.391 10 20 HECD C[C@H](NCC(=O)N1CCN(Cc2ccco2)CC1)c1ccc(N2CCOCC2)cc1 775253781 FEVIEJMVCYCXEL-IBGZPJMESA-N 412.534 2.111 10 20 HECD CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NCc1ccc(N3CCOCC3)c(F)c1)CC2 776118934 WVDOOYWZTRIOTM-VQTJNVASSA-N 421.513 2.124 10 20 HECD CC(C)CS(=O)(=O)N1CCC(NCc2ccc(N3CCOCC3)c(F)c2)CC1 776957673 FKQRZYLTZHKGJE-UHFFFAOYSA-N 413.559 2.202 10 20 HECD C[C@H](OC(=O)c1ccncn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778454255 FHXZNKXPKOLVHW-LBPRGKRZSA-N 401.378 2.436 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1 779475840 MEOXGYILDDFCQR-SOFGYWHQSA-N 422.890 2.298 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(NS(=O)(=O)c2cccs2)CC1 779476653 UDYBHPQYWAMGDO-GQCTYLIASA-N 408.501 2.142 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@]34CCOC4=O)cc2F)C[C@@H](C)O1 779531060 WHISKZLMWAVFEQ-ZSDSOXJFSA-N 405.470 2.430 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCN(C(C)C)C(=O)C2)c([N+](=O)[O-])c1Br 779930893 RYTCRRJAMXMEIV-UHFFFAOYSA-N 417.216 2.331 10 20 HECD COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 781523610 NIILKFUKNYDDCZ-UHFFFAOYSA-N 412.442 2.321 10 20 HECD CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)OCC(=O)c1ccc(O)c(O)c1 784589864 VHSBRHPWUXLHGV-UHFFFAOYSA-N 423.368 2.083 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F 785297545 PMFACHRAVLXXMD-LBPRGKRZSA-N 415.421 2.050 10 20 HECD CCCN(C)S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 795249436 UNGXNCCBCNSDCM-KRWDZBQOSA-N 414.572 2.495 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c(O)c1 797390505 HNQOUMDJDMDXAQ-UHFFFAOYSA-N 415.446 2.290 10 20 HECD Cc1cccc(CN2CCN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)c1 803663998 DIFBDGNGSDEPPU-UHFFFAOYSA-N 412.509 2.161 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 804117478 BYCZNYVFPKRXJL-IBGZPJMESA-N 420.513 2.083 10 20 HECD COc1cccc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)cc3C)CCO2)c1 807100351 LQTZAVWXJRTFNR-NRFANRHFSA-N 411.502 2.286 10 20 HECD Cc1nc2ccc(NC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cn2n1 809896114 DVVJIRRZVMYVSY-INIZCTEOSA-N 407.478 2.061 10 20 HECD COc1ccc(N2CCN(CCCNC3CCC(CS(C)(=O)=O)CC3)CC2)cc1 815554781 IRBVHINLCTTXED-UHFFFAOYSA-N 423.623 2.400 10 20 HECD CN(C)C(=O)c1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918214534 YBNXDUNIBXDDGY-UHFFFAOYSA-N 414.481 2.364 10 20 HECD CCNC(=O)c1cccc(NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 918461575 GMCVSAAWZFMIKO-UHFFFAOYSA-N 424.501 2.122 10 20 HECD CCc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918466056 XRTOLRLQPSBQIT-SFHVURJKSA-N 408.502 2.206 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)c1 920037537 MUGOZJYIGVRLEO-UHFFFAOYSA-N 423.535 2.065 10 20 HECD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1341407163 QQGPVTVLMKSWRM-FQEVSTJZSA-N 423.579 2.328 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1C 1795082116 ALNYEKRZAIRQEF-BTTYYORXSA-N 418.881 2.359 10 20 HECD COc1ncccc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1842432597 NMCWJVUUBIUEFA-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCC(F)(F)F)C1 1842803489 NZACTTJPASYBOI-HWKANZROSA-N 414.380 2.363 10 20 HECD O=C(NCCC(=O)N1CCCCC1)NCc1ccc(N2CCC(CO)CC2)cc1 195563237 QWZWQLBAYUPVKX-UHFFFAOYSA-N 402.539 2.097 10 20 HECD CCc1nnc(-c2ccc(NC(=O)C3=S=C([S@](=N)(=O)O)C(OC)=C3)cc2)o1 447430169 FEKXEKDXHXRPAU-UHFFFAOYSA-N 408.461 2.337 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1 729279042 YPZISCZMPMBQIZ-SWLSCSKDSA-N 410.517 2.493 10 20 HECD CC(=O)N1CCC(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 729497620 WTRLWQZOQKSXRB-IYBDPMFKSA-N 420.529 2.497 10 20 HECD COC(=O)c1ccc2c(c1)CN(CC(=O)N1CCN(c3ccc(OC)cc3)CC1)C2 730260112 AAIBKHKKZWRCGJ-UHFFFAOYSA-N 409.486 2.146 10 20 HECD COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741090693 LVGAMONPGRQIDY-MJGOQNOKSA-N 400.523 2.136 10 20 HECD COc1ccc(N2CCCN(C(=O)CCN3CCN(c4ccccn4)CC3)CC2)cc1 741145813 NBZBVMMMPRDTMI-UHFFFAOYSA-N 423.561 2.341 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](c3ccco3)N(C)C)CC2)cc1 743363687 VSYQSPMUKHPXNL-HXUWFJFHSA-N 415.538 2.012 10 20 HECD COc1cc(N2CCN(C(=S)NCC(C)(C)CN(C)C)CC2)cc(OC)c1OC 758922520 OTXVWCGNVONHHC-UHFFFAOYSA-N 424.611 2.297 10 20 HECD CCCCS(=O)(=O)NCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 761129475 JJCFPTKWAYENTI-AWEZNQCLSA-N 419.494 2.093 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)cc1F 762462672 WFGYLCGCJNXNKR-UHFFFAOYSA-N 400.406 2.452 10 20 HECD NC(=O)c1cc(N2CCCCC2)ccc1NS(=O)(=O)c1cccc2nonc12 766322891 VVQJFIMJFPUCQT-UHFFFAOYSA-N 401.448 2.113 10 20 HECD C[C@H](CN1CCOCC1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 767173982 PTNGIJWAMFPYNG-OAHLLOKOSA-N 415.456 2.127 10 20 HECD Cc1nn(C)c(N2CCOCC2)c1CN(Cc1ccccc1O)C[C@@H]1CCCO1 768161487 FTJIWSUROGRKGH-IBGZPJMESA-N 400.523 2.452 10 20 HECD COc1cccc(CNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1O 769495859 PESXQMYABKDMHZ-UHFFFAOYSA-N 410.386 2.093 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCN(C)S(=O)(=O)c1cccs1 772015317 HGTZODLFTJUDCJ-UHFFFAOYSA-N 410.565 2.276 10 20 HECD Cc1ccc(S(=O)(=O)NCCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1C 773760530 ARNDZVVIUDHETC-HNNXBMFYSA-N 406.504 2.130 10 20 HECD CCO[C@@H]1COCC[C@H]1NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 776482482 OODOEBNGPBGYBN-IEBWSBKVSA-N 408.454 2.184 10 20 HECD COc1cccc(C(=O)N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1OC 779506598 QNCYJKICVYGBRJ-VQHVLOKHSA-N 412.442 2.113 10 20 HECD Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 786225176 OQFSQKBVDSRPGA-NHCUHLMSSA-N 424.545 2.100 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccccc1CN1CCCC1=O 787430209 HZJRCRYCYSMTSE-UHFFFAOYSA-N 422.529 2.150 10 20 HECD CC(C)CCCNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 787614047 SBEUKTVFRVJYGF-UHFFFAOYSA-N 400.567 2.387 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2nc(O)c3ccccc3n2)cc1 788955142 SETSHDHMSDIEFD-UHFFFAOYSA-N 421.501 2.456 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CCO1 789854799 DOPCZJRAKMMVFU-IAGOWNOFSA-N 405.564 2.177 10 20 HECD CSc1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 792702708 XTLHGNXFQWQTJS-UHFFFAOYSA-N 414.530 2.356 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c(OC)c1 793864186 KXTYDOCLEBSOOG-UHFFFAOYSA-N 409.486 2.055 10 20 HECD CN(C)C(=O)CCCOC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 795546544 PZEMGSWIKUJRCX-UHFFFAOYSA-N 412.489 2.280 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc1 797431393 NRUGXNGEIPLFHE-UHFFFAOYSA-N 409.411 2.382 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](NC(=O)C3CC3)[C@@H](C)O)cc2Cl)C1 800570317 KPLLSXHQGGTWFJ-PJIJBLCYSA-N 407.942 2.468 10 20 HECD CNC(=O)C1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 800744823 VRAJMENJCULDRG-AWEZNQCLSA-N 419.481 2.247 10 20 HECD CCC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(N)=O 804808790 KXWWPHVDLSRRMD-CVCOIXHCSA-N 411.574 2.500 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1F 804851398 AVKGZJNQPITYOR-QGZVFWFLSA-N 421.513 2.480 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](c3ccnn3C)C2)cc1F 804853335 ONRNSWLRCSZVOZ-QGZVFWFLSA-N 415.513 2.428 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 805008851 ILFHSTPLSAPFHC-CQSZACIVSA-N 411.505 2.177 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)CCSC)cc2F)CC1 805009554 LVUYECMGUWLDLX-INIZCTEOSA-N 424.586 2.184 10 20 HECD CC(C)N1CC[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)C1=O 806261017 OLGFYJNVOIZYEQ-GOSISDBHSA-N 401.507 2.179 10 20 HECD CN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccccc1 807289376 RSHUFJJFPYRHRH-VXKWHMMOSA-N 404.514 2.241 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CSc3nnnn3C3CC3)cc2F)C[C@@H](C)O1 917203862 JIBIKNAUFINKBG-BETUJISGSA-N 420.514 2.169 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 920926939 SPKWIGWGDBVJFM-INIZCTEOSA-N 424.501 2.041 10 20 HECD C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC[C@@H](CC(N)=O)C1 1319326775 NJVOJLZECZMDAN-CABCVRRESA-N 419.481 2.376 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(N2CCCC2=O)cc1 1323858453 AVLGBTKBFFZQGD-KRWDZBQOSA-N 412.442 2.129 10 20 HECD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)nc1 1795239541 ZCEBNLFMJOHXQB-YKMDKHMNSA-N 423.469 2.472 10 20 HECD O=C(CCN1CCCC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502573 OCMWTMHDBQDIFW-UHFFFAOYSA-N 407.898 2.054 10 20 HECD CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)c1 60750491 HWZQVLFZNZLYMV-UHFFFAOYSA-N 408.502 2.382 10 20 HECD C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(N2CCOCC2)cc1 145478493 ZEWOLDJCONRZMV-MRXNPFEDSA-N 417.531 2.265 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)CC2)cc1 726727080 ZRLRKGZRQXAZPA-UHFFFAOYSA-N 424.501 2.121 10 20 HECD COc1ccc(NC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 726727412 YPRMIOIDWNUIKH-UHFFFAOYSA-N 420.416 2.415 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCC(C(=O)NCCCO)CC3)cc2)CC1 731119957 VGFOSUAZRNGEOX-UHFFFAOYSA-N 416.566 2.343 10 20 HECD O=C(NCCS(=O)(=O)NCC1CCC1)N(Cc1ccco1)Cc1ccccc1O 731760855 DOPJZNUBMBUXSB-UHFFFAOYSA-N 421.519 2.417 10 20 HECD CN(C)c1ccc(CN(C(=O)NCCS(=O)(=O)NCC2CCC2)C2CC2)cc1 731760993 MBPIGJMPIZWFDT-UHFFFAOYSA-N 408.568 2.146 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCC[C@H](C(N)=O)C1 745830866 CIWWVIYLAACVET-IBGZPJMESA-N 403.571 2.260 10 20 HECD CN(C)c1ccc(CNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1F 746890380 NESFCVQZHLABGO-QBFSEMIESA-N 405.495 2.488 10 20 HECD Cc1cc(C(=O)COC(=O)c2ccc[nH]2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 749958616 NQFLRJZDXTUNIE-UHFFFAOYSA-N 401.444 2.109 10 20 HECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)cc1S(=O)(=O)N1CCCCC1 751150308 ASZPXIPOWWUPDS-UHFFFAOYSA-N 424.544 2.354 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCCN(c4ccccc4)CC3)CC2)cc1 754014752 NZSCEYZXMXDPDF-XMMPIXPASA-N 424.589 2.390 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 754450608 JCHAZPMUTKLFDQ-UHFFFAOYSA-N 414.510 2.082 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCN(c4ncccc4F)C3)CC2)cc1F 755304452 VQQKXRAPRSMHFK-OAHLLOKOSA-N 417.460 2.479 10 20 HECD CCOC(=O)[C@H]1CCCN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)C1 756326922 LSADWMYEIUOXNU-OALUTQOASA-N 404.507 2.175 10 20 HECD C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NCc1cccc(Br)c1O 765731947 NFZXMQHOOCWHOF-IBGZPJMESA-N 419.275 2.178 10 20 HECD COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1F 770719751 OTGJMOWRHSMFPZ-UHFFFAOYSA-N 405.401 2.065 10 20 HECD COc1ccc(N2CCC(NC(=O)NC(C)(C)CCN3CCN(C)CC3)CC2)cc1 771316491 OXESGXUXWXJNHL-UHFFFAOYSA-N 417.598 2.379 10 20 HECD CS(=O)(=O)Nc1ccc(OCCNCc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 773424604 BFYWJODVJAXIPT-UHFFFAOYSA-N 415.855 2.494 10 20 HECD Cc1noc(C)c1CNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 774152364 FEWDNDGWQNYEAT-UHFFFAOYSA-N 422.432 2.294 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1 774246732 KAYBGFFDAUZPKM-MUUNZHRXSA-N 416.377 2.283 10 20 HECD CCCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CCS(=O)(=O)C1 776039937 YVXAOUOCDLPQNQ-LPHOPBHVSA-N 409.552 2.193 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN(C)C(=O)c1cccs1 777828526 KQJXORIBGSQEMW-UHFFFAOYSA-N 410.879 2.381 10 20 HECD COC(=O)c1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)sc(C)c1C 785305328 XJIYDGXYRLGFFR-SECBINFHSA-N 406.460 2.249 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@H](C)C(C)(C)C)CC2)cc1 785527056 JIKPTYCYKFMVFW-GOSISDBHSA-N 418.582 2.217 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(C4OCCO4)c3)cc2)CC1 787318524 GBZKNRXZZMMLGB-UHFFFAOYSA-N 409.486 2.331 10 20 HECD CCOCCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCCC1 788314124 YUYXCEIGMBIVFZ-UHFFFAOYSA-N 417.550 2.243 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(c3ncccc3F)CC2)cc1 788955941 YLVRYYFSQGHMDR-UHFFFAOYSA-N 413.497 2.032 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3C[C@H](C)S[C@H](C)C3)cc2F)C[C@@H](C)O1 789828968 ZQQHGYSQPCTYKG-GEEKYZPCSA-N 423.554 2.408 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCCC12CCOCC2 789863444 GZJOENGSQUMOHF-IBGZPJMESA-N 417.575 2.322 10 20 HECD CCOc1nc(C)ccc1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 791653431 YLTCBXOOGIPXPA-UHFFFAOYSA-N 413.474 2.303 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc4ccccc4c(=O)o3)nc12 797478333 JTXLSOBJOBKIIX-UHFFFAOYSA-N 409.354 2.075 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)Cn3ncn4nccc4c3=O)cc2Cl)C1 800049040 LEAKNGYVZXITHM-AWEZNQCLSA-N 414.897 2.097 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@@H]1CCOc2ccccc21 804082392 NYKBKVKZCGRDSE-IBGZPJMESA-N 423.513 2.164 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)c3ncc(C)s3)CC2)cc1 804315685 PYGWGIJDJDHBLK-CQSZACIVSA-N 402.520 2.423 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)c3ccco3)cc2F)CC1 805007029 DEGPTXDHNQEDTI-INIZCTEOSA-N 416.497 2.396 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCO[C@H](COC(C)C)C3)cc2)CC1 805026000 YPOWFECPMYJRCY-NRFANRHFSA-N 417.550 2.192 10 20 HECD C[C@@H](OC(=O)[C@@](C)(O)C1CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 805581068 UAJLYZNMJQOVCI-SPSFWMDKSA-N 407.422 2.493 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCc2cn3cccc(C)c3n2)cc1 806538110 WLYCKPPWSJNTMR-UHFFFAOYSA-N 407.518 2.464 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(CC2CCCCC2)CC1 807287666 LVHSHTPJBUOQJP-UHFFFAOYSA-N 410.562 2.404 10 20 HECD Cc1ccn2c(=O)c(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cnc2c1 919969108 WOTQIHRUEJLNEV-UHFFFAOYSA-N 406.486 2.142 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)c1ccc2c(c1)OCO2 1324540359 GQYRGDGNAYITOR-WFASDCNBSA-N 401.415 2.221 10 20 HECD COc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796602872 WHMCWCUCGNJZDO-KXXXJKOBSA-N 423.469 2.467 10 20 HECD O=C(Cc1ccsc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442072 UWPFPVWOFVUTKH-UHFFFAOYSA-N 422.510 2.287 10 20 HECD C[C@@H]1Oc2ccccc2N(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 26077611 RIVDZMYDSBAJKE-KRWDZBQOSA-N 409.486 2.296 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](C)NC(=O)C3CCCC3)cc2F)CC1 730235997 RRRQZGKUHGXXHJ-INIZCTEOSA-N 404.530 2.279 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c(OCCN(C)C)c1 739080209 LMYLUORXBLNGOH-UHFFFAOYSA-N 416.497 2.395 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CN(C)c1ncnc2[nH]cnc12 743807470 BAZWYRAFNYOKKP-UHFFFAOYSA-N 419.283 2.306 10 20 HECD CC(=O)N[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 748123015 SHQAANSDRYGVAU-ZDUSSCGKSA-N 400.431 2.116 10 20 HECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)c1 751318030 KHQXLPAUDYJDBG-CQSZACIVSA-N 420.487 2.402 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(F)c(C(=O)N(C)C)c3)CC2)cc1 753128335 ZXDREBBZNNPTDI-UHFFFAOYSA-N 414.481 2.297 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccccc3SCC(N)=O)CC2)cc1F 753739267 CAXPRUIIRDLILM-UHFFFAOYSA-N 403.479 2.374 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)[C@@H](O)C(C)C)CC2)cc1 754619835 QMYGSNPOCWCUSD-FQEVSTJZSA-N 406.571 2.160 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1 756455469 JTRBEGVBZPTUAD-CJNGLKHVSA-N 414.458 2.154 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)c3nccs3)CC2)cc1 756688559 OSGWEOAJFKLRAL-XITLMJRVSA-N 414.531 2.276 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(OCCO)CC1 757653711 HFHYMWRJEPSDGP-OAHLLOKOSA-N 413.465 2.440 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccn(Cc2ccccn2)n1 759022647 OLQFYBCWMZTIGB-UHFFFAOYSA-N 404.474 2.182 10 20 HECD O=C(NC[C@@H]1CCCS1(=O)=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765899609 WUIWJKAYMSRPFR-INIZCTEOSA-N 417.478 2.133 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)CCCN1CCOCC1 766060686 SLESRFHPSMIEAJ-UHFFFAOYSA-N 421.357 2.029 10 20 HECD Cc1cc(C)n2nc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)nc2n1 768910892 BDCLPKZQHHTCNR-MRXNPFEDSA-N 414.897 2.495 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 770230278 NCYVKQFMCNFRAJ-AWEZNQCLSA-N 422.478 2.488 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN4CCOc5cccc3c54)CC2)cc1 771466390 CJUBILLRDWHPBK-UHFFFAOYSA-N 408.502 2.063 10 20 HECD CCOc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1OCC(=O)OC 773740278 JNVUTDBQDQPYEI-ZDUSSCGKSA-N 403.431 2.409 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1 785294423 MONSPQQIBAZGBE-INIZCTEOSA-N 411.502 2.422 10 20 HECD CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295105 RJPCVGDEZFRCSE-ZDUSSCGKSA-N 424.461 2.018 10 20 HECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC2(CCCC2)O1 788323309 LQVRHQFJRCSNPM-UHFFFAOYSA-N 415.534 2.090 10 20 HECD COc1cccc(O)c1CNc1cccc(S(=O)(=O)N2CCCN(C)CC2)c1 796427052 HPUIZXADVULOOY-UHFFFAOYSA-N 405.520 2.339 10 20 HECD CN1Cc2cc(-c3csc(NS(=O)(=O)c4ccn(C)n4)n3)ccc2NC1=O 799186657 FRRCXUYXDYWWHR-UHFFFAOYSA-N 404.477 2.322 10 20 HECD C[C@](O)(CCc1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 801138399 WNDHZVBBDCCLCC-RDPSFJRHSA-N 409.530 2.388 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc1F 803381263 VSLWKIVHTALQAO-CQSZACIVSA-N 418.435 2.041 10 20 HECD COC[C@H]1CCCCN(C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1 804318756 SLDMPWXYNQPSQI-KRWDZBQOSA-N 403.523 2.055 10 20 HECD CN1CCN(C(=O)C(=O)NCCCSc2nccs2)[C@H](c2ccccc2)C1 806281941 CDKQJLWQLDSLBJ-INIZCTEOSA-N 404.561 2.257 10 20 HECD COCCn1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(=O)cc1C 806823566 XECLITVETYIIFF-SFHVURJKSA-N 400.475 2.330 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O)c1ccc(N(C)C)cc1 807673922 BQSHEYPOXNTPDQ-JXFKEZNVSA-N 414.550 2.370 10 20 HECD CC[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808854279 BCBMZNDIWCUUHS-DEOSSOPVSA-N 412.578 2.483 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)c3ccccc3F)CC2)cc1 913148086 OMQCRTQTRIXGEK-UHFFFAOYSA-N 412.509 2.356 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3nccnc3N)c2C)cc1 3568806 QGVNRLREVWESGM-UHFFFAOYSA-N 408.414 2.293 10 20 HECD Cc1cc(C(=O)COC(=O)c2nccnc2N)c(C)n1-c1ccc2c(c1)OCCO2 10072687 MBTJQCKVKISDDK-UHFFFAOYSA-N 408.414 2.277 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)ccc(C)c3N)CC2)cc1 64184687 PQXCERXWDBSDIR-UHFFFAOYSA-N 401.438 2.231 10 20 HECD COC(=O)CSCCNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 729855699 IANIDCGPQLKVJL-KBPBESRZSA-N 413.515 2.145 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(OCC(N)=O)cc2)cc1 730663576 OEFNDPFIIVWSNB-NRFANRHFSA-N 411.502 2.438 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1 734015085 YSRQFKJJYJIXPK-GOSISDBHSA-N 404.488 2.260 10 20 HECD CCN(CC)C(=O)c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 746297490 YWABAGANKXYUIH-UHFFFAOYSA-N 405.476 2.498 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 748848702 TUMLUPJMJMGDJF-CYBMUJFWSA-N 419.432 2.149 10 20 HECD O=C(CC1(N2CCOCC2)CCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405139 CKCGEXVGYRLPMJ-UHFFFAOYSA-N 419.541 2.438 10 20 HECD COc1ccccc1NC(=O)CN1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 750229564 PPAULGRHQLCBKD-UHFFFAOYSA-N 415.465 2.499 10 20 HECD COCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCCO1 752850591 KNCMVJQUBIMRBW-FQEVSTJZSA-N 415.538 2.467 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(-c2nnc(N(C)C)o2)cc1 768074226 IGRSSLGILSKEHC-UHFFFAOYSA-N 422.489 2.432 10 20 HECD COc1ccc(N2CCN(C(=O)C(C)(C)N3C(=O)c4ccccc4C3=O)CC2)cc1 769728181 NCCRZVLXCASXOJ-UHFFFAOYSA-N 407.470 2.419 10 20 HECD CC[C@@H]1CN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCS1 778297050 FVQVIOSFBYTIMB-CSHXORCISA-N 403.548 2.254 10 20 HECD COc1cccc(CNS(=O)(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1O 779627678 OMNACWCMCGSOJH-QGZVFWFLSA-N 404.488 2.125 10 20 HECD Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c(O)c1O 780862769 LPCIOVNYEUELGN-UHFFFAOYSA-N 413.474 2.332 10 20 HECD Cc1c(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cccc1-n1cnnn1 783318329 WXWMJPQMHGORJV-UHFFFAOYSA-N 421.505 2.412 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 783451587 LQGVDPPUYVGUSJ-INIZCTEOSA-N 412.398 2.022 10 20 HECD Cc1cc(O)cc(=O)n1CCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 783676093 AVBXWBQACMSJPS-KRWDZBQOSA-N 419.909 2.392 10 20 HECD NC(=O)COc1cccc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)c1 784058309 PFFAKRMUMUORDP-UHFFFAOYSA-N 410.474 2.437 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(N4CCCCC4)n3)cc2)CC1 786660090 UWOKTDKESYJFAN-UHFFFAOYSA-N 422.533 2.065 10 20 HECD COc1cc(CN(C)C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc(OC)c1 807289226 MSZRDTOPYXZDTA-UHFFFAOYSA-N 409.486 2.355 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H]1C[C@H](O)c1ccco1 807292767 YCQPCMKISCMUPC-PMACEKPBSA-N 409.486 2.387 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1cccc2c1COC2=O)c1ccc(N2CCOCC2)cc1 808922883 XTJRRJFSNIMHKW-CQSZACIVSA-N 409.442 2.010 10 20 HECD COc1cc(F)c(F)cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 810351724 RNOZDHOBJLVHLT-UHFFFAOYSA-N 419.428 2.407 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](n4cccn4)C3)cc2F)C[C@@H](C)O1 812874734 FOVSVTKQUUWEQD-LMMKCTJWSA-N 415.513 2.199 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4CN(c5ccccc5)C[C@@H]4C3)nc12 917189241 BJXGETPXIXDTLO-HOTGVXAUSA-N 407.474 2.180 10 20 HECD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 917364968 UGRVINBBVSTRIQ-QRVBRYPASA-N 414.502 2.465 10 20 HECD CNC(=O)c1cc(Cl)ccc1NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 917815154 QPBSKKGNJMSVEH-UHFFFAOYSA-N 416.909 2.469 10 20 HECD Cc1sc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)nc1-c1cccc([N+](=O)[O-])c1 917925420 MDYDJEDGXASCKE-UHFFFAOYSA-N 421.460 2.265 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-] 918284651 MLKGPVJYRRRQFD-UHFFFAOYSA-N 416.409 2.134 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(S(N)(=O)=O)c(C)c3)CC2)cc1 1324626542 DGUZJQQRSBMAKS-UHFFFAOYSA-N 403.504 2.004 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccoc2c1)c1cc(O)nc(O)c1 1796673757 XCHHIQMRYZJABF-QDMKHBRRSA-N 408.414 2.200 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)C3CCCC3)C2)CC1 1808933821 ZRMQSDWMFREQSV-UHFFFAOYSA-N 423.604 2.268 10 20 HECD O=C(c1ccns1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426706 AUMLHYRSPFEPNG-OAHLLOKOSA-N 416.503 2.496 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)/C=C/c2cnccn2)C1 1846654124 OGHTZVVKEQPFBR-NSCUHMNNSA-N 414.849 2.072 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(F)ccc3F)CC2)cc1 56966061 NJAYEDBFEFHRNJ-UHFFFAOYSA-N 411.474 2.074 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 726239764 YHNGAZKZABSAJF-UXHICEINSA-N 417.598 2.237 10 20 HECD COC(=O)CCNC(=O)c1ccc(NC(=O)NCc2cc(OC)ccc2O)cc1 734060074 OVNFNAVPJFTWKU-UHFFFAOYSA-N 401.419 2.015 10 20 HECD Cn1cc(N2CC[C@@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2=O)cn1 735584335 SNZIKDOZCSHCOP-GOSISDBHSA-N 409.446 2.236 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccccc1SCCC(N)=O 737208229 FYCLADOHXJHNMS-UHFFFAOYSA-N 414.531 2.283 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCCS1 743316690 GMIJPTJVHGIJOF-GOSISDBHSA-N 401.511 2.454 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H]1CN1CCOCC1)c1ccc(N2CCOCC2)cc1 745778331 APHBIQJTFPJDCN-NQIIRXRSSA-N 402.539 2.090 10 20 HECD COc1cccc(CNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1O 745779947 FRJIVIXYRHWMNA-SFHVURJKSA-N 413.474 2.309 10 20 HECD CN(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCS(=O)(=O)C1 745905819 NVPXZNZTZCBCKZ-DZGCQCFKSA-N 417.478 2.085 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1 746793814 IIUFYYLCOAVEAI-CYBMUJFWSA-N 413.430 2.482 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCSc3ccccn3)CC2)cc1 756736609 JPGJISLCMKQQSI-UHFFFAOYSA-N 415.515 2.464 10 20 HECD CCS(=O)(=O)N1CCC(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)CC1 757705571 PSAXDEMXFSDFGP-INIZCTEOSA-N 413.559 2.375 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCC[C@H]1N1CCOCC1 763660796 UVOSGTFOSWCDOB-FCHUYYIVSA-N 416.566 2.308 10 20 HECD CCNS(=O)(=O)c1cccc(C(=O)NCc2cccc(Br)c2O)c1 765755155 GXJYUNRFHFRILS-UHFFFAOYSA-N 413.293 2.383 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4c(cc3F)NC(=O)CC4)cc2)C1 767888799 SSJMFYWFSKZBST-MRXNPFEDSA-N 424.476 2.342 10 20 HECD CN(CCNCc1ccc(N2CCOCC2)c(F)c1)S(=O)(=O)c1cccs1 771979230 LVNVJXJQVATFIY-UHFFFAOYSA-N 413.540 2.134 10 20 HECD O=C(CN1CCC[C@H](C[C@H]2CCOC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 773703733 VIVYXRFOWMRNTO-WOJBJXKFSA-N 419.541 2.417 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 773757757 YZSJIFRMDHIUFX-ZDUSSCGKSA-N 401.419 2.204 10 20 HECD COc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1OCC(=O)NC(C)C 773764248 YRLWMLQBWGXRBA-AWEZNQCLSA-N 416.474 2.371 10 20 HECD C[C@H](NC(=O)C(=O)Nc1ccccc1CN1CCNC1=O)c1ccc(N(C)C)cc1 773859958 XSAWTFNOPYLHEN-HNNXBMFYSA-N 409.490 2.094 10 20 HECD CC[C@]1(CO)CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 779537418 SYSMFHQLTLOAQK-GCJKJVERSA-N 402.539 2.082 10 20 HECD C[C@@H](NC(=O)N1CCC(CC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)cc1 781370221 CXPKFVAXKVOQTN-QGZVFWFLSA-N 402.539 2.484 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCS1 789825509 MMGFCIJABVITME-YQQAZPJKSA-N 423.554 2.410 10 20 HECD COc1ccc(CNC(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c(O)c1 797649352 XGPUCTRSDFAKQX-UHFFFAOYSA-N 403.410 2.334 10 20 HECD COCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802470155 YHGAUPBQRKBZGU-UHFFFAOYSA-N 410.522 2.403 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(F)c(C(C)=O)c3)CC2)cc1F 806935623 VNQGXBGMYBMVML-UHFFFAOYSA-N 417.412 2.463 10 20 HECD O=C(N[C@H]1CCCOCC1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807562630 RAWMDOXLGTWWQB-GJZGRUSLSA-N 411.449 2.058 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cn(C)nc3C)n2)s1 808527971 RZQKUURJVMLKOZ-UHFFFAOYSA-N 411.534 2.350 10 20 HECD CC[C@H](O)c1nccn1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 810004547 VSLFNKJMIAWCRU-DOXZYTNZSA-N 404.486 2.396 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](CO)c4ccccc43)CC2)cc1 817783141 RLDJBCZOBZAEAF-RXQFDZFGSA-N 421.497 2.023 10 20 HECD CCCCn1nnnc1CSCC(=O)N1CCN(c2ccc(OC)cc2)CC1 913111592 DDCVMLKYEXVUMM-UHFFFAOYSA-N 404.540 2.064 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CCOCc3ccccc3)CC2)cc1 917995140 CCJZQDNRHHIJHG-UHFFFAOYSA-N 412.486 2.494 10 20 HECD Cc1nn(C)c2ncc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc12 918296481 KIYLOIXKSLWSSN-KRWDZBQOSA-N 423.473 2.129 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCc3ccc(F)cc3)CC2)cc1 920255454 XIBUGOCGHGQINX-KHPPLWFESA-N 411.477 2.398 10 20 HECD C[C@@H](NC(=O)Nc1cccc(N2C(=O)CNC2=O)c1)c1ccc(N2CCOCC2)cc1 920871422 KEXXWPCHJJRTMQ-OAHLLOKOSA-N 423.473 2.462 10 20 HECD CC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)CC1 1790242215 VYMOQXJOSBSMSH-RBOXIYTFSA-N 408.882 2.145 10 20 HECD Cc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)n1 1796597464 DGQNVIVDOWXFOI-KXXXJKOBSA-N 408.458 2.161 10 20 HECD C[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC1 1803222837 JIARAVYPKFDNBT-JHJNDJDLSA-N 423.604 2.311 10 20 HECD COc1ccc(N2CCN(CC(=O)N3CCN(c4ccccc4F)CC3)CC2)cc1 7354623 SGQIZAGLUSDVEB-UHFFFAOYSA-N 412.509 2.305 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cc2c(cc1F)NC(=O)CC2 542930294 MQRHQWVMBMFQQI-UHFFFAOYSA-N 405.451 2.364 10 20 HECD Cc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 726976569 NSSQBZWELBMCCU-UHFFFAOYSA-N 408.545 2.017 10 20 HECD CS(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731844185 BKDGWQXHALTUEW-GOSISDBHSA-N 418.515 2.415 10 20 HECD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCCCSc1nccs1 733974897 PBTGCTFDFOKTPK-UHFFFAOYSA-N 409.493 2.149 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1 737133660 BTISLMGTOHFCJB-UHFFFAOYSA-N 413.455 2.185 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccccc2Br)c1 747216886 BQIIRXHKUDYGDH-UHFFFAOYSA-N 413.293 2.499 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](c4ccccc4)C3)CC2)cc1 754010306 OURHIOKPAIBGHQ-LADGPHEKSA-N 411.546 2.252 10 20 HECD O=C1Cc2cc(S(=O)(=O)NCCCSc3nccs3)cc3c2N1CCC3 765114661 YWFJBIXMLVNWFS-UHFFFAOYSA-N 409.558 2.439 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](CCO)C1 765230801 NKXKDGSFJALCEH-ZDUSSCGKSA-N 410.517 2.489 10 20 HECD O=S(=O)(c1ccccc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768153142 UGVGYGFNXDFTEZ-UHFFFAOYSA-N 401.532 2.030 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@H]3CCCCO3)cc2F)C[C@@H](C)O1 772317692 GCWBERIKRFCPDC-SPYBWZPUSA-N 408.470 2.168 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)ccc21 773028200 YPABPFGVJXGEAK-OAHLLOKOSA-N 408.502 2.269 10 20 HECD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)n1 774162124 CMHQODFAZAEERM-CYBMUJFWSA-N 418.881 2.396 10 20 HECD C[C@H](NC[C@@H]1CCC[C@@]12NC(=O)N(C)C2=O)c1ccc(N2CCOCC2)c(F)c1 777126323 VEOGIVSDOXQAQZ-WDUKFBBWSA-N 404.486 2.033 10 20 HECD COC(=O)CN(Cc1cc(OC)cc(OC)c1)C(=O)/C=C\c1ccc(O)c(O)c1 779511666 VOTHZQFCOMZZRI-ALCCZGGFSA-N 401.415 2.330 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C)c(S(C)(=O)=O)c3)c2)CC1 781045592 LLUMCYNMYBUSBI-UHFFFAOYSA-N 415.515 2.319 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccc(NC(=O)COC)c1 787094578 XHBMSIDUCUIPKH-UHFFFAOYSA-N 413.474 2.032 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1 789462523 GZEATRFPJMBTSE-GFCCVEGCSA-N 415.446 2.103 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnnn3-c3cccc(F)c3)cc2)C1 789906030 XAVFRQUPALVJDD-INIZCTEOSA-N 422.464 2.038 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cccnc3OC(C)C)CC2)cc1 792837252 ISLVAYACRPNTDZ-UHFFFAOYSA-N 413.474 2.383 10 20 HECD CNC(=O)[C@]1(C)CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 797525805 SENRZQDAAKHPRR-JBEBIEQOSA-N 419.481 2.247 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCCCSc2nccs2)cc1OC 798437457 HQHHRJISPHMQKU-UHFFFAOYSA-N 402.519 2.399 10 20 HECD COC(=O)c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc1 799204729 QIHQTSMBHIBBSR-DTQAZKPQSA-N 406.529 2.397 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 802610389 XABKAKHWRRVIAG-UHFFFAOYSA-N 424.501 2.096 10 20 HECD C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 804269038 SVGKDQPGMBDUAY-YJBOKZPZSA-N 418.538 2.446 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@H]3c3cc(C)on3)CC2)cc1 804316635 GXCWFKDHHAHTEP-FQEVSTJZSA-N 412.490 2.440 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN3CCCCC3=O)cc2)CC1 804775276 BIACLYCVVIJKEU-UHFFFAOYSA-N 414.550 2.058 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@H](C)CCC3CC3)cc2F)CC1 805007304 PWZXOBJHGYTKAE-MRXNPFEDSA-N 404.530 2.279 10 20 HECD O=C(NC[C@H]1CCCS1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806917936 RHJBOERVRQIHEE-XJKSGUPXSA-N 413.490 2.385 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)cc1 807385910 UJPPMHUNXLKOQK-UHFFFAOYSA-N 407.220 2.196 10 20 HECD Cc1cc(CCNC(=O)C(=O)Nc2cccc(C(N)=O)c2)c(C)n1-c1ccccc1 915749713 YJVRONYXNXKHOA-UHFFFAOYSA-N 404.470 2.490 10 20 HECD O=C(COc1ccccc1Cl)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 916676315 GQLXIEIILMBMSU-UHFFFAOYSA-N 408.907 2.270 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccccc3C(=O)N(C)C)CC2)cc1 918461475 DUOBKOAAGUQEHT-UHFFFAOYSA-N 424.501 2.074 10 20 HECD CCOc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 919662028 DYYUZZIODRZWJK-QGZVFWFLSA-N 424.501 2.042 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(F)ccc1NS(C)(=O)=O 920436380 ILMBCKZIKAMWDS-UHFFFAOYSA-N 421.494 2.306 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 920919861 CVRLXBVAVRNZJF-NQIIRXRSSA-N 404.555 2.240 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(OC)c(OC)c(OC)c1 1320270975 BQTQBNVOVWSHEB-AWEZNQCLSA-N 419.430 2.028 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 1321703268 WGJXVCKEBXLZIP-SHSWAGTRSA-N 417.380 2.044 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc3n(n2)CCC3)C1 1844109895 JGWDXOGDJYGOTM-UHFFFAOYSA-N 416.865 2.025 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)cc1 728949133 NTPCGJXAZINSMG-QGZVFWFLSA-N 401.555 2.027 10 20 HECD C[C@H](c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1)N1CCOCC1 729537372 CBQPVMUFNUHECH-CQSZACIVSA-N 419.503 2.409 10 20 HECD Cc1ccc(C(=O)NCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 732247567 IGUDFQNWRQJUFR-UHFFFAOYSA-N 410.518 2.403 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@@H]3CCCc4ccccc43)nc12 733895133 RSHJYAPGPCLADO-LJQANCHMSA-N 410.474 2.484 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](CO)c1c(F)cccc1F 734659677 CVRFLHHQPVSTAP-KRWDZBQOSA-N 409.408 2.473 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccnc(N4CCCC4)n3)CC2)cc1 739493518 IAKFRPXKFFUEQK-UHFFFAOYSA-N 424.549 2.028 10 20 HECD CS(=O)(=O)Cc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739767361 APTRJWCRBHFJEQ-UHFFFAOYSA-N 415.515 2.185 10 20 HECD Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097860 ZKMVCHGHLMIAQW-UHFFFAOYSA-N 402.458 2.113 10 20 HECD NC(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)c1 745593325 QHRMLANGXKSEGI-UHFFFAOYSA-N 414.531 2.103 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1 746396476 RTRBTQGQSLUOGL-LBPRGKRZSA-N 409.446 2.321 10 20 HECD COCCn1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1=O 750874534 LJUOQFUUJCNXAD-NRFANRHFSA-N 413.518 2.382 10 20 HECD Cn1ncc2c(O)nc(CCC(=O)Nc3c(-c4ccccn4)nc4ccccn34)nc21 751307114 FKTXEISZGJEQIU-UHFFFAOYSA-N 414.429 2.350 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1F 754039906 FVVPDNCGDITEEQ-UHFFFAOYSA-N 408.451 2.116 10 20 HECD O=C(CN1CCO[C@@H]([C@H]2CCCO2)C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 756898829 ZHJSLUGOUDHBKM-WOJBJXKFSA-N 420.465 2.280 10 20 HECD CCn1c(COC(=O)c2cccc(O)c2O)nc2cc(S(=O)(=O)N(C)C)ccc21 758547859 NUNZRJUISRMUSK-UHFFFAOYSA-N 419.459 2.075 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN(C)CCN3CCCC3)cc2F)C[C@@H](C)O1 760834288 WLBPADNOMNAULG-QZTJIDSGSA-N 406.546 2.083 10 20 HECD CON(C)C(=O)[C@H](CCSC)NC(=O)NCc1cccc(Br)c1O 764798464 SYXIPBPHXYBKRU-LBPRGKRZSA-N 420.329 2.095 10 20 HECD CCC[C@@H]1C(=O)NCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 766256009 HDZASEADODQJJV-LJQANCHMSA-N 405.454 2.001 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](CO)Cc1ccc(F)cc1 766762648 FNLWHHCMBJQYRV-GOSISDBHSA-N 405.445 2.204 10 20 HECD COC(=O)C1(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 766835093 SZKFTERWJOAMPO-GFCCVEGCSA-N 421.405 2.285 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3coc(C4CCOCC4)n3)cc2)CC1 768260014 KDXZOSPRORZRCX-UHFFFAOYSA-N 412.490 2.167 10 20 HECD C[C@H]1CCCCN1C(=O)CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 768299932 OEVQOEGZIHRAIK-IBGZPJMESA-N 418.557 2.181 10 20 HECD CN1CCN(c2ccc(CN[C@H]3CC(=O)N(CCOc4ccccc4)C3)cc2)CC1 771843100 RLSRLWLZVDOELX-NRFANRHFSA-N 408.546 2.208 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)cc1 772353016 AYNANHJKMYYPOT-UHFFFAOYSA-N 423.560 2.016 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(CS(=O)(=O)NC(C)C)cc2)c1O 775013347 NIJNASSRYROIFL-UHFFFAOYSA-N 423.491 2.427 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCCNS(=O)(=O)c2cc(C)sc2C)c1O 775031109 BWCYDHXNTCSSIG-UHFFFAOYSA-N 415.493 2.055 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cccc(C)c3O)CC2)cc1 775642807 HTBJUXTVDOPDFL-UHFFFAOYSA-N 418.515 2.384 10 20 HECD C[C@H](O)CN1CCN(Cc2cc(Br)cc(Br)c2O)CC1 775675990 IIVJLRMSTGJHRV-JTQLQIEISA-N 408.134 2.416 10 20 HECD COC(=O)c1cc(Br)c(S(=O)(=O)NCc2ccccc2O)s1 777961114 GECVMQKXQAADQS-UHFFFAOYSA-N 406.279 2.481 10 20 HECD COc1cc(OC)cc(N2CC[C@H](N(C)C(=O)/C=C/c3ccc(O)c(O)c3)C2=O)c1 779529558 DZECAWPOVXVJCB-FZMUQLTDSA-N 412.442 2.392 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cnc3N)cc2F)C[C@H](C)O1 782165973 GIQICOAITQEAMS-RYUDHWBXSA-N 403.414 2.255 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)c1 787831985 JLTLZJHUOVLLMV-OAHLLOKOSA-N 402.831 2.020 10 20 HECD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@H]1CCN(c2ccccc2)C1=O 788912817 ZCNCKPVHHXZFLP-NRFANRHFSA-N 420.513 2.167 10 20 HECD Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 789557859 GOCRQHUNAUWNTI-UHFFFAOYSA-N 419.485 2.272 10 20 HECD CCCN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 789862575 WRYMVVZLFCKAMO-IBGZPJMESA-N 418.607 2.046 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C)c3nnnn3C3CC3)cc2F)C[C@@H](C)O1 790220134 UAPMLWHDKXQOSR-MGPQQGTHSA-N 417.489 2.321 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4ccccc4c(=O)n3C)cc2)CC1 803161519 CWHBTAYEMKDEJW-UHFFFAOYSA-N 418.497 2.137 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@H]1CCc2ccccc2OC1)c1ccc(N2CCOCC2)cc1 803309224 RVRGEJSJBKDHFT-XLIONFOSSA-N 423.513 2.210 10 20 HECD CC[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1nnc2n1CCCCC2 804101766 QLVHJFUGSNKZNP-ZDUSSCGKSA-N 422.580 2.327 10 20 HECD Cc1ncsc1CNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804620377 NCOKSKSJVGDTDO-CYBMUJFWSA-N 424.473 2.454 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1COC2(CCCCCC2)O1 806281983 DGWQTXVHTMAZPX-AWEZNQCLSA-N 413.565 2.324 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H](C)Cc3c(C)noc3C)CC2)cc1 807309937 WBUKRJWZEVSCHW-OAHLLOKOSA-N 414.506 2.086 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCCN(C2CCC2)C1 808022299 IZXNGAQMAZZDDE-IEBWSBKVSA-N 400.567 2.480 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)cc3)cc2)CC1 813532033 QNZMLJQGKKFVPZ-FQEVSTJZSA-N 401.894 2.358 10 20 HECD CN(C)C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c3nonc23)c2ccccc2O1 814385776 HSZBHTAEDMZKEZ-NSHDSACASA-N 408.867 2.394 10 20 HECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 915779133 VJYCVHPHIPLGJM-UHFFFAOYSA-N 421.545 2.294 10 20 HECD COc1cc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc(C(=O)O)c1OC 917884863 OPFWMKKHEQYOAT-UHFFFAOYSA-N 420.487 2.481 10 20 HECD O=C(NCCCOC[C@H]1CCCO1)NCc1ccc(N2CCC(CO)CC2)cc1 918196897 HXIKOUWZUVKJPE-OAQYLSRUSA-N 405.539 2.280 10 20 HECD Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918372821 QEYDXORBYWXGOS-LJQANCHMSA-N 422.529 2.051 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc1 918428939 DAPXGDNOGYAYFZ-UHFFFAOYSA-N 421.494 2.330 10 20 HECD Cc1ncnc(O)c1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1317921149 STINNCYGFPJBNR-OKILXGFUSA-N 402.470 2.492 10 20 HECD Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808752161 VSMAXDVMGBBWFZ-YWZLYKJASA-N 421.457 2.158 10 20 HECD C[C@H](Sc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249134 ZYWKBKBUAWRTRG-AWEZNQCLSA-N 413.499 2.491 10 20 HECD COc1cccc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1844912238 XEEWEPRBSCCKGZ-VQHVLOKHSA-N 424.453 2.342 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCCN(c2nccs2)CC1 64759060 QDBBQXSXBUNCDO-UHFFFAOYSA-N 401.536 2.402 10 20 HECD Cc1ccc([C@H](CN2CCOCC2)NCC(=O)NCc2ccc(N(C)C)cc2)cc1 727384101 KXAZWKKDKOMESI-QHCPKHFHSA-N 410.562 2.340 10 20 HECD COc1ccc(CN2CCCN(C(=O)COC(=O)c3cc(O)cs3)CC2)cc1 732354889 VOCIQNLTNJURBQ-UHFFFAOYSA-N 404.488 2.354 10 20 HECD O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 732589885 GHCUQMLJJOMLPZ-GJZGRUSLSA-N 415.412 2.246 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)CC2)cc1 733892003 WPLITWYAKPQVQR-XMMPIXPASA-N 409.530 2.371 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 736196675 UDEDDLMDTJQVJP-UHFFFAOYSA-N 413.430 2.462 10 20 HECD O=C(Cn1cc(Br)c(O)nc1=O)NCc1ccc(N2CCCCC2)cc1 742476027 SVHMEQMKZQGWOX-UHFFFAOYSA-N 421.295 2.018 10 20 HECD COc1ccc(OCCC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742916809 OQIFNUBABCVXQJ-UHFFFAOYSA-N 413.518 2.411 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)c1 743335863 COOXOISXPYCYQJ-NSHDSACASA-N 424.475 2.281 10 20 HECD Cn1cc(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2ccccc21 743869257 OKPNQEYLEJUCJM-UHFFFAOYSA-N 411.527 2.272 10 20 HECD Cc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 746037526 FTTSXBCJRMSHPD-ZIAGYGMSSA-N 400.454 2.398 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)N1CCN(C2CCOCC2)CC1 747495817 QGZMSPFCXRAYKC-UHFFFAOYSA-N 404.580 2.246 10 20 HECD CCOC[C@@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 747967957 ZODYEULBUVLFLN-ZHALLVOQSA-N 407.530 2.414 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1nnc2n1CCC2 754667197 WNKGIDVHXINYKW-UHFFFAOYSA-N 415.453 2.070 10 20 HECD Cc1nn(C)cc1[C@H]1CCCN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 759419914 IPPZKUZRFQJEMD-HXUWFJFHSA-N 415.513 2.158 10 20 HECD CC(C)N1CCC(O)(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 761645506 ACVGGAPDLWVQJI-SFHVURJKSA-N 404.555 2.119 10 20 HECD O=C(NCc1cccc(Br)c1O)C(=O)Nc1ccc(OC2COC2)cc1 765925200 FRXQRKRTBMTUJY-UHFFFAOYSA-N 421.247 2.187 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc(OC(F)F)n(C)n3)cc2F)CC1 767078388 WQWRZIZIWMMYCI-UHFFFAOYSA-N 411.428 2.233 10 20 HECD C[C@H](C(=O)NCc1ccccc1O)N1C(=O)c2ccc(Br)cc2C1=O 769358746 QPLUTVPPMLVYDQ-SNVBAGLBSA-N 403.232 2.456 10 20 HECD COc1ccc(-n2cnnc2SCC(=O)NCc2cccc(OC)c2O)cc1 769502999 FPFXJRXXALBXEB-UHFFFAOYSA-N 400.460 2.399 10 20 HECD Cc1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1C(C)C 771177598 HCBMZYUAYYQISE-UHFFFAOYSA-N 418.469 2.221 10 20 HECD COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1=O 771243901 QVAROYDSUZMRCK-QHCPKHFHSA-N 424.501 2.187 10 20 HECD C[C@H](NCC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C)c1ccc(N(C)C)cc1 775835559 UYAWOXJXCINDJI-GJZGRUSLSA-N 416.547 2.028 10 20 HECD CC(C)[C@H]1NC(=O)N(Cc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 777615445 AAFQYAHDZRACKN-GOSISDBHSA-N 412.469 2.019 10 20 HECD C[C@@H]1CCN(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 777972563 WYSVQYIIHFAUKY-CYBMUJFWSA-N 407.458 2.218 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)ncn4C)CC2)cc1 778295481 STWCHJMDQCHVIZ-KTKRTIGZSA-N 419.485 2.425 10 20 HECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 779337024 VIFXZTIAOHQSBA-NLWGTHIKSA-N 402.539 2.081 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccccc2OC(F)F)cc1F 787006389 ICZLZPDYRAFZLR-UHFFFAOYSA-N 409.408 2.468 10 20 HECD COC(=O)[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[C@H]1C 787328785 UKJBEAWJYMXBQS-DZGCQCFKSA-N 406.438 2.284 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)C2CC2)cc1 789383392 XGXYMHAHZVAECP-LJQANCHMSA-N 411.506 2.467 10 20 HECD COc1ccc(O)c(CNC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c1 789772668 CDFORCLGQDVRSB-GOSISDBHSA-N 402.466 2.347 10 20 HECD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC[C@H]1C 789840476 JHVUYKIUFZNCFM-HLLBOEOZSA-N 405.514 2.344 10 20 HECD CSCCONC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 792842819 UQAHZAZIYRCYBW-UHFFFAOYSA-N 420.514 2.036 10 20 HECD O=C(CN1CCOC[C@@H]1[C@@H]1CCCO1)Nc1cccc2c1C(=O)c1ccccc1C2=O 796340595 MNSPSBXZLYNWFV-UXHICEINSA-N 420.465 2.280 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c1 798015282 AYMMBRLDRMENBT-IINYFYTJSA-N 400.378 2.467 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc(NCC4CC4)nc3)CC2)cc1 800691520 YEHRKHGMUWYZFT-UHFFFAOYSA-N 409.534 2.464 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCCN(Cc3ccccc3)CC2)cc1F 803663583 UGGQNWMGUGFGIH-UHFFFAOYSA-N 412.509 2.242 10 20 HECD COc1ccccc1O[C@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685359 DXUDVPZPVKNMEQ-MRXNPFEDSA-N 411.502 2.278 10 20 HECD Cc1nc(CNC(=O)C(=O)NCCCSc2nccs2)nc2ccccc12 804288313 UUBPICFPRKVHLM-UHFFFAOYSA-N 401.517 2.310 10 20 HECD COCC[C@@H](NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1)c1ccco1 804317503 FYVWAYWKGSXYHC-LJQANCHMSA-N 415.490 2.267 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](C)O[C@@H](C(F)(F)F)C2)cc1F 804853466 QFFGFPDSKCRXEV-BLLLJJGKSA-N 419.419 2.466 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3nnc4ccccn34)cc2)CC1 805025865 XCSCRKCAMRAPEF-UHFFFAOYSA-N 420.517 2.240 10 20 HECD COC[C@]1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCN(C(=O)OC(C)(C)C)C1 813513727 RSRAZJIDUCGCFQ-QKKBWIMNSA-N 408.495 2.419 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@H]2CCCS(=O)(=O)C2)cc1 815153251 KHJJNUNIERPESM-UYAOXDASSA-N 408.564 2.475 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccccc3NC(=O)C3CC3)nc12 815516064 BFYQBKKZXWMPPK-UHFFFAOYSA-N 424.413 2.317 10 20 HECD CC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 914037663 SADQBUGKBXAXDT-NTCAYCPXSA-N 423.585 2.420 10 20 HECD CC(=O)NCCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 914453981 SLHGMOBNNNDJPH-SDNWHVSQSA-N 411.574 2.372 10 20 HECD O=C(NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc2c(c1)OCO2 917364853 PKEJAVIGOFQJEJ-KRWDZBQOSA-N 412.442 2.059 10 20 HECD CC(=O)N1C[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)Oc2ccccc21 917708294 DAKDOYVUSCIKLU-NRFANRHFSA-N 413.449 2.093 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CS4)cc2)C1 917831813 AMEWETPAMVFODD-MRXNPFEDSA-N 424.526 2.363 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2)CC1 1825821641 AEYIMKUHJQDLPK-GOSISDBHSA-N 410.474 2.435 10 20 HECD COc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(Br)cc1O 33439047 SONPMAIAJZLDFQ-KMKOMSMNSA-N 404.263 2.449 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@H](C(C)C)N3CCOCC3)CC2)cc1 726612671 DDFLVCTUOPNIRM-OAQYLSRUSA-N 404.555 2.320 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(COC)c2)cc1OC 727357775 RLAZTDQQTAHDKQ-UHFFFAOYSA-N 414.505 2.404 10 20 HECD CCCN(Cc1ccccc1O)C(=O)NCCCN1CCN(c2ncccn2)CC1 731280362 RXTBPONGNVWCOM-UHFFFAOYSA-N 412.538 2.316 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCOCc3ccccc3)cc2)C1 747508050 SPHBLGKWEMWWKI-FQEVSTJZSA-N 410.518 2.404 10 20 HECD Cc1nc2n(n1)CCN([C@@H](C)C(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)C2 750058817 XOGFGTZGYKTIQW-ZDUSSCGKSA-N 415.453 2.205 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCC[C@H]3C[C@@H](C)O)CC2)cc1 752640133 FYGQXQJXWRAVML-QUCCMNQESA-N 404.555 2.152 10 20 HECD COc1cc(N2CCN(Cn3nc(C)c([N+](=O)[O-])c3C)CC2)cc(OC)c1OC 758955389 PDSQHAFNAIDKOQ-UHFFFAOYSA-N 405.455 2.214 10 20 HECD CCN1CCN(C(=O)c2ccc(NC(=O)NCCc3ccc(O)c(O)c3)cc2)CC1 761629426 JTLZERPEAFYAFI-UHFFFAOYSA-N 412.490 2.240 10 20 HECD CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 766330093 RVFLNTMFOOJOOC-MOPGFXCFSA-N 423.579 2.457 10 20 HECD COc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1[N+](=O)[O-] 766433936 SCBFTNLTDGUIAH-HNNXBMFYSA-N 412.446 2.235 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(CCCO)Cc3ccccc3)cc2)C1 769038472 SMRIZZYPIHHYAA-OAQYLSRUSA-N 424.545 2.483 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1 769153431 IFRBNRBFBVXDAZ-FGZHOGPDSA-N 416.566 2.042 10 20 HECD C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NCc1ccc(N(C)C)c(F)c1 770436008 UQSAXRPKYRRMCY-CYBMUJFWSA-N 408.499 2.442 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCC4CCOCC4)n3)CC2)cc1 771055550 GBKDIJYUTROIDO-UHFFFAOYSA-N 414.506 2.329 10 20 HECD CC1(CS(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCCCC1 772605650 GPCMPNWIOIWRJV-UHFFFAOYSA-N 414.593 2.311 10 20 HECD Cc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C(C)C)cc1 773739997 IEUHDFMSPDFGLA-QRWLVFNGSA-N 420.531 2.457 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3ccc(O)cc3)CC2)cc1 778318453 HBOCSPBGMJYNGK-VAWYXSNFSA-N 409.486 2.264 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1OC 780408933 POBUZEYVPYBGMA-UHFFFAOYSA-N 419.503 2.173 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C[C@@H]3CCO[C@H](C(C)C)C3)nc12 781791126 RWEBHGJYCJKSPS-CJNGLKHVSA-N 405.451 2.496 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CC[C@H](O)C1 781798188 NEWZCOYUCYYPMW-QHCPKHFHSA-N 424.545 2.089 10 20 HECD C[C@H]1CN(c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)CCO1 785295476 HUXZAHSBYVJMBX-CABCVRRESA-N 413.474 2.009 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 785424318 MWNWSNRPEXVDTA-UHFFFAOYSA-N 412.559 2.238 10 20 HECD CC(=O)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 785505375 MMWGIPAAIJFTQE-UHFFFAOYSA-N 414.550 2.199 10 20 HECD COc1cc(O)c(CNc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)cc1OC 785990401 IKDZDDXUQYAHHA-UHFFFAOYSA-N 422.503 2.167 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCSC[C@@H]3C)cc2F)C[C@@H](C)O1 789823199 ZNZVJLQSHSZDHR-SOUVJXGZSA-N 409.527 2.019 10 20 HECD CC(C)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834226 KXGZBWIIKYDUFT-QGZVFWFLSA-N 405.514 2.298 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@H](N4CCCC4=O)C3)cc2F)C[C@@H](C)O1 790220535 YCFAQNINWVPHGY-JZXOWHBKSA-N 418.513 2.346 10 20 HECD Oc1c(Br)cc(Br)cc1CNCc1nnc2n1CCOC2 792193754 ZMVNPASXMCQURU-UHFFFAOYSA-N 418.089 2.329 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@@](C)(OC)CC3)CC2)cc1 794186281 ZBNBBDVQELZZEK-JJNABOQBSA-N 415.534 2.318 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(OC)c(Br)c2)c(O)c1 797389791 YJXOUQIWOZIGKL-UHFFFAOYSA-N 409.236 2.427 10 20 HECD C[C@H]1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(=O)N1c1cnn(C)c1 806884108 QPDXNOVGCOCNJI-LKFCYVNXSA-N 412.277 2.426 10 20 HECD CC1CCC(N2CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)CC2)CC1 807291856 IKTMROGVELWARN-UHFFFAOYSA-N 410.562 2.402 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 807671885 UJPNNRMZOGTQEX-QGZVFWFLSA-N 422.529 2.351 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 807841462 BJBCYTDSTZDIPN-SFHVURJKSA-N 401.507 2.038 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3[C@H]4CC[C@H]3CC(=O)C4)cc2F)C[C@@H](C)O1 809980436 OASBZWATATZFFI-LMSBXDPUSA-N 403.498 2.251 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCCCCC(=O)C3)CC2)cc1 811387174 XKATYKSIRIYLEV-KRWDZBQOSA-N 402.491 2.427 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc2cccnc12 918284405 FOHVKMPIWCSDAJ-UHFFFAOYSA-N 408.433 2.465 10 20 HECD CCOC(=O)CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CC1 920089158 VOBPSMZQJDOGNV-UHFFFAOYSA-N 406.438 2.428 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 920251544 BTDLJJOFVKNSSQ-SEYXRHQNSA-N 422.529 2.282 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCCS3)CC2)C1 1810550308 JALGYUTWQRKINR-HNNXBMFYSA-N 405.520 2.233 10 20 HECD C[C@@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841525730 SFYRQYVWKLFRJU-CQSZACIVSA-N 413.499 2.491 10 20 HECD Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1S(N)(=O)=O 730842892 UOALQTRXSHPNFG-UHFFFAOYSA-N 405.545 2.126 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCc3ccc4c(c3)CCCN4C)ccc21 735633050 ATELIRGIXLBZFI-UHFFFAOYSA-N 420.513 2.024 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cs1 742283904 JOWOKJAVNQYPIA-ZDUSSCGKSA-N 410.517 2.411 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cncn3-c3ccccc3)CC2)cc1 742927261 LIUBAKBIQPDURM-UHFFFAOYSA-N 405.502 2.433 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)CN1CCOCC1 745500526 DJXYUHCTWSJGBH-ZDUSSCGKSA-N 400.317 2.407 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)N(C)C3CCCC3)nc12 754874446 YLYBUJBSCZCAPM-UHFFFAOYSA-N 404.467 2.308 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1 758184104 DSLVXEQXMJIHGJ-ISKFKSNPSA-N 424.589 2.042 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3cnn(-c4ccccc4)c3)CC2)cc1F 768736289 XMIHOXJWDUNPGX-UHFFFAOYSA-N 423.448 2.307 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1c(C)nn(C)c1N1CCOCC1 769380285 RGQPONBARMKXQF-UHFFFAOYSA-N 422.913 2.099 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1Cl 771201660 MVDFQGYLVYBPED-UHFFFAOYSA-N 406.822 2.195 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1F 778677640 CPHVKOMZXJWZPB-UHFFFAOYSA-N 410.515 2.191 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@H]3CCO)CC2)cc(OC)c1OC 779710229 AAUKHGYCSZCNFV-RDJZCZTQSA-N 407.511 2.095 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cc4nn[nH]c4cc3F)cc2F)CC1 781923459 CSDIBFGLEJRIHK-UHFFFAOYSA-N 400.433 2.308 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccccc3-n3ccnn3)cc2F)CC1 783963755 IYKKLZYPMARTHA-UHFFFAOYSA-N 408.481 2.478 10 20 HECD Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1 784109779 XTYCYXSGKPZYSJ-UHFFFAOYSA-N 416.503 2.078 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)Nc1cc(C)cn(C)c1=O 785193828 HLWHQNQLUZMORF-UHFFFAOYSA-N 422.279 2.149 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cnn(-c2ccccc2)c1 786130386 XPFUNZXPBWFVIA-UHFFFAOYSA-N 405.502 2.256 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccc(F)c(F)c3)CC2)cc1 786683372 LYWIRZAEAMSJHP-UHFFFAOYSA-N 403.429 2.329 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H](C)CN3CCC[C@H](C)C3)CC2)cc1 793901181 LJVAHAOFXJFIHV-ZWKOTPCHSA-N 416.566 2.017 10 20 HECD C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 793908442 IBRMDEQRGBXYBS-QGZVFWFLSA-N 400.567 2.312 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797710277 WNHHLKDZKYXVEP-KSMMKXTCSA-N 423.485 2.118 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(S(N)(=O)=O)cc1 798332998 VZYJRYJGIDMKDI-UHFFFAOYSA-N 413.293 2.464 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCCC34CCOCC4)CC2)cc1 804317221 WTHWHXDOVWODHC-HXUWFJFHSA-N 415.534 2.246 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCN(CCc2cccs2)CC1 806277501 BRMPELPCIPWQHM-UHFFFAOYSA-N 424.617 2.190 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nc(C2CC2)cs1 806847743 WVGVTROKDMGWFI-UHFFFAOYSA-N 400.504 2.454 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@H](Cc2ccccc2)C1 807286924 FMLAPQMYMQOAQO-JOCHJYFZSA-N 405.498 2.149 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O 807654009 JSYGYFOVAIXWCB-UWJYYQICSA-N 422.529 2.411 10 20 HECD C[C@H](NC(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807674797 QZYHTHKQYYZCGZ-HNNXBMFYSA-N 404.511 2.009 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@@H](N3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)[C@H]2C1 809184389 GIAPCTKQSWGXLJ-RRQGHBQHSA-N 405.882 2.457 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3(c4ccc(N(C)C)cc4)CC3)nc12 815304377 WBXJFTJDKKVNRS-UHFFFAOYSA-N 424.457 2.453 10 20 HECD Cc1cc(C(=O)NCC2(NS(C)(=O)=O)CCCCC2)c(C)n1-c1ccccn1 914849464 KJSVOFITUAGUIB-UHFFFAOYSA-N 404.536 2.471 10 20 HECD C[C@H]1CN(CCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 916249795 KYASQACWLRTOLV-KDURUIRLSA-N 404.555 2.164 10 20 HECD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 917822139 FVTUWFHYJGWLCV-FQEVSTJZSA-N 423.579 2.328 10 20 HECD C[C@@H]1CCCN([C@H](C)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 918117424 KOHNNDFLZPIQGG-QWFCFKBJSA-N 415.582 2.308 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cnc1Cl)c1cc(O)nc(O)c1 1798725591 LFQKTNYPZZIYGF-CLLJXQQHSA-N 420.828 2.246 10 20 HECD Cc1nn(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712603 NHBQAJINOMHHFJ-BTTYYORXSA-N 418.881 2.359 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827423819 JMKXFEZGTOYCKQ-LPHOPBHVSA-N 419.522 2.133 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1O 1847038178 DQIFIJZCANZLNA-SOFGYWHQSA-N 424.453 2.348 10 20 HECD COc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)ccc1OC(=O)c1ccccc1F 21269902 SPAQMSYLZKEKLP-UHFFFAOYSA-N 412.373 2.487 10 20 HECD CCS(=O)(=O)c1ccccc1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 104996462 NIFCWKRPDSKIET-UHFFFAOYSA-N 418.515 2.362 10 20 HECD CS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 303679714 IRQOLIKVFVIJJU-UHFFFAOYSA-N 402.516 2.229 10 20 HECD Cc1cc(C(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c(C)n1-c1ccccn1 726168128 MHQIKALTQMARBI-QHCPKHFHSA-N 417.469 2.474 10 20 HECD CSCCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726237970 WMSLTCOZSZIDFM-UHFFFAOYSA-N 404.515 2.105 10 20 HECD O=C(Nc1ccc(-n2ccnn2)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 727037562 ORIPWJLZRHNGLX-IBGZPJMESA-N 421.457 2.119 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H](c1ccccc1)N1CCC(O)CC1 727767601 GGEKIJFFAPHQOE-QHCPKHFHSA-N 409.530 2.337 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1F 731363856 NVJVHSZVXFOPAC-UHFFFAOYSA-N 408.499 2.319 10 20 HECD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733972355 DVHPVYSACWKOHD-GOSISDBHSA-N 404.517 2.209 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N(CC(N)=O)C(C)(C)C3=O)c2C)c1 735792271 AWWVOKCKFJSCLI-UHFFFAOYSA-N 410.474 2.113 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCSC[C@H](C)C3)CC2)cc1 754746048 SUGUJDJXMWZPNG-IWAYRVGRSA-N 403.548 2.112 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](C)N3CCc4ccccc43)CC2)cc1 758209222 JAMOAOGKDWDIOQ-REWPJTCUSA-N 424.589 2.219 10 20 HECD COC(=O)c1cc(F)ccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 758288325 MROMBUHDNKKPPF-UHFFFAOYSA-N 422.478 2.270 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(S(=O)(=O)CC)CC1 758741163 DVEPROXQFFYKJS-UHFFFAOYSA-N 410.584 2.346 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(F)cc3)CC2)cc(OC)c1OC 759410931 ZUQGAGNWNSLVOB-UHFFFAOYSA-N 417.437 2.139 10 20 HECD C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC[S@@](=O)C1 763877533 JYWWLNVNAFKINN-IZPCHGGPSA-N 410.495 2.101 10 20 HECD Cc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)ccc1S(N)(=O)=O 767383326 KZUYQPXGCJTINH-UHFFFAOYSA-N 416.547 2.425 10 20 HECD Cc1noc(C2CC2)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 767998590 MOUBWXXVYJZRGW-UHFFFAOYSA-N 402.426 2.091 10 20 HECD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773991390 XOKXZMANICCORG-HNNXBMFYSA-N 413.522 2.203 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1OC 774730639 WSQJYHCJXFQOAU-UHFFFAOYSA-N 409.486 2.055 10 20 HECD O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc2nonc12 776303284 JEXIAMKIDTUFOT-UHFFFAOYSA-N 422.488 2.198 10 20 HECD CC[C@H]1C[C@H](CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 781762628 DOSIUZVRJOSZOF-MJGOQNOKSA-N 404.507 2.482 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1 784030340 OYIYSIPBIPJFMS-UHFFFAOYSA-N 419.503 2.449 10 20 HECD Cc1ccncc1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768384 XEGBGDRZUCPHPF-INIZCTEOSA-N 402.882 2.468 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cc(C)ccc3F)cc2)CC1 786122077 MVJXOUZUVKISQI-UHFFFAOYSA-N 405.495 2.281 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N[C@H](C)c2cc(OC)ccc2O)n1 786742705 XEFPZUSRVMYXEC-CYBMUJFWSA-N 410.496 2.223 10 20 HECD CSCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789819138 LYHVZEHZOOMYLB-GJZGRUSLSA-N 411.543 2.315 10 20 HECD Cc1cnccc1CNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789825496 MILGPHMWRCMDPS-HOTGVXAUSA-N 414.481 2.075 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3C[C@H](C4CC4)O[C@H](C)C3)CC2)cc1 792010585 ZFQYOGXOIABTJG-XMSQKQJNSA-N 416.566 2.416 10 20 HECD COc1ccc(CNC(=O)c2cc(Cn3cc(Br)cn3)on2)c(O)c1 794377030 DZJFMVOOEKKQTL-UHFFFAOYSA-N 407.224 2.326 10 20 HECD COc1ccc(CNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c(O)c1 794379810 WTIMSDDUOMKJIS-UHFFFAOYSA-N 404.488 2.091 10 20 HECD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)cn1 795608418 BDLULOQJUMPAHZ-UHFFFAOYSA-N 423.497 2.302 10 20 HECD COCCn1cc(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 799887274 RVMFCZXVPQLOPQ-HZPDHXFCSA-N 419.501 2.282 10 20 HECD C[C@H](NC(=O)C(=O)N(C)CCOc1ccccc1)c1ccc(N2CCOCC2)cc1 803302437 OHWAPPXGRXWJLN-SFHVURJKSA-N 411.502 2.238 10 20 HECD CCc1cnccc1[C@H](C)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 809518971 LGOXKPLNCYZJIT-KRWDZBQOSA-N 410.518 2.316 10 20 HECD C[C@H](NS(=O)(=O)c1cn(C)nc1C(F)(F)F)c1ccc(N2CCOCC2)cc1 815000335 IPIKONZNEXZPHH-LBPRGKRZSA-N 418.441 2.315 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC[C@H](CO)C1 916631865 LGQRBODXFJQBNV-AWEZNQCLSA-N 401.429 2.456 10 20 HECD CC(C)COC[C@@H](O)CNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918209347 VTRXQAXIBCLQKW-JZXOWHBKSA-N 411.518 2.272 10 20 HECD Cn1ncc2cc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cnc21 1116659534 HIYKNADGMHJLOI-MRXNPFEDSA-N 402.476 2.044 10 20 HECD C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1320397248 CXBBAPHWSXRLLN-KDOFPFPSSA-N 424.453 2.203 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3ccnn3C[C@H]3CCOC3)CC2)cc1F 1342972179 RHMIOBGFAFRJGT-OAHLLOKOSA-N 403.458 2.421 10 20 HECD CCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)COC1 1801510332 SPSWMYOQWIWIIZ-BTTYYORXSA-N 408.882 2.430 10 20 HECD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c[nH]1 1807995753 IHOGWSQSFKLLTD-FOIQADDNSA-N 421.457 2.158 10 20 HECD Cc1[nH]ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845772 VVROGAFHRAGSSO-HNNXBMFYSA-N 410.434 2.472 10 20 HECD O=C(CCc1ccc(F)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847411698 XSHGHHWYCAWZOJ-IRXDYDNUSA-N 417.412 2.219 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C/c1cc2ccccc2nc1N1CCOCC1 26763693 VFOQQLMLZJMZNV-NBVRZTHBSA-N 410.499 2.374 10 20 HECD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c(O)c1O 727004480 WIICSZQWYLSODZ-CQSZACIVSA-N 400.431 2.427 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCNc3ccccn3)cc2F)CC1 730113385 QBKCDOUFFMIECR-UHFFFAOYSA-N 400.502 2.274 10 20 HECD COC(=O)c1ccc(OCCNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 731222674 QVLNRFVNTVRXBD-UHFFFAOYSA-N 413.474 2.188 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 731857821 FNNUZUBSGGNFCA-QGZVFWFLSA-N 423.469 2.237 10 20 HECD CN(Cc1nnc2ccccn12)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 734270186 QVAINRFIUDSKPU-UHFFFAOYSA-N 412.469 2.171 10 20 HECD CC(=O)NC[C@@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 742614914 OJCNDDULZRXFTC-INIZCTEOSA-N 419.481 2.249 10 20 HECD CCCc1nnc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)s1 743288153 VGQAFVQUSBXWOQ-UHFFFAOYSA-N 404.540 2.443 10 20 HECD CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NCCCSc2nccs2)cc1 749730725 CGAZFQKOUMDKKZ-UHFFFAOYSA-N 406.533 2.011 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)nn3)cc2F)C[C@@H](C)O1 750871903 JGQBVFWCTXBYOK-HUUCEWRRSA-N 410.453 2.345 10 20 HECD COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NCCCSc1nccs1 752135967 JUYPQDRRGAFUGG-UHFFFAOYSA-N 422.532 2.091 10 20 HECD CCCCN(C)C[C@H](C)NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 752925800 HKGIFWJLUHETRG-JZHDPFOFSA-N 416.566 2.137 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCCCS1(=O)=O 753486197 LSRZSVCFNUSDQH-MRXNPFEDSA-N 402.463 2.340 10 20 HECD COc1cc(N2CCN(C(=O)c3cccc(NC(N)=O)c3)CC2)cc(OC)c1OC 759406876 YDCNAKDCDZNDSO-UHFFFAOYSA-N 414.462 2.165 10 20 HECD COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)/C=C/c1ccc(O)c(O)c1 759593266 MQHGIYNIXDMREL-GQCTYLIASA-N 407.400 2.071 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N(C)C)cc2C)cc1 763655411 OXNWHADCGJNLMW-UHFFFAOYSA-N 404.536 2.359 10 20 HECD O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(-n2cncn2)nc1 771055787 FDZUMBOIEXYVRH-KRWDZBQOSA-N 412.881 2.416 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)CN3CCCN(C(N)=O)CC3)c2C)cc1 772722050 GGNJMCCLNDCHEX-UHFFFAOYSA-N 412.490 2.150 10 20 HECD COC1(CO)CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 773934410 JBGLPWAKHWQMPB-HNNXBMFYSA-N 422.481 2.262 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccn2c(O)nnc12 780918016 CBRWAZGRXQINTN-UHFFFAOYSA-N 403.389 2.435 10 20 HECD CCN(CC(=O)NCC(=O)OC(C)(C)C)Cc1cc(Br)ccc1O 784163218 NOZATJGHVJAXFN-UHFFFAOYSA-N 401.301 2.435 10 20 HECD COC[C@@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C[C@@H](C)O1 784374182 XVVMFXBVZNXSOC-CABCVRRESA-N 408.454 2.136 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cncc(-c4cnn(C)c4)c3)cc2)CC1 786659749 NIWMYLRGYPZKMA-UHFFFAOYSA-N 418.501 2.081 10 20 HECD CNC(=O)c1cccc(CNC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 787861404 FDUYKLOOISMJNW-UHFFFAOYSA-N 421.453 2.190 10 20 HECD CN(CCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)OC(C)(C)C 788877553 XMXYHFUFNZARLF-UHFFFAOYSA-N 418.538 2.276 10 20 HECD CCN(CCc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789863894 LACNXVMFARGFGG-UHFFFAOYSA-N 412.559 2.342 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 793689886 PQWGDKCKGIGCAG-CALCHBBNSA-N 407.426 2.306 10 20 HECD CCC1(CC)CCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793733173 LOYYXRAGPDQXNF-GOSISDBHSA-N 414.550 2.043 10 20 HECD Cc1cccc(CC2(O)CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 794137368 UVIUUCKKUHGELG-UHFFFAOYSA-N 418.515 2.282 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F 794597268 WIZZIBIABKVJBT-UHFFFAOYSA-N 405.400 2.392 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 798321388 MYLSEXWIALBBHC-UHFFFAOYSA-N 419.547 2.028 10 20 HECD CON(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC1CCOCC1 801604196 NHKFAGQIVCMJLZ-CALCHBBNSA-N 423.529 2.346 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3cnc4n3CCC4)ccc21 802205493 YHJCASNUGFFENX-UHFFFAOYSA-N 416.503 2.166 10 20 HECD CO[C@]1(C)C[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803306308 TZNDHJCDSPQCKV-FXCLAUTBSA-N 403.523 2.020 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cc1F 803660887 IACAHCJYRPOHBF-QGZVFWFLSA-N 416.472 2.432 10 20 HECD CN(c1ccc(CNC(=O)C(=O)N(CCO)C2CCOCC2)cc1)C1CCCCC1 803679658 UUTBBEZUHZCAFW-UHFFFAOYSA-N 417.550 2.072 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H]3CCO[C@@H](C)C3)CC2)cc1 804315915 VLMGSDKWYGPDDO-IRXDYDNUSA-N 403.523 2.102 10 20 HECD CN(C)Cc1cc(CNC(=O)C(=O)NCCCSc2nccs2)ccc1F 806040197 FMEXUAOXGXMZCC-UHFFFAOYSA-N 410.540 2.259 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 806421439 SPCFIYXKJUSDCD-NRFANRHFSA-N 422.529 2.413 10 20 HECD CSc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 806782636 RTQAUIOFGCWHPX-UHFFFAOYSA-N 406.533 2.360 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1nc2c(s1)CSCC2 806862688 PMFZYHOWFZVPSP-UHFFFAOYSA-N 418.544 2.024 10 20 HECD COc1ccccc1N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 807100738 PNFGGAFRCCPRIR-UHFFFAOYSA-N 410.518 2.035 10 20 HECD COCCOCCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 812006069 QWPSVMQHGDQXTJ-UHFFFAOYSA-N 419.444 2.346 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCN(c3ccccc3F)C2)c1 812602037 KGWAWIGZDUUCNX-ZDUSSCGKSA-N 407.467 2.159 10 20 HECD CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NCCc1ccc(O)c(O)c1 815833918 KNYYITKXPGOZMC-HSZRJFAPSA-N 423.469 2.146 10 20 HECD C[S@](=O)Cc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918373356 WTDUBECZSQMEKH-SLQAJWMNSA-N 413.543 2.197 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)C2CC2)cc1 918455873 GIWXNKGLVNJZED-UHFFFAOYSA-N 415.515 2.286 10 20 HECD O=C(C1=CCCC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004427 DAYYUDGXNAJLJY-HXUWFJFHSA-N 406.866 2.305 10 20 HECD O=C(CC(F)(F)F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285658 MIZIOOWOORVZOT-JHURRJJJSA-N 414.380 2.407 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cccnc1 1816376425 ZTPOLMPIAONXQV-HNNXBMFYSA-N 408.418 2.231 10 20 HECD C[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)O1 1818871935 AQMZWGYOOALOQB-KCPJHIHWSA-N 415.450 2.089 10 20 HECD O=C([C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424842 PSJZUROQBSCXKY-ROUUACIJSA-N 417.506 2.295 10 20 HECD O=C(C1CCC1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898669 VNTSDXCUOVTZMK-INIZCTEOSA-N 423.604 2.267 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)C2=CCCS2)C1 1841647319 JEFKWARYUWIWEB-FNORWQNLSA-N 402.472 2.041 10 20 HECD CNC(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1847764741 HHWYAJPATFSSAY-PMACEKPBSA-N 408.502 2.046 10 20 HECD CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847937969 ZXHDASYHTCFVLT-KBPBESRZSA-N 424.881 2.298 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(OC)cc3F)CC2)cc1 5689265 DXXKIHWMXGMRCF-UHFFFAOYSA-N 402.422 2.349 10 20 HECD CC(=O)Nc1ccc(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1 560763092 JSGHOLNJKWPWJM-UHFFFAOYSA-N 406.486 2.420 10 20 HECD COc1ccc(N2CCC(NC(=O)CN3C(=O)c4ccc(C)cc4C3=O)CC2)cc1 726562863 ZARMPRIADGRMAH-UHFFFAOYSA-N 407.470 2.385 10 20 HECD COCc1cccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 727453105 UEXGTXDYXBSUAW-GOSISDBHSA-N 417.531 2.013 10 20 HECD COCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 731977358 IZYLYVGCPRXAQT-LJQANCHMSA-N 411.502 2.344 10 20 HECD COC(=O)CCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 732892866 LBQYZNLUISFZEI-UHFFFAOYSA-N 400.431 2.321 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCOC[C@H]3c3ccco3)CC2)cc1 735095417 LTHLCIMIGSIBHT-FQEVSTJZSA-N 414.506 2.193 10 20 HECD CN(C)c1ccc(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 741143955 CBSWISXPWUDTBF-UHFFFAOYSA-N 418.515 2.394 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CNc3ccccc3[N+](=O)[O-])cc2)C1 743869317 OJRXCZWMOBRBFN-MRXNPFEDSA-N 411.462 2.025 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)cc1F 753933424 WEPTWNPZPJRLBZ-CVEARBPZSA-N 406.502 2.313 10 20 HECD COc1cc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc(OC)c1 754212641 NRWGOJGLPISHCX-UHFFFAOYSA-N 417.437 2.139 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccnn1-c1nc(C)cc(C)n1 760201779 YMQSMBBWCKSADX-UHFFFAOYSA-N 421.505 2.332 10 20 HECD O=C(NCc1ccc2c(c1)C(=O)NCC2)NCc1cccc(Br)c1O 765534292 CQKFGSCOHVQWHD-UHFFFAOYSA-N 404.264 2.440 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOC4(CCCC4)C3)cc2)C1 766880169 KBZRVUZIZYOMCO-SFHVURJKSA-N 400.523 2.243 10 20 HECD CCOC(=O)C1CCN(C(=O)CN(C)Cc2cc(Br)ccc2O)CC1 769304662 AGAWPDLMYFNFLS-UHFFFAOYSA-N 413.312 2.388 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnc([C@@H](C)O)s3)CC2)cc1 773731349 BCFOQKHTNRITOG-OAHLLOKOSA-N 404.536 2.147 10 20 HECD O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)NCc1ccc(N2CCCC2)cc1 773794160 VHTQBVDCEWEGSN-UHFFFAOYSA-N 408.433 2.404 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)CC2)cc1 775159384 DUGGJKXGXLVAAU-ZDUSSCGKSA-N 400.306 2.044 10 20 HECD O=[N+]([O-])c1cc(CN[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)ccc1N1CCCCC1 776498174 IRJLHHIJYJVWKK-PXNSSMCTSA-N 423.535 2.411 10 20 HECD CC(C)CN1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)[C@H](C)C1=O 777470948 XEXLHMMFSSYSDA-QZTJIDSGSA-N 402.539 2.483 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(Br)c(=O)n(C)c1 784026602 CBXUWLIAWJOZDJ-UHFFFAOYSA-N 422.279 2.231 10 20 HECD CCS(=O)(=O)CCn1cc(C)c(NC(=O)N2CCOc3cc(N(C)C)ccc32)n1 786729804 ADNHJUNOVSKOFU-UHFFFAOYSA-N 421.523 2.123 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCC[C@H](C)C3)cc2F)CC1 787322542 LOUGCCUXJOGCPD-FUHWJXTLSA-N 404.530 2.279 10 20 HECD COc1ccc(CNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c(O)c1 794379566 QHTKESGYSJCQHX-NSHDSACASA-N 402.476 2.092 10 20 HECD O=C(COC(=O)[C@@H]1CCC(F)(F)C1)NCc1ccc(N2CCOCC2)c(F)c1 796369028 FTTVIFGXXMBHTO-CQSZACIVSA-N 400.397 2.257 10 20 HECD Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 799262905 MIYJBOHYSCNUJT-AWEZNQCLSA-N 408.458 2.493 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCc3ccccc3[C@@H]2CO)cc1F 804852671 DJZDHUYEORHPNN-NRFANRHFSA-N 413.493 2.406 10 20 HECD C[C@H]1CN(C[C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 807674743 QCNFSGLSDRFSCD-NYUBLWNDSA-N 416.566 2.030 10 20 HECD CCN(CC)c1ccc(CNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1 810165164 YTQNGHDKHGXGFS-UHFFFAOYSA-N 411.474 2.406 10 20 HECD CCOC1(C)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 813594431 JGXYCTPMAYJNGH-GOSISDBHSA-N 402.539 2.489 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2 919725372 CVBDXCYYCYHJTH-UHFFFAOYSA-N 420.487 2.433 10 20 HECD CCN(CCOC)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919910004 GJXZWKAMFYSFBC-UHFFFAOYSA-N 416.501 2.120 10 20 HECD Cc1nc([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 1116580610 WNTKNNZXUGUCHJ-HZSPNIEDSA-N 405.474 2.098 10 20 HECD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)Nc1c(Cl)ccc2nonc12 1321102958 CJMXDGRLMAGKMJ-IBGZPJMESA-N 411.805 2.208 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]c(C)c(C(C)=O)c1CC 1337827237 XLPBGBACSPOCEH-HNNXBMFYSA-N 402.447 2.404 10 20 HECD CO/C=C(\C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819277085 NQJUTVGJDDQIQL-VNDWYCCKSA-N 401.423 2.072 10 20 HECD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)n1cccn1 1845502272 HSXUYOJZLDCKAZ-GFCCVEGCSA-N 404.854 2.026 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCCNC1=NS(=O)(=O)c2ccccc21 28312931 AASNIDFTBUOFOY-UHFFFAOYSA-N 414.531 2.230 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])CC2)cc1 57548567 UKSGLRPPTQVXRZ-UHFFFAOYSA-N 400.435 2.373 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCN3CCC(C)CC3)cc2F)CC1 303350286 YDONEFBOYOYHSV-UHFFFAOYSA-N 405.562 2.499 10 20 HECD Cc1c(CNC(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)n(C)c2ccccc12 550942646 RHXABIRQRHXNSO-UHFFFAOYSA-N 419.529 2.279 10 20 HECD CCN(C)C(=O)c1cccc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 574549795 FOBYPUIPVQEUSO-UHFFFAOYSA-N 403.504 2.432 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSC[C@@H]3CCCCO3)CC2)cc1 727376290 XCBONYSEOJDQGH-FQEVSTJZSA-N 407.580 2.236 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cccc[n+]2[O-])NC(=O)OC(C)(C)C)cc1 742750417 NHKXHTAZHQTOCP-QGZVFWFLSA-N 400.479 2.382 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(CN2CCCCC2=O)CC1 744403584 SBHRKIFRJVJBEV-UHFFFAOYSA-N 400.567 2.436 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN(C)c1ccccc1[N+](=O)[O-] 745614833 OSEHEXWYRDZVKP-UHFFFAOYSA-N 414.462 2.299 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCC(OC[C@@H]4CCCCO4)CC3)nc12 750064357 GVYKWMISPOCFDK-KRWDZBQOSA-N 418.494 2.162 10 20 HECD C[C@H](C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cnn(C)c1 750554712 VGZGSSQCWDKQSQ-ZDUSSCGKSA-N 417.421 2.481 10 20 HECD Cc1cc(C(=O)CN2CCC[C@@H]2C[C@@H](C)O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 752142904 RYDDTCLZOCYLCZ-CRAIPNDOSA-N 419.547 2.160 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CN(C(C)=O)c4ccccc4O3)CC2)cc1F 753738325 HTUMJGWEERVAGH-OAQYLSRUSA-N 413.449 2.297 10 20 HECD COc1ccc(N2CCN(CC(=O)NCCc3ccccc3OC)CC2)cc1F 753861254 ONVPISPAYIDDSL-UHFFFAOYSA-N 401.482 2.324 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cnn(-c2ccccc2)n1 755202186 MTAHQZCOMQAGRN-UHFFFAOYSA-N 422.514 2.075 10 20 HECD C[C@@H](N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(F)cc1O 756712401 PRPBVWDBQUUMFD-WBVHZDCISA-N 401.486 2.478 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccn(-c2ncccc2F)n1 758964888 PYAWGMMSTYQCTO-UHFFFAOYSA-N 410.453 2.460 10 20 HECD C[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(-n2cnnn2)cc1 765257126 WONIATYDOADGGI-VQIMIIECSA-N 405.506 2.215 10 20 HECD CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 767477408 AMZQBSGVIDWCPE-IBGZPJMESA-N 421.538 2.411 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2)CC1 771635097 DVHURORYPCDGOK-UHFFFAOYSA-N 418.519 2.158 10 20 HECD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773089204 STOCOKIUKQETCA-ZDUSSCGKSA-N 420.487 2.365 10 20 HECD CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 775287577 CTTCRGNODFEZDI-UHFFFAOYSA-N 406.825 2.158 10 20 HECD CN1CCN(c2ccc(CN3CCN(CC(=O)NC4CCCCC4)CC3)cc2)CC1 775676184 NWGOQZMKMMJAOP-UHFFFAOYSA-N 413.610 2.005 10 20 HECD CCCN(C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 776040231 ASMSBVVLUFITQQ-GOSISDBHSA-N 409.552 2.273 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nc(C)ccc3OC)CC2)cc1 778300459 AZGSKPKXCQYDFV-KHPPLWFESA-N 410.474 2.251 10 20 HECD O=C(Cc1ccncc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 779654962 APESWDOMEYHUST-UHFFFAOYSA-N 406.465 2.196 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3C)c2)CC1 780408059 UHVLPBVARXHINX-UHFFFAOYSA-N 418.475 2.373 10 20 HECD CC(=O)NCCN(Cc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)C(=O)OC(C)(C)C 781529063 JLQDIXOGMGKZIW-INIZCTEOSA-N 423.529 2.331 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC([C@@H]4CCCO4)CC3)CC2)cc1 784078673 VVBQWONIKWETLA-QFIPXVFZSA-N 416.566 2.418 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)n1 784765256 OJOVULMCJGURAT-HNNXBMFYSA-N 418.881 2.174 10 20 HECD CCCOC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785294538 NBQBTZDJQKLVNB-CYBMUJFWSA-N 400.431 2.351 10 20 HECD CC(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1Cl 785294751 DZGUWZZTNDNGSN-SNVBAGLBSA-N 405.838 2.396 10 20 HECD CO[C@]1(C)CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 792893350 RSVFGULNDNAWJB-PGRDOPGGSA-N 402.539 2.489 10 20 HECD CCc1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cs1 803297926 KFHKTEMXJLMZKY-CQSZACIVSA-N 402.520 2.036 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)c1 804117480 BYCZNYVFPKRXJL-LJQANCHMSA-N 420.513 2.083 10 20 HECD CCc1nc(CN(C)C(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cs1 804319710 SCZQYFARSCQVEN-UHFFFAOYSA-N 416.547 2.458 10 20 HECD CC[C@@H]1CN(C(=O)c2ccccc2SCC(=O)NC(C)C)C[C@H](C)S1(=O)=O 805392840 NOVNZDUTGQVVCF-LSDHHAIUSA-N 412.577 2.341 10 20 HECD CC(C)C(=O)Nc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)ccn1 815074622 ZOCJUVOTAPNWPW-SFHVURJKSA-N 423.517 2.308 10 20 HECD CCn1nncc1C(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 815529616 DYUZZQCRZRBXOC-LBPRGKRZSA-N 418.409 2.257 10 20 HECD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1CN(C(=O)OC(C)(C)C)C1 816549116 FBRFZTYQBZGJNE-MRXNPFEDSA-N 423.579 2.266 10 20 HECD Cc1nc(CN2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)CC2)cs1 912888298 ZJLYTNVMWVKKMX-UHFFFAOYSA-N 401.580 2.294 10 20 HECD Cc1cc(CC(=O)OCC(=O)N[C@@H](C)C(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 919011512 FCYGTXCVDHRDLR-AWEZNQCLSA-N 419.909 2.426 10 20 HECD CN(Cc1ccc(C(N)=O)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1251193568 OSTVFJFADZVKFN-UHFFFAOYSA-N 400.454 2.103 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1COc2cc(OC)ccc21 1320514638 XNOZUQPWRPJWMV-PBHICJAKSA-N 415.442 2.263 10 20 HECD CCN1CCOC[C@@H]1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1337093406 HIMMKBAVUFFMMS-RTBURBONSA-N 420.554 2.155 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1 1782022321 VTRFMHGOPXWLDL-HSZRJFAPSA-N 423.469 2.128 10 20 HECD O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995005 WUUVABVPXLRVEE-PXAZEXFGSA-N 424.379 2.160 10 20 HECD Cc1cc(C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c(C)n1-c1ccc(F)cc1 8362070 NUIALRITOBPQQL-GOSISDBHSA-N 401.438 2.256 10 20 HECD COc1cc(N2C[C@@H](C(=O)NCc3ccccc3O)CC2=O)cc(OC)c1OC 109677881 DIFSKLOAUSFCIS-AWEZNQCLSA-N 400.431 2.087 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cnc4c(c3)c(C)nn4C)cc2F)CC1 303296034 LUWBSTZEXUVJKN-UHFFFAOYSA-N 410.497 2.488 10 20 HECD CC(C)Cn1nccc1NC(=O)C(=O)Nc1ccc(NC(=O)C2=S=CC=C2)cc1 438811998 RIVPWDDCNZCQGD-UHFFFAOYSA-N 411.487 2.332 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3[C@H]4C[C@H]5[C@H]([C@@H]4O)[C@@H]4C[C@H]5[C@@H](O)[C@@H]43)ccc21 555544120 MLOBBGUBEUMCKI-NMVMEHQPSA-N 410.514 2.105 10 20 HECD CCCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 727795606 POOBMXTTXPUCHU-UHFFFAOYSA-N 412.489 2.426 10 20 HECD COC(=O)CCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)cc1 729062315 PVSUNBQGNYIVJD-ZDUSSCGKSA-N 416.430 2.159 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3nc(C4CC4)no3)cc2F)CC1 730128407 NQLAGHRVLPGKFQ-UHFFFAOYSA-N 402.474 2.227 10 20 HECD CCS(=O)(=O)N[C@H](CCSC)C(=O)NCc1ccc(N2CCCCC2)cc1 730537367 JVBJTYMXZJHJBJ-GOSISDBHSA-N 413.609 2.354 10 20 HECD C[C@](O)(CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1 734066049 NEUPGNXZLAFFFX-MBSDFSHPSA-N 410.518 2.095 10 20 HECD O=C(Cc1nc2ncccn2n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742805332 IYPPTAGNHKUVCQ-CYBMUJFWSA-N 402.405 2.053 10 20 HECD CC1CCN([C@H](C)CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 743334143 OOGCBGHJSBSEIN-QUCCMNQESA-N 415.582 2.308 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 743958031 HVNMFPNTXWMLOW-UHFFFAOYSA-N 408.458 2.269 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(C(=O)NC3CCCCC3)CC2)c1 744380831 WPCSWZASDPRECZ-UHFFFAOYSA-N 423.535 2.065 10 20 HECD Cc1cc(C(=O)CN2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccc(Br)cc1 747835159 AQJLWCRQJHSCLC-GOSISDBHSA-N 420.307 2.225 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC(=O)N(C)C1CCCCC1 748665240 TXHSVDIVMINUDZ-UHFFFAOYSA-N 402.539 2.456 10 20 HECD O=C(CNC(=O)CC1CCCCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 748837637 GXVZQJHCDDTLLW-UHFFFAOYSA-N 405.514 2.490 10 20 HECD Cc1cc(C(=O)CN2CCN(C(C)(C)C(N)=O)CC2)c(C)n1-c1cccc(F)c1 750826681 AQESKYAPMJGWTK-UHFFFAOYSA-N 400.498 2.297 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(-c4ccccn4)no3)nc12 750954218 KPZZCGSILQEDAT-UHFFFAOYSA-N 409.358 2.019 10 20 HECD CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 754567775 DKZSAFILVQPXEV-HKUYNNGSSA-N 404.555 2.231 10 20 HECD COC(=O)c1ccc(O)c([C@@H](C)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1 756648278 VJVGDTBINTVFDF-SNVBAGLBSA-N 410.414 2.143 10 20 HECD COC[C@@H](C)CC(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 756664165 CBVJNFUZXJIKJQ-HRCADAONSA-N 410.486 2.271 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CSc3nnc(NC4CC4)s3)CC2)cc1 758188454 DVNOLGPQSPKGDU-INIZCTEOSA-N 421.592 2.396 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H]3C[C@H](OC)C3(C)C)CC2)cc(OC)c1OC 759281213 PLKMNQMIHIPULS-MSOLQXFVSA-N 407.511 2.358 10 20 HECD CC(C)c1nc([C@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n[nH]1 763008423 ILNBRRSTGKXSGI-HOCLYGCPSA-N 413.526 2.190 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2ncc(I)n2c1 768903327 CDZJNBNDDWGGTK-UHFFFAOYSA-N 423.210 2.323 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)c2)CC1 769847462 IFPUWYRNVNMQBE-UHFFFAOYSA-N 416.503 2.074 10 20 HECD CCc1nn(C)cc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770696104 IFFYSDUQOYJACG-UHFFFAOYSA-N 423.496 2.168 10 20 HECD Cc1cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)sc1C 773234971 UUYNQKHJEDFCAV-UHFFFAOYSA-N 404.491 2.235 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCc3ccco3)cc2F)C[C@H](C)O1 775117216 WTBHYKWRMKUWGI-GJZGRUSLSA-N 403.454 2.007 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1COCCN1CC(F)F 776668126 NCGOULRZGVTUGL-ZDUSSCGKSA-N 407.255 2.469 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCCCC(=O)N1CCN(c2ccccc2)CC1 779484311 MACDWLNEJRUCOC-LUAWRHEFSA-N 409.486 2.356 10 20 HECD CCc1cc(=O)c2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)ccc2[nH]1 781432568 MIGPZLMQINHONG-UHFFFAOYSA-N 401.444 2.420 10 20 HECD Cc1cc2c(cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)OCO2 781457746 NUJPXSFMAYPYPW-HNNXBMFYSA-N 411.458 2.376 10 20 HECD O=C(COC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1ccc(O)c(O)c1 782693659 SEDFFRJRPQVCGI-UHFFFAOYSA-N 419.455 2.358 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Nc1ccn(CCS(C)(=O)=O)n1 782779536 LNMYZSDSCZMSAD-UHFFFAOYSA-N 407.540 2.436 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)cc1 785424049 LCNXSDUAEGIIAR-JOCHJYFZSA-N 408.546 2.396 10 20 HECD CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312727 LMCCCLZIJZIPMP-AZUAARDMSA-N 417.550 2.097 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 788778757 ULFSVMZLUWPJME-MRXNPFEDSA-N 414.472 2.149 10 20 HECD C[C@@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC[C@@H]1CCCO1 789009128 GUPJUNDKGFMVJQ-KGLIPLIRSA-N 407.422 2.303 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2cc(F)ccc2C1 789813280 ROLXQLUVWDVMRV-UHFFFAOYSA-N 415.440 2.003 10 20 HECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 789969611 WOAGZCZRNGSOBC-WIYYLYMNSA-N 416.566 2.018 10 20 HECD CN1CCCC(C)(C)[C@@H]1CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 790536890 AHZZKMAEHBAKFV-ICSRJNTNSA-N 415.582 2.308 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C(N)=O)c2cccc(Br)c2)c1O 793265162 GVEHKGZFAITNIV-CYBMUJFWSA-N 410.224 2.388 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1c1ccc(Br)cc1 794701709 CMFSGQXITRUPGL-AEFFLSMTSA-N 419.275 2.254 10 20 HECD C[C@H](Oc1ccc(C=O)cc1)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 795396980 NOBIBWNUAWGYRT-QFBILLFUSA-N 409.486 2.285 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(S(=O)(=O)NCc2ccco2)c1 798334109 NLEDNAFASBKKAJ-UHFFFAOYSA-N 416.455 2.142 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccc(Cl)cn1)c1ccc(N2CCOCC2)cc1 803300426 RZFVFAFBDGQJDV-AWEZNQCLSA-N 402.882 2.065 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c[nH]c4ccc(C)cc4c3=O)cc2)CC1 804610275 YMBSHSDRSNSUOG-UHFFFAOYSA-N 418.497 2.435 10 20 HECD CCOC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 805022874 HAWUUHFWIKYIJP-UHFFFAOYSA-N 415.534 2.341 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)N(C)CCO4)CC2)cc1 806847492 QIACKRTTWBKLRX-UHFFFAOYSA-N 410.518 2.076 10 20 HECD O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 807073294 GEWJEEFSNQYTSY-MLGOLLRUSA-N 423.318 2.235 10 20 HECD C[C@@H](CO[C@@H]1CCOC1)NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 808280503 LXMHAWMBDXSERX-QFBILLFUSA-N 404.507 2.364 10 20 HECD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 809240316 VIKKPKAJLOHILS-ROUUACIJSA-N 401.507 2.084 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CC4(CCC4)[C@H]3[C@H]3CCCO3)CC2)cc1 810092431 ALBBBCCODIKFKV-MDNUFGMLSA-N 415.578 2.212 10 20 HECD Cc1c(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cnn1C 813662483 YENZNYQJEVMJGU-UHFFFAOYSA-N 400.451 2.277 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc(Cl)nc3)cc2)C1 918017273 XYHXRYTWLQBLRE-MRXNPFEDSA-N 401.898 2.436 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCSCC3)cc2)cnn1-c1ccc(O)nn1 918617537 WTOOORUHCFBSLH-UHFFFAOYSA-N 410.503 2.160 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc4n(c3=O)CCS4)cc2F)C[C@@H](C)O1 918635709 YEALYZJXDVAICZ-BETUJISGSA-N 418.494 2.032 10 20 HECD CCN(C(=O)COC(=O)c1sccc1-n1c(C)ccc1C)[C@H]1CCS(=O)(=O)C1 919565704 IPBWAMDRVCUWST-HNNXBMFYSA-N 424.544 2.348 10 20 HECD CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 920636800 LVYHKEJHOWJCIP-LBPRGKRZSA-N 422.459 2.339 10 20 HECD CC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753576 KGSASVBGSLZQCD-HSZRJFAPSA-N 409.486 2.127 10 20 HECD Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808496294 HRRIIGBADBKGBM-DNVCBOLYSA-N 422.441 2.423 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CC(N)=O)cc1 1847855903 TZPHATRTKFQGER-NQERJWCQSA-N 422.529 2.421 10 20 HECD O=C(CN1CCC2(CC1)OCCO2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 26933393 IPMMTDAQNOJHBD-UHFFFAOYSA-N 406.438 2.239 10 20 HECD O=C(C[C@H]1CCS(=O)(=O)C1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565425 MWLBAAVROAJXRQ-CYBMUJFWSA-N 402.463 2.198 10 20 HECD COc1cc(F)c([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 734015989 CVACGNPSESHPEM-JTQLQIEISA-N 412.439 2.411 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1 734702345 XXHSCQSNVRSUHP-UHFFFAOYSA-N 423.561 2.458 10 20 HECD NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3N3CCOCC3)c2)CC1 739765472 IQUKHLHRKFGUFW-UHFFFAOYSA-N 408.502 2.477 10 20 HECD NC(=O)c1ccccc1N1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 740916079 UWCYMOCGVCCSHE-SFHVURJKSA-N 405.502 2.240 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 740919527 ZTJKCKLHQOTRLV-UHFFFAOYSA-N 408.462 2.398 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2ccn(C)c(=O)c2)NC(=O)OC(C)(C)C)cc1 742753573 KDSKCSNSKXEIRV-SFHVURJKSA-N 414.506 2.447 10 20 HECD CNC(=O)CC1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 746414903 IEAUNXSVWCQJLQ-HZPDHXFCSA-N 420.529 2.497 10 20 HECD Cn1cc(C[C@@H]2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)cn1 746757143 FTAGDONIJKIQPE-KRWDZBQOSA-N 401.486 2.170 10 20 HECD CN(C)c1ccc(CNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1F 746865857 FGFRPLOOBRXRHZ-UHFFFAOYSA-N 408.433 2.145 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccccc3)[C@@H](C)C(=O)OC)nc12 751033078 KZHBRAKXSQTWGC-FZKQIMNGSA-N 412.446 2.252 10 20 HECD CCOC[C@H]1C(=O)N(Cc2ccc(N3CCOCC3)cc2C(F)(F)F)C(=O)N1C 761102058 YQXCZJYRZJBGSF-INIZCTEOSA-N 415.412 2.341 10 20 HECD CNC(=O)[C@H]1CCC[C@H]1NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 765783447 OHTBNAWIBURDJG-DLBZAZTESA-N 410.465 2.471 10 20 HECD CCN(CC)c1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)cc1 767030025 AKUGEDYXTDOMJQ-UHFFFAOYSA-N 405.520 2.419 10 20 HECD C[C@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)c1ccc(N(C)C)cc1 773016970 FHOYLULQDJRXQJ-HNNXBMFYSA-N 404.511 2.009 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NCc2cc(Cl)cc(F)c2O)c1 776170242 SHHOMWFNRRAMOH-SNVBAGLBSA-N 415.874 2.210 10 20 HECD CCC1(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOCC1 778294823 PAHSCWJBHFDHBP-CMDGGOBGSA-N 415.534 2.223 10 20 HECD COc1cc(OC)cc(N2CC[C@@H](N(C)C(=O)c3ccc(C)c(O)c3O)C2=O)c1 780965006 ZASOOPKUBPFNGK-QGZVFWFLSA-N 400.431 2.301 10 20 HECD Cc1c([N+](=O)[O-])cn(CC(=O)NCc2ccc(N(C)C)cc2)c(=O)c1Br 783923843 DZXFXHIPGFFANY-UHFFFAOYSA-N 423.267 2.210 10 20 HECD CC[C@]1(CO)CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 784389236 NPICQLAADMOEIB-DRSNIGMVSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCN(CCNCc3cc(Br)nn3C)CC2)cc1 785436130 MPDVSOKAYWPLKP-UHFFFAOYSA-N 408.344 2.103 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](c1ccccc1F)c1nccn1C 785601949 CVUGXYPJAIIDES-HXUWFJFHSA-N 423.492 2.456 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCc3cc(F)ccc3F)CC2)cc1 787042303 UQRJTEOGZKSAHJ-UHFFFAOYSA-N 403.429 2.329 10 20 HECD C[C@@H](NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1)c1ccc(N(C)C)cc1 787143134 DULMPVYQTZJJBJ-QGZVFWFLSA-N 409.534 2.106 10 20 HECD C[C@H]1CSCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789823197 ZNZVJLQSHSZDHR-RRFJBIMHSA-N 409.527 2.019 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cnc(CC(C)C)nc3)CC2)cc1 792330474 NQMVWRXZYOOKJC-UHFFFAOYSA-N 411.506 2.361 10 20 HECD O=C(COC(=O)c1ncccc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 796579928 WXRBYSFJARZLRO-UHFFFAOYSA-N 407.829 2.184 10 20 HECD O=C1/C(=C\c2ccc3c(c2)OCCO3)SC(=S)N1CCCN1CCOCC1 799204703 PQEPWWMQRCNQDC-GHRIWEEISA-N 406.529 2.381 10 20 HECD C[C@@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)c1ccccc1 803688613 WULJYJRDXUMFCK-DYESRHJHSA-N 409.530 2.356 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCc4ccccc4OC3)CC2)cc1 804318558 NRTYSLRYGYBKFP-LJQANCHMSA-N 423.513 2.290 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@H](Cn1cccn1)c1ccccc1 806164514 VOVCZIKZSQFUEV-MRXNPFEDSA-N 415.544 2.496 10 20 HECD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1COc2ccccc21 809536218 JAZYQJDNJXZUOH-LAUBAEHRSA-N 423.513 2.163 10 20 HECD COC(=O)c1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1C 815062564 MLUXVTPCGXUAEO-ZIAGYGMSSA-N 403.454 2.494 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 819755978 OQZBWXNOMQQJPP-NRFANRHFSA-N 420.437 2.100 10 20 HECD C[C@H](NC(=O)c1ccoc1)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918139403 BTFLMIKZGZOPBP-KFWWJZLASA-N 403.454 2.467 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cl)cc3)cc2)C1 918463026 GVCJDUXLMOLNLW-HNNXBMFYSA-N 414.893 2.297 10 20 HECD C[C@H](NC(=O)Cn1cc(C(N)=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 920882787 ZBTOZHFNRYIECB-INIZCTEOSA-N 406.486 2.454 10 20 HECD Cc1cncc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c1 1796598993 UPBKJRFTMBKKMI-BCDXTJNWSA-N 410.474 2.081 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)c(F)c2)C1 1845308033 ILVFAALBNYXGLV-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CCOc1ccsc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847185389 BLCLYUMJYIHLIF-STQMWFEESA-N 403.460 2.082 10 20 HECD O=C(OCC(=O)N1CCCC1=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 20867520 XJZRMACKEABYMV-UHFFFAOYSA-N 411.797 2.421 10 20 HECD CCOC(=O)N[C@H](C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)C(C)C 303258660 CNRNUPZZKAKHEJ-IBGZPJMESA-N 408.518 2.355 10 20 HECD COc1ccc([C@H](CNCc2cc3c(cc2O)OCO3)N2CCOCC2)cc1OC 725841962 TWTCKBTYGOYTFN-KRWDZBQOSA-N 416.474 2.301 10 20 HECD C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)N1CCCC[C@H]1C 726616891 VDLCGMQRXIMLMF-MSOLQXFVSA-N 416.566 2.484 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](N4CCCCC4)C3)cc2)C1 730905407 XJZDQOYZGIAGRI-TZIWHRDSSA-N 413.566 2.158 10 20 HECD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)NCc1ccc(N2CCC(C)CC2)cc1 731039126 VGOBJHUAOSMFJW-IBGZPJMESA-N 409.552 2.285 10 20 HECD Cc1cc(C(=O)CN2CCCS(=O)(=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 731894220 YKGZTHKREDQWDR-UHFFFAOYSA-N 418.515 2.169 10 20 HECD CN(CC(=O)N1CCOCC1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 732455164 JEFIEXXWOJGULG-UHFFFAOYSA-N 402.539 2.456 10 20 HECD Cc1cc(C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c(C)n1-c1ccc(F)cc1 734466461 AVZWIHCBJHELBP-HXUWFJFHSA-N 414.525 2.370 10 20 HECD Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)c2)n[nH]1 737165194 AJQAVZBPRXJYLG-UHFFFAOYSA-N 404.474 2.417 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(Cc2cccc(F)c2)C(=O)C1 741798446 FWUOCNMCYZEGLL-UHFFFAOYSA-N 412.509 2.195 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCn1c(O)nc2ccccc21 753038056 MZCMHOYTNMKFLJ-UHFFFAOYSA-N 409.490 2.420 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(C)C3(C(=O)OCC)CCCCC3)nc12 763657279 NALFVWXZGJVDAN-UHFFFAOYSA-N 404.467 2.309 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)NCc1cccc(Br)c1O 765903342 JNIVYZXMLRJFGP-UHFFFAOYSA-N 413.249 2.258 10 20 HECD Cc1noc(C2CC2)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 768035280 XQLKYMIXHYTPRS-UHFFFAOYSA-N 416.453 2.216 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 772448739 XKTLIGFHXJYXSH-MSOLQXFVSA-N 412.577 2.391 10 20 HECD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(Cc2cc(F)ccc2O)CC1 778993929 YIMATXAMVLGQGH-UHFFFAOYSA-N 409.439 2.254 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC(Cn2cncn2)CC1 779528063 HCPUZMAYDAQMDE-UHFFFAOYSA-N 416.501 2.000 10 20 HECD CCN(C[C@H](O)C(F)(F)F)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 779529683 ORTXFLHHQUJZNH-INIZCTEOSA-N 407.408 2.242 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccc(N2CCOC2=O)cc1 783000668 WDUNYIWLDAVHTO-UHFFFAOYSA-N 410.474 2.479 10 20 HECD CCc1ccccc1S(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786122627 WPIVMJXRPKJCQO-UHFFFAOYSA-N 401.532 2.396 10 20 HECD C[C@H](CCc1cccn1C)NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854215 FHIHLXXSHSEDGF-QGZVFWFLSA-N 414.575 2.332 10 20 HECD CN1CCCC(C)(C)[C@H]1CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 790536892 AHZZKMAEHBAKFV-UYAOXDASSA-N 415.582 2.308 10 20 HECD COC(=O)c1cccc(NC(=O)C(=O)NCc2cccc(OC)c2O)c1OC(C)C 799253097 DSUNVHDZAAVXFZ-UHFFFAOYSA-N 416.430 2.230 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC[C@@H]3c3cc(C)on3)CC2)cc1 804316636 GXCWFKDHHAHTEP-HXUWFJFHSA-N 412.490 2.440 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12 806275853 XTHSXRADIGUPHT-UTUOFQBUSA-N 403.620 2.237 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1CCC(F)(F)CC1 806771162 NMUGGERRHJLWET-UHFFFAOYSA-N 409.477 2.423 10 20 HECD CC[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1nccs1 807257561 PSERMFWBJBVPQF-QGZVFWFLSA-N 402.520 2.206 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@@H](OCC(F)(F)F)C1)c1ccc(N(C)C)cc1 807674437 KVTDQZZRYMZQLN-CZUORRHYSA-N 401.429 2.500 10 20 HECD Cc1cnn([C@H]2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)C2)c1 812009964 LEIZFRFKRLVNTL-QUCCMNQESA-N 410.522 2.050 10 20 HECD COC(=O)c1cc(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1F 913068395 XIUGJCOJIKPWEK-UHFFFAOYSA-N 401.438 2.382 10 20 HECD CCNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918216148 PPPLEUJZOHFZPV-UHFFFAOYSA-N 414.481 2.411 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc(-c4nnco4)c3)CC2)cc1 918461792 LUCBWTPPZBRZOU-UHFFFAOYSA-N 421.457 2.423 10 20 HECD CCC(=O)N[C@H](CCSC)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969380 KJUWQXIXXSHREV-QGZVFWFLSA-N 411.543 2.051 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 1116864155 ASARUWYSPNJNTM-UHFFFAOYSA-N 407.467 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3nc(C)sc3C)CC2)cc1 1320069737 YZIUBHIGIVUWPM-UHFFFAOYSA-N 423.560 2.032 10 20 HECD O=C(/C=C/C1CC1)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1805575783 GAOJWFFKUFBWPJ-SNAWJCMRSA-N 421.588 2.044 10 20 HECD CC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290884 MBBJLWSOZMURJX-ZDUSSCGKSA-N 406.826 2.369 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ncc(Cl)cn2)C1 1842326289 MWXJUZXQYNYFDW-UHFFFAOYSA-N 423.256 2.325 10 20 HECD O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 31671572 QIKOWOYYMVDRHC-UHFFFAOYSA-N 403.350 2.171 10 20 HECD C[C@H](NC(=O)N1CCN(CC(F)(F)F)CC1)c1ccc(N2CCOCC2)cc1 65698442 UETXRGAVYSZJEZ-HNNXBMFYSA-N 400.445 2.474 10 20 HECD COc1ccc(N2CCN(Cc3nnc4n(C)c(=O)c5cc(C)ccc5n34)CC2)cc1 108064065 XCNPQNGRUUCDAC-UHFFFAOYSA-N 418.501 2.220 10 20 HECD CNC(=O)c1ccc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c([N+](=O)[O-])c1 302619947 FBUHXIXXWLCZPG-UHFFFAOYSA-N 411.462 2.235 10 20 HECD O=C(Nc1ccc(NC(=O)c2cc(N3CCOCC3)ccn2)cc1)C1=S=CC=C1 439467790 ZIFTXURXLLXDRJ-UHFFFAOYSA-N 408.483 2.387 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3cccc(C(=O)OC)n3)cc2F)CC1 730235362 UCKKMJICOUUXJN-UHFFFAOYSA-N 400.454 2.079 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1 734665939 ULVOWKBLITUQPB-UHFFFAOYSA-N 409.534 2.209 10 20 HECD CCNC(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 734752850 RYYPIJJEVNNLQW-UHFFFAOYSA-N 415.465 2.107 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccnc(N2CCCCC2)n1 740083158 FBZIBBKPJODFQT-UHFFFAOYSA-N 413.497 2.497 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](COCc3ccccc3)C2)c1 743718699 QUDZYEFFCBDPEO-MRXNPFEDSA-N 404.488 2.443 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)CC[C@@H]3CCCCN3C)CC2)cc1 745784012 KSGBTAACKNJOQU-FQEVSTJZSA-N 417.598 2.333 10 20 HECD Cc1nncn1CCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 746606535 GFFVYHMYPOYOGM-GXDHUFHOSA-N 421.573 2.446 10 20 HECD CN(C)c1ccc(CN(C(=O)NCC2CCN(S(C)(=O)=O)CC2)C2CC2)cc1 749016748 CKDSBOBVCFUKES-UHFFFAOYSA-N 408.568 2.098 10 20 HECD CC(=O)N1CCCc2cc(NC(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)ccc21 750362963 UQGGIIAWVARGJQ-UHFFFAOYSA-N 412.465 2.446 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CCNC(=O)C3CCCCC3)CC2)cc1 751384235 AXCYACDFALIZIP-UHFFFAOYSA-N 416.566 2.020 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCCNS(=O)(=O)c3ccccc3)cs2)cc1 751935372 BAMCJCMDNOFEJF-UHFFFAOYSA-N 417.512 2.451 10 20 HECD CN(C)c1ccc(CNc2ncc(Br)cc2S(N)(=O)=O)cc1F 754678179 LMGZHJAIJORMET-UHFFFAOYSA-N 403.277 2.309 10 20 HECD CCc1cnc(NC(=O)C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)s1 756102474 KKTABEQFJAABBR-UHFFFAOYSA-N 419.526 2.241 10 20 HECD COc1cccc(CNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)c1O 759666166 ULWQSMGNHFJTFJ-UHFFFAOYSA-N 421.519 2.335 10 20 HECD CCOC(=O)C[C@H](C)CNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 760370116 GPEMUEQTTCPUOD-INIZCTEOSA-N 408.518 2.356 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]([C@@H](C)O)C3)cc2F)C[C@@H](C)O1 760877838 ZSNGRJUTKJIWDE-NTDBWNAOSA-N 407.530 2.148 10 20 HECD Cc1cc(C(=O)NCc2cccc(Br)c2O)nc2nc(O)nc(O)c12 765751185 RGQDLPHBMRNZSY-UHFFFAOYSA-N 405.208 2.143 10 20 HECD C[C@@]1(c2cccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2)NC(=O)NC1=O 769038116 BARXEHRNQJXKFL-MBSDFSHPSA-N 423.469 2.268 10 20 HECD CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 770109035 DIXUAMQWXZJTQC-UHFFFAOYSA-N 405.520 2.404 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc([C@]4(C)CCCOC4)n3)CC2)cc1 771080672 FBKVBJAQXFVESI-OAQYLSRUSA-N 400.479 2.038 10 20 HECD C[C@H](NS(=O)(=O)c1ccc2c(c1)ncn2C)c1ccc(N2CCOCC2)cc1 772928525 IXUFVBDNFVJVLG-HNNXBMFYSA-N 400.504 2.449 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2C[C@@H](CO)C[C@@H](OCCOC)C2)cc1F 774849314 DGQWNSWCQNVRKC-ZWKOTPCHSA-N 411.518 2.227 10 20 HECD COc1c([N+](=O)[O-])ccc(CNCc2ccc(CN3CCN(C)CC3)cc2)c1O 774973659 CWEVJNIIZIIOGY-UHFFFAOYSA-N 400.479 2.346 10 20 HECD C[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 775254352 HLIRAFWBKNDRCO-IERDGZPVSA-N 404.532 2.311 10 20 HECD COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 775370396 GAEBXKDSIDNQTF-LSDHHAIUSA-N 401.463 2.018 10 20 HECD CS(=O)(=O)c1cccc(C(=O)N2CCN(Cc3cccc(Cl)c3O)CC2)c1 775701151 CNSQJQHKLQEUAL-UHFFFAOYSA-N 408.907 2.407 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)C[C@](C)(O)c3ccccc3)CC2)cc1 778335339 DXISLVKDOXJZFX-QHCPKHFHSA-N 412.486 2.185 10 20 HECD COc1c(S(=O)(=O)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c(C)nn1C 778859402 LLLYFUKUPKSEQI-UHFFFAOYSA-N 420.466 2.402 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCCNC(=O)c1ccc(Br)cc1 779501149 WAWPFTZMWQLHHF-WAPJZHGLSA-N 405.248 2.420 10 20 HECD CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779519333 KMRCIGVFRIYEFK-NTMALXAHSA-N 411.502 2.400 10 20 HECD O=C(COC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)c1ccc(O)c(O)c1 783379675 XRTOLFMQBZBULG-UHFFFAOYSA-N 408.292 2.132 10 20 HECD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CN1C(=O)OC(C)(C)C 785439947 XULHRAMRTJEIQU-CVEARBPZSA-N 418.538 2.225 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NOC[C@@H]1CCOC1 788094738 BYWRUGNCFLEUHS-CYBMUJFWSA-N 403.401 2.309 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C3CCN(C)CC3)C2)cc1 788955594 UFRYIHFNDJALTH-FQEVSTJZSA-N 400.567 2.339 10 20 HECD CC[C@H](CSC)NC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789818727 KOHDXAJLUXSCFJ-IIAWOOMASA-N 411.543 2.313 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCC[C@@H]3C[C@H](C)O)CC2)cc1 791166662 ZVYMWTPBYXCXRY-SWECLWCZSA-N 415.534 2.052 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCc3ccccc3C(N)=O)cc2F)CC1 791572762 IDNQWAYYHHFOAF-UHFFFAOYSA-N 412.509 2.316 10 20 HECD CCOc1cccc(CNc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1O 796391199 GPKHKUHQWAEULP-UHFFFAOYSA-N 422.503 2.433 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)cn3C)cc2Cl)C1 800344410 RHXVWPZXMKIRJC-CYBMUJFWSA-N 424.954 2.492 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N(CCO)Cc2ccccc2)cc1F 804851871 RCRHMOUHOXIGFW-UHFFFAOYSA-N 401.482 2.309 10 20 HECD C[C@]1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 805758483 MKTPXGPDYSZRTN-VBKZILBWSA-N 411.449 2.058 10 20 HECD CN1CCOc2ccc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc21 806539199 JTTHLEXFXLXQID-SFHVURJKSA-N 408.502 2.147 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc(C4CC4)cs3)CC2)cc1F 806934328 DWRLLDPIRNIUIE-UHFFFAOYSA-N 404.467 2.456 10 20 HECD COC(=O)c1cc(C)c(NC(=O)C(=O)NCc2ccc(OC)cc2O)c(Cl)c1 807070741 XBOCBPUDUABWIB-UHFFFAOYSA-N 406.822 2.404 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc(N(C)C)cc1 807672566 DJUHFIYRTQKBBZ-JMGYQRAPSA-N 401.532 2.326 10 20 HECD CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)[C@H]2C1 808237668 AWZLTDCFURJMRB-CMKODMSKSA-N 418.513 2.109 10 20 HECD CCc1nnc(CNC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)s1 811967234 MWUMACQHCFENIH-UHFFFAOYSA-N 406.531 2.381 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1Cl 917735293 LLJHAFSMPOBNAQ-UHFFFAOYSA-N 416.864 2.183 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1C 917758104 HQYDCYFXIFHEJR-UHFFFAOYSA-N 409.489 2.052 10 20 HECD CNC(=O)c1ccc(C)c(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918031485 FLOGXXRKJVCFJS-GOSISDBHSA-N 423.517 2.378 10 20 HECD Cc1ccc(F)c(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918438606 ILSRDARJTUZLAW-UHFFFAOYSA-N 403.429 2.489 10 20 HECD C=CC(=O)Nc1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 919347880 XTUYFABCTCTZBP-UHFFFAOYSA-N 423.469 2.325 10 20 HECD Cc1nn(C)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1[N+](=O)[O-] 919986172 YRQMFPGPPZLEKZ-RYUDHWBXSA-N 405.430 2.319 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CO[C@@H]2CCOC2)NC(=O)OC(C)(C)C)cc1 1318924422 UATYXWUEENSCMT-QZTJIDSGSA-N 407.511 2.240 10 20 HECD COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(N(C)C)c(F)c1 1320620586 CMEVTHSWRZRXGD-UHFFFAOYSA-N 411.411 2.065 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799169391 OCKGJBOJKBFFQP-QGVMXNRZSA-N 408.882 2.001 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)c1cccc(O)n1 1800715951 ZTHGLTSGHZLNGE-CLLJXQQHSA-N 417.849 2.417 10 20 HECD Cc1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)c1 1804285799 UKEUSVTVMQIEBB-ZXRXUGKRSA-N 423.469 2.472 10 20 HECD Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1808580258 LRWMFFORMSIQMF-FOIQADDNSA-N 421.457 2.158 10 20 HECD CC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1826386629 SXNPQJWMCBJFBF-KRWDZBQOSA-N 403.479 2.095 10 20 HECD COc1ccc(N2CCC(NC(=O)NC[C@@H]3CN(CC(C)C)CCO3)CC2)cc1 110419666 XBWXRRBZYNIOIM-OAQYLSRUSA-N 404.555 2.320 10 20 HECD Cc1c(CNC(=O)C(=O)Nc2ccccc2Cn2cncn2)n(C)c2ccccc12 472781605 BFSUBEXQVKMHKF-UHFFFAOYSA-N 402.458 2.381 10 20 HECD COc1cccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1O 729859793 WFZNRVABWVPNEM-AWEZNQCLSA-N 410.517 2.240 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1cc(C(=O)O)ccc1F 748864996 LHQAOFZRKFAYKR-UHFFFAOYSA-N 408.451 2.181 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCN1Cc1ccccn1 749406378 OTHBFJXEIVYICU-QFIPXVFZSA-N 412.509 2.463 10 20 HECD CSC[C@@](C)(O)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 751069301 ITJLXGXGSLUMLS-INIZCTEOSA-N 416.546 2.098 10 20 HECD Cc1cc(C)c(O)c(CN2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1 754726677 UJSOJKHWBXTRAH-UHFFFAOYSA-N 402.516 2.371 10 20 HECD Cc1ccc([C@H](C)[C@H](O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764859551 QBOKNFVHSMEVMK-XJABCFGWSA-N 409.530 2.478 10 20 HECD O=C([C@@H](Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1)N1CCOCC1 764982829 YRROTXRFWPUEKZ-HSZRJFAPSA-N 409.530 2.083 10 20 HECD COc1cccc(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1O 768200046 KJRVYPZVZWWXKX-UHFFFAOYSA-N 421.475 2.035 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 768914615 BXMPYHQEKQKMMU-UHFFFAOYSA-N 408.451 2.342 10 20 HECD Cc1ccc(S(=O)(=O)NCCNC(=O)NCc2ccc(N3CC=CC3)cc2)s1 771984930 HFYKZUTVKULUPM-UHFFFAOYSA-N 420.560 2.210 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cnn(CC(F)(F)F)c3)CC2)cc1 772601730 LMXCHDKIIDLEFR-UHFFFAOYSA-N 418.441 2.401 10 20 HECD C[C@H](NS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1)c1ccc(N(C)C)cc1 773087242 HSCUMMRHQTYPNF-LBPRGKRZSA-N 400.497 2.335 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCCn2ccnc2)cc1 774473120 UQYSIIKLCBOBEI-UHFFFAOYSA-N 409.490 2.277 10 20 HECD CN1CCCc2cc(CNC(=O)Nc3ccc(C[C@H]4NC(=O)NC4=O)cc3)ccc21 775708529 OXPLHLOHVWZXDB-GOSISDBHSA-N 407.474 2.141 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccc(C(=O)NCCN2CCCC2)cc1 779512509 CKJGRHRRKSHDQX-UXBLZVDNSA-N 409.486 2.253 10 20 HECD Cc1ccnc(OC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 782819042 MBGILFRIHBILBT-UHFFFAOYSA-N 405.476 2.151 10 20 HECD COc1ccccc1OCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931146 GHYKRAKTQXYFQD-UHFFFAOYSA-N 411.502 2.497 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N(C)CCOC(C)(C)C)cc2F)C[C@H](C)O1 789816654 DUIZMUKHFCYJTJ-HOTGVXAUSA-N 423.529 2.329 10 20 HECD CC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)O1 789825389 LOKWNEOGKLLYRB-UIBIWLFHSA-N 421.513 2.081 10 20 HECD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC(=O)N(C2CC2)C1 790464045 ICKRRZXGLVXYAY-ZDUSSCGKSA-N 403.438 2.053 10 20 HECD C[C@H]1c2nncn2CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792379444 HIVJNPBVEFDCRU-ZDUSSCGKSA-N 401.426 2.069 10 20 HECD COc1ccc(CNS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)c(O)c1 795361602 CKUVWNYCIDRJCS-UHFFFAOYSA-N 408.451 2.254 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCc4cc(C)ccc4O3)nc12 796301509 WYKILRPLUFGVLF-QGZVFWFLSA-N 411.414 2.357 10 20 HECD C[S@](=O)c1ccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 797877805 DHYDQPHZTUXCOB-NDEPHWFRSA-N 400.544 2.492 10 20 HECD O=[N+]([O-])c1ccc(O)c(CNCCNS(=O)(=O)c2ccc(F)cc2Cl)c1 800895602 QBIZOVQDORUUFX-UHFFFAOYSA-N 403.819 2.161 10 20 HECD Cc1cc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)no1 803305905 OCHZNBWWZNLSHM-OXJNMPFZSA-N 412.490 2.361 10 20 HECD CNC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1 803677105 FXOFXZZEMDNLLM-HSZRJFAPSA-N 414.550 2.056 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315849 UABGXYJORSOFJR-IBGZPJMESA-N 416.566 2.161 10 20 HECD C[C@H](O)CN1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@H](C)C1 806457238 HBPRJMGOLSZUCL-OWSLCNJRSA-N 422.545 2.036 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289999 AWDDQRWWXPDCRE-AUSIDOKSSA-N 418.541 2.316 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 809129391 AMJJYYRSRVJHTK-GCJKJVERSA-N 403.523 2.054 10 20 HECD Cc1cc(C)c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)s1 814211349 ZXIRSMZESHCCJV-UHFFFAOYSA-N 404.491 2.235 10 20 HECD CC(C)[C@H](CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)N1CCOCC1 916254232 PPEDCLLSHBCBBV-NRFANRHFSA-N 404.555 2.021 10 20 HECD O=C(COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(O)c(O)c1 916595522 OCTQZDNFEILTOU-INIZCTEOSA-N 419.455 2.067 10 20 HECD COc1ncccc1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918286339 HBWIJEMLJAYEAM-OKILXGFUSA-N 416.453 2.098 10 20 HECD CC(=O)c1ccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 919155281 OEPPPNDQAMOQTI-UHFFFAOYSA-N 414.433 2.338 10 20 HECD Cc1cc(C(=O)CN2C[C@@H](C)OC[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920406463 PSJGMKZJUCYMPX-HUUCEWRRSA-N 405.520 2.033 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@H](CC(N)=O)C1 1322787343 XIXKHQLMHODBOX-HUUCEWRRSA-N 419.481 2.376 10 20 HECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)cc1F 1796600820 GLHBLVMJGPNDAK-QDMKHBRRSA-N 415.421 2.206 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)C1=CCCS1 1796930808 CLAKGRMWUXLAPF-ACHSLPGTSA-N 424.526 2.438 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)[C@@H]1CCC=CO1 1796934869 WCDUMVREWHIBDC-NFBUACBFSA-N 422.485 2.110 10 20 HECD Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817419366 RSQPMWUVRVCJNP-NSHDSACASA-N 414.443 2.390 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCCC23CN(C(=O)Cn2nccn2)C3)cc1 1845399125 SZUIPYOPBVKXJZ-UHFFFAOYSA-N 418.501 2.203 10 20 HECD CCc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n(C)n1 1845501627 JVCIDIFPGJALRO-UHFFFAOYSA-N 418.881 2.178 10 20 HECD COc1ccc(-n2nnnc2SCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 7354424 PJQOGJYFTGOFLS-UHFFFAOYSA-N 412.519 2.488 10 20 HECD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cccc(C(=O)NC2CC2)c1 409509861 KSWYTQCHUJKBAP-UHFFFAOYSA-N 401.488 2.233 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccc(C(F)(F)F)c2)SC1=S 727178076 RJTVXWBEYFKBQD-DHZHZOJOSA-N 410.464 2.456 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCCc3cnn(C)c3)cc2F)CC1 730127257 MUNIXDWKRVVOHJ-UHFFFAOYSA-N 402.518 2.133 10 20 HECD CN(C)C(=O)CN1CCC(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 731678850 OBIAEUQISOYTBB-UHFFFAOYSA-N 403.527 2.227 10 20 HECD O=C(COC(=O)CC[C@@H]1CCCCO1)NCc1ccc(N2CCOCC2)c(F)c1 732380747 BSHBNBFHYTWNNZ-KRWDZBQOSA-N 408.470 2.171 10 20 HECD CCC[C@@H](O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 740979719 XKDQJCZPIBZJOW-MRXNPFEDSA-N 422.503 2.019 10 20 HECD CC(C)[C@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)N1C[C@@H](C)O[C@H](C)C1 741021294 OTFHNJVVAWEYFG-JBYIUTFZSA-N 419.566 2.388 10 20 HECD O=C1CSc2ccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)cc2N1 741097157 MSTQIBBLEJLYGS-UHFFFAOYSA-N 408.483 2.362 10 20 HECD C=C1c2ccccc2C(=O)N1CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742920600 KUQASSSLIURRRZ-UHFFFAOYSA-N 420.513 2.060 10 20 HECD CC(C)c1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 743893249 RYEMQPQBGCUASD-UHFFFAOYSA-N 404.442 2.153 10 20 HECD Cc1cc(C(=O)CN2CCC(NC(N)=O)CC2)c(C)n1-c1ccc2c(c1)OCCO2 746484766 VJUPRGHRDBDPFA-UHFFFAOYSA-N 412.490 2.181 10 20 HECD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)cc1 748216814 IUDIZOZLMCREDA-UHFFFAOYSA-N 411.462 2.311 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(CC(=O)N3CCc4ccccc43)CC2)c1O 750816902 BWYLEROMIZHIPK-UHFFFAOYSA-N 411.477 2.441 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@@H](OC)C3(C)C)CC2)cc1 753349080 IUOQYDHXOYSABC-WOJBJXKFSA-N 404.555 2.320 10 20 HECD Cc1cc(C(=O)CN(C)C[C@H]2CCC[C@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 755060044 VXOFSLZAINALAE-OXQOHEQNSA-N 419.547 2.017 10 20 HECD C[C@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756440389 COOJRRUXFJFUBH-MJGOQNOKSA-N 415.559 2.340 10 20 HECD CC1(C2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)OCCO1 756681195 JOMCBEZKVSOSEG-UHFFFAOYSA-N 407.486 2.347 10 20 HECD COCCS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(N(C)C)cc2C)cc1 758792031 SVNYPUQDTDQXES-UHFFFAOYSA-N 419.547 2.481 10 20 HECD CC(C)C[C@H]1CCC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 760369740 OZHPCINTNRNIDY-QGZVFWFLSA-N 419.497 2.090 10 20 HECD CNS(=O)(=O)c1cccc(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)c1 765265369 GWROHEFSCDWBCP-HNNXBMFYSA-N 407.511 2.421 10 20 HECD O=C(CCc1nc(-c2ncccn2)no1)NCc1cccc(Br)c1O 765766833 CODYQIZCWLLOKF-UHFFFAOYSA-N 404.224 2.244 10 20 HECD C[C@H](NC1CCN(CCC(=O)N(C)C)CC1)c1ccc(N2CCOCC2)c(F)c1 765885112 LQBYNLZUDBPKPI-KRWDZBQOSA-N 406.546 2.256 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCN(C)CC3(C)C)cc2F)C[C@@H](C)O1 766999839 XWSSAELPYLUMMC-CALCHBBNSA-N 406.546 2.082 10 20 HECD O=S(=O)(c1c[nH]c2ncccc12)N1CCN(Cc2c(O)cccc2Cl)CC1 769021369 HVVLYHKYXLOXPO-UHFFFAOYSA-N 406.895 2.428 10 20 HECD CN(C)c1ccc(CN(CCC(=O)Nc2cccc(S(N)(=O)=O)c2)C2CC2)cc1 771790846 HNDBEYGKFSLQAD-UHFFFAOYSA-N 416.547 2.393 10 20 HECD CC(C)(C)n1nccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 772209795 SFADSCMEWJZOGD-INIZCTEOSA-N 400.479 2.490 10 20 HECD COc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 772930218 UXYJYPKXNBUTPT-UHFFFAOYSA-N 401.438 2.234 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccccc1OCC(=O)N(C)C 773756903 QHGSYUVIGUXSEB-CYBMUJFWSA-N 422.428 2.404 10 20 HECD CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362213 LPNQANFYJYSPNK-LJAQVGFWSA-N 418.515 2.442 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)N(C)C)c1 774951575 VUBHHSUFBBSMNQ-QFIPXVFZSA-N 424.545 2.113 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c1 775371499 YTZVBEZIQVQFBW-ZBFHGGJFSA-N 410.536 2.010 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3cc(F)ccc3O)CC2)cc1 778992950 MIKWBHYVPIRENM-UHFFFAOYSA-N 422.478 2.215 10 20 HECD COCc1cccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1 780408075 VFDGUWQPFRRRHH-UHFFFAOYSA-N 403.504 2.302 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(CS(C)(=O)=O)cc3)c2)CC1 781046311 CJVBXRHDQBJHDV-UHFFFAOYSA-N 415.515 2.152 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cccc(C)c3F)CC2)cc1 781713977 SRCPRWXMZDJVTA-UHFFFAOYSA-N 407.511 2.243 10 20 HECD Cc1nn(C(C)(C)C)cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 785354058 IOHZSDXLXZPNRU-UHFFFAOYSA-N 404.536 2.111 10 20 HECD O=C(COC(=O)/C=C/c1cncc(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 785854292 OYSGYOOAMBXPJE-DUXPYHPUSA-N 417.412 2.069 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3COc4cc(C)c(C)cc43)nc12 786957842 HIFTYIBJALEBSJ-MRXNPFEDSA-N 411.414 2.448 10 20 HECD O=C(NCCc1cn2c(n1)CCCC2)C(=O)N(Cc1ccco1)Cc1ccccc1O 788846863 LEZITODMBVOJFU-UHFFFAOYSA-N 422.485 2.406 10 20 HECD CS[C@@H]1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 789799040 MAPWASMRSVHUNE-JKSUJKDBSA-N 409.527 2.069 10 20 HECD CC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 793733245 LVQCQOJLISUFSK-HKUYNNGSSA-N 414.550 2.043 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](C(N)=O)O3)cc2Cl)C1 799949887 CAPXXMDUFPMSTL-DDUZABMNSA-N 408.930 2.408 10 20 HECD COCCN1CN(Cc2cc(Br)cc(Br)c2O)CC1=O 802658579 BQHCTBGJXRFONR-UHFFFAOYSA-N 408.090 2.165 10 20 HECD CC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803301811 ZFONRDSATMQZFG-PBHICJAKSA-N 402.520 2.424 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCC(C)(C)C(=O)OC)cc2F)CC1 805767125 FWNRSZFAAVXVKK-UHFFFAOYSA-N 408.518 2.356 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1(S(C)(=O)=O)CCCC1 805839907 JKUSZODVYFXOPS-UHFFFAOYSA-N 409.552 2.022 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NCc1cc(F)ccc1O 809682200 GTQJVCAOUMXLFH-UHFFFAOYSA-N 409.483 2.088 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC(O)(c2ccc(F)cc2)C1 812009009 LHGQHROYFAKSEG-UHFFFAOYSA-N 417.456 2.339 10 20 HECD COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc2cccnc12 815410251 XCSHNECSXTVVDG-UHFFFAOYSA-N 420.469 2.335 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COc3cccnc3[N+](=O)[O-])cc2F)C[C@H](C)O1 917180612 GLQHENXEPVJIKQ-KBPBESRZSA-N 418.425 2.438 10 20 HECD O=C(Nc1cccc2c1OCCO2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 918298291 YMNQEFDPZJDJQJ-INIZCTEOSA-N 412.442 2.310 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl 918305558 KKPGGKIPOTXNHH-UHFFFAOYSA-N 423.922 2.407 10 20 HECD O=C(NCCc1ccc(F)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918777973 UKHMUQUPLMUION-UHFFFAOYSA-N 405.495 2.102 10 20 HECD CC(C)C(=O)Nc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 919810848 NDEZWKRSZWNITH-UHFFFAOYSA-N 405.476 2.288 10 20 HECD Cc1cccc(OC[C@H](O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 920043027 DYRYDRIYSQVCDJ-GOSISDBHSA-N 417.481 2.210 10 20 HECD COc1cc(N2CCN(C(=O)N[C@@H](C)c3cnn(C)c3C)CC2)cc(OC)c1OC 1320154734 YVADMFZQCOCULY-AWEZNQCLSA-N 417.510 2.347 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)cc1 1344522707 CIRZOPLSJVZNOS-UHFFFAOYSA-N 423.922 2.349 10 20 HECD CCCCC[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787295026 LTOSIJHFYDGMDX-FZCLSBEQSA-N 419.522 2.303 10 20 HECD Cc1nn(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1793781608 XVZULOATEIMVBO-BTTYYORXSA-N 418.881 2.359 10 20 HECD CC(=O)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1822338712 CYWGMYWZNIKNRZ-NHYWBVRUSA-N 415.450 2.137 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccnc(C(F)(F)F)c2)C1 1842327823 ZOYKDXAHRONNLL-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1c(CNC(=O)C(=O)N(C)C2CCN(c3cnccn3)CC2)n(C)c2ccccc12 564003472 NFBRUTUGUMXPPY-UHFFFAOYSA-N 420.517 2.020 10 20 HECD Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccn(C)n3)cc2)cc1 727354536 OILNLWXIWVSJAG-UHFFFAOYSA-N 406.489 2.330 10 20 HECD C[C@H](O)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 729473251 UDGHBNLRSJFJNN-KRWDZBQOSA-N 407.530 2.294 10 20 HECD CC1(C)Cc2cc(/C=C3\SC(=S)N(CCNS(C)(=O)=O)C3=O)ccc2O1 729687891 FRWINDISEDNTEP-ZROIWOOFSA-N 412.558 2.151 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4ccnc4)nc3)cc2F)CC1 730235229 QFFFHZKKJBUFOF-UHFFFAOYSA-N 408.481 2.478 10 20 HECD O=C(c1cc(S(=O)(=O)NCCCSc2nccs2)c[nH]1)N1CCCC1 733899342 GNBITKRBQHTWFR-UHFFFAOYSA-N 400.551 2.168 10 20 HECD C[C@H](NC(=O)N1CCC(N(C)CCCO)CC1)c1ccc(N2CCOCC2)cc1 741080365 ICLDXNYTXYVEJA-SFHVURJKSA-N 404.555 2.072 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnc4c(c3)c(C)nn4C)CC2)cc1 743294454 JUEPRQATIYQSKC-UHFFFAOYSA-N 423.521 2.229 10 20 HECD CC(C)(C)OC(=O)N1CC(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 751780610 FZJPFCWKMBAIDK-UHFFFAOYSA-N 418.538 2.314 10 20 HECD Cn1nnc2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cnc21 755528601 FOLGYTNSNOLUFI-OAHLLOKOSA-N 400.870 2.117 10 20 HECD COc1ccc(N2CCN(CCN3C(=O)N[C@H](c4ccccc4F)C3=O)CC2)cc1 761182670 GIESPJCZHHXFMA-HXUWFJFHSA-N 412.465 2.249 10 20 HECD COc1cc(N2CCN(Cc3ccc(C(=O)N(C)C)[nH]3)CC2)cc(OC)c1OC 761218772 HWFMSAPEKZMUTR-UHFFFAOYSA-N 402.495 2.065 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc([N+](=O)[O-])c1 761597298 YRPQOAOYGGRFAL-OAHLLOKOSA-N 417.487 2.250 10 20 HECD O=C(CN1CCCC2(C1)OCCO2)Nc1cccc2c1C(=O)c1ccccc1C2=O 761691736 PYMTUCTWTIHARM-UHFFFAOYSA-N 406.438 2.239 10 20 HECD COc1ccc2oc(/C=C3/SC(=S)N(CCNS(C)(=O)=O)C3=O)cc2c1 763281219 DNCVMZILPLBFSI-NTEUORMPSA-N 412.514 2.192 10 20 HECD COc1cccc(CNC(=O)C2(C(=O)NCc3cccc(OC)c3O)CCC2)c1O 769498834 POVBVRFORHWWDI-UHFFFAOYSA-N 414.458 2.218 10 20 HECD Cc1cc(O)cc(=O)n1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771064077 HISLBBBABYUOAC-INIZCTEOSA-N 405.882 2.002 10 20 HECD CC[C@@H](NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccc(N(C)C)cc1 773015440 MPZZUTXWFQMUIM-HXUWFJFHSA-N 405.568 2.380 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 774362879 GRLJSLDGFGPNHD-UHFFFAOYSA-N 414.849 2.293 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)c1 775528566 ZLKSOKGPTIMQRT-ZDUSSCGKSA-N 424.461 2.316 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(Br)n3)CC2)cc1 775605285 ZFPAXTPHAWIUTR-UHFFFAOYSA-N 419.323 2.405 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4n[nH]cc4c3)CC2)cc1 778227432 XMCCPHYZKZBLBT-HJWRWDBZSA-N 405.458 2.415 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](OC)c3ccccc3)CC2)cc1 778228953 TWYUUQCMNNPCOM-OTDUKCBNSA-N 423.513 2.404 10 20 HECD CCCn1cc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1=O 778243018 OTYOZKRQRWJIPQ-PKNBQFBNSA-N 424.501 2.110 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)OCc3ccccc3)CC2)cc1 778393069 XRFHYLJRGQDFME-OUKQBFOZSA-N 409.486 2.490 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1F 778596938 RTYVCKCXHPHMIM-UHFFFAOYSA-N 402.401 2.170 10 20 HECD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 786424255 OJZKZFWWBFKGHQ-UHFFFAOYSA-N 415.494 2.039 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3C[C@H](C)O[C@]4(CCOC4)C3)cc2F)CC1 792991604 ADEAREVSSPVELT-HTAPYJJXSA-N 420.529 2.057 10 20 HECD CCN1CCN(S(=O)(=O)c2cccc(NCc3cccc(OC)c3O)c2)CC1 796400743 YMRRGPALCGTWHA-UHFFFAOYSA-N 405.520 2.339 10 20 HECD COc1ccccc1N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 803420741 PGMYIAYCWYGAQN-UHFFFAOYSA-N 424.545 2.471 10 20 HECD Cc1nc2ccc(NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)nn2n1 804373209 QRJGGDSJOWBNMZ-UHFFFAOYSA-N 419.468 2.301 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)cc1F 804852732 FGKAVPNWQAGWCT-AWEZNQCLSA-N 417.529 2.386 10 20 HECD C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 806493908 IBUUDWMRCPESBR-LMNJBCLMSA-N 413.566 2.157 10 20 HECD C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290002 AWDDQRWWXPDCRE-XXBNENTESA-N 418.541 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3cc([N+](=O)[O-])c(=O)c4ccccc43)CC2)cc1 813578986 NIDFFGDNIATFQL-UHFFFAOYSA-N 422.441 2.267 10 20 HECD Cn1c(=O)c(CNC(=O)NCc2ccc(N3CCOCC3)cc2)cc2ccccc21 813600556 SMGLIWIHQGKQDF-UHFFFAOYSA-N 406.486 2.375 10 20 HECD C[C@H]1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC[S@]1=O 821568970 RNQYUBVSJJLABH-CNVKORTGSA-N 411.543 2.492 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)NC3CCN(S(C)(=O)=O)CC3)c2C)cc1 913087300 WQSLESUSEUHZML-UHFFFAOYSA-N 405.520 2.257 10 20 HECD CC(=O)Nc1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918122840 NCWWYATZXUIJNF-IBGZPJMESA-N 423.517 2.346 10 20 HECD COc1cc(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1C 918339052 AWHXZXKTFUMTNP-UHFFFAOYSA-N 402.516 2.097 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(=O)c1ccccc1 918371569 HFYJLGKUTNEKAM-FXAWDEMLSA-N 422.529 2.213 10 20 HECD Cc1cc(C(=O)OCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c(C)n1-c1ccccn1 919077763 XNYYWBYUIVGZCQ-INIZCTEOSA-N 412.490 2.163 10 20 HECD COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(Br)cc(Br)c1O 1320989995 WAAJTVXRQXMIQK-MWLCHTKSSA-N 409.074 2.025 10 20 HECD CCOc1ccc(S(=O)(=O)NCC(=O)NCc2ccc(N3CCCC3)cc2)cc1 1324159784 YNHUCYCSUAGBCV-UHFFFAOYSA-N 417.531 2.280 10 20 HECD Cn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1794921543 FBUKFWTWLYMXRL-ZURAMSNBSA-N 411.458 2.107 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)[C@H]1CCCOC1 1800720101 ZWTKAXVCYHPNKF-MHEUCROKSA-N 408.882 2.430 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C1=CCCC1 1816722707 VBOKZKRAVSMYPC-GFCCVEGCSA-N 400.460 2.285 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccc(F)cc2)C1 1844933055 DUEGTZCAPPOLBX-WEVVVXLNSA-N 412.417 2.473 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccccc3F)CC2)cc1 12068985 YQWUNXXCNRZRLK-UHFFFAOYSA-N 407.511 2.325 10 20 HECD COc1cccc(C[C@H](C(=O)N2CCOc3cc(N(C)C)ccc32)n2nnnc2C)c1 475932548 OPFNKXVVUBIPIU-HXUWFJFHSA-N 422.489 2.266 10 20 HECD COc1ccc([C@@H](CNCc2cc3c(cc2O)OCO3)N2CCOCC2)cc1OC 725841967 TWTCKBTYGOYTFN-QGZVFWFLSA-N 416.474 2.301 10 20 HECD CCn1nc(C)c(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 727601289 SHJQSLRZMHROEX-SFHVURJKSA-N 412.538 2.221 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 727903005 CYGSGHRJUBFEEY-BFYDXBDKSA-N 408.470 2.025 10 20 HECD NC(=O)[C@@H]1CCCN(CCCNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 729684876 YBUWDLCTGJXUJS-GOSISDBHSA-N 403.527 2.262 10 20 HECD CN(C)c1nc(N)nc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)n1 731034922 OKNVYGIRKKYYIL-UHFFFAOYSA-N 413.526 2.497 10 20 HECD COc1cccc(CNC(=O)[C@@H](CCSC)NC(=O)Cc2ccccc2)c1O 732829847 GGKHWIDKPYNWKQ-QGZVFWFLSA-N 402.516 2.498 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1O 737278675 NHZUTWIEGWBOCQ-OAHLLOKOSA-N 413.474 2.049 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 742279798 XGLLDXHFZPSSLW-UHFFFAOYSA-N 422.478 2.236 10 20 HECD CCOC(=O)CCS(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742334741 SNIFQAGVKVPRCO-ZDUSSCGKSA-N 406.451 2.129 10 20 HECD CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745819515 AATBVFARMADEJX-ZIAGYGMSSA-N 419.494 2.379 10 20 HECD COCCCn1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)n1 754936683 HDJBCNKQKXDMKZ-UHFFFAOYSA-N 413.522 2.411 10 20 HECD Cc1cc(C(=O)CN(C)C[C@@H]2CCC[C@H]2O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 755060037 VXOFSLZAINALAE-OXJNMPFZSA-N 419.547 2.017 10 20 HECD COc1cc(N2CCN(c3nc(C(C)C)nc(N(C)C)n3)CC2)cc(OC)c1OC 758933846 BMKTXMDFOYJHLM-UHFFFAOYSA-N 416.526 2.413 10 20 HECD COc1cc(N2CCN(C(=O)c3csc4cncn34)CC2)cc(OC)c1OC 759219692 COSSPMAYOYOSFI-UHFFFAOYSA-N 402.476 2.384 10 20 HECD COc1cc(N2CCN(CCn3cnc4ccccc4c3=O)CC2)cc(OC)c1OC 759877261 FMMBZQPAAQWCDO-UHFFFAOYSA-N 424.501 2.245 10 20 HECD C[C@H](OC(=O)C[C@@H]1COC(=O)C1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767602528 RDBDLVIOOGVSGI-QWHCGFSZSA-N 421.405 2.285 10 20 HECD C[C@@H](NC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1)c1ccc(N2CCOCC2)cc1 768977956 USQIVBIJOSJKDA-CMJOXMDJSA-N 422.485 2.069 10 20 HECD COCCN1CCN(C(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1=O 769002827 CLNAJIRMDOTGEN-UHFFFAOYSA-N 409.446 2.358 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 772701036 NJQBYEWWFGCQTA-SCTDSRPQSA-N 411.520 2.435 10 20 HECD COc1ccc(CNC(=O)[C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)cc1OC 772777714 XUNIBFYAGVOTBC-XURPKSDJSA-N 401.415 2.376 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cn2cc(Br)cn2)on1 773747732 GSYRFOGECMSDNT-SNVBAGLBSA-N 421.251 2.454 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NCCc3cccs3)cc2F)CC1 775095301 HQLBNJBZDNTKSA-UHFFFAOYSA-N 418.538 2.004 10 20 HECD O=C(CN1CCOCC2(CCCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 775850097 SSYLDYXHCUTPAK-UHFFFAOYSA-N 405.514 2.171 10 20 HECD C[C@@H]1C[C@H](CCNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCO1 784509657 HKGHSSWQAVBAMX-ZHALLVOQSA-N 402.539 2.393 10 20 HECD COc1ccc(Cn2cc(C(=O)OCC(=O)c3ccc(O)c(O)c3)cn2)cc1OC 784831006 XXOMUMJJPMGSRQ-UHFFFAOYSA-N 412.398 2.400 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cc(F)ccc1F 787036146 FVMATJJLAXIJRA-UHFFFAOYSA-N 403.429 2.076 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(Cc1ccccc1)[C@@]1(CO)CCOC1 787674949 IGHOVMMESGJLAP-XMMPIXPASA-N 411.546 2.365 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N(Cc1ccc(F)cc1)C1CC1 788312534 IIXGOVDHEPMZGO-UHFFFAOYSA-N 411.477 2.470 10 20 HECD C[C@H](NC(=O)C(=O)NCCCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 788893468 RGAQKRVDINUHNB-HNNXBMFYSA-N 406.527 2.303 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC(=O)N(CC4CC4)C3)cc2F)C[C@@H](C)O1 789830323 NXIGUDPWZXZPGO-HUUCEWRRSA-N 404.486 2.161 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@H](C(N)=O)c2cccc(Br)c2)c1O 793265163 GVEHKGZFAITNIV-ZDUSSCGKSA-N 410.224 2.388 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 793689890 PQWGDKCKGIGCAG-IRXDYDNUSA-N 407.426 2.306 10 20 HECD CC(=O)c1cc(CN(C)Cc2nncn2C(C)C)c(O)c(CN2CCOCC2)c1 793811813 XJLYIJIOULXOEU-UHFFFAOYSA-N 401.511 2.231 10 20 HECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 800296897 ZWKMJCXAASRUOH-XFPUZKTBSA-N 422.497 2.412 10 20 HECD O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)N1CC[C@]2(CCOC2)C1 803447950 CJGFWRLYWIYQQV-NRFANRHFSA-N 423.460 2.012 10 20 HECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806234403 KZGLSBQGOOIUSH-YLJYHZDGSA-N 424.501 2.192 10 20 HECD COc1cc(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)cc(C(=O)O)c1OC 917857737 IAMKOICMTZYOTF-UHFFFAOYSA-N 408.476 2.289 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1 1117741914 JBAXNQNSHUOKOG-UHFFFAOYSA-N 418.441 2.349 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)C1 1319764341 AYXKMFVSGJVQSA-HXUWFJFHSA-N 422.529 2.155 10 20 HECD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2O)C3)no1 1795220446 YZRPTYVJDVTNPO-PLCSWTFUSA-N 413.430 2.065 10 20 HECD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)o1 1807993715 MNXNBHFXXGEBOM-YWZLYKJASA-N 422.441 2.423 10 20 HECD O=C(c1cccc2ncccc12)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249570 ZMUHVWJMQCUNHG-UHFFFAOYSA-N 404.426 2.172 10 20 HECD C[C@H](NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C)c1ccc(N2CCOCC2)cc1 65277606 NKTZMJDYVORSQF-AWEZNQCLSA-N 417.487 2.008 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)CCN1CC(F)F 571545835 OHTJMJMJVRYSLI-HNNXBMFYSA-N 406.477 2.291 10 20 HECD Cc1c(CNC(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)n(C)c2ccccc12 576367371 YVHAROMCCMYUOD-LJQANCHMSA-N 406.530 2.392 10 20 HECD CNC(=O)COc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 729582007 SOLUDDWHSJGAIM-UHFFFAOYSA-N 412.490 2.312 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C3(C(=O)NC4CC4)CCC3)cc2F)CC1 730236005 SGCXUWVYWHXISS-UHFFFAOYSA-N 402.514 2.033 10 20 HECD COc1ccc(N2CCCN(C(=O)c3sccc3S(=O)(=O)N(C)C)CC2)cc1 731977541 NAWKRLMJLOABBO-UHFFFAOYSA-N 423.560 2.360 10 20 HECD O=C(C[C@@H]1C=CS(=O)(=O)C1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742800336 IXBASKLVOHIRCE-KBPBESRZSA-N 400.447 2.321 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C/c2ccc(OCC(F)F)cc2)SC1=S 743283040 USIYGDIBSYADKW-WQLSENKSSA-N 422.500 2.081 10 20 HECD CC(C)NC(=O)NC(=O)[C@H](C)OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 744473415 DWTHWFHNSKYDKN-LBPRGKRZSA-N 408.410 2.242 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCNS(=O)(=O)c1cccs1 747437317 HOILFPGALRIBIS-UHFFFAOYSA-N 410.565 2.324 10 20 HECD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccccc3O)c2)C[C@H](C)O1 748354264 XQRZPAJTLKNYCY-GJZGRUSLSA-N 404.488 2.120 10 20 HECD CSc1ccncc1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 750253950 UIRBUDVLYMDOQV-UHFFFAOYSA-N 418.494 2.159 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(N(C)C)n1 750398596 JGNLEYJQPHTUFI-KRWDZBQOSA-N 410.522 2.479 10 20 HECD Cc1ccc(C(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c(O)c1O 751533694 BJZBXUUKBOTIKW-UHFFFAOYSA-N 404.488 2.237 10 20 HECD COCc1ccccc1NC(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 754209621 BARZDMZDSBKHEG-UHFFFAOYSA-N 401.438 2.268 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCCC[C@@H]3CCCCO3)CC2)cc1 760670789 WKCHSCCGONJHSS-NRFANRHFSA-N 404.555 2.466 10 20 HECD COc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1-n1nnnc1C1CC1 761657034 MITRBBYWOYWUHE-UHFFFAOYSA-N 410.434 2.324 10 20 HECD CN(C)C(=O)NCCN(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 763111410 VLYNZNKPGRFYSS-CQSZACIVSA-N 413.469 2.169 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc5nccn5c4)n3)CC2)cc1 771083041 MWBIZGXIWGNRET-UHFFFAOYSA-N 418.457 2.284 10 20 HECD C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(N2CCN(C)CC2)cc1 775664630 NNZIESBWXMVBBP-KRWDZBQOSA-N 402.564 2.279 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOc4ccccc4C3)CC2)cc1 778243994 BETLTNUXEBRIRB-KHPPLWFESA-N 421.497 2.321 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(Br)cn3C)cc2)CC1 786659470 KYLSIEYNWRBXCH-UHFFFAOYSA-N 419.323 2.386 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)C[C@H]3CCCOC3)cc2F)C[C@@H](C)O1 792749227 QLHVRQMUAFUZTB-INMHGKMJSA-N 400.516 2.285 10 20 HECD C[C@@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)NCCF 800710829 XRIKKGVTEHPSKR-CHWSQXEVSA-N 402.417 2.030 10 20 HECD Cc1cn(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1[N+](=O)[O-] 800870748 SNQGXPBOQZDKPX-ZIAGYGMSSA-N 405.430 2.169 10 20 HECD COC[C@H]1CCCN1C(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803450464 HZBVKLHGWWNPLV-MRXNPFEDSA-N 411.449 2.010 10 20 HECD CC1CCN([C@H](C)CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CC1 803542306 VLDJVGSUOLGNET-UYAOXDASSA-N 417.550 2.136 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCCN(c2ncccc2F)CC1 806277267 VXUKRBAUMLEWJA-UHFFFAOYSA-N 423.539 2.015 10 20 HECD COc1ccc(N2CCC(NC(=O)N3C[C@H](N4CCOCC4)C[C@H]3C)CC2)cc1 806683792 MSGOMNDIPRRYQR-YLJYHZDGSA-N 402.539 2.169 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 807100600 LAGLDRBGKKZMDI-JOCHJYFZSA-N 408.546 2.410 10 20 HECD COCCOc1cccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c1 807387775 WKAQSYJUSKJAJJ-UHFFFAOYSA-N 423.263 2.435 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O 807654008 JSYGYFOVAIXWCB-UTKZUKDTSA-N 422.529 2.411 10 20 HECD C[C@H](NC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807676424 GKDJCRYIEAOBLR-CABCVRRESA-N 406.527 2.301 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 808220537 IMGMNWLSUHDAFJ-OAQYLSRUSA-N 422.529 2.018 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc4c(c3)CCCC4=O)nc12 815374845 ZKPRPTYQJAOAOX-UHFFFAOYSA-N 409.398 2.488 10 20 HECD Cc1nc2c(cc1C(=O)NCc1ccc(N3CCC[C@H](C(N)=O)C3)cc1)c(C)nn2C 917834663 MULLHSXPZSYGHX-KRWDZBQOSA-N 420.517 2.217 10 20 HECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccco1 918118531 TYPQUGJHJAPRTO-IEBWSBKVSA-N 413.522 2.083 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1 920481981 ASSGALXUSLXKFB-UHFFFAOYSA-N 404.491 2.399 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3ncccn3)CCC2)cc1)c1cc(O)nc(O)c1 1788426253 ARCVIIXALCZXTI-UHFFFAOYSA-N 405.414 2.344 10 20 HECD C/C(=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)C(=O)O 1804174032 KRJKZUGBBFIXSJ-MWYMOPEQSA-N 408.838 2.034 10 20 HECD Cc1ncoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426844 KCJNSMPEEALKJX-MRXNPFEDSA-N 414.462 2.336 10 20 HECD Cc1onc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1C 1841739056 MRZXUJXGPQJQKC-UHFFFAOYSA-N 405.838 2.487 10 20 HECD Cc1ccnc(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1843478412 AOWPZWSMKCRJTF-GQCTYLIASA-N 409.442 2.037 10 20 HECD O=C(c1ccc(F)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038153 CZUZQQABNOKCNO-WEVVVXLNSA-N 412.417 2.473 10 20 HECD O=C(CNC(=O)c1ccccc1I)NCc1ccccc1O 109678048 RYVYAFAZSFGEFE-UHFFFAOYSA-N 410.211 2.043 10 20 HECD COC(=O)c1c(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)[nH]c(C(C)=O)c1C 725983723 ZTPSUWHGNUFPKK-UHFFFAOYSA-N 413.474 2.212 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CNC(=O)c3ccc(O)cc3)cc2F)C[C@@H](C)O1 727484159 YCWVFJWDEHBPDD-HUUCEWRRSA-N 415.465 2.191 10 20 HECD CC(=O)NCC(=O)N1CCc2cc(C(=O)NCCCSc3nccs3)ccc21 735660529 ADGSAOOGQQPCQK-UHFFFAOYSA-N 418.544 2.081 10 20 HECD CCOc1ncccc1CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742948552 YFSYLZYTIINVAR-UHFFFAOYSA-N 413.522 2.110 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)OC)c2)cc1 745977829 BGSUUZNGSYPKQD-UHFFFAOYSA-N 412.489 2.344 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)cc1 749254548 UNBSGANUMLTLEH-XLIONFOSSA-N 411.506 2.036 10 20 HECD CCOC(=O)c1cc(NC(=O)NCc2cccc(OC)c2O)cc(S(C)(=O)=O)c1 753547610 XNBUBKYSWJVFFY-UHFFFAOYSA-N 422.459 2.303 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2 753635664 GSZZODWNBSMRFR-CQSZACIVSA-N 403.500 2.498 10 20 HECD COC(=O)C[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 754538096 JZQKNNBEYZIKBA-IBGZPJMESA-N 406.438 2.332 10 20 HECD COC(=O)C12CCC(C(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)(CC1)C2 759322521 KYOCWUUITGAYDI-UHFFFAOYSA-N 413.518 2.095 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)N[C@@H](Cc4ccccc4)C3=O)CC2)cc1 760948090 CTXHORCJIPGQLV-QFIPXVFZSA-N 422.529 2.370 10 20 HECD C[C@H](CCS(C)(=O)=O)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 762014051 ZDRXQBJMSCUUHP-RBSFLKMASA-N 415.531 2.062 10 20 HECD O=C1CSC(=O)N1Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765069037 VTPORTVNRZPYKC-UHFFFAOYSA-N 404.429 2.219 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)COc2ccc(Cl)cc2)c1 767304714 CSWOSFFXRWQBJL-UHFFFAOYSA-N 413.835 2.222 10 20 HECD COc1cc(OC)cc(-n2nnnc2CN(C)Cc2cc(OC)c(OC)cc2O)c1 768463017 FAKACXHYLGJXHF-UHFFFAOYSA-N 415.450 2.034 10 20 HECD O=C(Cc1ccccc1)NCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768912612 PTNLUCGIKDZHES-LJQANCHMSA-N 415.921 2.485 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769022818 GMSLSYIROSHKDH-UHFFFAOYSA-N 411.506 2.078 10 20 HECD COc1cccc(OC)c1S(=O)(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772712308 GPARAUKMOQZQOL-UHFFFAOYSA-N 420.531 2.391 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCC(C(=O)NCC(C)(C)CN(C)C)CC2)c1O 774853118 NKZXCBMPKJEYME-UHFFFAOYSA-N 422.526 2.225 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 775370400 MLQMASDLTDFVQN-OAHLLOKOSA-N 417.481 2.344 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)NCC(=O)N[C@H](C)c2ccc(F)cc2)c1 775373187 OTUISUOZBIRFSQ-KGLIPLIRSA-N 403.454 2.184 10 20 HECD CNC(=O)[C@@H]1CN(CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)CCO1 782097433 BRZMSMBFUPVJAA-IBGZPJMESA-N 421.444 2.325 10 20 HECD Cc1ncc2c(n1)CC[C@@H](NC(=O)C(=O)NCc1ccc(N3CCC(C)CC3)cc1)C2 786673873 NEQYOJZCAJMHPO-HXUWFJFHSA-N 421.545 2.311 10 20 HECD CCN1CCCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1=O 786813511 OYZYULIUKSKWEJ-UHFFFAOYSA-N 417.216 2.333 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CCOc3cccc(C=O)c3)cc2)CC1 787318152 CVISQSASLKLLSG-UHFFFAOYSA-N 409.486 2.253 10 20 HECD COCc1ccc(CNC(=O)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cc1 787504675 LZDWNHCHQHCYOT-UHFFFAOYSA-N 411.502 2.243 10 20 HECD CC(C)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCS1 789840864 OYGXYOXJVZVKIK-IBGZPJMESA-N 423.554 2.003 10 20 HECD COCCN(C)c1ccc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 790954790 YQGUIELGVBGYRH-HXUWFJFHSA-N 411.550 2.156 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1ccn(-c2ccccc2)n1 793655201 PAQFHLOYIQQURF-UHFFFAOYSA-N 401.517 2.244 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccc(N2CCOCC2)cc1 803303970 BJUZDTSWZDALLG-FOIQADDNSA-N 409.486 2.210 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C 804262830 BAYZUVPAXCMGMZ-GOSISDBHSA-N 418.538 2.227 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C 806516131 YOECFKQRUGFVGF-HNNXBMFYSA-N 406.527 2.097 10 20 HECD O=C(CNC(=O)c1cc(O)cs1)Nc1ccc(I)cc1 807514187 KUQXWRXDPRVJNW-UHFFFAOYSA-N 402.213 2.427 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)[C@@H](O)c3ccccc3)CC2)cc1 813850922 OYHZMHYPMOJEBO-NUAVTCJJSA-N 423.513 2.138 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)NC(=O)CO4)cc2)C1 918031067 IVUZEUYOXVANNQ-OAHLLOKOSA-N 423.473 2.041 10 20 HECD O=C(NCc1ccc(Cn2cncn2)cc1)NCc1ccc(N2CCOCC2)c(F)c1 918201914 WGKNFXDHOAAHRI-UHFFFAOYSA-N 424.480 2.302 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)C3(F)CC3)cc2)CCC1 1791156308 QWCVVNKGOBVTGP-UHFFFAOYSA-N 421.519 2.483 10 20 HECD Cc1occc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721494 MEHFFMBJHSBTRQ-LLVKDONJSA-N 414.443 2.390 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCc3c(C)noc3C)CC2)cc1 148237239 UNHXSDDDYBLRAU-UHFFFAOYSA-N 401.511 2.312 10 20 HECD COc1ccc(N2CCCN(S(=O)(=O)c3cccc4c3OCCO4)CC2)cc1 725824999 BNHCZCMEFKQUCV-UHFFFAOYSA-N 404.488 2.367 10 20 HECD Cn1cc(Br)cc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 728165990 YIZDKOGEEWBUOJ-CQSZACIVSA-N 419.323 2.419 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)c1 729062342 QMUKOWMAZGXRNX-QWHCGFSZSA-N 415.446 2.190 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1 734074219 LVEQWZNFXPFEDE-UHFFFAOYSA-N 411.458 2.200 10 20 HECD CN1CCCc2cc(CNC(=O)N3CCN(c4ccc(C(N)=O)cc4)CC3)ccc21 735580045 OJSJMXMNQJAHIO-UHFFFAOYSA-N 407.518 2.200 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)Cc3c(C)noc3C)CC2)cc1 738462506 UXLAJZJIXQERGV-MRXNPFEDSA-N 415.538 2.352 10 20 HECD CNC(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 742799434 AQZLSVQJNYPRKD-AWEZNQCLSA-N 404.417 2.441 10 20 HECD COc1ccc(C(=O)NCC(=O)NCc2c(O)ccc3c2CCCC3)cc1[N+](=O)[O-] 743717486 NNALWVWXILONNQ-UHFFFAOYSA-N 413.430 2.234 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 748856671 QEILEDLDPBHXSW-GFCCVEGCSA-N 407.268 2.279 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)CN3CC[C@@H](S(=O)(=O)NC)C3)c2C)cc1 750213807 CQWPOWDOPRTQGJ-LJQANCHMSA-N 419.547 2.299 10 20 HECD O=C(NCc1ccccc1O)C(=O)Nc1ccc(F)cc1I 750255460 LJYGJXKJGYNPST-UHFFFAOYSA-N 414.174 2.391 10 20 HECD C[C@]1(C2CC2)NC(=O)N(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 751303158 UTJJHGCZERBNNB-OAQYLSRUSA-N 404.430 2.055 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)NCc2ccc3c(c2)CCCN3C)cc1 751385908 BLTOBMYMHKFWAY-UHFFFAOYSA-N 423.513 2.473 10 20 HECD C[C@H](CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCCC1 753121154 JMSMSQLJDFRFGN-QUCCMNQESA-N 415.582 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccc3-n3cccn3)CC2)cc1F 754215988 RKFPLIJXSIHRHN-UHFFFAOYSA-N 423.448 2.307 10 20 HECD C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)c(F)cc1O 756417239 LXQPMDZXWCASRT-JTQLQIEISA-N 424.270 2.360 10 20 HECD COCCNC(=O)[C@H](CC(C)C)NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 756690385 SETRJGJLNPQWEI-XLIONFOSSA-N 420.554 2.061 10 20 HECD C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1ccc(Br)cc1O 756706230 NVSUSFHAOOLGHE-OCCSQVGLSA-N 421.357 2.294 10 20 HECD COc1ccc(N(Cc2ccccc2)Cc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 762381097 JUUOIZQQKDIDRP-UHFFFAOYSA-N 405.458 2.176 10 20 HECD C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 762665558 OAZYLSFFRUWSRH-MUUNZHRXSA-N 400.500 2.404 10 20 HECD CCNS(=O)(=O)c1ccc(CNC(=O)NCCCSc2nccs2)cc1 764361385 SDRYNEOSKBTASN-UHFFFAOYSA-N 414.578 2.423 10 20 HECD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCc2cccc(Br)c2O)C1 765750458 GUXUFRFWBGCRBR-ZDUSSCGKSA-N 415.284 2.407 10 20 HECD CC[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](O)C(F)(F)F 766251331 NPBVYHBIRYPLFP-GOEBONIOSA-N 407.408 2.288 10 20 HECD Cc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768447798 PTQYVRKNVCHVMJ-OXQOHEQNSA-N 412.486 2.238 10 20 HECD Cc1ccc(N([C@@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2cccc3nonc23)cc1C 775150880 CCYQMZUULTUCGD-OAHLLOKOSA-N 419.484 2.346 10 20 HECD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)c1ccc(O)c(O)c1 782703956 GNESWJFSIDDWAD-UHFFFAOYSA-N 423.418 2.061 10 20 HECD COC(=O)[C@@H]1[C@H](O)CCCN1Cc1cc(Br)cc(Br)c1O 783704107 JKAFQZYLANWXML-NEPJUHHUSA-N 423.101 2.416 10 20 HECD COCCn1ccc2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc21 785296873 JYLLWOMYCLPPDO-CQSZACIVSA-N 411.458 2.385 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccc(N(C)C)c3)CC2)cc1 786897412 GXYQAIGVJBODBN-UHFFFAOYSA-N 410.518 2.163 10 20 HECD CC(=O)N1CC(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)C1 788158509 GZJWNOMUAWKOMV-UHFFFAOYSA-N 412.442 2.070 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 789840183 GRDSGMDKIWJWIA-KZNAEPCWSA-N 417.525 2.488 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1nc2nccc(C)n2n1 791249457 HCEWLIWVDPEWPU-UHFFFAOYSA-N 410.478 2.435 10 20 HECD CS(=O)(=O)C1(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 793345478 CWECGBJRAOKCNE-UHFFFAOYSA-N 402.463 2.340 10 20 HECD COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 795066397 AJDPZTCDOJQOHX-UHFFFAOYSA-N 421.475 2.261 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1ccc(Cl)nc1)c1ccc(N2CCOCC2)cc1 803303874 VOHOFAJLJCUWAN-OAHLLOKOSA-N 416.909 2.108 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc1 803385753 FJWOVTNFOQVNSF-MRXNPFEDSA-N 414.472 2.244 10 20 HECD CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc2n1CCCCC2 803663425 YTCHMELDWNAWAB-INIZCTEOSA-N 416.501 2.093 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCN(C)c3ccccc3)CC2)cc1 804316628 GHUQXJHEIHDCAK-UHFFFAOYSA-N 424.545 2.375 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCC(C)(C)[C@@H]3CCCCO3)CC2)cc1 804317110 SDROKZLQDFLMQO-FQEVSTJZSA-N 417.550 2.492 10 20 HECD COC(=O)Cc1occ(C)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 810165280 NXKARMIXUAITGD-UHFFFAOYSA-N 400.475 2.442 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@](C)(O)C3CCC3)cc2F)C[C@@H](C)O1 812665449 SGZRTTPXGHYPSY-KIMHZCHSSA-N 422.497 2.150 10 20 HECD CNC(=O)COc1cc(C(=O)OC)ccc1NCc1cc(Cl)cc([N+](=O)[O-])c1O 864018199 PGZMICUSCSJMBR-UHFFFAOYSA-N 423.809 2.477 10 20 HECD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 918308573 MKMHLPGLIQVFLL-UHFFFAOYSA-N 412.446 2.337 10 20 HECD Cc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1795032761 GUHLQELARFRUGH-FJXIAYRNSA-N 423.469 2.472 10 20 HECD O=C(CCc1ccc[nH]1)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1810042614 WZYFLTYLANYCDS-UHFFFAOYSA-N 412.490 2.299 10 20 HECD Cn1c(CC(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc2ccccc21 1841250096 XEHVXMNINLZUAU-UHFFFAOYSA-N 420.469 2.044 10 20 HECD O=C(/C=C/c1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847985548 SCRRYSGRIHKANK-BPTRJATKSA-N 415.396 2.300 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)Cc3ccccc3C)CC2)cc1 11900621 LIWRRRPLIPQNND-UHFFFAOYSA-N 403.548 2.245 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](CS(N)(=O)=O)C3)ccc21 554296985 XWWCVQYFYIIQME-INIZCTEOSA-N 407.536 2.045 10 20 HECD COC(=O)CN1CCN(c2ccc(NC(=O)N(C)Cc3ccccc3O)cc2)CC1 729044537 WAIMDYWHHNZHLI-UHFFFAOYSA-N 412.490 2.351 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1 731055295 NFYMZVPWUOJTND-LJQANCHMSA-N 422.478 2.489 10 20 HECD CN1CCCC[C@@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 732276772 QEOBGQJGOKXPMR-HXUWFJFHSA-N 412.513 2.043 10 20 HECD CC(C)N[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 732449642 MICXJQHDIOBLPZ-MOPGFXCFSA-N 401.555 2.060 10 20 HECD COc1ncc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 734046052 JXTWKDANTLRHNN-UHFFFAOYSA-N 417.377 2.056 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1O 737286391 YKVWVNJZOOUWMT-QGZVFWFLSA-N 400.431 2.214 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)CN2CCCCC2=O)NC(=O)OC(C)(C)C)cc1 742751143 RVDAZWYAMGIJPE-GOSISDBHSA-N 418.538 2.447 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(O)c(OC)c3)CC2)cc1 743363559 UCOYIMJVUYXAOF-UHFFFAOYSA-N 414.506 2.031 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 743955032 FZERLIXSJVSOBK-UHFFFAOYSA-N 416.499 2.238 10 20 HECD COc1ccc(N2CCN(CCC(=O)NC(=O)NCc3ccccc3)CC2)cc1F 753859905 APJUJHBFLWHDJJ-UHFFFAOYSA-N 414.481 2.372 10 20 HECD C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(Br)cc1O 756418097 OYJNRQSGRPKFIP-NSHDSACASA-N 406.280 2.221 10 20 HECD COc1cc(N2CCN(C(=O)NCCc3c(C)noc3C)CC2)cc(OC)c1OC 759267114 OENLWFDZGCPBOT-UHFFFAOYSA-N 418.494 2.392 10 20 HECD COCc1ccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)o1 764412101 PMSUOEHHEQNQLT-NVNXTCNLSA-N 424.525 2.475 10 20 HECD O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NCc1ccc(N2CCCC2)cc1 764841808 UJQJVOWBFMECIT-UHFFFAOYSA-N 421.545 2.427 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1 765756880 NUOBSNULSAFSAT-HUUCEWRRSA-N 423.307 2.212 10 20 HECD Oc1cc2c(cc1CN1CCC[C@H](CN3CCN(c4ccccn4)CC3)C1)[C@@H](O)CO2 768443503 FLKOGMYPDYSXPY-GCJKJVERSA-N 424.545 2.247 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 774364387 YSSJBHIHNYVMLH-HNNXBMFYSA-N 418.421 2.092 10 20 HECD CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(N4CCOCC4)c(F)c3)CC2)n1 775205603 NOYQYHUWENRUOY-UHFFFAOYSA-N 417.485 2.337 10 20 HECD COCc1cccc(CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 778520769 JCCDSFRETWVMLA-UHFFFAOYSA-N 412.486 2.276 10 20 HECD Cc1ccc(C(=O)N2CCC[C@@H](S(=O)(=O)N3CCc4ccccc43)C2)c(O)c1O 781019027 AUJRZDZPLKYWJV-MRXNPFEDSA-N 416.499 2.403 10 20 HECD Cc1ccc(Cn2nccc2NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)s1 785297468 PJLFGDBJCKOOHC-GFCCVEGCSA-N 414.487 2.398 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)N(C)[C@@H](C)C(C)(C)C)CC2)cc1 785527057 JIKPTYCYKFMVFW-SFHVURJKSA-N 418.582 2.217 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCc3cnn(-c4ccccc4)c3)ccc21 786119186 BQGHFHSNNLSDQO-UHFFFAOYSA-N 417.513 2.230 10 20 HECD CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(CC(F)F)c2)cc1 790067788 DRJGBGRSBNAFQU-UHFFFAOYSA-N 422.479 2.491 10 20 HECD COc1ccc(CNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c(O)c1 792888735 CJTCEOQUFWAZPF-CYBMUJFWSA-N 407.492 2.212 10 20 HECD Cc1ccsc1S(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 802865081 MRTXULHUZJBHPX-UHFFFAOYSA-N 406.510 2.391 10 20 HECD CCCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 803308932 MZPIBJDRLFPQKQ-SFHVURJKSA-N 416.566 2.081 10 20 HECD CN(C[C@H]1CCCO1)C(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769359 TXHNSQLNPCZRNQ-WMLDXEAASA-N 411.449 2.010 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3OC)OC)CC2)cc1 810107331 GGIYCJRPBBWZBR-NRFANRHFSA-N 415.534 2.250 10 20 HECD O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1CCCN1CCOCC1 814285720 MTWAQFZKGASODO-RVDMUPIBSA-N 409.489 2.224 10 20 HECD Cc1nn(C(C)C)c(C)c1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 814330294 PDPBOCRTEUHVCX-UHFFFAOYSA-N 418.563 2.175 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CN(c2ccc(Br)cc2)C1=O 817028987 UGJGZBGQCAPEIH-OLUUIJGHSA-N 403.232 2.405 10 20 HECD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 915555752 VFKBVEHFRLEUDR-UHFFFAOYSA-N 411.451 2.020 10 20 HECD Cc1cc(CCNC(=O)N2CCCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1 916221101 OGWRZOUWDXYILC-UHFFFAOYSA-N 418.563 2.314 10 20 HECD Cc1cc(CCNC(=O)N2CCC[C@@H](NS(C)(=O)=O)C2)c(C)n1-c1ccccc1 916221534 YWPLPFJJDCKBNS-LJQANCHMSA-N 418.563 2.360 10 20 HECD CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918118423 RUQKVZZWVNUTRE-GOSISDBHSA-N 424.501 2.459 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccccc2S(C)(=O)=O)C2CC2)cc1 918457479 UYJRQWZEPLZHGA-UHFFFAOYSA-N 415.515 2.286 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(NC(C)=O)ccc1F 1323844042 DGBWKLKIJSEPPS-INIZCTEOSA-N 404.394 2.100 10 20 HECD C[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)CC1 1804340079 HKFOFVQLLYEGKQ-JHJNDJDLSA-N 423.604 2.311 10 20 HECD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)C1CCCC1 1806179512 GEOBCRHDWHJDBB-OXQOHEQNSA-N 410.474 2.398 10 20 HECD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1C1CC1)CC2)c1cc(O)nc(O)c1 1816720271 ILNGZCAHICMKEB-JHJVBQTASA-N 414.487 2.221 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)[nH]n1)c1cc(O)nc(O)c1 1817842554 FWRLQEPJYINYIG-CABCVRRESA-N 415.450 2.091 10 20 HECD Cn1cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1825760075 AEMMVOWQHQDJFL-QGZVFWFLSA-N 412.490 2.378 10 20 HECD CC(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424639 LEBWFGLPMABPTJ-KRWDZBQOSA-N 405.495 2.151 10 20 HECD O=C(c1cnc(Cl)nc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1847178455 NNCHQVVONDQXKC-STQMWFEESA-N 423.256 2.324 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(=O)Cc3ccccc3)cc2F)C[C@@H](C)O1 57373890 UTJMZNJGJRTUSK-CALCHBBNSA-N 413.493 2.414 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](c4cccc(F)c4)C3)nc12 727435892 VZYRYYMVPIOCSI-QGZVFWFLSA-N 400.410 2.324 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1 734521332 XDISYUMZYBANDE-UHFFFAOYSA-N 404.536 2.311 10 20 HECD C[S@@](=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 737131491 PBZCCTIELDCMBA-MUUNZHRXSA-N 417.556 2.232 10 20 HECD CNS(=O)(=O)Cc1ccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)cc1 743503467 WSIBXFVAJDTZAP-UHFFFAOYSA-N 417.531 2.320 10 20 HECD COc1ccc(N(C)CC(=O)NCC(=O)N[C@@H](C)c2ccc(F)cc2)cc1OC 744390145 CYBOPDMBFQOWHW-AWEZNQCLSA-N 403.454 2.273 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCC4(CCOCC4)C3)cc2)C1 745690569 DCNIDWFDNBYUED-SFHVURJKSA-N 400.523 2.100 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)CCC(=O)NC3CCCC3)CC2)cc1 755427788 UXVPFACODBUKRH-UHFFFAOYSA-N 416.566 2.163 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CNCC3(N(C)C)CCCCC3)CC2)cc1 758184662 FKNIHUPXIPDTTF-OAQYLSRUSA-N 404.599 2.032 10 20 HECD CNc1nnc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 758796280 TWBHJPYVPBTIAW-UHFFFAOYSA-N 415.441 2.294 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccnn1-c1nc(C)cc(C)n1 760302882 QQTSCOWXUPFKJF-UHFFFAOYSA-N 408.462 2.362 10 20 HECD COC(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 761523639 MWRVTZFVMQLVOK-NWDGAFQWSA-N 424.409 2.077 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1F 763707072 VQDNUMAEJDXNBK-UHFFFAOYSA-N 420.510 2.431 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)c3cccc(C)c3)CC2)cc1 767939709 NZFATIKUDZZTPU-JOCHJYFZSA-N 412.534 2.158 10 20 HECD O=C(CCCNC(=O)c1cccnc1)NCc1ccc(N2CCC(CO)CC2)cc1 772428708 LYLOFMDNNBVVDM-UHFFFAOYSA-N 410.518 2.117 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(Cl)cn1 772955300 RQPRWQBVKQNIMB-UHFFFAOYSA-N 402.882 2.199 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 775703429 OWAAOLKGADLBSG-SFHVURJKSA-N 408.458 2.343 10 20 HECD COC(=O)c1cn(C2CN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)C2)nn1 779613180 IKXDVJJMBKVSDE-UHFFFAOYSA-N 400.439 2.020 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1F 786203894 QLQRTMWODDGKJI-UHFFFAOYSA-N 420.506 2.368 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H]3C[C@H](C)O[C@H](C)C3)cc2F)C[C@H](C)O1 789835543 PORHZDDRYZIMOJ-IWSXDTNSSA-N 421.513 2.128 10 20 HECD C[C@H]1CN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H](C)S1=O 792387963 JYPNZEHNHIWQKM-KBPBESRZSA-N 410.495 2.242 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)c3ccc4c(c3)OCO4)nc12 795921155 GGXYVZCOMLHDKL-NSHDSACASA-N 413.386 2.187 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c(O)c1 797389926 FJFBRGSQXLCJMJ-UHFFFAOYSA-N 411.458 2.200 10 20 HECD Cc1ccc([C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)N2CCCC2)o1 803660908 IWFAEKPHFXJPIA-IBGZPJMESA-N 416.497 2.363 10 20 HECD O=C(NCCc1nc2c(s1)CCCC2)C(=O)NCc1ccc(N2CC=CC2)cc1 804087628 KRDTXDKEAGFYAO-UHFFFAOYSA-N 410.543 2.373 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc2)CC1 805025636 RWBIZGZGYYRYQD-RXVVDRJESA-N 400.567 2.480 10 20 HECD C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290001 AWDDQRWWXPDCRE-WMZHIEFXSA-N 418.541 2.316 10 20 HECD COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 807292771 YCROIWMBLIRMAW-IBGZPJMESA-N 420.513 2.083 10 20 HECD Cc1cc2c(cc1NC(=O)C(=O)NCc1cc(Br)ccc1O)OCO2 807386859 MUXCFWBDDFRMHG-UHFFFAOYSA-N 407.220 2.447 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)C12CCC2 807607853 KVCUVPXVAREOGR-WOJBJXKFSA-N 415.534 2.198 10 20 HECD CCS(=O)(=O)N1CCN(Cc2cc(Br)cc(OC)c2O)[C@H](C)C1 809725225 MCJTXKHLJFILEL-LLVKDONJSA-N 407.330 2.019 10 20 HECD CCc1nc(C)c(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)o1 815685185 MGZHHFGWVJDSJY-UHFFFAOYSA-N 411.462 2.495 10 20 HECD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1CN(C(=O)OC(C)(C)C)C1 816549115 FBRFZTYQBZGJNE-INIZCTEOSA-N 423.579 2.266 10 20 HECD CCC(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 914672585 UNWPLUGAFVUDSF-STQMWFEESA-N 422.437 2.247 10 20 HECD COC(=O)N1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 917172230 ARCBHKOMESKGRL-AWEZNQCLSA-N 421.453 2.173 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)C3CCCCC3)cc2)C1 918120720 BSSQGQJUVNTXMQ-QUCCMNQESA-N 402.539 2.129 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 920250080 BBTCXGBOWJQECA-HJWRWDBZSA-N 423.469 2.310 10 20 HECD COc1cccc(N2CCC(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)c1 1322088926 MGTWPNVONATCBW-UHFFFAOYSA-N 419.503 2.171 10 20 HECD Cc1nc[nH]c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827837456 VWKBXZVVCYJTKQ-INIZCTEOSA-N 413.478 2.071 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)Oc3ccc(F)cc3)CC2)cc1 6129605 ZULGDLUWORYVNZ-INIZCTEOSA-N 416.449 2.494 10 20 HECD C[C@H](NC(=O)NCCNC(=O)c1ccccc1F)c1ccc(N2CCOCC2)cc1 140989480 WZNZYSJTOGTURM-INIZCTEOSA-N 414.481 2.453 10 20 HECD COCCOc1cccc(CNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)c1 671050886 QBFAJXHQOMTLFZ-UHFFFAOYSA-N 409.486 2.445 10 20 HECD COCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)CC(F)F 728928902 LGLCZFROWWEVDC-GJZGRUSLSA-N 417.472 2.269 10 20 HECD O=S(=O)(N[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)c1cccc(F)c1 729468900 SNBRAEOCVFHZBE-HNNXBMFYSA-N 408.451 2.203 10 20 HECD CCN1CCN(c2ccc(CNC(=O)CCCCN3CCOCC3)cc2F)CC1 732081349 XBWKBOYQBZTHRW-UHFFFAOYSA-N 406.546 2.086 10 20 HECD O=[N+]([O-])c1cc2c(cc1S(=O)(=O)NCCCSc1nccs1)OCCO2 733899107 DWFONCCEGVJRAA-UHFFFAOYSA-N 417.490 2.283 10 20 HECD COC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(C)c1 734701844 KXJDQZUDHWVWIQ-UHFFFAOYSA-N 413.474 2.176 10 20 HECD CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)cc1 745746528 PRTDAAMFNYXLGH-JOCHJYFZSA-N 417.598 2.081 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](Cc3cnn(C)c3)C2)c1 747462507 ZHJBSUBAIPWKPA-SFHVURJKSA-N 412.534 2.225 10 20 HECD Cc1cc(C(=O)CN2CCCN(S(C)(=O)=O)CC2)c(C)n1-c1cccc(F)c1 754643416 WHFUOURRGZQOCN-UHFFFAOYSA-N 407.511 2.383 10 20 HECD CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 762262181 UIWJSTHXQIYYNE-UHFFFAOYSA-N 406.504 2.288 10 20 HECD CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 773843891 BDXNCUVVBGLMRM-AWEZNQCLSA-N 418.519 2.330 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCN(CCC(=O)OC)C[C@@H]2C)cc1F 774715676 KBZXVWPBLHZODS-INIZCTEOSA-N 408.518 2.451 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCc3cccs3)cc2F)C[C@@H](C)O1 774787292 LBGGASFIHMYNFI-ZIAGYGMSSA-N 405.495 2.433 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCN1C(=O)C(F)(F)F 776336267 RACVDIHWTFDMGG-OAHLLOKOSA-N 401.454 2.409 10 20 HECD COCC1(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 778875821 UXAJOYKKOVNVOX-GJZGRUSLSA-N 408.470 2.025 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(C)c(C(=O)O)c3)c2)CC1 780407149 GGJPSMSHPGKLFZ-UHFFFAOYSA-N 417.487 2.163 10 20 HECD CC(C)[C@@H]1C[C@H](CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCO1 781951823 QOSAKAZJAQYCEO-QUCCMNQESA-N 408.564 2.379 10 20 HECD Cc1cc(C(=O)CN2CC[C@@H](O)C(C)(C)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 782583518 MAMVQBIEPQTEBH-HXUWFJFHSA-N 419.547 2.017 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@H](O)Cc3cccc(OC)c3)cc2F)CC1 785587086 DCMFBOJPQANMJF-JOCHJYFZSA-N 415.509 2.196 10 20 HECD C[C@H](NC(=O)C(=O)NCc1ccccc1Cn1cccn1)c1ccc(N(C)C)cc1 785638678 CLHAQKXPCVMIKP-KRWDZBQOSA-N 405.502 2.491 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1C 787494868 QMGSYWUVNVLNRY-UHFFFAOYSA-N 409.490 2.154 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1)c1ccc(N(C)C)cc1 789707010 VQIJJDFVTHXOSA-QGZVFWFLSA-N 418.607 2.408 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 789798388 GRMBQOLSYHUUAB-OKZBNKHCSA-N 403.498 2.364 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H](C)C1 789864176 MYXKFSFDGWHGLP-MSOLQXFVSA-N 418.607 2.093 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nc1 792401611 YNHJQLOPCCCDOL-UHFFFAOYSA-N 403.508 2.252 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CC[C@@H]4NC(=O)OC[C@H]4C3)cc2F)C[C@@H](C)O1 798373295 VUPLPAWHUZEJDK-KKBFJZEXSA-N 420.485 2.079 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N1CCc2ccccc21 803913881 NZQLQNPRGXEWLZ-SFHVURJKSA-N 404.514 2.246 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NCc3cc(F)cc(OC)c3)CC2)cc1 804316641 HDFCIOQAQLYEKS-UHFFFAOYSA-N 415.465 2.244 10 20 HECD CCn1nc(C)c(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1C 804465168 FCRWAWJRPUVKMY-GOSISDBHSA-N 414.506 2.049 10 20 HECD O=C1CCc2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc2N1 807387738 UPTNERZCVYCNIA-UHFFFAOYSA-N 418.247 2.294 10 20 HECD Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918462553 CEMFZEISBZFHNL-MRXNPFEDSA-N 412.465 2.091 10 20 HECD CN1Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2C1 919795376 PCIAAUSXYZXBPQ-UHFFFAOYSA-N 410.543 2.440 10 20 HECD CC(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790242226 WTYLIHLKIXERQI-JDFRZJQESA-N 410.898 2.391 10 20 HECD CC(C)N(C)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1803302393 HSMBJUVDWCRGMZ-QDMKHBRRSA-N 409.914 2.343 10 20 HECD Cc1nocc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817844370 YXJYZIQNYMQVFS-AWEZNQCLSA-N 412.406 2.132 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccncc2)CC1 1830174955 ZGLWOVKHVLKJOE-LJQANCHMSA-N 424.501 2.364 10 20 HECD Cc1nn(C)c(C)c1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1841709412 ZUWUJWBIKBSWAS-UHFFFAOYSA-N 418.881 2.232 10 20 HECD O=C(c1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250520 ICPNFLXFYFMSBF-UHFFFAOYSA-N 405.813 2.416 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3ccncc23)C1 1845601126 JRHDDGCKAXOYPX-UHFFFAOYSA-N 404.426 2.172 10 20 HECD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCc1ccc(N2CCCC2)cc1 28046561 RTORXUUUMWMPEB-UHFFFAOYSA-N 408.414 2.107 10 20 HECD CC(C)CN1CCO[C@H](CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 139941901 CVRLXBVAVRNZJF-GHTZIAJQSA-N 404.555 2.240 10 20 HECD Cc1nc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)no1 729817707 PFAZTGOOALZIFH-OKILXGFUSA-N 419.501 2.272 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)Cc2cnn(C)c2)NC(=O)OC(C)(C)C)cc1 742752147 YZWOUQNVTQNKIR-SFHVURJKSA-N 401.511 2.411 10 20 HECD COc1ccc(O)c(CNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1 743213656 XHVBGDZDYWCDFP-UHFFFAOYSA-N 405.476 2.411 10 20 HECD CN(CCN1CCOCC1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904148 MMECSYILZPRIMJ-MRXNPFEDSA-N 412.481 2.230 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CC(C)(C)OC[C@@H]3C)CC2)cc1 753343842 KJUHJHPYZTVFLG-SFHVURJKSA-N 404.555 2.416 10 20 HECD CNC(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 753423714 GJXNVFYSBLSGKE-UHFFFAOYSA-N 412.490 2.005 10 20 HECD COc1ccc(COC[C@@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 755304519 QLPJDMYEAUHVHJ-OAQYLSRUSA-N 414.502 2.320 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 756092960 FTOYGBBWZAZWOE-QGZVKYPTSA-N 410.518 2.091 10 20 HECD COc1cc(N2CCN(C(=O)c3ccnc(N(C)C)c3)CC2)cc(OC)c1OC 759222915 ZBGKLGRLBVRWDA-UHFFFAOYSA-N 400.479 2.136 10 20 HECD Cc1cc(C(=O)CN(C)[C@H]2CCSC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 760890048 PYFJLDCZIWSFES-INIZCTEOSA-N 407.561 2.362 10 20 HECD O=C1NCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1c1cccc(Br)c1 768466259 XBKOEIBVNXWUJJ-AEFFLSMTSA-N 419.275 2.254 10 20 HECD Cc1csc(CNC(=O)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 774143455 AQFVUQMIPDAQSJ-UHFFFAOYSA-N 424.473 2.454 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 778897025 RSNFQMWFGHLINU-UHFFFAOYSA-N 415.402 2.205 10 20 HECD COCc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780407583 MJQGSERLWYCDPX-UHFFFAOYSA-N 403.504 2.302 10 20 HECD CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780408062 ULNWORVQCGXMAR-UHFFFAOYSA-N 416.503 2.114 10 20 HECD COCCc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 780408328 ZKBRJMODSBWKQO-UHFFFAOYSA-N 417.531 2.345 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCC(=O)[C@H](C)C3(C)C)nc12 781312491 GCGVOEYLSBMSJV-SMDDNHRTSA-N 403.435 2.296 10 20 HECD CC[C@@](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)(C(N)=O)C(C)C 781931546 XTPVQYSVHOWIQU-QFIPXVFZSA-N 423.425 2.390 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)cc1 785439000 JOLIAIZRWGXTRP-UHFFFAOYSA-N 408.546 2.192 10 20 HECD COCc1ccccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 787502292 AXHKUMACQCJHCO-UHFFFAOYSA-N 413.543 2.319 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCN2CCc3ccccc3C2)cc1 787623210 QWPUJKGLMOUIMG-UHFFFAOYSA-N 408.546 2.324 10 20 HECD CS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 789834255 LHCCBSQQMYTKAM-NVXWUHKLSA-N 423.554 2.193 10 20 HECD COc1cccc2c1OC[C@@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C2 804674521 SIILFFCRZRAECP-SFHVURJKSA-N 423.513 2.372 10 20 HECD CNS(=O)(=O)c1ccc(NC(=O)NCc2cc(Cl)cc(Cl)c2O)nc1 806435174 GPCRNUSNZJQBNA-UHFFFAOYSA-N 405.263 2.324 10 20 HECD CCCC(=O)NC[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807676481 GYYUXVBGEWUWEP-IRXDYDNUSA-N 402.539 2.085 10 20 HECD C[C@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccccc1 812051125 JMTVBRNZGGVPJI-HNNXBMFYSA-N 415.519 2.279 10 20 HECD COc1cc(CNC(=O)NCc2ccc(N3CCCC3)cc2)ccc1OCC(N)=O 916587385 BZXJTIGRUPYRCQ-UHFFFAOYSA-N 412.490 2.159 10 20 HECD CC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 918438080 FHQGQEUBJBBUJG-UHFFFAOYSA-N 413.449 2.244 10 20 HECD CCOC(=O)C[C@H]1CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1320610930 BVPAKVLUYNNOSA-MRXNPFEDSA-N 407.486 2.414 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C12CCC(C(=O)OC)(CC1)CC2 1324325547 PMXBTYOJIMTZIP-NYMDZQDESA-N 419.474 2.202 10 20 HECD CC1(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)CCC1 1804796915 BANAKDPVIZEHFV-UHFFFAOYSA-N 423.604 2.268 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)[C@@H]3C[C@@H]3F)C2)CC1 1806463832 KMSARZLLDWMYAA-CFSAUIFESA-N 418.465 2.406 10 20 HECD COCc1noc(CN2CCN(C(=O)NCc3c(C)c4ccccc4n3C)CC2)n1 472235946 CKBDZHKEFOWWPE-UHFFFAOYSA-N 412.494 2.044 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 543883122 YVTMAJCHBDEACG-HNNXBMFYSA-N 408.458 2.389 10 20 HECD CCCN1CCC(N(C)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CC1 727226601 NEPIJICWVMSWEU-UHFFFAOYSA-N 417.598 2.333 10 20 HECD O=C(CCc1nc(-c2ncccn2)no1)NCc1ccc(N2CCSCC2)cc1 727730628 IRHJHOBIBUICOP-UHFFFAOYSA-N 410.503 2.329 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 728984495 QMFUAWVAQZLRGA-GFCCVEGCSA-N 418.446 2.034 10 20 HECD CC(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCCC1 729598495 CJYAUJRVSKSOKK-PZJWPPBQSA-N 415.582 2.308 10 20 HECD CCN(CC)c1ccc(CNC(=O)CCc2nc(O)c3cnn(C)c3n2)cc1F 731346007 PGBUBLYZUMODKB-UHFFFAOYSA-N 400.458 2.303 10 20 HECD CCN(CC)c1ccc(CNS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1F 731356795 SMCQAJKAZNHACV-UHFFFAOYSA-N 404.471 2.126 10 20 HECD O=C(CCn1nnc2ccccc2c1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 731858838 OIHDWKIHNOGEMV-KRWDZBQOSA-N 408.458 2.095 10 20 HECD CCn1cc(C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 734044921 GDHSJEFRCIIIBN-UHFFFAOYSA-N 403.394 2.474 10 20 HECD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)N1CCOc2cc(N(C)C)ccc21 742952584 MMMGTTHHSVLHIL-UHFFFAOYSA-N 409.490 2.303 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 744878484 YFZDWMUANBUKSS-JOCHJYFZSA-N 422.529 2.466 10 20 HECD CCN(CC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(OC)cc1 746109750 VFGITQJBDOCMEK-UHFFFAOYSA-N 411.502 2.310 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](CN4CCCC4)C3)cc2)C1 746413183 CIJGWPLZSVIEKL-PMACEKPBSA-N 413.566 2.016 10 20 HECD COc1ccc(OC)c(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 754217542 WJYNUPMTZUDRIZ-UHFFFAOYSA-N 417.437 2.139 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)[C@H]3CCN(C)C[C@@H]3C)CC2)cc1 754365171 XGBLXBAMANEUHK-UGKGYDQZSA-N 417.598 2.189 10 20 HECD CN(CC(=O)N(C1CCCCC1)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 756646408 WDBXQYLPYWVMNR-KRWDZBQOSA-N 408.520 2.200 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(C2CCCCC2)C1=O 765679232 QEZOLUCJCGLTHB-LJQANCHMSA-N 418.513 2.395 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCOC4(CCOCC4)C3)CC2)cc1F 769204431 VTRDVWBQUADJKW-MRXNPFEDSA-N 407.486 2.394 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1 769804172 PZXYCLGMAKCSLT-UHFFFAOYSA-N 404.536 2.450 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2Cl)C1 774243995 MODQEDUDAJUINA-BFYDXBDKSA-N 407.942 2.422 10 20 HECD COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 775258009 OISSSGDDGNRNOZ-LAUBAEHRSA-N 414.502 2.400 10 20 HECD CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCCCN1C(=O)c1cc(O)cs1 776269562 GOAWNDUQOVGTDX-CYBMUJFWSA-N 411.524 2.479 10 20 HECD O=C1[C@@H]2CCCCN2C(=O)N1Cc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 777616630 SSWGOVURJOEAAX-IBGZPJMESA-N 424.480 2.259 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 779515803 CBBNUQDIEYGPFJ-FUKPKEADSA-N 407.470 2.061 10 20 HECD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296344 DMFDJLWSIPGCCR-CYBMUJFWSA-N 411.458 2.441 10 20 HECD CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 785428820 SLYZQMWBMCANLI-INIZCTEOSA-N 410.518 2.214 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)c3cccc4cccnc34)cc2)CC1 786119693 CSEWWIIHMKPZRE-UHFFFAOYSA-N 424.526 2.382 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cn2ccccc2n1 786157605 WUYCJGFTQWPHMI-UHFFFAOYSA-N 407.518 2.496 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3csc(-c4cnn(C)c4)n3)cc2)CC1 786254811 ILAUGRGZPCCPNS-UHFFFAOYSA-N 424.530 2.142 10 20 HECD CN(C)c1cccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 786901850 WULHLVAIIFNQOI-FQEVSTJZSA-N 411.502 2.282 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccc(N(C)C)nc2)cc1F 787632053 AKADWMMIXKNXRE-UHFFFAOYSA-N 401.486 2.066 10 20 HECD CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)nn1 792967122 RCJRUHNRRMCHMF-UHFFFAOYSA-N 415.519 2.072 10 20 HECD O=C(C[C@@H]1CCCOC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793155967 COTZIPHOHNUQEO-SFHVURJKSA-N 413.497 2.375 10 20 HECD COc1ccc(CNC(=O)[C@@H](C)[C@H](C)C(=O)NCc2ccc(OC)cc2O)c(O)c1 794389732 CTPIQFOOSWLTLS-KBPBESRZSA-N 416.474 2.320 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c(O)c1 797390673 MOONLEUBICVAEJ-UHFFFAOYSA-N 417.849 2.201 10 20 HECD CCn1c([C@H](C)OCCOC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 802007582 OILJTXGCFMENEU-HNNXBMFYSA-N 407.490 2.496 10 20 HECD CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCOC1 802761800 RVPOZSFGBFPAKA-INIZCTEOSA-N 419.501 2.325 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCc1cccc(C(N)=O)c1 804271943 XSSWMTRPDRICMG-UHFFFAOYSA-N 422.529 2.093 10 20 HECD Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)N(C)Cc1ccccc1O 807548195 UVXLOKAKPDLWCX-UHFFFAOYSA-N 411.911 2.474 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(c2nnc3ccccn23)CC1)c1ccc(N(C)C)cc1 807670960 JWSVIGYXFILRFT-MRXNPFEDSA-N 420.517 2.379 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H](CC(=O)NC)c2ccccc2)cc1 807730136 CUEIMPLWKTXEKJ-NRFANRHFSA-N 424.545 2.485 10 20 HECD COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H](c4ccccc4)OC3=O)CC2)cc1 809679953 JFAKRPVVKHMGRD-FCHUYYIVSA-N 423.513 2.238 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1COc2ccccc2[C@@H]1O 812009398 PDUOQMUXLWXPEK-RXVVDRJESA-N 415.465 2.081 10 20 HECD CCC[C@@]1(CO)CCN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1 812016836 RPTRRADOJWLBBG-JOCHJYFZSA-N 404.555 2.011 10 20 HECD COC(=O)C1=S=c2nc(/C(Cl)=C\c3ccc(C(=O)OC)cc3)nc(O)c2=C1C 916152984 APQAWBVDUBHYTR-XYOKQWHBSA-N 418.858 2.219 10 20 HECD COCCOc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 917917702 FZJGVJOGMIELGP-UHFFFAOYSA-N 424.494 2.166 10 20 HECD Cc1oc2ncnc(O)c2c1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971075 MVEQKKLVPJYCHF-UHFFFAOYSA-N 400.410 2.267 10 20 HECD CC[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)Nc1ccc(OC)cc1 920636557 BXACLQUOINWGQR-QGZVFWFLSA-N 422.459 2.346 10 20 HECD Cc1[nH]nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1794811014 HJJUHJSUQQNVDB-ZSBIGDGJSA-N 422.844 2.487 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCn1cccc1)c1cc(O)nc(O)c1 1798560711 XRICBCGBUXLSEW-BCDXTJNWSA-N 412.490 2.417 10 20 HECD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)o1 1803780560 IPZJDQVHAQPMSB-YWZLYKJASA-N 422.441 2.423 10 20 HECD COCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811803383 INAYTXQXCIJGKR-SCLBCKFNSA-N 419.865 2.112 10 20 HECD Cc1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c(O)c1 1847036757 AYGVGEIVSZBUSR-VMPITWQZSA-N 424.453 2.348 10 20 HECD COc1ccc(O)c(CNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)c1 734016058 IDUPSQYASVNDKS-UHFFFAOYSA-N 408.476 2.026 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)c1 737206723 DVIBWAUXIJGWOD-UHFFFAOYSA-N 411.458 2.167 10 20 HECD COC[C@H]1CN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CCO1 741794325 JFAHNHQCWQANCK-LJQANCHMSA-N 400.475 2.411 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3cccc(Cl)c3C(N)=O)CC2)cc1 742264001 MNFJLRQFWQHLGV-UHFFFAOYSA-N 402.882 2.208 10 20 HECD COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1F 747254682 QKAASVFKISAFHW-AWEZNQCLSA-N 422.478 2.488 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 753740538 QSEVQPFEOMXDQH-UHFFFAOYSA-N 421.494 2.013 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1F 753914711 AAEWQPXCCWDGTK-ZDUSSCGKSA-N 404.408 2.303 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3C3CCOCC3)CC2)cc1 754234881 RDTCJQZBZARAJB-GMAHTHKFSA-N 403.567 2.069 10 20 HECD Cc1c(NC(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1C 757273569 SUQOOCHPFFHGFZ-CYBMUJFWSA-N 407.421 2.054 10 20 HECD COc1cc(N2CCN(CC(=O)N3CCc4ccccc43)CC2)cc(OC)c1OC 759888013 YPCUFTDDWUJFBO-UHFFFAOYSA-N 411.502 2.424 10 20 HECD COc1cc(N2CCN(C(=O)CCCC(=O)NC(C)C)CC2)cc(OC)c1OC 760088927 YMEZREAVPANFNK-UHFFFAOYSA-N 407.511 2.056 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)c3n[nH]c(C(C)C)n3)CC2)cc1 763008136 DQBHTLMVPUEOQG-INIZCTEOSA-N 415.542 2.119 10 20 HECD C[C@@H](N[C@H]1CCCN(S(C)(=O)=O)C1)c1ccc(N2CCOCC2)cc1Cl 765422604 ANNPSGPFZRBLTE-CABCVRRESA-N 401.960 2.251 10 20 HECD O=C(NCc1cccc(Br)c1O)[C@@]1(O)CCN(Cc2ccccc2)C1 765747940 RJWAZPIPENYNBI-LJQANCHMSA-N 405.292 2.408 10 20 HECD CCS[C@@H](C)c1noc(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 768292748 MOVIAHJTRGENLH-JTQLQIEISA-N 414.509 2.233 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1 768909962 FQLIAHODVAWHAZ-ZDUSSCGKSA-N 421.471 2.213 10 20 HECD C[C@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 770059882 NUBRNJCTGWKQJX-ZDUSSCGKSA-N 416.389 2.279 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccn2c(O)nnc12 770485140 FRECHMXJZKZKNI-UHFFFAOYSA-N 421.379 2.220 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3ccc([S@@](C)=O)cc3)CC2)cc1 775620441 YXKRCVLUBSSWFD-SFNQZPIRSA-N 415.559 2.432 10 20 HECD COc1ccc(O)c(CN2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1 775644568 OTJQJZYHVMSIDQ-UHFFFAOYSA-N 421.475 2.035 10 20 HECD O=C1NC[C@@H]2CN(Cc3cc(Br)cc(Br)c3O)CCN12 775736479 GNNXJFHVWMIYAD-SNVBAGLBSA-N 405.090 2.127 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCOCCC(C)C)CC2)cc1 778250271 YITXJVBUTKZPOP-HJWRWDBZSA-N 403.523 2.079 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOCC34CCCC4)CC2)cc1 778410595 NFJYVDRTUROSIL-CMDGGOBGSA-N 413.518 2.072 10 20 HECD CC(=O)N[C@H](C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 779377522 IZFDHVXZBWTMJE-FQEVSTJZSA-N 422.437 2.104 10 20 HECD CO[C@H](C)CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 782433142 FWOCAWVFKRXQQP-CQSZACIVSA-N 422.503 2.283 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 783316951 QVIKZTPOLRQRBO-UHFFFAOYSA-N 422.489 2.104 10 20 HECD O=C(OCCCCO)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 785398305 GJOOFSHHGGYYJG-UHFFFAOYSA-N 410.404 2.031 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccc(F)c(Cl)c1 786946920 KZTKVBVMDUSMJU-UHFFFAOYSA-N 405.857 2.248 10 20 HECD Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 787455404 LSBCTUNBLKLVKD-UHFFFAOYSA-N 409.490 2.188 10 20 HECD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC12CCC2 789836099 RWVSUMHMLJKZHM-INIZCTEOSA-N 417.525 2.442 10 20 HECD COC(=O)c1cc(Cl)cc(S(=O)(=O)NCc2ccc(OC)cc2O)c1OC 790332912 CABFTEBFYSEDGM-UHFFFAOYSA-N 415.851 2.328 10 20 HECD COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)c1 791528677 XBJRMJAYTWHFSS-NRFANRHFSA-N 413.449 2.480 10 20 HECD NC(=O)CC1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 794280510 HOTSOUPIIQVKDN-MDWZMJQESA-N 409.558 2.063 10 20 HECD C[C@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 795397330 PQHFZBMHQXSBRS-WBVHZDCISA-N 418.538 2.165 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc3c(C)ccnc23)cc1 797431609 UKQIKYZEQCBKDD-UHFFFAOYSA-N 406.489 2.220 10 20 HECD O=C(NC[C@H]1CCC=CO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803449262 UBDAWHNFFIHULI-QGZVFWFLSA-N 409.433 2.182 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)NCCCSc3nccs3)C2)c1 804117900 IIRZWAGJPJCQCL-CQSZACIVSA-N 420.560 2.145 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1CCN(C)[C@H](C)C1 806040150 DWYGWJJJSWILMN-DOMZBBRYSA-N 412.328 2.102 10 20 HECD CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 806511008 CKZLFFFHAYLHHW-IBGZPJMESA-N 404.511 2.333 10 20 HECD CC(C)n1nnnc1SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917200956 VWFKKKNGGQAGMW-OKILXGFUSA-N 422.530 2.415 10 20 HECD Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 918303615 BRJQFYSKCUPHFK-UHFFFAOYSA-N 410.518 2.495 10 20 HECD COc1ccc(C(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(OC)c1 920637080 YWNWGRMMOLCYTR-NSHDSACASA-N 423.443 2.209 10 20 HECD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1 1324192698 PSPQMYAGKMLSNF-VQTJNVASSA-N 420.575 2.475 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C(=O)OC)ccc1Cl 1347491569 KZYUWZPSWLBJQB-HNNXBMFYSA-N 421.833 2.442 10 20 HECD CC(C)(C)[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800712824 VUCLUOZVUHYRKK-LKQDWFRTSA-N 410.898 2.410 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1Cc2ccccc2C1)c1cc(O)nc(O)c1 1804542249 PFDDRASCRSZUNI-REPLKXPHSA-N 407.470 2.160 10 20 HECD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cn1 1810547628 VXCZKJLNKXWOKC-UHFFFAOYSA-N 424.501 2.284 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@H]1CCc2nc(NC(=O)C3CC3)sc2C1 1827475231 ALJSNBPAIJHICJ-GXWOQWCDSA-N 415.471 2.295 10 20 HECD COc1ccc([C@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841572671 JZHIGNMIKPVRQT-QZTJIDSGSA-N 423.469 2.122 10 20 HECD O=C(c1cc2cc[nH]c2cc1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250397 SZCCGILUXXIUNR-UHFFFAOYSA-N 410.405 2.244 10 20 HECD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=CCCS2)=NN1c1ccccc1 1847846417 PPQSBGAZKFGGFX-IRXDYDNUSA-N 410.499 2.002 10 20 HECD CCCN(CCC(=O)NN1C(=O)NC2(CCCCC2)C1=O)Cc1ccccc1O 110990085 NFDTVOYYESWVDJ-UHFFFAOYSA-N 402.495 2.280 10 20 HECD CN(C)c1ccc(CNCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 237128726 SHHDZXRPJFRZAU-FQEVSTJZSA-N 403.548 2.500 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 729049964 FRGCQSHDZDBBHB-OAHLLOKOSA-N 422.526 2.314 10 20 HECD CCOc1cc2c(cc1CN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O)O[C@H](C)C2 730971287 PFFPFTKCPWNTIS-BVTUPMQUSA-N 417.531 2.282 10 20 HECD CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 732893837 HMFXVELSWNCAMU-UHFFFAOYSA-N 404.488 2.360 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[S@](=O)[C@@H](C)[C@@H]3C)cc2F)CC1 737050406 RMAQQHYDSKVPKJ-LMGGTIKBSA-N 410.559 2.019 10 20 HECD Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)c2)n[nH]1 741097449 QUOJKERAQUPPMX-UHFFFAOYSA-N 402.458 2.411 10 20 HECD COCCOC[C@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 744416920 JVLQLBKXUXQLIL-INIZCTEOSA-N 422.481 2.385 10 20 HECD COc1cccc(CNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1O 745504046 PHDSYSMGCLDTMC-UHFFFAOYSA-N 412.534 2.408 10 20 HECD C[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2C)c1cccc(S(N)(=O)=O)c1 746982685 IXCWYURZWPYLBT-CQSZACIVSA-N 402.520 2.277 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCc2nc[nH]n2)NC(=O)OC(C)(C)C)cc1 750620061 UDSBSSNJQYIBBG-INIZCTEOSA-N 402.499 2.186 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3nc(C(C)(C)C)no3)CC2)cc1 755058689 APXKIKWOXCLBRV-WMZOPIPTSA-N 417.554 2.209 10 20 HECD COC(=O)CCSc1cccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)c1 756781209 VWTDSUJEIGXJEN-UHFFFAOYSA-N 418.471 2.311 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)c2cnn(C)c2N)NC(=O)OC(C)(C)C)cc1 758290745 RMQZIURFEPHCFF-INIZCTEOSA-N 402.499 2.064 10 20 HECD NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCSc2nccs2)CC1 759550571 ABGKYJUDQXMCOA-MRXNPFEDSA-N 419.576 2.179 10 20 HECD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCc1ccccc1CN1CCCC1=O 759592953 HQOBIVPWDAOIIB-NTMALXAHSA-N 424.453 2.093 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](C)NS(=O)(=O)c1cccnc1Cl 760598339 YOZHYTIOINSLSN-CQSZACIVSA-N 424.954 2.483 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCOC[C@@H]3C3CC3)cc2F)C[C@@H](C)O1 761127377 SMPIABAWOJSLTG-WHSLLNHNSA-N 405.514 2.166 10 20 HECD CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NCCc1ccc(O)c(O)c1)=NO2 763283105 MFLOWITUIPKIPM-UHFFFAOYSA-N 419.478 2.303 10 20 HECD O=C(O)c1cc(Br)c(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)s1 769635081 ZOIMVBKQQOLUII-UHFFFAOYSA-N 422.234 2.413 10 20 HECD COc1ccc(N2CCCN(C(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)CC2)cc1 771463453 WIJRBBAULPRVLO-UHFFFAOYSA-N 422.489 2.324 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3CCCCO3)cc2F)C[C@@H](C)O1 772317690 GCWBERIKRFCPDC-KHYOSLBOSA-N 408.470 2.168 10 20 HECD CS(=O)(=O)NC[C@H]1CCCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 772599979 QBKARMPFNPZQIN-QGZVFWFLSA-N 410.540 2.346 10 20 HECD COc1cccc(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 772956484 YYTLZANXXODXFH-UHFFFAOYSA-N 415.465 2.359 10 20 HECD CCOc1ncccc1NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778234105 JYFPYKAJACIYLF-ZHACJKMWSA-N 410.474 2.332 10 20 HECD COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NCc1ccc(O)c(O)c1)CC2 778922874 LUZAKKWTSPWSHG-UHFFFAOYSA-N 414.458 2.096 10 20 HECD COc1cc(N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c([N+](=O)[O-])cc1OC 781673640 ACXGWCFPCSAZGF-CQSZACIVSA-N 413.496 2.443 10 20 HECD CCNC(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 782341077 AOEPHGYANZBTEV-UHFFFAOYSA-N 400.431 2.133 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1 785294799 NNHXGIXYGYZTRZ-INIZCTEOSA-N 411.502 2.422 10 20 HECD C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785445361 WXZZVAKPABZENU-YJBOKZPZSA-N 418.538 2.131 10 20 HECD CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788319160 AZISYPMAHJBTNA-IEBWSBKVSA-N 405.564 2.320 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(F)c1 790634415 MBHKNDNIFGJXHV-UHFFFAOYSA-N 407.467 2.337 10 20 HECD CN(CCO)S(=O)(=O)c1ccccc1CNCc1c(O)ccc(Cl)c1F 790965416 KXLIXRJVYSJGKV-UHFFFAOYSA-N 402.875 2.087 10 20 HECD CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3c(C)cnn3C)n2)s1 795550318 UKZIYBGTRAUFAL-UHFFFAOYSA-N 411.534 2.350 10 20 HECD COCCNC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)c1 795789291 HDQUZEFYSVNDFU-UHFFFAOYSA-N 417.531 2.142 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCCC(=O)N2)NC(=O)OC(C)(C)C)cc1 799643722 CZSBOSWYGNVYHX-IAGOWNOFSA-N 404.511 2.103 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H]3CCn4c(cnc4C)C3)CC2)cc(OC)c1OC 811045365 AFZHTVVYEVZSMV-MRXNPFEDSA-N 414.506 2.129 10 20 HECD COc1ccc(N2CCN(CN3C(=O)C4(CCC4)[C@@H]3[C@H]3CCCO3)CC2)cc1F 811754889 LUMKXDRATBBDNW-UXHICEINSA-N 403.498 2.474 10 20 HECD CCOc1ccc(N2CCN(S(=O)(=O)c3cnc4c(c3)c(C)nn4C)CC2)cc1 1253812265 SLIUNLLRQWZVQH-UHFFFAOYSA-N 415.519 2.186 10 20 HECD COC1=CC(C(=O)Nc2ccc(N=S(C)(C)=O)cc2)=S=C1[S@](=N)(=O)O 1636794872 PNUCHJCIOSQNIY-UHFFFAOYSA-N 403.507 2.083 10 20 HECD COC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424221 UTSCIMPKNDPZTP-RHSMWYFYSA-N 405.495 2.009 10 20 HECD CNC(=O)CC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1841562788 UDZPBITXQMZASU-UHFFFAOYSA-N 408.502 2.047 10 20 HECD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841572672 JZHIGNMIKPVRQT-ROUUACIJSA-N 423.469 2.122 10 20 HECD C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)c(O)c(Cl)c1 1848269297 NBRFYCPNGHNWGI-KCXAZCMYSA-N 418.881 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)COc3ccc(Cl)cc3C(N)=O)CC2)cc1 7022721 GZNHXRQLYUCMNA-UHFFFAOYSA-N 403.866 2.175 10 20 HECD CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)ccc21 109190892 GXPQNBKJLPHVCF-OAHLLOKOSA-N 422.485 2.037 10 20 HECD COc1ccc(N2CCCN(C(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 728207414 PVPJAZKOFBAGPA-INIZCTEOSA-N 421.501 2.429 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)c1 729061928 MDAOCWNQYDJDNF-LLVKDONJSA-N 404.419 2.243 10 20 HECD COc1cccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 732450179 OGNJPUWBNCOLPB-NRFANRHFSA-N 417.481 2.328 10 20 HECD O=C1Cc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)ccc2N1 733849901 HSKKYLJVKSVWPB-KRWDZBQOSA-N 409.442 2.033 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NCC3(O)CCCCCC3)CC2)cc1 735579892 NAOVZPDCIOQYPE-UHFFFAOYSA-N 404.555 2.202 10 20 HECD O=C(COC(=O)c1cccc2c[nH]nc12)NCc1ccc(N2CCOCC2)c(F)c1 746952216 PAJPPAKFJNBKKL-UHFFFAOYSA-N 412.421 2.012 10 20 HECD O=C(CN1CCc2ccc([N+](=O)[O-])cc21)NCc1ccc(N2CCOCC2)c(F)c1 754601334 VPUKWLRFTRCNCQ-UHFFFAOYSA-N 414.437 2.249 10 20 HECD COc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cc(OC)c1OC 758963856 ILJDQCCOVFUZPF-SFHVURJKSA-N 416.474 2.166 10 20 HECD CCCn1nc(C)c(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1C 759992442 CNKFDCZQWUIRMZ-UHFFFAOYSA-N 401.423 2.192 10 20 HECD CCC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1 762082958 NOXFSLHBPNTXBJ-HLLBOEOZSA-N 406.502 2.249 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 762089333 NQCCQANUKIWXPA-GOSISDBHSA-N 418.513 2.253 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)c2)CC1 770149032 VIUKWGARDYDERC-UHFFFAOYSA-N 416.547 2.331 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 771936329 FVZYQVGIZFLBOL-OAHLLOKOSA-N 401.511 2.388 10 20 HECD C[C@H](NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O)c1ccc(N(C)C)cc1 773083906 LFHNBVURGGCATM-LBPRGKRZSA-N 411.911 2.310 10 20 HECD C[C@H](NC(=O)N1CCN(c2nccn3cnnc23)[C@H](C)C1)c1ccc(N(C)C)cc1 773613415 QSGKMXVHFZWCGK-CVEARBPZSA-N 408.510 2.172 10 20 HECD Cc1noc(C)c1CNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 774155149 QDBUHKKQWWHVBF-AWEZNQCLSA-N 422.432 2.294 10 20 HECD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(Br)c1 774363842 XRTGEPCEBMPNQK-UHFFFAOYSA-N 409.236 2.166 10 20 HECD CC(C)N1CC[C@@H](OC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1=O 785407130 DNNUPJINFKPNFN-OAHLLOKOSA-N 424.500 2.421 10 20 HECD Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C 785857955 PCKLUTUVPKFALI-KUHUBIRLSA-N 405.520 2.493 10 20 HECD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccc(N4CCOCC4)c(F)c3)cc21 786577218 ZVHLLKVQRLVHIV-UHFFFAOYSA-N 415.425 2.373 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC[C@@H]3[C@H]3CCCO3)CC2)cc1 790699601 XMLVTEKPLKQKFF-NHCUHLMSSA-N 402.539 2.170 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 802281163 RSFFKJUBRBJGRJ-FXAWDEMLSA-N 410.536 2.440 10 20 HECD COc1ccccc1CN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803298269 SFCMODUTGOLNBB-KRWDZBQOSA-N 411.502 2.368 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1COC2(CCCCCC2)O1 807099482 WSZJMHGZSZMJNZ-IBGZPJMESA-N 403.523 2.259 10 20 HECD CS[C@H]1CCC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 807204870 JCXGIKHEXLNDLR-MJGOQNOKSA-N 405.564 2.272 10 20 HECD Cc1cc(N2CCC(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)nc(C)n1 807670851 KXHDSQKZEKISFY-MRXNPFEDSA-N 424.549 2.122 10 20 HECD CCO[C@@H]1C[C@@H]1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 917305920 UTBREQTZDSFENT-QMYADUOMSA-N 408.470 2.024 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 917709726 WYGXTHWPOJNMKS-UHFFFAOYSA-N 403.366 2.229 10 20 HECD CN(C)C(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c1 918265230 GXEZPRGXIIEERT-UHFFFAOYSA-N 424.501 2.009 10 20 HECD CC(C)(C)c1cc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[nH]n1 919322875 QLIQENNUHBCOKF-UHFFFAOYSA-N 418.469 2.156 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCc3ccc4c(c3)CCO4)nc12 1319139273 YGCRUEXRYJZLTJ-UHFFFAOYSA-N 411.414 2.223 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nc(C)no2)cc1 1320692408 MGGDGKXPTLABEN-INIZCTEOSA-N 411.414 2.360 10 20 HECD COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1336704909 BEZFKYJZLVRCCD-KRWDZBQOSA-N 424.906 2.160 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc(O)c1F)c1cc(O)nc(O)c1 1800657107 FFVLGGVKCILBAJ-ZSBIGDGJSA-N 419.384 2.042 10 20 HECD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)cn1C 1818299200 RGRWDOCMLVBRKQ-MRXNPFEDSA-N 424.461 2.483 10 20 HECD O=C(N[C@@H]1CCc2nc(NC(=O)C3(F)CCC3)sc2C1)c1cc(O)nc(O)c1 1827418195 CNMWSYNTBWHGCU-SNVBAGLBSA-N 406.439 2.067 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3ccc4nnc(C(F)F)n4n3)cc2)CC1 302732737 XIRINNSZGAVIAI-UHFFFAOYSA-N 401.421 2.343 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(C[C@@H]2CCOC2)CC1 303810860 VGPDJCMYTVSPLO-FQEVSTJZSA-N 416.566 2.166 10 20 HECD Cc1nn(C)c(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1C 728164823 NNVOEHFYDSMKDH-UHFFFAOYSA-N 424.423 2.183 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)cc1 732990977 WSPRAAYDTORNHH-QFIPXVFZSA-N 421.545 2.385 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCCn1nc2n(c1=O)CCCC2 735888050 ZKULGRUSPPXIAI-UHFFFAOYSA-N 414.554 2.457 10 20 HECD COc1ccc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1-n1cnnn1 743194502 SIWDFFLMBVBBIZ-UHFFFAOYSA-N 423.477 2.171 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(C(=O)OC)c2)cc1 743257657 VHFPRYJNZINTNU-UHFFFAOYSA-N 418.518 2.487 10 20 HECD C[C@@H](NC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2)c1ccc(N2CCOCC2)cc1 746795126 WJSWBNMCTNGJMX-MRXNPFEDSA-N 424.501 2.168 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1F 748470846 MNCNFTOWIYTYHE-UHFFFAOYSA-N 418.444 2.122 10 20 HECD COC(=O)c1ccc(Br)c(S(=O)(=O)NCc2ccccc2O)c1 751149201 NPVOJPPPVIJGLP-UHFFFAOYSA-N 400.250 2.420 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN(C[C@H](C)O)C3CCCCC3)CC2)cc1 754027401 JLPIVKZTCCSWCG-SIKLNZKXSA-N 405.583 2.194 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@H](CO)C3CC3)nc12 755045415 QRGPEBKKDVMJNE-LJQANCHMSA-N 410.474 2.385 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H]1CCCS(=O)(=O)C1 758662671 MDOIEMPJFCHWHS-UONOGXRCSA-N 417.478 2.133 10 20 HECD COc1cc(N2CCN(S(=O)(=O)c3cn(C(C)C)cn3)CC2)cc(OC)c1OC 759099757 OLFKAPSEFLBASY-UHFFFAOYSA-N 424.523 2.001 10 20 HECD COc1cc(N2CCN(C[C@H](O)COc3ccc(F)cc3)CC2)cc(OC)c1OC 759876815 CGLIAHHIKCDNLG-SFHVURJKSA-N 420.481 2.413 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)CCC[C@@]1(C)NC(=O)NC1=O 764456074 GATOKWILYZRTJI-QGZVFWFLSA-N 412.284 2.272 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NCc2cccc(Br)c2O)C1 765516913 RKTMRSCIIBGULZ-NEPJUHHUSA-N 405.314 2.310 10 20 HECD NC(=O)[C@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(F)cc1 766597910 PYBLYMFQQKFVPJ-GOSISDBHSA-N 402.495 2.405 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc2ncc(I)n2c1 768913949 IVTGPVNNDCYJKN-UHFFFAOYSA-N 409.183 2.280 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(O)nc(C4CC4)c3)CC2)cc1 770584629 FKMVZNAYHQOVET-UHFFFAOYSA-N 411.458 2.179 10 20 HECD C[C@@H](NC(=O)C(=O)NCC1(N(C)C)CCCCC1)c1ccc(N2CCOCC2)cc1 774815486 LDPSKTKMYVCTTL-GOSISDBHSA-N 416.566 2.081 10 20 HECD Cn1cc([C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccc(F)cc2)cn1 775229955 IMDRVAKYUBTCHT-GOSISDBHSA-N 418.450 2.156 10 20 HECD C[C@@]1(CCCO)CCCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 776123818 NGFUHTOEMPXAKN-AVRDEDQJSA-N 402.539 2.225 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCc4c(O)cccc43)CC2)cc1 778275533 KXCNEERUCBEBDL-GMGKOPGTSA-N 421.497 2.409 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 779473188 KKIDSZZACJONKB-WAPJZHGLSA-N 422.890 2.298 10 20 HECD CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 785296057 BFBDVGOVVJPCNR-ZIAGYGMSSA-N 413.474 2.312 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 785298622 WYHFXUPBFCVWHZ-GFCCVEGCSA-N 421.457 2.446 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CC3CCC4(CC3)OCCO4)cc2)C1 788090397 RGYLZFMOEAMEFX-IBGZPJMESA-N 415.534 2.328 10 20 HECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc2c(c1)CCN(C(C)=O)CC2 790068720 SGBIHPSNTMNAQI-UHFFFAOYSA-N 402.472 2.343 10 20 HECD O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC([C@@H]2CCOC2)C1 792616910 ZQIVJENKZMTWIE-GFCCVEGCSA-N 408.501 2.363 10 20 HECD Cn1nnc2c(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)ccnc21 800886457 ZIBRNYGTRNQITK-UHFFFAOYSA-N 402.405 2.364 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)NC[C@@H](C)CC3(C)OCCO3)cc2)CC1 805025197 KMUGKCOENVDLSB-SFHVURJKSA-N 417.550 2.445 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1nc(C2CC2)cs1 806842176 GKJJOSJPSUVVGO-UHFFFAOYSA-N 404.467 2.251 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(c2nnc3n2CCCC3)CC1)c1ccc(N(C)C)cc1 807674057 FKZOTKDNXYUEFM-MRXNPFEDSA-N 424.549 2.264 10 20 HECD CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807679273 PLBZZSLREIGORR-JZXOWHBKSA-N 418.538 2.303 10 20 HECD CCOC1CC(CCNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)C1 809810201 OIXLWNTUYCRWPL-UHFFFAOYSA-N 403.523 2.055 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4c(c3)C(=O)OC4)CC2)cc1 813872261 ZYFDDZKUQDBAPJ-HJWRWDBZSA-N 421.453 2.209 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](O)C34CCCC4)cc2F)C[C@@H](C)O1 814665833 SOMFWUQZVPFCNW-LLGFUMIMSA-N 419.541 2.435 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCCN3C3CCCC3)nc12 815444636 GQPDGISMZBAOHS-KRWDZBQOSA-N 416.478 2.452 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CCCc2nn[nH]c21 816889739 KCUHNVCNVOVURU-CQSZACIVSA-N 409.412 2.396 10 20 HECD CC(C)CS(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916458153 XAHFOBBARBLSHF-UHFFFAOYSA-N 422.469 2.229 10 20 HECD CN(C)[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1 918117961 LHGGRVSHFYNFHK-IFMALSPDSA-N 423.561 2.490 10 20 HECD CNC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 918211171 HQOYCYFEPBFXIO-UHFFFAOYSA-N 410.518 2.254 10 20 HECD COCC(=O)NCCC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)CCC3)c1C 1115846675 CQSIKVSHINPNEN-UHFFFAOYSA-N 412.486 2.461 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1c(C)nn(C(C)C)c1C 1327852544 HWZMLHXQGKPWPW-KRWDZBQOSA-N 403.479 2.325 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)C1CCCC1)CCO2 1782004708 KMWVHWPQMJLBEU-HXUWFJFHSA-N 408.882 2.385 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccccn1 1796932713 VJPPDZFLNGRKNI-VBUUOAMHSA-N 417.469 2.126 10 20 HECD CC(C)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727973 DGZBHLXROCYHDN-UXONFWTHSA-N 402.476 2.387 10 20 HECD CC(C)NC(=O)CN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 7923747 GLKCXOMOERMMKR-AWEZNQCLSA-N 407.470 2.245 10 20 HECD Cc1ccc2c(c1)C(=O)N(CC(=O)N(C)Cc1ccc(N3CCOCC3)cc1)C2=O 16134817 ISHRXDREIVTFKQ-UHFFFAOYSA-N 407.470 2.086 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCN(c4ccccc4F)CC3)CC2)cc1 69147817 ONUBFARJHAQQNI-UHFFFAOYSA-N 412.509 2.305 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)O[C@@H](C)C(=O)NC(=O)NC3CC3)ccc21 728637530 NEGSJVRTDNTRRK-AWEZNQCLSA-N 401.463 2.438 10 20 HECD Cc1ccccc1C(=O)NC1CCN(C(=O)COC(=O)c2cc(O)cs2)CC1 732353840 BFBVMTYDCUYBMC-UHFFFAOYSA-N 402.472 2.340 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(N)cccc3Cl)CC2)cc1 732406402 UPTPPSVGIZCJIU-UHFFFAOYSA-N 403.866 2.436 10 20 HECD CCCn1c(=O)nc(O)c2c(C(=O)NCc3cc(OC)ccc3O)cc(C3CC3)nc21 734018061 CZGGRFQMBIZCBK-UHFFFAOYSA-N 424.457 2.429 10 20 HECD CCC[C@H](O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 740979718 XKDQJCZPIBZJOW-INIZCTEOSA-N 422.503 2.019 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 749255681 CORZVCXOXRKYDR-UHFFFAOYSA-N 410.517 2.444 10 20 HECD COc1ccc(O)c([C@@H](C)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 756362196 JJBUACUQBAYHLJ-OAHLLOKOSA-N 406.504 2.273 10 20 HECD C[C@H](NCCCCN1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1O 756531642 AYQOSSZXNBTKPC-INIZCTEOSA-N 400.483 2.343 10 20 HECD CC(C)n1cc(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 757247237 IOXBAMXTJNKVNE-GJZGRUSLSA-N 417.485 2.472 10 20 HECD COc1cc(N2CCN(Cn3ncc4ccccc4c3=O)CC2)cc(OC)c1OC 758955627 SFUMAECXYFASDQ-UHFFFAOYSA-N 410.474 2.202 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)C3CCOCC3)CC2)cc1 762061676 IYXVIZHHFHEYQR-SFHVURJKSA-N 404.555 2.322 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)c1coc(S(N)(=O)=O)c1 764456959 KRZIVZPDCUVWOC-UHFFFAOYSA-N 403.254 2.057 10 20 HECD CCCCCCn1cc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)c(O)nc1=O 766047482 KBNRDRSAZYMMIR-UHFFFAOYSA-N 409.464 2.238 10 20 HECD CN1CCC[C@@H]2CN(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC[C@H]21 766880256 KYPIOZASHYSTEN-SFHLNBCPSA-N 413.566 2.014 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 772107170 NEZVVODLBJEATA-UHFFFAOYSA-N 401.511 2.169 10 20 HECD COC(=O)c1cn(C2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)nn1 773615418 XQDMBBLVHLPIOY-CQSZACIVSA-N 400.483 2.238 10 20 HECD COCC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(N)=O 775970964 FFXRQEBDGSRUDQ-OAHLLOKOSA-N 408.296 2.477 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNCc1cc(Cl)cc(F)c1O 776175601 PMUKGKJIRXWWSM-UHFFFAOYSA-N 403.819 2.161 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CC[C@@H](n4cncn4)C3)cc2F)C[C@@H](C)O1 776854822 ARKQBJSIVBQTOU-BFYDXBDKSA-N 402.474 2.187 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnc4c(c3)COCC4)cc2)C1 777740286 ZQISAUDIKDDAFY-INIZCTEOSA-N 409.490 2.178 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCOCc3ccccc3)CC2)cc1 778311215 PSXUPBZBJNIDFF-VAWYXSNFSA-N 423.513 2.233 10 20 HECD CNc1cc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc(Cl)n1 787327476 NFVLGFNGAWIWCC-UHFFFAOYSA-N 401.898 2.375 10 20 HECD CC(=O)Nc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 788881868 NFTGYMOHGOKCBW-UHFFFAOYSA-N 401.442 2.015 10 20 HECD Cn1nc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)c2ccccc21 788931619 ILGKRDKYLWMJDN-UHFFFAOYSA-N 405.502 2.149 10 20 HECD O=C(NCc1ccccc1O)NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1 788941928 TUGZTIKZRQJAKE-GOSISDBHSA-N 415.465 2.048 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCO[C@]4(CCO[C@H]4C)C3)cc2F)CC1 792077138 WQACAGOMLMSTEU-HTAPYJJXSA-N 420.529 2.057 10 20 HECD CN(C)c1ccc(CN[C@H]2CCN(CCN3CCOCC3)C2)c(C(F)(F)F)c1 792978477 VALLVIQBVJJWFQ-KRWDZBQOSA-N 400.489 2.268 10 20 HECD CCN(Cc1cc(Br)ccc1O)S(=O)(=O)c1ccnn1COC 795128692 JISGRVMDKZGWDP-UHFFFAOYSA-N 404.286 2.166 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCN(C)[C@H]3c3ccccc3)ccc21 803686563 DTISPHLEUDPNJA-IRLDBZIGSA-N 406.530 2.247 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCCN(C(C)(C)C)CC3)CC2)cc1 804319102 YRUAYJNJIJMRTB-UHFFFAOYSA-N 416.566 2.113 10 20 HECD CCN(C)C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 805026277 IKUMUQONFBKMQX-HXUWFJFHSA-N 400.567 2.339 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1 806543849 KTCHDCYQJHMFAV-NSHDSACASA-N 411.455 2.240 10 20 HECD CCN1C[C@H](CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)Oc2ccccc21 807095305 NOTONKOVHFZORN-FQEVSTJZSA-N 424.545 2.423 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCCC34CCOCC4)CC2)cc1 814182513 XNAZQRDPLQBPID-HXUWFJFHSA-N 415.534 2.199 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(-c2ccccn2)c1N 815952163 BVZYYHGNEKOBMA-UHFFFAOYSA-N 415.837 2.024 10 20 HECD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CN(C)S(C)(=O)=O)c2C)cc1 914923451 JPHXTCOKDYUOOA-UHFFFAOYSA-N 422.503 2.110 10 20 HECD CC(C)CN1CCO[C@@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 915922992 RXJCWNNOVXKPLG-PMACEKPBSA-N 405.539 2.440 10 20 HECD NS(=O)(=O)c1cc(NCc2ccc(N3CCSCC3)cc2)cc([N+](=O)[O-])c1 917390747 DNEGWEYLJKJPCP-UHFFFAOYSA-N 408.505 2.408 10 20 HECD CC(=O)N1CCCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 918222770 XAIHTZFVKWIVDU-IYBDPMFKSA-N 406.502 2.203 10 20 HECD CCC(=O)Nc1ccc(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920637622 LQAHRASVFBRUFJ-UHFFFAOYSA-N 420.443 2.152 10 20 HECD CN(C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821290889 MFXUWASAHCTUIE-AWEZNQCLSA-N 421.885 2.342 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)C1=COCCC1 1822460228 RXVZPTBJKJSLJE-HNNXBMFYSA-N 413.434 2.216 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@H](O)c2ccccc2)C1 1842794749 IKAPVRXJEQCEHK-QGZVFWFLSA-N 416.861 2.302 10 20 HECD COc1c(C)cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)cc1C 1843250476 DODLBKIGVJOTNP-UHFFFAOYSA-N 411.458 2.249 10 20 HECD COc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)n1 1845500840 VBLXMQMRSCKBQY-UHFFFAOYSA-N 417.849 2.286 10 20 HECD O=C(CC[C@@H]1CCOC1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502477 CIZJBGXPMWCYAL-CYBMUJFWSA-N 408.882 2.385 10 20 HECD Cc1cc(C)n(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)c(O)c(Cl)c2)n1 1848222757 NZKZYKVCTGERPJ-HOTGVXAUSA-N 418.881 2.080 10 20 HECD COc1cc(C(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)ccc1C 71958042 SLWFTWVOXHFLHV-UHFFFAOYSA-N 424.545 2.144 10 20 HECD COC[C@@H](C)CNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 140897440 MMMCDJRUJHPETG-INIZCTEOSA-N 416.501 2.024 10 20 HECD COc1ccc(N2CCN(c3ccc(S(=O)(=O)N4CCCC4)cn3)CC2)cc1F 301582627 UBAWOORVOJSGCZ-UHFFFAOYSA-N 420.510 2.340 10 20 HECD CCN1C(=O)[C@H]2CN(C(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)CCN2C1=O 674452278 JPEJKCOUYNYYEC-LJQANCHMSA-N 412.490 2.013 10 20 HECD O=S(=O)(Cc1ccccc1CNCc1c(O)cccc1Cl)N1CCOCC1 733324545 JHINHRLLSFDUMF-UHFFFAOYSA-N 410.923 2.497 10 20 HECD CCOC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 741097167 NASGALRJFHSEMP-UHFFFAOYSA-N 423.469 2.260 10 20 HECD CN(C)[C@@]1(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCSC1 748620743 ZSQJQCQTLNEVFL-HXUWFJFHSA-N 410.559 2.023 10 20 HECD CC[C@](C)(NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(=O)OC 748676382 WBQFKNBQMZZRRF-NRFANRHFSA-N 410.382 2.442 10 20 HECD O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 755199333 RBFWEQNRMKSVQH-UHFFFAOYSA-N 417.487 2.079 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCCO[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 756924783 PVXLCYQNLBZVEH-SOLBZPMBSA-N 409.502 2.434 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN(C)[C@@H](C)C3)CC2)cc(OC)c1OC 759280553 AUOIUMVNHLVDBP-HOTGVXAUSA-N 406.527 2.027 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOCC4(CCC4)C3)CC2)cc1 760105879 ZYFYUSZDNXPLOH-UHFFFAOYSA-N 416.566 2.419 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)Cn1nc(-c2cnccn2)n(C)c1=S 764866451 WEIPGUCPFOAROG-UHFFFAOYSA-N 411.535 2.334 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(c2ccccc2)C(=O)C1 765228455 GRPLHEPBNUDPSS-UHFFFAOYSA-N 412.465 2.221 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1 765879326 FAYLEBVBFRSWPK-JOCHJYFZSA-N 424.545 2.330 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc([N+](=O)[O-])c2)cc1OC 768882302 NWHYMCQVSOVGPK-UHFFFAOYSA-N 421.478 2.227 10 20 HECD Cn1ccnc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(F)cc1 769637246 QJUGTETYRPUROP-QGZVFWFLSA-N 418.450 2.156 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N[C@H](C)c3ccccn3)cc2F)C[C@@H](C)O1 774883840 GBXJSECHPJFYMW-BZUAXINKSA-N 414.481 2.328 10 20 HECD COc1ccc(O)c([C@H](C)NCC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c1 775371498 YTZVBEZIQVQFBW-HOCLYGCPSA-N 410.536 2.010 10 20 HECD CC(=O)N1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)(C)C1 775564272 WIDMYMNGOJKPHR-UHFFFAOYSA-N 419.481 2.343 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1 789802464 ZXPXABKXYOHUTB-HNNXBMFYSA-N 417.456 2.338 10 20 HECD CCN1CC[C@@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H]1C 789863839 JZJNENUGXZGSPV-FXAWDEMLSA-N 418.607 2.187 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(-c3coc(C)n3)cc2)ccc1O 790407846 UWWYQBRBVAABDS-UHFFFAOYSA-N 423.472 2.065 10 20 HECD CCN(CC)C[C@H](C)NC(=O)C(=O)N(CC)Cc1cc(Br)ccc1O 793795790 RXYDBISFKXXQBD-ZDUSSCGKSA-N 414.344 2.350 10 20 HECD C[C@H](NCCNS(=O)(=O)c1ccc(F)cc1F)c1cc([N+](=O)[O-])ccc1O 799724798 AHAZGLJQIMOSJC-JTQLQIEISA-N 401.391 2.208 10 20 HECD CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(=O)NC)C1 802014586 SAUJMROQNPZLLN-LJQANCHMSA-N 408.506 2.324 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803306318 TZNDHJCDSPQCKV-YBOAYWMSSA-N 403.523 2.020 10 20 HECD O=C(N[C@@H]1CCc2c(O)cccc21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804399654 AYORWTIQPJMRKQ-QFBILLFUSA-N 410.470 2.409 10 20 HECD CNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 806457373 LAFFESYMKFFVEX-INIZCTEOSA-N 408.474 2.082 10 20 HECD COC[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(C)o1 806779619 QFFITLZAARMEJS-QZTJIDSGSA-N 416.474 2.305 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1 807098402 VLJOBFFXSRTDBM-KRWDZBQOSA-N 405.564 2.238 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 807290737 NAGHTTGDPQFBMV-NRFANRHFSA-N 409.461 2.418 10 20 HECD O=C1CCc2ccc(NC(=O)C(=O)NCc3cc(Br)ccc3O)cc2N1 807387214 DKJZCBNZCQBIIJ-UHFFFAOYSA-N 418.247 2.294 10 20 HECD CCOC(=O)N1CCC([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 807677203 MRDCRDLMANLWAY-HZPDHXFCSA-N 418.538 2.303 10 20 HECD CNC(=O)C[C@H](NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)c1ccccc1 807730748 QHSVDXJBZDEKEF-NRFANRHFSA-N 422.529 2.237 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 808220536 IMGMNWLSUHDAFJ-NRFANRHFSA-N 422.529 2.018 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc4c3COC4=O)cc2)C1 808908470 QMXXQNHAUFLTEK-OAHLLOKOSA-N 408.458 2.380 10 20 HECD CN(C)c1ccc(CNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1 914689080 NVTHMTRJSYWFEI-UHFFFAOYSA-N 401.511 2.197 10 20 HECD COCCN1C(=O)/C(=C/Nc2nc(-c3ccccc3)c(C)s2)C(=O)NC1=S 920978626 NEHBXPRFGJJJFN-JLHYYAGUSA-N 402.501 2.304 10 20 HECD COCCN1C(=O)/C(=C/N[C@H](C)c2cccc(C(F)(F)F)c2)C(=O)NC1=S 920980623 RXGQVUSTKNPDKI-QQMDNXKGSA-N 401.410 2.130 10 20 HECD COC(=O)COc1ccc(/C=C2\N=C(C3=S=C(C)C=C3)OC2=O)cc1[N+](=O)[O-] 1116737457 ULUCKKOOXJJMOZ-GHXNOFRVSA-N 402.384 2.111 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(nc1O)CCCCC2 1338288353 QCVMXMGMRHZWRD-KRWDZBQOSA-N 414.458 2.372 10 20 HECD C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1nnnn1C 1518425710 UIMVMXQYALWFET-QSARLWQPSA-N 422.561 2.130 10 20 HECD Cc1occc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782004621 IKNWVGJMSVHHDR-HXUWFJFHSA-N 420.849 2.410 10 20 HECD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)nc1 1845501188 LUYOYNHNNXRVEJ-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1 53697555 JDJQKRWYNLLPRA-UHFFFAOYSA-N 404.488 2.178 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 105051905 TZLKMDDVNVLVCG-UHFFFAOYSA-N 414.531 2.133 10 20 HECD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc3c(c2)CCCN3C)c1 109460257 FQWHHFCYFMZKPS-UHFFFAOYSA-N 403.504 2.181 10 20 HECD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN(C)c2ncnc3[nH]cnc23)cc1 730419312 IQDVYHIQVAQCEP-UHFFFAOYSA-N 421.427 2.446 10 20 HECD COC(=O)CN(CCN1CCOCC1)C(=O)c1cc(C)n(-c2ccccc2C)c1C 732097404 FSXBYCSHFGJBNN-UHFFFAOYSA-N 413.518 2.350 10 20 HECD COC(=O)NCCCC(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 733543134 SZCOQZNHRDKVAZ-UHFFFAOYSA-N 424.409 2.080 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-] 734491667 LJSCTWXMXYBYAT-UHFFFAOYSA-N 409.439 2.357 10 20 HECD C[S@](=O)CCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 735054359 ZLINYWWJQQSQJU-VVNKITKKSA-N 402.588 2.224 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)N3[C@@H](C)CC[C@H]3C)CC2)cc1 741018383 RIXRJUNDYGSFGL-KSZLIROESA-N 403.523 2.148 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@]1(O)CCN(Cc2ccccc2)C1 741411372 LPLWYTINYBPJTE-XMMPIXPASA-N 406.530 2.499 10 20 HECD CN(c1ccc(CNC(=O)c2cc(S(N)(=O)=O)cn2C)cc1)C1CCCCC1 742822139 BZEZYZRQYMROQS-UHFFFAOYSA-N 404.536 2.371 10 20 HECD CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NCc1cc(OC)ccc1O 743178297 FSAYLMTWQWAUHJ-UHFFFAOYSA-N 423.491 2.372 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3C[C@@](C)(OC)C3(C)C)CC2)cc1 745784567 XXCPYXOBISZWEV-SIKLNZKXSA-N 404.555 2.320 10 20 HECD C[C@@H](NC(=O)CNC(=O)CN1CCOc2cc(N(C)C)ccc21)c1ccc(F)cc1 746492972 ONHHRDOLGNYCLL-OAHLLOKOSA-N 414.481 2.084 10 20 HECD O=S(=O)(C[C@@H]1CCCCO1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 751358708 GCYFPQMZUUMXCT-IRXDYDNUSA-N 402.944 2.499 10 20 HECD NC(=O)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 753941180 QBXJQMDAVVYNNZ-CQSZACIVSA-N 419.432 2.250 10 20 HECD COc1cc(N2CCN(C[C@@H](O)COc3ccccc3F)CC2)cc(OC)c1OC 759886686 OVWYCTOVBQXNRK-QGZVFWFLSA-N 420.481 2.413 10 20 HECD CC(C)Oc1ccc(N(C)CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1 759933137 JQZOXLWAHVTRHQ-UHFFFAOYSA-N 403.504 2.147 10 20 HECD O=C(CCNS(=O)(=O)c1ccccc1)NCc1cccc(Br)c1O 765757633 SCDJAGYBGWIWNA-UHFFFAOYSA-N 413.293 2.140 10 20 HECD C[C@@H](O)CNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 769106396 LSUQPVVYYGVUTC-DKBJHAQFSA-N 415.334 2.147 10 20 HECD O=C(Cn1ccc(=O)c2sccc21)NCc1ccc(N2CCOCC2)c(F)c1 772896785 DMJFRKMESWYQOZ-UHFFFAOYSA-N 401.463 2.355 10 20 HECD O=C(COc1nnc(-c2ccccc2)o1)NCc1ccc(N2CCOCC2)c(F)c1 776282455 IHTBYFBGIIHXCA-UHFFFAOYSA-N 412.421 2.408 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N3CCC([C@@H]4CCOC4)CC3)CC2)cc1 784252648 SUCGTAYMXDTQQW-HXUWFJFHSA-N 416.566 2.275 10 20 HECD Cc1noc(C)c1NC(=O)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784765529 AAXMWHZRVLZQAT-HNNXBMFYSA-N 406.870 2.370 10 20 HECD NS(=O)(=O)C[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 784817017 CSOANXUIKWMGJY-KRWDZBQOSA-N 415.475 2.320 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1 785304843 RXTZGQNKAURPOA-NSHDSACASA-N 415.837 2.018 10 20 HECD CC(C)Oc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 786821038 VCATUHPLURSOKG-UHFFFAOYSA-N 411.502 2.243 10 20 HECD CC[S@@](=O)c1ccccc1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787319559 MCRVNFVPZVQACF-GDLZYMKVSA-N 413.543 2.413 10 20 HECD C[C@@H]([C@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)S(C)(=O)=O 788282783 LKGIFCANVBLXFW-STQMWFEESA-N 422.469 2.227 10 20 HECD COCCN(Cc1scnc1C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933598 QTSYYRLPVGKSOV-UHFFFAOYSA-N 416.547 2.343 10 20 HECD CCCN(C[C@H]1CCCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789814125 YOUDOCUPPAUQLF-GOSISDBHSA-N 421.513 2.086 10 20 HECD CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789825666 NJJUVWIXDVRODC-ZDUSMZPESA-N 421.513 2.129 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1 798098172 QVIYNNSICXDCDI-UHFFFAOYSA-N 422.526 2.354 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(OC(C)(C)C)nc2)cc1F 803663691 XGLJPXDDBNKGDU-UHFFFAOYSA-N 402.470 2.397 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 806254793 SUTIUHVKJNGMTB-WOJBJXKFSA-N 417.550 2.281 10 20 HECD CNC(=O)OC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 806457599 PGRPQQOHNFAIDW-MRXNPFEDSA-N 422.501 2.207 10 20 HECD Cc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2=O)cc1 807587485 HGBSTVHSGRZAFM-OXJNMPFZSA-N 408.502 2.160 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 807841482 CAPFYRVAWIQCJD-LJQANCHMSA-N 414.550 2.008 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c(O)c1 810409320 MBSLCGXXWYAJOT-UHFFFAOYSA-N 424.207 2.326 10 20 HECD O=C(CNC(=O)Cc1cccc(F)c1)NCc1ccc(N2CCC(CO)CC2)cc1 919969352 WBASKMRAELJGFQ-UHFFFAOYSA-N 413.493 2.010 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991023 MQRWCKNPXMDZTN-OXQOHEQNSA-N 408.458 2.318 10 20 HECD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2cccc(F)c2)C1 1844897210 BIQTTYQXTZZDGB-UHFFFAOYSA-N 420.444 2.436 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 437023403 HWRXYRAUHMXBJF-UHFFFAOYSA-N 418.837 2.470 10 20 HECD O=C(Cc1noc(-c2ccc(NC(=O)C3=S=CC=C3)cc2)n1)NCc1ccco1 445281794 QHOPNNRJRVIKGW-UHFFFAOYSA-N 408.439 2.405 10 20 HECD CC(=O)N1CCN(c2ccccc2CNC(=O)NCc2ccc(N(C)C)cc2)CC1 725857859 CVGXNNCASCZOTD-UHFFFAOYSA-N 409.534 2.421 10 20 HECD O=C(CCC1CCCC1)NCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 726621927 OEHFSYNXAUJLNM-UHFFFAOYSA-N 405.514 2.490 10 20 HECD Cc1ccc(/C=C/S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 726976759 OSPCQLBBDGOPIA-JLHYYAGUSA-N 420.556 2.320 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1F 728761166 KYXOIFJGYFWVCX-UHFFFAOYSA-N 403.429 2.489 10 20 HECD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594386 ULIAIDZEEBEBGN-HHXXYDBFSA-N 424.492 2.419 10 20 HECD O=C(COC(=O)c1ccncc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 745770862 ALGOLHCGPBKOFR-UHFFFAOYSA-N 407.829 2.184 10 20 HECD Cn1cc(CCCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 751060988 SOWYVWFRKUPAMX-UHFFFAOYSA-N 420.516 2.351 10 20 HECD O=C1CC2(CCN(CC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2)CN1 752303084 XHMXTACGZBJWLV-UHFFFAOYSA-N 417.465 2.003 10 20 HECD COCCCS(=O)(=O)N1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 754739552 CFCRSURAWBCOPO-UHFFFAOYSA-N 414.568 2.182 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCC(=O)[C@@H]1CCOC1)c2[N+](=O)[O-] 762833698 YZNRZGISBZCKHN-LLVKDONJSA-N 409.350 2.133 10 20 HECD CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NCc2cccc(Br)c2O)C1 765516917 RKTMRSCIIBGULZ-NWDGAFQWSA-N 405.314 2.310 10 20 HECD CC[C@@H](NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)[C@@H](O)C(F)(F)F 766248820 PRDYNNIQLYDVQZ-NVXWUHKLSA-N 420.451 2.469 10 20 HECD CCC[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 770215600 ZJZOLTMEBXRZPI-ZSDSOXJFSA-N 410.486 2.150 10 20 HECD CCN1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2F)CC1 770456277 NDIUYHAPPACGBV-UHFFFAOYSA-N 400.502 2.206 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC[C@@H](O)c3ccccc3)CC2)cc1 778296124 WZIIBUKAIUQCLL-SSSWZJSRSA-N 423.513 2.140 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn(CC4CC4)c3)CC2)cc1 778299465 WWVNZDQGOUOKAF-CMDGGOBGSA-N 409.490 2.145 10 20 HECD C[C@H](c1ccccc1)N(C(=O)C(=O)Nc1cccc(C(N)=O)n1)c1ccc(N)cc1 783483159 OEFIECYDILSQJF-CQSZACIVSA-N 403.442 2.496 10 20 HECD Cc1ncccc1NC(=O)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 784768328 WFDFYJYVJMGNLP-MRXNPFEDSA-N 402.882 2.468 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-n4cncn4)c(C)c3)cc2)CC1 786660234 BLXMFLSRJAKINQ-UHFFFAOYSA-N 418.501 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(NC(C)C)nc3)CC2)cc1 787253916 XGYKVNVRSDFWGS-UHFFFAOYSA-N 412.490 2.416 10 20 HECD CCO[C@@H]1C[C@@](O)(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 788756312 KECRQGJVMQFGRI-DKZVUGQWSA-N 405.539 2.450 10 20 HECD CNS(=O)(=O)c1cccc2c1CCN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C2 793608100 HQCVZKQLXWKWTL-UHFFFAOYSA-N 411.867 2.420 10 20 HECD CCn1c(=O)nc(O)c2c(C(=O)NCc3ccc(OC)cc3O)cc(C3CC3)nc21 794376158 BIURIXHVAKPRLH-UHFFFAOYSA-N 410.430 2.039 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)c(O)c1 797387065 CJLGEZXEKQMCHS-UHFFFAOYSA-N 411.458 2.167 10 20 HECD CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 798169666 LJMPQZJNQIIWED-MAUKXSAKSA-N 404.463 2.386 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)Cc3ccccc3)cc2)C1 799557126 TUAMKHAYQDYGEB-SFTDATJTSA-N 424.545 2.181 10 20 HECD O=C(CN[C@H]1CCCC12CCOCC2)NCc1ccc(N2CCOCC2)c(F)c1 800436763 HOOIVUYZBLIZJN-FQEVSTJZSA-N 405.514 2.217 10 20 HECD CC(C)[C@@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCO1 803300095 PLBZSIOWWLHMEM-HQRMLTQVSA-N 403.523 2.020 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cc1F 803661917 OJCWTDQUQFCMOV-SFHVURJKSA-N 421.513 2.085 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(COC(C)(C)C)on2)cc1F 803662456 KCZJWUGNNGBLAL-UHFFFAOYSA-N 406.458 2.127 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(Cc2cccc(F)c2)CC1 807289555 ZELWNFXYSRRGPI-UHFFFAOYSA-N 422.504 2.163 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)CC2)cc1 807611371 FCPFMROZFPAAFA-AQNXPRMDSA-N 415.534 2.054 10 20 HECD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)Cc3ccc(C)cc3)cc2)CC1 808308207 UQPDKDDTMCTZJI-UHFFFAOYSA-N 401.532 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C(=O)O[C@@](C)(c4ccccc4)C3=O)CC2)cc1 810024576 MMQJIVFGYWPHRD-QHCPKHFHSA-N 423.469 2.238 10 20 HECD CCCN(CC(N)=O)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 817056709 QUZLRHBTGLLKBQ-RAXLEYEMSA-N 411.574 2.453 10 20 HECD COCCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 864674268 XCPGKFFODWVYAZ-WQLSENKSSA-N 415.334 2.413 10 20 HECD Cc1cc(C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 1115881482 UMCVRMVWSAARMJ-OAHLLOKOSA-N 424.906 2.208 10 20 HECD COc1cc(C(=O)Nc2c(Cl)ccc3nonc23)cc(OC)c1OCC(N)=O 1116850683 UJYAGSPYPPGSKM-UHFFFAOYSA-N 406.782 2.010 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)C1CCCC1)CCO2 1782004706 KMWVHWPQMJLBEU-FQEVSTJZSA-N 408.882 2.385 10 20 HECD O=C(Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1)c1cncnc1 1787441135 NNPSGAJDBXLYDC-UHFFFAOYSA-N 405.414 2.344 10 20 HECD Cc1cc[nH]c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794701100 JMLIFJHLMCNIDK-VBUUOAMHSA-N 419.485 2.368 10 20 HECD COc1c(C)cc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1C 1845445103 QQEOKODIJTZONS-UHFFFAOYSA-N 411.458 2.249 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCCC(=O)N4)CC2)cc1 21881002 ZNFFYEHBGFRGFZ-UHFFFAOYSA-N 415.515 2.481 10 20 HECD NC(=O)CC[C@H]1CCCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 727158288 LVFLNEFVPLFFSA-OAHLLOKOSA-N 419.481 2.378 10 20 HECD Cc1nn(CCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1[N+](=O)[O-] 727851221 IUPNKGUWDNQZBS-UHFFFAOYSA-N 419.457 2.215 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1 729064966 XDZYMPKNPUUKBY-JTQLQIEISA-N 401.444 2.261 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCCNc3ccccn3)cc2)C1 729599154 NQLHSIVNGBJDNB-IBGZPJMESA-N 424.549 2.475 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)C1 731456728 DRQGBNRSZJRKRX-CQSZACIVSA-N 400.410 2.366 10 20 HECD COC(=O)c1ccc(CCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 731577405 KIBWPVFOKCCPLZ-FQEVSTJZSA-N 423.513 2.424 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2 734687635 NKGPCWGVLIKRQZ-KRWDZBQOSA-N 401.463 2.029 10 20 HECD O=S1(=O)CCN(c2ccc(CNC(=S)Nc3ccc4c(c3)OCO4)cc2)CC1 735237724 GPXOUGOQSPYXNY-UHFFFAOYSA-N 419.528 2.137 10 20 HECD CN(C)c1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 738881366 HTRVKXAORPSCLA-UHFFFAOYSA-N 402.520 2.309 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nc(C(F)(F)F)cs2)c1 743805148 JKYISOOXTMWHML-UHFFFAOYSA-N 409.411 2.212 10 20 HECD COc1ccc(N2CCN(C(=O)CN3C[C@@H](C)C(=O)Nc4ccccc43)CC2)cc1 745987145 NIDAULYMQGUABM-QGZVFWFLSA-N 408.502 2.439 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)c1c(C)cc(=O)n(CC(=O)NC(C)C)c1C 746273446 XQJGTMUCHFFAET-UHFFFAOYSA-N 412.534 2.294 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@]3(C)CCCC[C@H]3O)CC2)cc1 748625828 VPEWPUSCTUCHMV-IRLDBZIGSA-N 404.555 2.058 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c1 751070383 UBUJNKYAHWSRRM-AWEZNQCLSA-N 409.895 2.426 10 20 HECD Cn1cnc(S(=O)(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1Cl 751371890 LVYVKVOMSVVEKV-ZDUSSCGKSA-N 419.334 2.375 10 20 HECD COc1ccc(N2CCN(C(=O)CCNC(=O)c3ccc(F)cc3)CC2)cc1F 753738387 PZNXFWOHPPUKOB-UHFFFAOYSA-N 403.429 2.442 10 20 HECD Cc1cc(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n[nH]1 756701215 OOVCZHDUNLOPIS-UHFFFAOYSA-N 403.394 2.218 10 20 HECD CC(C)NS(=O)(=O)NCCN[C@H](C)c1cc(Br)cc(Cl)c1O 760045240 HEZODGRXGTZGMZ-SECBINFHSA-N 414.753 2.291 10 20 HECD COc1ccc(CCC(=O)N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)cc1 768440083 NRZOIHMROOLRBG-OAQYLSRUSA-N 412.486 2.104 10 20 HECD O=C(Cc1c[nH]c2ccccc12)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768441538 DGVYUGCQPWRBHQ-NRFANRHFSA-N 407.470 2.186 10 20 HECD O=C(C[C@H](O)c1ccc(Cl)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 772609351 MKAKEEPOOIMTKA-IBGZPJMESA-N 422.934 2.315 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 772829061 GKOXWZVXKMYTFF-MAUKXSAKSA-N 414.499 2.018 10 20 HECD C[C@@H](NS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1)c1ccc(N(C)C)cc1 773086622 FFUCTVPPNFEJJO-GFCCVEGCSA-N 415.512 2.303 10 20 HECD Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773847787 SWVFDXWNAQBOOJ-CQSZACIVSA-N 403.504 2.280 10 20 HECD COc1ccc(-c2noc(CN3CCN(C(=O)c4cccc(O)c4O)CC3)n2)cc1 776326997 MRALKQCZRYAFGI-UHFFFAOYSA-N 410.430 2.114 10 20 HECD CC1(C)CN(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCO1 776859326 VDAKRUZJRQGGKJ-UHFFFAOYSA-N 419.494 2.202 10 20 HECD COCc1ccccc1S(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 778627965 RFJORIZORFMNMZ-UHFFFAOYSA-N 408.495 2.412 10 20 HECD CC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC[C@@H]1O 783757228 VGBNDMIWWQSNEF-HNNXBMFYSA-N 410.517 2.488 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1c(C)noc1C 788333930 SOONMLGJJMTRTK-GOSISDBHSA-N 400.479 2.012 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@@H]3N(C)CCCC3(C)C)CC2)cc1 790505746 XJPZKBUPUAWWGJ-NRFANRHFSA-N 417.598 2.237 10 20 HECD CC(C)(C)n1nccc1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 792371024 HYTCLZBGQLTYSJ-UHFFFAOYSA-N 405.524 2.195 10 20 HECD Cc1cnc([C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)s1 803302931 FZKYWIYDFBZNGI-GDBMZVCRSA-N 416.547 2.385 10 20 HECD CC(=O)Nc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cn1 805026157 DSHGMJMSEGZIMO-UHFFFAOYSA-N 423.517 2.209 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 806276262 AQHVYLORMKHXGG-GOEBONIOSA-N 408.593 2.217 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCc2ccccc2C1 807116630 NRHGPBNNNGYQRZ-FQEVSTJZSA-N 421.541 2.403 10 20 HECD Cc1cn2cc(NC(=O)C(=O)NCc3cc(Br)ccc3O)ccc2n1 807386880 ODJXTDSKTQQCKN-UHFFFAOYSA-N 403.236 2.366 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COc4ccccc43)cc2)C1 808368325 ZNGLPFYKFLOHEE-ZWKOTPCHSA-N 408.502 2.364 10 20 HECD Cc1cc(F)ccc1CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 808648486 DAYRKLQJCVYKJO-UHFFFAOYSA-N 413.493 2.288 10 20 HECD CC[C@H]1CCC[C@H]1NC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808736610 WSANCWYIPGNQPI-DOTOQJQBSA-N 419.522 2.056 10 20 HECD COCCN1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 836220558 YFARWBZSMAKBGA-UHFFFAOYSA-N 419.232 2.043 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3sc(N(C)C)nc3Cl)cc2)CC1 857493907 FVVJOHBZKCLJHB-UHFFFAOYSA-N 421.954 2.461 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918294294 FFCZAPOBQSEJRI-SFHVURJKSA-N 412.442 2.325 10 20 HECD CN(C)CC(C)(C)CNC(=O)C1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 918777226 GTGNVNFCNOKZLG-UHFFFAOYSA-N 417.598 2.378 10 20 HECD Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc(S(N)(=O)=O)c1C 920889357 UBNORXXIDYAQFO-MRXNPFEDSA-N 417.531 2.278 10 20 HECD CCOc1ccc(N2CCN(CC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)cc1 1253677149 HMJHLONXXMMUID-UHFFFAOYSA-N 417.531 2.250 10 20 HECD CCCN1CCCC[C@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1318669550 BJNYRPLRRXLERT-FQEVSTJZSA-N 421.513 2.086 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(C3)C4)[C@H]2C1 1791829274 NYTJHCXFGKKTJM-GRDLGNPVSA-N 420.893 2.145 10 20 HECD CC(=O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796931214 VAJPXCUVBOHRLE-VBUUOAMHSA-N 424.501 2.033 10 20 HECD Nc1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)s1 1800715310 HUVXQIYIFCSROZ-JGPRNRPPSA-N 422.894 2.356 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 437024700 YQNWXTBGKDACGJ-UHFFFAOYSA-N 416.459 2.277 10 20 HECD COCCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 485543417 JLCYCSLAWHRTPP-PZJWPPBQSA-N 404.507 2.455 10 20 HECD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727141330 IOZUSOCRMZDJSK-AEFFLSMTSA-N 418.538 2.308 10 20 HECD Cc1nnnn1/C(=C/c1ccccc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 728302244 VDWZPIYSAPKXLI-CJLVFECKSA-N 418.501 2.475 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1 728955345 QSMDAAPRTWAWEH-HNNXBMFYSA-N 414.506 2.253 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)c1 728985439 WLZUKXCEPBEPQR-DLBZAZTESA-N 418.515 2.251 10 20 HECD CC(=O)Nc1c(C)cccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 729342022 UPDYPYNXOJQISE-UHFFFAOYSA-N 401.488 2.441 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)cc1F 731365032 ZPIBJQKIAMRPCS-MRXNPFEDSA-N 414.547 2.143 10 20 HECD O=C(Cc1cccc(F)c1)NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 731859413 VICVTVJDRUWEQF-IBGZPJMESA-N 400.450 2.398 10 20 HECD COCC1CCN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CC1 732882928 IHMIRSSKDMJWHX-UHFFFAOYSA-N 404.555 2.275 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1 734073634 SSPVYHIJPWGYAI-UHFFFAOYSA-N 417.849 2.436 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)[C@@](C)(O)Cc3ccccc3)CC2)cc1 742241052 KYWSHOGFJLBYCM-DEOSSOPVSA-N 411.546 2.317 10 20 HECD COc1ccc(O)c(CNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1 743413125 RKORSHBFEJERKU-NSHDSACASA-N 402.476 2.092 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H]1[C@H](O)C(F)(F)F 750636920 IQIAKGWRPYVOLH-HOTGVXAUSA-N 405.392 2.260 10 20 HECD CCOC(=O)Cc1nnc(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)s1 752341986 LDQYYNLNHCAHOA-UHFFFAOYSA-N 419.507 2.443 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(F)(F)[C@@H](C)C3)CC2)cc1 753027070 YYFYYRGRFUGITF-PTZVLDCSSA-N 407.461 2.404 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)[C@@H]3CCCN(C4CCC4)C3)nc12 754465858 QBIKLOUJDSRLDF-LSDHHAIUSA-N 401.511 2.354 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCC[C@H]3O)CC2)cc1 755053395 JYCCCZIPHYOYKX-WIYYLYMNSA-N 404.555 2.010 10 20 HECD CC[C@@H](NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCCO1 756106300 YXZGWDKJKMNJGN-NHCUHLMSSA-N 404.555 2.464 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC(C)(C)[C@H]3C)CC2)cc1 764352921 YMADRBPPUGGTES-GOSISDBHSA-N 404.555 2.416 10 20 HECD COc1ccc(N2CCC(NCc3ccc(C(=O)N4CCNC(=O)C4)cc3)CC2)cc1 765062814 ZPMHPUPLYGMQBQ-UHFFFAOYSA-N 422.529 2.026 10 20 HECD C[C@H](NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccc(N2CCOCC2)c(F)c1 765626633 QDULTBMLUIRWKN-LAUBAEHRSA-N 406.546 2.256 10 20 HECD CN1CCc2ccc(NC(=O)C(=O)NCc3cccc(Br)c3O)cc21 765902551 AMRCNKFPCLYGEU-UHFFFAOYSA-N 404.264 2.402 10 20 HECD Cn1ccnc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 770302476 WHAOYRVWCRXNMJ-RTBURBONSA-N 424.549 2.211 10 20 HECD CN(C)c1cnc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 770485937 LZUCKEGZSTXXRX-UHFFFAOYSA-N 409.412 2.328 10 20 HECD Cc1c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1-c1ccccc1 772472986 UZHIMSRHLPMHHC-UHFFFAOYSA-N 419.485 2.272 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 773740193 OHOXRZYNXLSAPO-CZUORRHYSA-N 412.442 2.179 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 774356081 HKXJUEPAKMFTBX-UHFFFAOYSA-N 409.398 2.241 10 20 HECD CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 775260819 QBGXXCKHLXKJSR-XLIONFOSSA-N 403.523 2.118 10 20 HECD COc1cc(O)c(CN2CCN(c3ccc(NS(C)(=O)=O)cc3)CC2)cc1OC 775747294 JYLLMVKWZPEGLU-UHFFFAOYSA-N 421.519 2.103 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)OCCc3c(C)nc4nc[nH]n4c3=O)ccc21 777355729 ONBWPVPJNYSEKQ-UHFFFAOYSA-N 423.473 2.343 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCC(CC(=O)N(C)C)CC2)c1 781144458 MGXCCOVBEXCFAJ-UHFFFAOYSA-N 417.550 2.117 10 20 HECD C[C@H](NC(=O)C(=O)NCc1cccc(N(C)C)c1)c1ccc(N2CCOCC2)cc1 786898212 IBZRNLHRNQEKEY-KRWDZBQOSA-N 410.518 2.083 10 20 HECD CN1CCN(c2ccc(CNc3cccc(C(=O)N4CCC[C@H]4CO)n3)cc2)CC1 788744694 YRUWSXLWFKZELR-FQEVSTJZSA-N 409.534 2.042 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1nccs1 789867074 FMKVIMBAGQJLMF-CQSZACIVSA-N 404.561 2.232 10 20 HECD CC[C@]1(C)CCCN(C(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 793733244 LUPZDGXPROAWTF-WZONZLPQSA-N 414.550 2.043 10 20 HECD CC[C@@H]1NC(=O)N(c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)C1=O 794613543 TWPYVVIKGMOYGK-LBPRGKRZSA-N 417.472 2.327 10 20 HECD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(Cl)cc2Cl)ccc1O 797431942 CWVQWZAZNDCBBQ-UHFFFAOYSA-N 411.288 2.408 10 20 HECD COCC1(CNC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CCC1 799997010 MGJMGIKEEVNINK-UHFFFAOYSA-N 407.511 2.361 10 20 HECD CC(C)O[C@@H]1C[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 803307125 WEHOKVKKTWODOX-NSISKUIASA-N 417.550 2.409 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nc3cccc(Cl)c3n2C)cc1F 803663787 ZZSNZKSNQGSGRA-UHFFFAOYSA-N 417.872 2.364 10 20 HECD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CN1Cc1ccccc1 803664726 PQJJMZJSRZCIKC-VQIMIIECSA-N 412.509 2.287 10 20 HECD O=C(NCCCSc1nccs1)C(=O)N1CCCN(Cc2ccccc2)CC1 806279589 SUCRUNYZSUYPTI-UHFFFAOYSA-N 418.588 2.476 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cc(Br)ccc2O)c(OC)c1 807386780 IXUFPGHCKKLDBV-UHFFFAOYSA-N 409.236 2.427 10 20 HECD C[C@H](NC(=O)C(=O)N1CCCN(c2nccs2)CC1)c1ccc(N(C)C)cc1 807670533 GFVCHZOLLRRMRF-HNNXBMFYSA-N 401.536 2.125 10 20 HECD CN(Cc1ccccn1)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807770333 KLSUIIGZDKBGAO-MRXNPFEDSA-N 418.444 2.427 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 808296352 OHPJRPKMUYBEBI-OAHLLOKOSA-N 418.943 2.129 10 20 HECD NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1ccc(N3CCOCC3)cc1)CCC2 810213538 UYRXYPTUXBTAOP-NRFANRHFSA-N 401.532 2.338 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NCc2cc(Cl)c(F)cc2O)c1 816547246 PIXVTNYQLNHMCD-JTQLQIEISA-N 415.874 2.210 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccccc3)cc2)C1 918116888 BUUIPYKGFJRVHG-RTWAWAEBSA-N 424.545 2.039 10 20 HECD NC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccs1 919969160 GHWLABRWHFGBLF-MRXNPFEDSA-N 420.510 2.264 10 20 HECD NC(=O)c1cn(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccccc12 919970567 MGYPZAJEXQGUCQ-UHFFFAOYSA-N 424.476 2.157 10 20 HECD CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)cc3)cs2)cn1 1318190290 WWTGEXGQDPNDBC-UHFFFAOYSA-N 405.505 2.463 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(C(C)C)nn3CC)nc12 1337707804 VPMWRVMJSFXXFV-UHFFFAOYSA-N 401.423 2.308 10 20 HECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)s1 1796598785 HZCQFJVTZWAXGL-CLLJXQQHSA-N 403.460 2.129 10 20 HECD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1841572673 JZHIGNMIKPVRQT-ZWKOTPCHSA-N 423.469 2.122 10 20 HECD O=C(c1ccsc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441348 LMWIYFCMLQQZJR-UHFFFAOYSA-N 408.483 2.358 10 20 HECD COc1ccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)c2c1 1844050452 IMYOYWUPRLZEIG-UHFFFAOYSA-N 422.441 2.114 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(F)c(F)cc2F)C1 1845327783 DRLUHOABUFHUAJ-UHFFFAOYSA-N 407.348 2.041 10 20 HECD C[C@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)Oc1ccccc1 1845878378 WEQDGCODDHAQIV-OAHLLOKOSA-N 411.458 2.167 10 20 HECD COc1ccc(S(=O)(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 6275084 URBMYQXGOTUUEO-UHFFFAOYSA-N 422.503 2.232 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 17333453 UYXIALFEJZEZSB-UHFFFAOYSA-N 423.560 2.016 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 138442460 UUCZFNHMQYEJOR-PMACEKPBSA-N 413.518 2.047 10 20 HECD COCCO[C@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 485543415 JLCYCSLAWHRTPP-FPOVZHCZSA-N 404.507 2.455 10 20 HECD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 728203148 HAWFCRDPCAFLOF-MRXNPFEDSA-N 421.501 2.176 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(C)CC(=O)N3CCCC3)cc2F)C[C@@H](C)O1 729224938 AKSNVIOPVSEZHE-IYBDPMFKSA-N 406.502 2.203 10 20 HECD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccccc2O1 732478535 GLOBFXYQTDYTNW-KRWDZBQOSA-N 409.486 2.296 10 20 HECD COC(=O)NCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 733545060 VSJLNAFUENIUSW-LBPRGKRZSA-N 424.409 2.078 10 20 HECD CCOc1ccc(N(C)CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1 739924691 UHPYBZQTHTZJRS-INIZCTEOSA-N 406.508 2.025 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(C(C)C)c2)cc1OC 741647337 BUJLCDLFPDHDKH-UHFFFAOYSA-N 402.498 2.035 10 20 HECD CN1CC[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1=O 742751698 VVNVDLUILOXVHO-FUHWJXTLSA-N 418.538 2.303 10 20 HECD CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 743699086 IZGAKULEBWRNPH-VXGBXAGGSA-N 423.425 2.403 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3C(=O)Nc4ccccc43)CC2)cc1 748705784 VZKKLEBTKHFQPA-NRFANRHFSA-N 422.529 2.450 10 20 HECD Cc1cc(C(=O)O)cc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1F 749143867 RWBILTDJHHCBPM-UHFFFAOYSA-N 402.425 2.005 10 20 HECD COC(=O)[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 752338481 WYSKRTWNIAEMQJ-MRXNPFEDSA-N 408.366 2.052 10 20 HECD CC(C)[C@@H](NC(=O)NCCCSc1nccs1)c1nc(-c2nc[nH]n2)no1 752690110 WVUODYMJELTRDL-SNVBAGLBSA-N 408.513 2.490 10 20 HECD CC[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](CC)CN1C(C)=O 752901581 CLDYHAXSBNTFTL-VQTJNVASSA-N 402.539 2.454 10 20 HECD COc1ccc(N2CCN(C(=O)NC[C@@H]3CN(CC(C)C)CCO3)CC2)cc1F 753933895 QCBBFGDISGBKQC-GOSISDBHSA-N 408.518 2.023 10 20 HECD COc1ncnc(N(C)C)c1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 754452458 RVIKMRCVUOIQTM-UHFFFAOYSA-N 400.483 2.052 10 20 HECD COC[C@@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 755218313 CUVYFHLRMOWPSM-INIZCTEOSA-N 401.486 2.231 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1 757879467 KTAAUSGMUVNNRH-RZNKXZLBSA-N 403.479 2.325 10 20 HECD Cc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(O[C@H]2CCOC2)c1 759095389 XNLYPUGJDSSRII-INIZCTEOSA-N 420.487 2.170 10 20 HECD O=C(N[C@@H]1CCc2c[nH]nc2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 759098959 NFQYMMHEJYZWCR-GFCCVEGCSA-N 418.500 2.265 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(NC(C)=O)ccc2NS(C)(=O)=O)c1 761968998 XAXAWVPFORJGTB-NSHDSACASA-N 421.475 2.222 10 20 HECD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C1 763281683 WOXWOQTZFWBOPT-KSSFIOAISA-N 411.458 2.343 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(F)nc3)cc2F)C[C@@H](C)O1 766326282 BYWXACWZWUCTLT-BETUJISGSA-N 404.417 2.228 10 20 HECD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1F 768156207 LHHNCLYWBSDYQO-UHFFFAOYSA-N 422.482 2.306 10 20 HECD Cc1cccc([C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 769037341 LZFRMDJXKCTHBJ-CTNGQTDRSA-N 410.518 2.230 10 20 HECD CC(C)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC(C)(C)C 769976010 YBVIYPGSHCYRKN-CQSZACIVSA-N 400.497 2.250 10 20 HECD COCCn1nc(C)c(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 772549817 RJUNTQDQBNDNLV-UHFFFAOYSA-N 405.474 2.444 10 20 HECD C[C@H](C(=O)N1CCN(c2ccccc2O)CC1)N1CCOc2cc(N(C)C)ccc21 774750231 BWZBZWCTWDCTCN-QGZVFWFLSA-N 410.518 2.394 10 20 HECD Cc1cc(C(=O)COC(=O)COC(C)(C)C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 778153856 UURRYYUWRPXYQK-UHFFFAOYSA-N 422.503 2.283 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCc3cccc(OC)c3)CC2)cc1 778233908 OIQQXSNXMVDQKF-ZHACJKMWSA-N 423.513 2.268 10 20 HECD Cc1cc(Br)cc([C@H](C)NCCNS(=O)(=O)Cc2ccon2)c1O 779026671 DMGAXAHJSKXBIK-NSHDSACASA-N 418.313 2.221 10 20 HECD CCOCc1cc(CNC2CN(S(=O)(=O)c3ccc(OC)cc3)C2)ccc1OC 779170540 BJWPHFUKDBDRDP-UHFFFAOYSA-N 420.531 2.403 10 20 HECD Oc1cc2c(cc1CN1CCCN(c3nnc(C(F)(F)F)s3)CC1)[C@H](O)CO2 786105363 HLXURSQXSSBKAR-CYBMUJFWSA-N 416.425 2.401 10 20 HECD CC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccncc1 789840114 DFKTZHFSPGLUEX-LJQANCHMSA-N 414.481 2.066 10 20 HECD O=S1(=O)N=C(N2CCN(Cc3c(O)ccc(Cl)c3F)CC2)c2ccccc21 792167289 KDQKDOHYPCIKDJ-UHFFFAOYSA-N 409.870 2.451 10 20 HECD CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(OC)cc2O)cc([N+](=O)[O-])c1C 795357248 MBUGDCJXLGFBIZ-UHFFFAOYSA-N 424.431 2.273 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 799763762 CARZFEMYCKBDJN-OKILXGFUSA-N 409.483 2.321 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@](C)(c4ccccc4)C3)ccc21 803685663 HXKKIBYXIPAMRS-XMMPIXPASA-N 407.514 2.459 10 20 HECD CC[C@H](C)N(CCO)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 805791128 JGRLXBCSQZKIQR-AWEZNQCLSA-N 407.536 2.017 10 20 HECD COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1Cc1cc2c(cc1O)OCO2 809720066 WYSCSSYGIOLINF-CQSZACIVSA-N 408.451 2.105 10 20 HECD NS(=O)(=O)c1ccc2c(c1)[C@@H](NCc1ccc(N3CCOCC3)c(F)c1)CCC2 810211896 XPMNGWCZBJHSTD-FQEVSTJZSA-N 419.522 2.477 10 20 HECD C[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(=O)c1ccccc1 918371571 HFYJLGKUTNEKAM-XLIONFOSSA-N 422.529 2.213 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(F)c(F)c(F)c1F 920738901 ISVOQLWSIUGPBB-UHFFFAOYSA-N 416.396 2.408 10 20 HECD CC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)CCC1 1799767066 OVSDSVFTJXFWEP-YWVIFJGQSA-N 408.882 2.145 10 20 HECD O=C(c1ccncc1F)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501131 DFXHJGPLZNRYHE-UHFFFAOYSA-N 405.813 2.416 10 20 HECD CCOc1ccccc1C(=O)NCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 10907572 JAMLRTFSOVFDHT-UHFFFAOYSA-N 411.502 2.310 10 20 HECD O=C1CCC(=O)N1Cc1ccccc1NS(=O)(=O)c1cccc2nsnc12 63443609 HOHHSRCEJVPYRA-UHFFFAOYSA-N 402.457 2.141 10 20 HECD CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 148463787 CPXWMPPODNYJCX-INIZCTEOSA-N 417.531 2.231 10 20 HECD CC(C)C(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 726234564 ITGXHWVZIRPDCD-GOSISDBHSA-N 420.529 2.356 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)CC2)cc1 727057028 LWZNIZLFFMGHQR-MOPGFXCFSA-N 413.499 2.048 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1 727356308 FVKMEBXCHGJGRP-UHFFFAOYSA-N 416.452 2.175 10 20 HECD COc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1OCC(N)=O 735519245 PMUMDSDGGOSWHK-QGZVFWFLSA-N 414.458 2.086 10 20 HECD C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NCc1ccc(N(C)C)c(F)c1 735519645 VDBPOSBGVJKAGC-KRWDZBQOSA-N 414.529 2.297 10 20 HECD Cc1ccccc1[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 746759002 ZJCRJPTUWZVCGN-NQIIRXRSSA-N 410.518 2.230 10 20 HECD CCc1cc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 751068691 VEUNNXGMNHODGM-UHFFFAOYSA-N 406.489 2.470 10 20 HECD COc1ccc(N2CCN(CC(=O)Nc3cccc(C(=O)N(C)C)c3)CC2)cc1F 753858091 SFCJVVHGNHWYSO-UHFFFAOYSA-N 414.481 2.297 10 20 HECD COc1cc(N2CCN(C(=O)[C@H]3CC(=O)N(C(C)(C)C)C3)CC2)cc(OC)c1OC 759220950 NGJADGUWJPPLAZ-HNNXBMFYSA-N 419.522 2.008 10 20 HECD COc1ccc2c(c1)CCCCN2CC(=O)c1c(O)nc(=O)n(CC(C)C)c1N 766268902 GYBMQYWJUJKBMP-UHFFFAOYSA-N 400.479 2.221 10 20 HECD Cn1cc(C[C@H]2CC(=O)N(CN3CCCc4cc(OC(F)F)ccc43)C2=O)cn1 766353130 ZXMLYPQYCMEQDK-HNNXBMFYSA-N 404.417 2.349 10 20 HECD CC(C)(C)S(=O)(=O)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 767796279 QZZNOGQGTGWNQQ-HNNXBMFYSA-N 402.944 2.340 10 20 HECD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3cnc(Cl)n3C)cc2F)C[C@@H](C)O1 769394218 CXPUPNKGUNULNV-TXEJJXNPSA-N 416.906 2.305 10 20 HECD C[C@@H](NS(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1 773089787 VTXAOZAYILZVMF-CQSZACIVSA-N 411.549 2.042 10 20 HECD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(OCC(=O)O)c(Cl)c1 775286701 MKLVUJAOTGIDDA-UHFFFAOYSA-N 415.807 2.096 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc([C@H](C)O)cc3)CC2)cc1 778307289 PUEXTIHBSJUUJR-DXRVJIQQSA-N 423.513 2.270 10 20 HECD Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 781452608 KMBSLGBSGBWUSN-UHFFFAOYSA-N 419.485 2.272 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c(OC)c1 785487293 MJVAJUUIKCTVSZ-UHFFFAOYSA-N 404.488 2.343 10 20 HECD C[C@@H]1c2nncn2CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 790204646 ROKJQFQOQAMFTL-CYBMUJFWSA-N 424.427 2.420 10 20 HECD COc1cccc(CNS(=O)(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1O 799774373 WHCKBVIMHNNNQK-UHFFFAOYSA-N 400.497 2.220 10 20 HECD CC(=O)Nc1ccc(CCNC(=O)C(=O)NCCCSc2nccs2)cc1 803556417 CPTHKNDIVRYCCG-UHFFFAOYSA-N 406.533 2.059 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]4CCC[C@@H]43)cc2F)CC1 805007586 MOWRKCRHCGMPRB-ICSRJNTNSA-N 416.541 2.375 10 20 HECD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N(C)Cc1ccccc1 805944248 SCUFMLRGCXWXGO-IBGZPJMESA-N 406.530 2.316 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2 806899250 CGMBTVOSCCNTLF-UHFFFAOYSA-N 416.865 2.300 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)[C@H]1CCCN(C(=O)OC)C1 808033161 IEAWDKFPKGVZIM-HOTGVXAUSA-N 405.495 2.114 10 20 HECD CCN(Cc1ccoc1)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808853925 KULGTDVMAZVZHR-UHFFFAOYSA-N 424.545 2.477 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ncnn1-c1ccccc1 809867337 JGQZNYOMISFXOC-UHFFFAOYSA-N 420.517 2.387 10 20 HECD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)N(C)Cc2ccccc2O)CC1 916639884 SGVQATBPBYPNMK-UHFFFAOYSA-N 420.510 2.051 10 20 HECD Cc1cc(C(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 917916792 CFJKRSYQHXBUOS-UHFFFAOYSA-N 422.478 2.456 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)NCc1ccc(N3CCC(O)CC3)c(F)c1)C2 918204025 MGYWBDWYAVQLIA-KRWDZBQOSA-N 413.497 2.242 10 20 HECD C[C@@H](Oc1cccc(F)c1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339177 BXCFINQVHYXIEA-OAHLLOKOSA-N 406.479 2.144 10 20 HECD CC(C)COC[C@@H](O)CNCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 920092360 UWMIIBNMCGUTFR-IBGZPJMESA-N 417.529 2.065 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(N2CCCC2=O)c1 1323860234 QSXINGAWFLBEFH-KRWDZBQOSA-N 412.442 2.129 10 20 HECD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c[nH]1 1782005658 TWQNUCZYDCLFMF-FQEVSTJZSA-N 419.865 2.145 10 20 HECD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)C3(F)CC3)CCC2)cc1 1792316332 ZTTQMIDQENHZAN-UHFFFAOYSA-N 421.519 2.483 10 20 HECD C[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)Oc1ccccc1 1845878377 WEQDGCODDHAQIV-HNNXBMFYSA-N 411.458 2.167 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1 302932930 GIKVARLAUSBIFB-UHFFFAOYSA-N 414.937 2.480 10 20 HECD C[C@@]1(c2ccc(CNCc3cc(Cl)cc([N+](=O)[O-])c3O)cc2)NC(=O)NC1=O 726189872 PMMOTYTTZBELSQ-SFHVURJKSA-N 404.810 2.298 10 20 HECD CCN(C)[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccccc1 728601342 CBQLPSBECGSKAA-NRFANRHFSA-N 415.559 2.231 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NC2CCN(CCS(C)(=O)=O)CC2)cc1 731686982 TZJUDTWKARJWAH-UHFFFAOYSA-N 424.611 2.183 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](O)c3ccccc3C)CC2)cc1 732824687 PEKKYILXDIRUSW-QFIPXVFZSA-N 412.534 2.158 10 20 HECD Cc1cc(NS(=O)(=O)c2cccc3nsnc23)ccc1N1C(=O)CCC1=O 732951291 HEDBHXDAUVOAIX-UHFFFAOYSA-N 402.457 2.454 10 20 HECD COc1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc1C(=O)N(C)C 734494979 LRALMWMZROHAID-UHFFFAOYSA-N 417.531 2.258 10 20 HECD CS(=O)(=O)Cc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1 734842203 GJFFSMZURIQYMI-UHFFFAOYSA-N 408.545 2.310 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccc(C[S@](C)=O)c3)CC2)cc1 742921594 UNYAHAFFUGUHOO-LJAQVGFWSA-N 415.559 2.126 10 20 HECD Cn1ccc2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc21 743886773 BJASLBNXHXFPEJ-UHFFFAOYSA-N 410.449 2.409 10 20 HECD CN1CCN(C(=O)CCNC(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 745489656 SEEKEJVPULKKSR-UHFFFAOYSA-N 402.539 2.401 10 20 HECD C[C@H]1CN(CCNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 745790576 BALZOEYHAZFPKQ-JKSUJKDBSA-N 412.481 2.277 10 20 HECD CCN1CCN(CCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)CC1 746018834 NUSQDGPDELDANO-QFIPXVFZSA-N 402.583 2.288 10 20 HECD Cc1c(C(=O)N(C)Cc2ccccc2O)cc(Br)cc1S(N)(=O)=O 748027282 KHZCCARPUZKPGG-UHFFFAOYSA-N 413.293 2.383 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1 749564599 GXAASTCHGWXAQC-UHFFFAOYSA-N 424.545 2.019 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc3nc(O)nc(O)c3c2)cc1 751406985 SKSSLBGTULJWGI-QGZVFWFLSA-N 423.473 2.323 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@@H](c4ccccc4)C3)CC2)cc1 754010302 OURHIOKPAIBGHQ-ISKFKSNPSA-N 411.546 2.252 10 20 HECD O=C(CN[C@@H](CCO)c1cccs1)NCc1ccc(N2CCOCC2)c(F)c1 754394508 IRBXDMNYSLCELC-KRWDZBQOSA-N 407.511 2.053 10 20 HECD CC(C)(C)c1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n(-c2ccccn2)n1 755319956 QFFAXGHMTMRFTN-UHFFFAOYSA-N 423.473 2.273 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCOCC3CC3)cc2F)C[C@@H](C)O1 756047478 IDTRFNJFHATZFF-CALCHBBNSA-N 407.530 2.414 10 20 HECD O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 759046301 AKCWBFCZPSJXGA-UHFFFAOYSA-N 423.466 2.315 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3CCN4CCCC[C@H]34)CC2)cc(OC)c1OC 759254502 PUSQKCKZKLYVFF-ZWKOTPCHSA-N 418.538 2.171 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 762092448 UJJUJHQRXOZDGH-HXUWFJFHSA-N 414.550 2.456 10 20 HECD COc1cc2c(cc1NCC(=O)NCCCN(C)S(C)(=O)=O)oc1ccccc12 762780706 GPSLVIYTHFVCIY-UHFFFAOYSA-N 419.503 2.404 10 20 HECD CCOC(=O)c1cnn2c(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)ccnc12 763997226 JOHCIFSFBCCSTE-HNNXBMFYSA-N 423.473 2.234 10 20 HECD C[C@H](C(=O)NCc1cccc(Br)c1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 765735006 BVMZZHSJRBKKDJ-RTXFEEFZSA-N 409.280 2.335 10 20 HECD O=C(CCNS(=O)(=O)c1cccs1)NCc1cccc(Br)c1O 765753706 PEAQCFXGYZZMKJ-UHFFFAOYSA-N 419.322 2.201 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1 769663929 LBWKHZUZLXXUQB-SFHVURJKSA-N 403.504 2.331 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1nc2ccccc2s1 774955249 LCSNRAUCWHVYOM-UHFFFAOYSA-N 410.499 2.066 10 20 HECD C[C@@H]1C(=O)N(C)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 778127423 NRTCFKXDTNQNKR-POKNLVKOSA-N 423.585 2.419 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)c3ccc4c(c3)OCO4)CC2)cc1 778395655 RLNQDHPHJBRPAL-KTKRTIGZSA-N 423.469 2.292 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc4c(c3)C[C@H](C)O4)c2)CC1 780408140 AYXPJCPWTLYPTH-HNNXBMFYSA-N 415.515 2.479 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NN1CCCNC1=O 783603202 NRJJXPNWXVPTOT-BENRWUELSA-N 410.546 2.176 10 20 HECD CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 785294076 KMTACMMZQAULOF-SNVBAGLBSA-N 405.838 2.396 10 20 HECD C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785434862 VNCGPSCKNYLMSR-PGRDOPGGSA-N 408.546 2.396 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)Nc3cccc(C)c3)cc2)CC1 786255174 KJFVXVIPYHGHJF-UHFFFAOYSA-N 423.517 2.101 10 20 HECD CO[C@H](CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 786657003 PKRZOBSUDZVPJX-HXUWFJFHSA-N 413.543 2.360 10 20 HECD Cc1ccncc1/C=C\C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 786920418 RULCIBIXGJBASM-HYXAFXHYSA-N 413.449 2.239 10 20 HECD C[C@@H](NC(=O)C(=O)NCCCN1CCc2ccccc2C1)c1ccc(N(C)C)cc1 787707865 GMSGVILRERQZTA-GOSISDBHSA-N 408.546 2.494 10 20 HECD C[C@@H](Cn1ccnc1)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 789750877 BBTJSONXOULWGF-KRWDZBQOSA-N 409.490 2.276 10 20 HECD C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793932012 QVFGTCROFDSBKF-QFBILLFUSA-N 412.509 2.460 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C4CC4)c3)cc2)CC1 803161925 KOHKCFLDXWXYIY-UHFFFAOYSA-N 421.501 2.029 10 20 HECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCCCSc1nccs1 803975305 AAMOTDSNNQUXDQ-AWEZNQCLSA-N 404.561 2.309 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)cc1 804319308 NTTFCMUFCZNBGR-FXAWDEMLSA-N 417.550 2.490 10 20 HECD CN(C)Cc1ccc(CN(C)C(=O)C(=O)NCCCSc2nccs2)cc1 806277948 MBXGCSIZXJYEFR-UHFFFAOYSA-N 406.577 2.462 10 20 HECD CC(=O)NCC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 806458206 WCHDRJKXOYRQDU-KRWDZBQOSA-N 406.502 2.110 10 20 HECD CN(Cc1ccc2c(c1)OCCO2)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289484 WFJGGTNMZXIUGC-UHFFFAOYSA-N 407.470 2.109 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 807289528 YCCOFRLKUZIBBN-UHFFFAOYSA-N 408.477 2.167 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1 808406654 LHBGQISIRPYBNE-UHFFFAOYSA-N 418.538 2.275 10 20 HECD Cc1cccc2c1OC[C@H](NC(=O)NCc1ccc(N3CCC[C@@H](C(N)=O)C3)cc1)C2 812009525 IHHYUKKYMHLALX-WOJBJXKFSA-N 422.529 2.500 10 20 HECD Cc1nnc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)o1 813464419 CUISAYRPGFYHDY-MRXNPFEDSA-N 403.483 2.369 10 20 HECD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 816029091 VKIULIQJLRELFJ-VFNWGFHPSA-N 400.475 2.365 10 20 HECD CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(CCOC)C2)sc2c1CC[C@H](C)C2 914460995 ZJKCLLZSXLPBIZ-STQMWFEESA-N 408.520 2.483 10 20 HECD CCOc1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918463007 GHUCKYMLSMEVJF-QGZVFWFLSA-N 424.501 2.042 10 20 HECD Cc1ccc([C@H](C)NC(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1C 920637266 CUKIWYYREGWJLN-AWEZNQCLSA-N 420.487 2.415 10 20 HECD O=C(NC1(c2ccc(NC(=O)c3cc(CO)on3)cc2)CCC1)c1cc(O)nc(O)c1 1790172685 JROJIPZSECXWGH-UHFFFAOYSA-N 424.413 2.035 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1cccc(F)c1F 1796604420 DTMFSYAQHAUXJP-CLLJXQQHSA-N 403.385 2.337 10 20 HECD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)c(C)c1 1796604946 XTXLBLOQMAUUDV-MUJYYYPQSA-N 411.458 2.375 10 20 HECD O=C(NC[C@H]1CCN(C(=O)C2(F)CCC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807997610 BMHORNCNMCJSRG-KDOFPFPSSA-N 414.437 2.100 10 20 HECD Cc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1808183719 MCHLURNVXGDGEJ-UHFFFAOYSA-N 410.474 2.355 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)/C=C/C2CCCCC2)C1 1845197147 PHVMCFDOFJVVHK-BQYQJAHWSA-N 421.588 2.187 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(Cl)cncc1Cl 1847201920 JRPZQYMLWRPEDS-STQMWFEESA-N 423.256 2.324 10 20 HECD COc1ccc(N2CCC(NS(=O)(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1 110469235 CVJPIRVEXZCNTC-UHFFFAOYSA-N 424.544 2.046 10 20 HECD CC(C)N1CCC[C@H](CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 729598744 JTVYJKNDPNLPPU-WOJBJXKFSA-N 415.582 2.308 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 731405870 IZSJPZAMRHJKTN-UHFFFAOYSA-N 407.474 2.285 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1C[C@H]2CC[C@H]1O2 733758603 KQCXSKHVDKSFMR-FUHIMQAGSA-N 411.481 2.126 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1C 734073907 NJGFHWWVDOIGLT-UHFFFAOYSA-N 417.531 2.452 10 20 HECD CC(C)[C@@H](C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)N1C[C@H](C)O[C@H](C)C1 741021298 OTFHNJVVAWEYFG-SVMVAKDDSA-N 419.566 2.388 10 20 HECD COc1ccc(N2CCN(C(=O)[C@H]3CCCN(C(=O)c4ccncc4)C3)CC2)cc1 741883236 KRAAKXOTNIRZCN-IBGZPJMESA-N 408.502 2.291 10 20 HECD COCCOc1cccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 742916445 IKRYLSQHAOXXTN-UHFFFAOYSA-N 413.518 2.272 10 20 HECD O=C(CN1CC[C@H](CN2CCCCC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 743851760 LXYDDDCZDSOWRA-HXUWFJFHSA-N 418.557 2.086 10 20 HECD CCN(CC)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 745690509 CHUIPSFUZRZTAH-UYAOXDASSA-N 401.555 2.014 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccn(CC(F)(F)F)n3)cc2)C1 746140476 PVQUTYUWFDFXRM-AWEZNQCLSA-N 424.427 2.469 10 20 HECD C[C@]1(c2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)NC(=O)NC1=O 748024619 SXGZWXGKBAHFIH-JOCHJYFZSA-N 424.526 2.224 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccnc(F)c1 748714484 HJMRXVOSQDMWGH-UHFFFAOYSA-N 410.428 2.406 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCCS2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 750897346 ZMBZHCRKNODJRK-SFHVURJKSA-N 422.528 2.363 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CC[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 751715389 OSKUIHYGZUXEGA-IXDOHACOSA-N 422.497 2.415 10 20 HECD Cc1nc2n(n1)CCN(C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)C2 752895903 SODAIVZQSZTKGE-OKILXGFUSA-N 402.474 2.065 10 20 HECD CC1(Cn2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)nn2)COC1 759047376 BZWRHHLGGWWTDU-UHFFFAOYSA-N 421.448 2.315 10 20 HECD COC(=O)[C@]1(C)CCCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 759805738 QENBSKLKEOGZRC-QHCPKHFHSA-N 406.438 2.428 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC[C@H]3C3CC3)CC2)cc1 760821759 VTFIRRWIOYMTKU-NRFANRHFSA-N 402.539 2.028 10 20 HECD O=S(=O)(Nc1ccc2nc(N3CCOCC3)sc2c1)c1cccc2nonc12 765032746 HTRBCLXJLCPTRH-UHFFFAOYSA-N 417.472 2.470 10 20 HECD CC[C@@H]1CN([C@H](CC)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCO1 774015063 WRWIWNYLUXQFER-UYAOXDASSA-N 407.530 2.292 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](c3ccccc3)N(C)C)CC2)cc1 774782198 VHECLWVWOHGZPJ-JOCHJYFZSA-N 424.545 2.153 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 775372448 BIVPTFYARZKTGA-KGLIPLIRSA-N 421.519 2.329 10 20 HECD C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 787369378 ZIBTUXKNSSDLJR-AWEZNQCLSA-N 415.465 2.374 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CC3CCC4(CC3)OCCO4)CC2)cc1 788091420 RJZOPYHYRPAQIR-UHFFFAOYSA-N 417.550 2.257 10 20 HECD CCCN(CCc1ccccn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788324337 UGSGASASAUSOAR-UHFFFAOYSA-N 410.518 2.016 10 20 HECD CCO[C@H]1C[C@](O)(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1(C)C 788744682 YENQWHIOHGMFRU-RXVVDRJESA-N 409.502 2.028 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)[C@@H]2CCCN(C(=O)OC)C2)cc1 788979661 ZNRMREODPZKVFG-SJLPKXTDSA-N 418.538 2.132 10 20 HECD CCc1nc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cs1 789800388 OHERNNSWYFQGSS-ZDUSSCGKSA-N 420.510 2.175 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc(Cl)c1F 792295413 ONEXUHVCBLFUGD-VIFPVBQESA-N 424.812 2.363 10 20 HECD COc1ccc(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(O)c1 794381909 RSDMVQVMQKGFQE-UHFFFAOYSA-N 401.375 2.314 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(OC)cc2O)cc(Cl)c1F 797389246 WQUYMFZTZABJDT-UHFFFAOYSA-N 410.785 2.235 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N(CC(=O)O)C3CCOCC3)cc2F)C[C@H](C)O1 797709999 PPSZZAORGKCICS-GJZGRUSLSA-N 423.485 2.215 10 20 HECD COCCN1CCN(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)CC1 798225183 PIKRVFUDLSVVNV-UHFFFAOYSA-N 413.518 2.312 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)cc1F 803659052 JLVKNMDEISHQHL-IBGZPJMESA-N 404.461 2.066 10 20 HECD COc1ccc(CN2CC[C@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2=O)c(OC)c1 805442261 RVOIZISOHBUZBH-LYLYKKCESA-N 412.442 2.046 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NC[C@H]1CCc2ccccc21 805961195 VXMPOFDCIAGRLY-HXUWFJFHSA-N 407.514 2.328 10 20 HECD CN(C)CCN(Cc1ccccc1F)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290837 AYJGKJGBXVSMCI-UHFFFAOYSA-N 424.520 2.409 10 20 HECD CO[C@]1(C)C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1(C)C 809127611 RGPSOLIJIYKXHF-AQOAWAETSA-N 404.507 2.220 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(OC(F)F)c(F)c2)c1 818528548 WLNLFZBRCZQSPM-UHFFFAOYSA-N 404.366 2.434 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc(S(N)(=O)=O)o2)cc1 918055943 OJRBVNDTSDOLQD-UHFFFAOYSA-N 403.460 2.429 10 20 HECD O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(N2CCOCC2)c(F)c1 918192147 OUXVKYCBWZGLJW-UHFFFAOYSA-N 401.438 2.433 10 20 HECD Cc1nc(S)sc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918373123 SLBSFPCKXGJOMM-AWEZNQCLSA-N 404.561 2.301 10 20 HECD COc1ccc(OC2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 919815737 AAUKFBUUDQIPHD-UHFFFAOYSA-N 420.487 2.456 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc2c(c1)OCCCO2 919840788 WTGSICIJJYZDPQ-UHFFFAOYSA-N 402.472 2.335 10 20 HECD C[C@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769086 LBCIELWLNYVZEJ-QGVMXNRZSA-N 408.882 2.001 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1F)c1cc(O)nc(O)c1 1801822009 RGXDXVRGWULGQU-MUJYYYPQSA-N 417.412 2.266 10 20 HECD Cc1c[nH]cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817525389 VHWDJVPHDAJAGH-LLVKDONJSA-N 413.459 2.125 10 20 HECD Cc1ccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc2c1 1843249386 FUTGXOROBWTJKR-UHFFFAOYSA-N 406.442 2.413 10 20 HECD O=C([C@H](O)c1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845500983 LNQQXHVRSBGFOP-QGZVFWFLSA-N 416.861 2.302 10 20 HECD O=[N+]([O-])c1cc(F)ccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 24153427 KYCQKATXUPVOPV-UHFFFAOYSA-N 423.451 2.250 10 20 HECD COCCOC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c1 63203454 IRNLPOXAKDXUGO-UHFFFAOYSA-N 414.462 2.202 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CNC(=O)c1cc(F)cc(F)c1 108930849 DFGBWSPJIFIQDT-UHFFFAOYSA-N 403.429 2.190 10 20 HECD Cc1c(CNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)n(C)c2ccccc12 471739493 ULYPWFWLVMVXOT-NRFANRHFSA-N 402.564 2.494 10 20 HECD O=C1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCCN1 726781220 XVBAKOVVSXTWOA-RAXLEYEMSA-N 409.558 2.078 10 20 HECD COCCOc1ccc(F)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 729062580 SKPAGJAQIYBEJG-LBPRGKRZSA-N 406.410 2.381 10 20 HECD C[C@@H]1Oc2c(cccc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)NC1=O 729523921 YOXMOXPPJIOPPA-ZDUSSCGKSA-N 413.449 2.436 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1 729529584 XIAWPQFDPMHZKB-UHFFFAOYSA-N 417.403 2.314 10 20 HECD CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730122305 CXDWYLVGWBKLHX-HZPDHXFCSA-N 407.534 2.070 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)Cn3nc(C)c(Cl)c3C)CC2)cc1 733518131 FBTUHGISPXYHNZ-UHFFFAOYSA-N 420.897 2.054 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CC(F)(F)C(F)F)CC1 734002059 KMRDCUIDZDRTNV-UHFFFAOYSA-N 404.452 2.229 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1C 734701850 LGKMHCDWYKAYDK-UHFFFAOYSA-N 403.504 2.028 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CN2CCCC2=O)NC(=O)OC(C)(C)C)cc1 742749338 GDHCBJOOANJEFM-KRWDZBQOSA-N 404.511 2.057 10 20 HECD CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1 745978389 VFPIRDBSFGLVSE-UHFFFAOYSA-N 416.452 2.476 10 20 HECD COc1c([N+](=O)[O-])cc(N2CCC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1Br 747226867 IUZFAKMFBDBBPN-MRVPVSSYSA-N 417.216 2.366 10 20 HECD Cc1cc(C(=O)[C@@H](C)N2CCO[C@H](C(N)=O)C2)c(C)n1-c1ccc(OC(F)F)cc1 747835326 NQRBZAVRPHIHST-KDOFPFPSSA-N 421.444 2.453 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c(N(C)C)n1 750220342 HGPOHUKUZXSASU-UHFFFAOYSA-N 413.547 2.264 10 20 HECD COc1cccc(NC(=O)CN(C)C(=O)CN(C)c2ccc(OC)cc2OC)c1 752125581 HYDRCWNQLZGJQX-UHFFFAOYSA-N 401.463 2.246 10 20 HECD Cn1c(=O)oc2c(NC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cccc21 753347795 GPAPZRMIDMNGFD-OAHLLOKOSA-N 423.473 2.155 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(OC(C)C)c(N)c3)nc12 754588397 OQEYAKVLAYSHKZ-UHFFFAOYSA-N 414.418 2.338 10 20 HECD C[C@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN1Cc1ccccc1 758328939 WWKQAAAAQULADE-WMLDXEAASA-N 403.504 2.157 10 20 HECD COc1cc(N2CCN(c3ccc(C(=O)N(C)C)cn3)CC2)cc(OC)c1OC 758934533 HEOUVODSELSMME-UHFFFAOYSA-N 400.479 2.136 10 20 HECD C[C@H]1CN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@](=O)C1 763878642 SQARIDZJZAQNGR-MMEWPQADSA-N 410.495 2.101 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H]3[C@H](CCCN3C)C2)c1 765105767 KUUDMXIDLWEAHE-GCJKJVERSA-N 401.551 2.343 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCC2(C1)OCCO2 768255124 GFOOGGBKPACIEA-INIZCTEOSA-N 407.486 2.272 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC[C@@H]1COC2(CCCC2)O1 773733167 VXLCGPSCXDXUEP-HXUWFJFHSA-N 403.523 2.380 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 773749162 PJPDBXXULANVCU-WCQYABFASA-N 419.459 2.420 10 20 HECD Cc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(OC[C@@H]2CCCO2)c1 774363738 LJACETFSBSJKSG-INIZCTEOSA-N 414.458 2.261 10 20 HECD COC(=O)/C=C1/SCC(=O)N1CCCN[C@H](C)c1ccc(N2CCOCC2)cc1 775256193 WXQKRHUUYCNPTH-ZGPWBKFBSA-N 419.547 2.154 10 20 HECD COc1ccc(O)c([C@@H](C)NCC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)c1 775371496 YTZVBEZIQVQFBW-GDBMZVCRSA-N 410.536 2.010 10 20 HECD C[C@H](NC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1)c1ccc(N(C)C)cc1 776107420 HDWLEXTXUACGFX-UWJYYQICSA-N 409.534 2.367 10 20 HECD COC(=O)c1cccc(NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 779727532 OJGIXNXZMMUCBK-UHFFFAOYSA-N 408.505 2.037 10 20 HECD CSc1ccccc1S(=O)(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 780388097 VAADOCFCXPWBJD-UHFFFAOYSA-N 412.558 2.444 10 20 HECD COC(=O)COc1ccc(N(C)CC(=O)NC(=O)Nc2ccc(OC)cc2)cc1 784562287 WAROTIRGEVSSIC-UHFFFAOYSA-N 401.419 2.032 10 20 HECD CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 784619984 AWYQRNDQMKFQOS-UHFFFAOYSA-N 407.478 2.242 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)cc1 785438731 HUFZRFRTQKNTCO-UHFFFAOYSA-N 409.465 2.053 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCc3ccc(O)cc3)cc2F)C[C@@H](C)O1 786626760 MVPQQYDZIAHVDH-GASCZTMLSA-N 415.465 2.078 10 20 HECD COc1ccc([C@H](C)NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 786759503 IGCBVRXUGNUSKL-KRWDZBQOSA-N 411.502 2.368 10 20 HECD CSCCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 786790502 NXPNXSFOEQRFIB-UHFFFAOYSA-N 401.479 2.242 10 20 HECD C[C@@H]1Cc2ccccc2CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 789800843 QJHBXLJJXUVFES-MRXNPFEDSA-N 411.477 2.252 10 20 HECD CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789819163 MHGTXIVQWQLVHA-BQFCYCMXSA-N 421.513 2.083 10 20 HECD Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 790934320 KIPZKOOZHICAGI-OAHLLOKOSA-N 412.490 2.153 10 20 HECD CC[C@H]1NC(=O)N(c2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)C1=O 794613542 TWPYVVIKGMOYGK-GFCCVEGCSA-N 417.472 2.327 10 20 HECD COCCN1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 798213686 MPLHPOVQSIBADV-MRXNPFEDSA-N 421.497 2.053 10 20 HECD COc1ccc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)cn1 799636119 GVGZZAPFRGIEAC-UHFFFAOYSA-N 408.461 2.244 10 20 HECD C[C@H](NC(=O)N1CCC[C@H](CN2CCOCC2)C1)c1ccc(N2CCOCC2)cc1 801001746 PRTSXMZZTDBLBX-VQTJNVASSA-N 416.566 2.338 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCc4ccccc4OC3)CC2)cc1 801571421 SMKBMUOHEMWVAO-IFMALSPDSA-N 411.546 2.162 10 20 HECD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(CC)CC)c(F)c2)C[C@@]2(CCOC2)O1 804853263 VIQWDXJNMUWETK-HTAPYJJXSA-N 421.513 2.085 10 20 HECD C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc(N(C)C)cc1 806421660 WXKKCVFYUGTCTG-OXQOHEQNSA-N 408.502 2.242 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1)c1ccc(N(C)C)cc1 807172644 IPPKFHDYNWGOGW-GFCCVEGCSA-N 410.434 2.031 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCSC[C@H]1c1nccs1 807289118 JKLUGNVMFNFHGS-KRWDZBQOSA-N 414.556 2.452 10 20 HECD COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCC1 809818468 DGRAICQRDUHFKX-UHFFFAOYSA-N 424.563 2.048 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(F)(F)[C@H](CO)C3)cc2F)CC1 813063464 SLXLXVAZMZFZIW-INIZCTEOSA-N 414.472 2.127 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)N(C)[C@H](C)C3)cc2F)C[C@H](C)O1 815179467 RMGMGJRHGICJGA-MHORFTMASA-N 406.546 2.080 10 20 HECD CC[S@](=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918372612 NGHANRRBGYMAEY-JWRCQZCYSA-N 413.543 2.446 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1F 918442312 IPURWKOGKDSVCT-UHFFFAOYSA-N 415.465 2.298 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CN(Cc2ccccc2)CCO1 919790133 LSJHRTDBUQXMHO-HSZRJFAPSA-N 424.545 2.223 10 20 HECD CC(=O)c1ccc(OC[C@H](O)COc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 922480951 RCAKYLWTRHGHJD-NRFANRHFSA-N 412.486 2.376 10 20 HECD Cc1[nH]nc(C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1F 1842289047 GQMFVKIHJSIJRE-UHFFFAOYSA-N 408.817 2.053 10 20 HECD Cn1cc(F)cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1843583959 TWLYRDLTMUFQKS-UHFFFAOYSA-N 407.829 2.360 10 20 HECD COCCOc1ccc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 117357944 HDTDWRKFLRGHAG-UHFFFAOYSA-N 404.442 2.404 10 20 HECD COC(=O)c1ccc(F)c(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 146432601 VGMLDVUVIRMEMD-UHFFFAOYSA-N 408.451 2.132 10 20 HECD COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 737279245 WGFAPUVHGAUOKF-UHFFFAOYSA-N 416.430 2.230 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 741079650 MQKJDKQUGLNYJH-QUCCMNQESA-N 423.579 2.050 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2n[nH]c(-c3c(F)cccc3F)n2)c1 748324847 DCRXGDJKXIOYBE-UHFFFAOYSA-N 409.374 2.079 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCC(=O)NC(=O)NC3CCCC3)cs2)cc1 751930773 IWYZDGDVHOGSHI-UHFFFAOYSA-N 402.476 2.241 10 20 HECD CCc1ccc([C@H](COC)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 754345591 BOWAQOPVBFGWQQ-IBGZPJMESA-N 419.497 2.411 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccnc(C(=O)N(C)C)c2)cc1 754921018 IHPVGLVQXJMGAN-UHFFFAOYSA-N 411.506 2.227 10 20 HECD CCn1nc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C1CC1 759027904 OMHPONFUACHDHF-OAHLLOKOSA-N 411.506 2.433 10 20 HECD C[C@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC[S@]1=O 759856419 CQNOYZGDAZYQCV-MLNJSSBLSA-N 410.495 2.243 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2 761026199 MCSJRZSNRTURBM-UHFFFAOYSA-N 408.502 2.368 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(N4CCOCC4)cc3)no2)c1 761739245 UQPCCXZTPYSCRT-UHFFFAOYSA-N 416.459 2.317 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)cc2)C1 765315078 ACSPTBDRBJMDAT-QWFCFKBJSA-N 400.523 2.145 10 20 HECD C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)c(F)c1 765326172 UXSOVIPBOPDVTE-RDJZCZTQSA-N 418.465 2.482 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccn(Cc2ccncc2)n1 768091110 VNYQAZIKDSMKRV-UHFFFAOYSA-N 405.458 2.166 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CC[C@@H]4CC[C@H](C)O4)n3)CC2)cc1 771057934 QYJUYCNIEBFOPW-LPHOPBHVSA-N 414.506 2.470 10 20 HECD COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)NC1CCN(c2ccc(OC)cc2)CC1 772600415 HQDWQYBUMLWJAH-RBUKOAKNSA-N 410.536 2.315 10 20 HECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1F 773244018 GIXAMTSNVUPFNJ-UHFFFAOYSA-N 401.438 2.234 10 20 HECD CCC1(CC)CC(=O)N(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C(=O)C1 774668157 NIWRGCBOCXHKCR-LJQANCHMSA-N 417.550 2.134 10 20 HECD C[C@H](NC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C)c1ccc(N(C)C)cc1 775410609 LZOYIEUTPNCKNQ-LBPRGKRZSA-N 407.474 2.469 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3cnc(O)c([N+](=O)[O-])c3)cc2F)C[C@H](C)O1 776341496 TUZASKQCUGRLOJ-RYUDHWBXSA-N 404.398 2.378 10 20 HECD O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NCc1ccc(N2CCOCC2)c(F)c1 778627239 MERUMLFQLNDVDM-WAYWQWQTSA-N 423.448 2.350 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1 782539713 WHEBGLPBEHXXPG-CYBMUJFWSA-N 407.492 2.212 10 20 HECD CN(C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1)C(=O)OC(C)(C)C 785425187 XOOCOHXDZLYTET-QGZVFWFLSA-N 418.538 2.084 10 20 HECD CCC[C@H](C)N1C[C@@H](C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1=O 786656770 RECRJTYNBDIYKT-PXNSSMCTSA-N 414.550 2.008 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc(O)c2ccccc12 786797490 WSDQRBFTMDUDPW-UHFFFAOYSA-N 411.483 2.105 10 20 HECD CCOc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 787190737 BDICTJNHEZGQOX-QGZVFWFLSA-N 411.502 2.416 10 20 HECD CCC(CC)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)SC 789811210 DBVHYRDXIFMQJO-UHFFFAOYSA-N 411.543 2.317 10 20 HECD CCCCN(CCCO)C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789833174 DTZCTIRWJPZIBO-IAGOWNOFSA-N 423.529 2.067 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1COCCN1C1CCCC1 789977393 RGBFWNRALLGXAR-QFIPXVFZSA-N 401.551 2.155 10 20 HECD C[C@@H](NS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1)c1ccc(N2CCOCC2)cc1 798430990 ATGMZLXIQKEVBE-CYBMUJFWSA-N 423.922 2.315 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F 802610172 SQOLYPTVPSINCJ-UHFFFAOYSA-N 412.425 2.274 10 20 HECD COc1cccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)C2)c1 804117511 CJDNRDIEQYCWPZ-FUHWJXTLSA-N 410.518 2.334 10 20 HECD CC[C@@H]1C[C@@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007082 MQTMMEHCZWZCEL-SJLPKXTDSA-N 404.530 2.231 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)c1 805011997 NGKAOSOKXCBNGI-JTQLQIEISA-N 421.443 2.437 10 20 HECD C[C@@H](NS(=O)(=O)c1cn(C)nc1C(F)(F)F)c1ccc(N2CCOCC2)cc1 815000334 IPIKONZNEXZPHH-GFCCVEGCSA-N 418.441 2.315 10 20 HECD COc1ccc(N2CCCN(Cc3nnc4n(C)c(=O)c5sccc5n34)CC2)cc1 917210044 DNYGQZZGHWKLIF-UHFFFAOYSA-N 424.530 2.364 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1ccc(-n2nccn2)cc1 918437866 ASBCBLIDRZYCQH-UHFFFAOYSA-N 422.514 2.075 10 20 HECD CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2cc(O)n3ncc(C(=O)OCC)c3n2)C1 920090795 ILAOXDIWHSCEHH-HUUCEWRRSA-N 417.510 2.128 10 20 HECD Cc1c(CNC(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)n(C)c2ccccc12 472228079 YLDXZBSEQVFSFC-GOSISDBHSA-N 411.550 2.325 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)NCCOC)CC2)cc1F 731364494 OXJTURBPXWLTPS-UHFFFAOYSA-N 408.518 2.356 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 734017030 XVCUYWMKCKRXGW-ZDUSSCGKSA-N 405.432 2.292 10 20 HECD COc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(OC)n1 743310541 JLRLIFDKOTTZIX-OAHLLOKOSA-N 413.478 2.122 10 20 HECD COC(=O)CSCCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743594367 CCWIHXJUIQYAQE-CYBMUJFWSA-N 417.478 2.462 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(N2CCOC2=O)c1 743955583 LBXBNNSIXKGTOG-UHFFFAOYSA-N 409.442 2.483 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H](CC(N)=O)C3)cc2F)C[C@@H](C)O1 746758153 KVSFJNMOBIILQM-UXLLHSPISA-N 406.502 2.236 10 20 HECD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N(C)C)c(F)c1 746805314 QTKMFCBWIKICML-LJQANCHMSA-N 400.433 2.426 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](c3ccccc3)n3cccn3)cc2)C1 747644471 BWMDYGCXTSJJER-RBBKRZOGSA-N 417.513 2.491 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H]1CC(=O)N(C2CC2)C1 750649554 CBURGVAUSLMUJH-ZIAGYGMSSA-N 408.449 2.319 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3COC4=O)CC2)cc1 752862565 DXIBIUZJIIIKDH-KTKRTIGZSA-N 421.453 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)NCCNC(=O)c3ccccc3F)CC2)cc1F 753927650 COKSRMKAHHYCBD-UHFFFAOYSA-N 418.444 2.235 10 20 HECD COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN(C)c1ccc2c(c1)OCO2 756653375 IAXQPMHLFNBCBN-SFHVURJKSA-N 409.442 2.233 10 20 HECD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(OCCO)CC1 757123530 ZCDCSOFHLITYRH-OAHLLOKOSA-N 422.481 2.262 10 20 HECD Cc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1S(C)(=O)=O 758990314 ZLISIKKVHOKQEV-UHFFFAOYSA-N 415.515 2.036 10 20 HECD COc1cc(N2CCN(C(=O)NC[C@H](OC)C(F)(F)F)CC2)cc(OC)c1OC 759265179 FPNZUJSFIHSUTR-HNNXBMFYSA-N 421.416 2.121 10 20 HECD COC(=O)C1=C(C)O[C@H](CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759885362 CSDFBDJFQZMLME-INIZCTEOSA-N 406.479 2.070 10 20 HECD CCC(CC)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(N)=O 769743956 ITJXFVLRJXATLE-UHFFFAOYSA-N 411.505 2.028 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)NCC3CCCCC3)CC2)cc1 774498185 LHHAGQIJXOEXOR-UHFFFAOYSA-N 416.566 2.020 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 777829463 XWQKAWBTJJXJSE-AWEZNQCLSA-N 420.849 2.189 10 20 HECD O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)OCC(=O)c1ccc(O)c(O)c1 782862801 RPWCMULZSZKXEF-UHFFFAOYSA-N 404.440 2.176 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 785296096 BNDWHCBKHZCLTN-LLVKDONJSA-N 415.837 2.018 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CCCN3CCCC3)CC2)cc1 785424396 OOKDLHJIFZPDJW-UHFFFAOYSA-N 400.567 2.483 10 20 HECD CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 785444636 SNUPNCVOSGKOCU-KRWDZBQOSA-N 406.527 2.034 10 20 HECD O=C(NCCc1cccc(F)c1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 785541434 ZNVKKUYDISUHIP-IBGZPJMESA-N 400.450 2.398 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(-n2ccnc2C)nc1 787477551 KISFPCXKIRNCHJ-UHFFFAOYSA-N 407.474 2.336 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](c3ccsc3)N(C)C)ccc21 787653972 NITCCBSNMPBTMW-IBGZPJMESA-N 400.548 2.166 10 20 HECD CSC1(CNC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 789823782 GJDDNLFJTYODDX-HUUCEWRRSA-N 423.554 2.457 10 20 HECD CSCC[C@H](NC(=O)c1cccc(O)c1O)C(=O)Nc1ccc2oc(O)nc2c1 790685924 ARYTVQKADLNMNS-LBPRGKRZSA-N 417.443 2.435 10 20 HECD Cc1cncc(CCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 796129900 ZUPSFFLLEITTKS-UHFFFAOYSA-N 415.465 2.158 10 20 HECD CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1nccs1 803301813 ZFONRDSATMQZFG-WMLDXEAASA-N 402.520 2.424 10 20 HECD C[C@H]1Cc2ccccc2N1CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689634 VHRBNBZBNCSQCW-KRWDZBQOSA-N 406.530 2.253 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@@H](c4ccccc4)OC3=O)cc2)C1 809617363 OJSIXVTYXIBQBC-GIVPXCGWSA-N 421.497 2.309 10 20 HECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1O 809765251 LRLULFVJEIYSPG-QZTJIDSGSA-N 401.463 2.282 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(CCO)Cc3ccccc3)cc2)C1 918117959 LGYFGEQIVQZETE-FQEVSTJZSA-N 410.518 2.092 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cc(OC)ccc3OC)CC2)cc1 918460873 ISWNEBOOONDEMG-UHFFFAOYSA-N 413.474 2.390 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 919568758 KVEBIEGEFHEDKU-GJZGRUSLSA-N 424.544 2.346 10 20 HECD C[C@@H]1CN(C[C@H]2CCCN2CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 921231727 KSMSQBDTHOQJEY-WOIUINJBSA-N 402.583 2.285 10 20 HECD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNCc1ccc(N2CCCC2)cc1 1318644061 OERNSKJZYOLPOS-UHFFFAOYSA-N 404.492 2.263 10 20 HECD C[C@H]1C[C@@]1(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790243742 HBWZKCHZJGMAAD-SECIVOMGSA-N 422.909 2.391 10 20 HECD Cc1[nH]ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1797130713 GLCAQIKLKHBWIV-NCSLWMNCSA-N 411.458 2.405 10 20 HECD CCOC(=O)/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800715272 CRKCQKPBINJINP-FBKAWLDUSA-N 422.865 2.122 10 20 HECD COCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827424315 WNJIIEVNDRNUKD-QGZVFWFLSA-N 417.506 2.153 10 20 HECD C[C@@H](C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)n1cccc1 1847037897 YMOZBRUQXXMREK-VFADXPBXSA-N 411.458 2.083 10 20 HECD Cc1c(CNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)n(C)c2ccccc12 471232749 CDRWJIUDLUHHBT-UHFFFAOYSA-N 416.481 2.175 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=S)NCc1ccc(S(N)(=O)=O)cc1 726449345 NGZBRPYMSPSKNC-UHFFFAOYSA-N 406.577 2.297 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)C(=O)NC4=O)cc2F)C[C@H](C)O1 729286175 ZOGAAEVPTKYFLG-STQMWFEESA-N 411.433 2.253 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3cccnc3OC)cc2F)CC1 730114895 LQCRYTUCIAJBRP-UHFFFAOYSA-N 401.486 2.371 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3c4c(sc3=O)C[C@H](C)CC4)CC2)cc1 731836876 LZXFTLYZPMXLCX-OAHLLOKOSA-N 401.532 2.392 10 20 HECD CC[C@H]1CCCCN1CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 733351468 FXIXQBUYCSXTLA-UXHICEINSA-N 415.582 2.452 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c(F)cc(N)cc3F)CC2)cc1 748464116 GIOIYNFTRXZQRY-UHFFFAOYSA-N 405.401 2.061 10 20 HECD CC1CCN(c2ccc(CNC(=O)[C@@H]3Nc4ccccc4S(=O)(=O)N3)cc2)CC1 749985626 NGQHWJPVJGFBBY-HXUWFJFHSA-N 414.531 2.269 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Cc3c[nH]c4ncccc34)CC2)cc1 756906632 SIXGBZAJNKATKD-UHFFFAOYSA-N 407.518 2.443 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(-c4nnco4)cc3)CC2)cc1 758222050 DQCBKWVGDRTDAX-IBGZPJMESA-N 410.474 2.307 10 20 HECD CCC(=O)N1CCCC[C@@H]1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 759220871 LQFBCEFSIYBHPS-QGZVFWFLSA-N 419.522 2.152 10 20 HECD CS(=O)(=O)[C@H]1CCC[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 761401214 PRTCNPJPWBMOCT-KBPBESRZSA-N 400.884 2.166 10 20 HECD O=C(NCCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)c1ccccc1F 762219779 BUAISZNZSYEEEI-UHFFFAOYSA-N 405.813 2.379 10 20 HECD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCCS(=O)(=O)CC1 768089550 MXBLAWCHKOXXFF-CQSZACIVSA-N 417.478 2.087 10 20 HECD COC(=O)C1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1 768202698 VVSMAXVDYNSFHS-INIZCTEOSA-N 405.495 2.388 10 20 HECD CS[C@@H](CO)[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769340488 KYAPEHMKDRCJLO-HZMBPMFUSA-N 416.546 2.097 10 20 HECD CC(C)(C)OC(=O)C1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 770265853 RUHILELPEUCKCA-UHFFFAOYSA-N 412.508 2.394 10 20 HECD CO[C@@H]1[C@H](C)[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1(C)C 775772657 VPZIICLKFLVTSM-SKWUIDRYSA-N 402.539 2.247 10 20 HECD O=C(Nc1cnc2c(c1)COCC2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 777238140 PSINFPMHUNSDKX-GOSISDBHSA-N 411.458 2.006 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nnc(C4CC4)s3)CC2)cc1 778241960 IXIJPPORGUNSRW-HJWRWDBZSA-N 413.503 2.268 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccc(C(=O)NCCN2CCCC2)cc1 779512508 CKJGRHRRKSHDQX-POHAHGRESA-N 409.486 2.253 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)CNC(=O)O4)cc2F)C[C@@H](C)O1 780313826 ZJMUBRVAUQWVED-GASCZTMLSA-N 420.485 2.223 10 20 HECD COc1ccc(S(=O)(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1C 780407141 FYKKSWOBHQEHIX-UHFFFAOYSA-N 403.504 2.473 10 20 HECD CN(C)S(=O)(=O)c1cccc(CNC(=O)NCCCSc2nccs2)c1 782731570 IBYKWCDDLWUVSE-UHFFFAOYSA-N 414.578 2.375 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(F)cn1 783925290 VXBVBKDSJRSUEW-UHFFFAOYSA-N 410.428 2.406 10 20 HECD COC(=O)c1sccc1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 784644077 RQFFEGXQFSBCRE-AWEZNQCLSA-N 418.471 2.387 10 20 HECD Cc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1C(=O)NC(C)C 785296258 MXZKFDCZLIVFOE-AWEZNQCLSA-N 413.474 2.230 10 20 HECD C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788331261 ILGLJAIKWJFFDN-GDBMZVCRSA-N 413.440 2.329 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(c4ccccc4F)C[C@@H]3C)nc12 789492945 BUTYBKNVDXCFGX-AWEZNQCLSA-N 413.453 2.461 10 20 HECD O=C(NCCN1CC=CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 794119792 TUWOHXPMESBQAC-UHFFFAOYSA-N 407.517 2.246 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCc2cccc(CS(N)(=O)=O)c2)cc1F 799925120 MSXWSSKXQAGQGP-UHFFFAOYSA-N 422.526 2.460 10 20 HECD CC(=O)NCCNC(=O)CCC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800570415 NCWQEUSDPDYABD-OAHLLOKOSA-N 422.957 2.225 10 20 HECD CN(CCOCCO)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 800687371 QTHYBICNUQRSRX-OWBHPGMISA-N 414.574 2.197 10 20 HECD COC(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cc1F 802558653 WGXRVTZBNCJCTA-UHFFFAOYSA-N 415.396 2.383 10 20 HECD Nc1nnc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)o1 803125110 HCFQJZMHWPLJRQ-JXMROGBWSA-N 409.518 2.011 10 20 HECD CCN(CCc1nccs1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803299832 OBCRNGVZBWOZHD-MRXNPFEDSA-N 416.547 2.248 10 20 HECD COc1cccc(N2CC[C@H](CNC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)C2)c1 804083197 JHQOEZQQRHRAMM-LJQANCHMSA-N 424.545 2.362 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCC[C@@H]1N1CCOCC1 806088470 WIHVFNIXZQSRDG-UXHICEINSA-N 417.550 2.281 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H](c1cccc(F)c1)N(C)C 807097600 ZOYVSPJVLQMXCA-HXUWFJFHSA-N 400.498 2.235 10 20 HECD Cn1cc(/C=C\C(=O)N2CCN(C(=O)/C=C/c3cnn(C)c3)c3ccccc32)cn1 809239192 SUZVXQVOQZRSTF-FKJILZIQSA-N 402.458 2.260 10 20 HECD COc1ccc(CN2CC[C@H](NCc3cc(OC)c(OC)cc3O)C2=O)c(OC)c1 809725778 AQIZHUWSISSFLN-KRWDZBQOSA-N 416.474 2.317 10 20 HECD CO[C@](C)(C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C1CC1 812479729 PIQNKHHWCVAPOV-QFIPXVFZSA-N 413.497 2.374 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3Cc4ccccc4CO3)CC2)cc1 813699142 QHPHULICRAFBJV-ZHACJKMWSA-N 407.470 2.374 10 20 HECD O=S(=O)(CC[C@H]1CCOC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815016883 BRGXPERCUHWVMF-RHSMWYFYSA-N 402.944 2.356 10 20 HECD Cc1cc(-c2nc(-c3c(O)nc(=O)n(C)c3C)no2)ccc1NC(=O)C1=S=CC=C1 904906343 ONCOGMRZXXSRFI-UHFFFAOYSA-N 423.454 2.036 10 20 HECD O=C(CCOc1ccc(F)cc1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918645724 XLWOCQFIBWPQEH-UHFFFAOYSA-N 406.479 2.146 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3CCCC[C@@H]3N(C)C)CC2)cc1 1318438365 AURWWOFIVJPSKV-YADHBBJMSA-N 417.598 2.379 10 20 HECD Cc1ncoc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804285673 NJIXXNZMXYDUML-PLCSWTFUSA-N 413.430 2.065 10 20 HECD COc1ccc(/C=C(\C)C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1845833998 GHEUZRNVKVPMRA-XNTDXEJSSA-N 423.469 2.422 10 20 HECD Cc1ccc(CC(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)o1 1846671495 LSXZMJWNSZSPEN-VMPITWQZSA-N 412.442 2.164 10 20 HECD COc1ccc(N2CCN(Cn3nc(N4CCOCC4)sc3=S)CC2)cc1 63123590 YDHVIWBCBWUCSE-UHFFFAOYSA-N 407.565 2.299 10 20 HECD O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 732589887 GHCUQMLJJOMLPZ-HUUCEWRRSA-N 415.412 2.246 10 20 HECD COc1ccc(O)c(CNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1 734067262 MQYATQCMAMZNBO-LJQANCHMSA-N 413.474 2.309 10 20 HECD C[C@H](NC(=O)C(=O)Nc1cnc(C(C)(C)C)nc1)c1ccc(N2CCOCC2)cc1 737157620 KXTZPYYSQSJMFP-HNNXBMFYSA-N 411.506 2.427 10 20 HECD Cc1ccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c2[nH]ncc12 738943633 FSNVENBFUIYAMB-UHFFFAOYSA-N 413.503 2.428 10 20 HECD COCC(=O)N[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)C 742799122 GQMWLRCXQXTZGR-KDOFPFPSSA-N 413.465 2.160 10 20 HECD COc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1S(=O)(=O)N(C)C 743717833 RZKBJXUISWFTMI-UHFFFAOYSA-N 418.515 2.460 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1cccc(N2CCCNC2=O)c1 743955969 OMTSUSHJLQMNRT-UHFFFAOYSA-N 422.485 2.446 10 20 HECD COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2nc(O)nc(O)c2N)cc1 746244511 RHYUTTKCQQQCBN-UHFFFAOYSA-N 409.446 2.392 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)cc1 749254550 UNBSGANUMLTLEH-YLJYHZDGSA-N 411.506 2.036 10 20 HECD CSc1ccncc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 750254506 WWIPLBTZUUGVQD-UHFFFAOYSA-N 404.467 2.034 10 20 HECD O=S(=O)(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1cnn([C@H]2CCOC2)c1 751590327 UIDUKWBDCRJIQQ-LBPRGKRZSA-N 420.472 2.498 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(NC(C)=O)cc3)CC2)cc1F 753861034 LERRZOQMPWADPK-IBGZPJMESA-N 417.481 2.355 10 20 HECD COc1ccc(N2CCN(C(=O)N[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)CC2)cc1F 753932096 RKBWTCIXTUWZGA-GDBMZVCRSA-N 413.515 2.022 10 20 HECD COc1ccc(N2CCN(CN3C(=O)NC(C4CC4)(C4CC4)C3=O)CC2)cc1F 754013948 PJNBFMURRLRZDR-UHFFFAOYSA-N 402.470 2.024 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCN(Cc2cccs2)CC1 759588620 MUYOBEQZUDAYHO-GQCTYLIASA-N 402.472 2.060 10 20 HECD Cc1cc(F)c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)cc1C(=O)O 761258334 CKWDKHXODKCIPZ-UHFFFAOYSA-N 408.451 2.147 10 20 HECD Cc1cc(C(=O)CN2C[C@H](CO)OC[C@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 766944072 GLARCXDETIYCME-CRAIPNDOSA-N 400.475 2.130 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)Cc3ccccc3F)CC2)c1O 774856043 DCQZIGBOHZMNOH-UHFFFAOYSA-N 403.410 2.335 10 20 HECD COc1cccc([C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)N(C)C)c1 774947139 MUYXSIGFJHWMBA-KKSFZXQISA-N 412.534 2.358 10 20 HECD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)O1 775459740 GPRIHMUAJPLUOQ-PMACEKPBSA-N 402.539 2.454 10 20 HECD COC(=O)C1(c2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)cc3)cc2)CC1 776275853 LPUVVGFBJDJNGF-UHFFFAOYSA-N 424.500 2.064 10 20 HECD C[C@@H](OC(=O)c1ccncn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 778454254 FHXZNKXPKOLVHW-GFCCVEGCSA-N 401.378 2.436 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc(S(=O)(=O)Nc2nccs2)cc1 778915901 XQZCEROSEVRBGB-UHFFFAOYSA-N 405.457 2.285 10 20 HECD Cc1cc2c(cc1NC(=O)C(=O)N(C)Cc1ccc(N3CCOCC3)cc1)OCO2 781443261 MBHAOSMTTFESDM-UHFFFAOYSA-N 411.458 2.157 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](CO)C3CCOCC3)cc2F)C[C@@H](C)O1 782501588 UCIUFCGKSDFLHF-KHYOSLBOSA-N 409.502 2.026 10 20 HECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1 783264703 PTHGGFJIEMDMDT-DLBZAZTESA-N 418.515 2.251 10 20 HECD CS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 786264800 YOZWQESPGSMNIZ-UHFFFAOYSA-N 420.506 2.049 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCC[C@H]1c1cccnc1 789798379 GPPQSPDMTOUXOF-IBGZPJMESA-N 412.465 2.037 10 20 HECD CSCCCN(C)C(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789827448 SRLPEWCBSDBMTM-GJZGRUSLSA-N 411.543 2.267 10 20 HECD COc1ccc(N2CCCN(CN3C[C@@]4(CN5CCC4CC5)OC3=O)CC2)cc1 790365261 BRXXNNJSNWBDDU-JOCHJYFZSA-N 400.523 2.081 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@]2(CCO[C@@H]2C)O1 790666797 VEBWVBHFUBFFSY-MCFFVMPBSA-N 421.513 2.265 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N3CCC([C@@H]4CCCO4)CC3)CC2)cc1 804318910 VMEBQWXJGAZHDC-NRFANRHFSA-N 415.534 2.198 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)c1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C 804334070 XUEZRMSWKZZNFH-UHFFFAOYSA-N 411.462 2.258 10 20 HECD C[C@H]1C[C@H](N2CCOCC2)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 804968633 HLQSBRGCNRJNFD-PXNSSMCTSA-N 404.580 2.244 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H](C(C)C)C3)cc2F)CC1 805007706 XZBQQYRDNFWHKV-LJQANCHMSA-N 418.557 2.478 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCC[C@@H]4CN(C)CC[C@H]43)cc2)CC1 805025915 ZXEUYRPRLIKHTD-IFMALSPDSA-N 412.578 2.482 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1O 806907299 JTDMTPXXASCFGQ-UHFFFAOYSA-N 418.421 2.353 10 20 HECD COC(=O)c1c(F)ccc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1F 810368412 WCRLTIXGHWNWMQ-UHFFFAOYSA-N 415.396 2.383 10 20 HECD CN(C)c1ccc(CNC(=O)N2CCC[C@H](CNC(=O)C(F)(F)F)C2)cc1F 812017668 HLDRADVGLPSRAV-CYBMUJFWSA-N 404.408 2.492 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3ccco3)cc2F)C[C@@H](C)O1 918203046 VDPBEKCCDZMVBC-GASCZTMLSA-N 418.469 2.262 10 20 HECD CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)NCc1ccc(N2CCCC2)cc1 918208412 FCHLRHCDNVODOA-LJQANCHMSA-N 408.568 2.290 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1c[nH]nc1-c1ccccc1 918340535 RHDWIGJDFFHZSN-UHFFFAOYSA-N 410.499 2.242 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 918444182 MPXKVMRRYNJJRY-UHFFFAOYSA-N 409.364 2.281 10 20 HECD C[S@@](=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1330730856 NLMMXFNGVUWOSP-GUNSETOZSA-N 414.531 2.447 10 20 HECD C[C@]1(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)CCCN1 1788427714 GCUULXWGTCPHBB-OAQYLSRUSA-N 410.474 2.383 10 20 HECD O=C(Cc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425846 AZKRYSILUDHNCG-IBGZPJMESA-N 424.501 2.364 10 20 HECD Cc1c(CNC(=O)NCCCN2CCN(c3ncccn3)CC2)n(C)c2ccccc12 471601524 JQQIPQFNZJPXQX-UHFFFAOYSA-N 421.549 2.288 10 20 HECD CN(C)c1ccc(CNC(=O)CN2CCN(C(=O)c3ccc(F)cc3F)CC2)cc1 726971201 APZZDZZBISYTLV-UHFFFAOYSA-N 416.472 2.105 10 20 HECD Cc1nn(C)c(=O)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 728164757 KBLLUHOQPUSJOG-STQMWFEESA-N 402.470 2.080 10 20 HECD CCc1[nH]nc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)c1[N+](=O)[O-] 731826871 NWVHYGIJAYPFTQ-UHFFFAOYSA-N 404.446 2.091 10 20 HECD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733881046 YVPPXBGEPSHPDW-SFHVURJKSA-N 422.507 2.348 10 20 HECD CCOCCCN1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](C)C1 734660702 GCQHNBCZHIHBMJ-DENIHFKCSA-N 418.582 2.459 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1O 737284425 MENYBYAIOOBTCD-UHFFFAOYSA-N 415.446 2.290 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NCc2cc(OC)ccc2O)cc1 743911250 XPUPOJUZANFUOH-UHFFFAOYSA-N 400.431 2.106 10 20 HECD COC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)c1 743955605 LJNRURPLPCFMDU-UHFFFAOYSA-N 400.406 2.452 10 20 HECD COC(=O)c1cn(CC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)nn1 747386799 QTULFPFTNKVMOL-UHFFFAOYSA-N 423.473 2.373 10 20 HECD COCCn1cc(S(=O)(=O)Nc2nc(-c3ccc(NC(C)=O)cc3)cs2)cn1 747751636 PBGFXUDACHTQMO-UHFFFAOYSA-N 421.504 2.412 10 20 HECD CCOc1ccc(S(=O)(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1 751213777 YWMYHIILSZKUSA-UHFFFAOYSA-N 424.544 2.429 10 20 HECD NC(=O)CCNC(=O)c1cccc(NC(=O)NCCCSc2nccs2)c1 758599848 URBODUXWIVJXQQ-UHFFFAOYSA-N 407.521 2.052 10 20 HECD O=C(CCSc1ccccc1)NC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759588469 LPFKGTCCBVTVTD-VQHVLOKHSA-N 401.440 2.479 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC3(CC2)OCc2ccccc23)c1 760152566 RZRCRCXDWYRQGJ-UHFFFAOYSA-N 402.472 2.425 10 20 HECD CCOC(=O)C1CCC(O)(COc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1 762424724 MAVIPFSLGUNOTO-UHFFFAOYSA-N 404.507 2.218 10 20 HECD O=S1(=O)CCN(c2ccc(CNC3CCN(Cc4ccncc4)CC3)cc2)CC1 765979326 RDDJFFLBMSXWAM-UHFFFAOYSA-N 414.575 2.071 10 20 HECD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NCCc1ccc(O)c(O)c1 768901084 VOIKKNKRHVZOIP-UHFFFAOYSA-N 424.544 2.235 10 20 HECD CCc1nn(C)c(OC)c1CNC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 772107265 OYTIFNOSRHWUKZ-UHFFFAOYSA-N 405.474 2.171 10 20 HECD Cc1ccc(-n2nccc2NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nn1 773241938 BFFYLYIEARLUMZ-UHFFFAOYSA-N 419.489 2.166 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-n4cncn4)cc3C)c2)CC1 781272892 KDMHPQIASKQEBI-UHFFFAOYSA-N 404.474 2.497 10 20 HECD CCOC(=O)c1c(NC(=O)Cn2cnn(C)c2=O)sc(C)c1-c1ccccc1 781384163 JDXFNSIDRRUZOL-UHFFFAOYSA-N 400.460 2.434 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@H](CO)C1CCOCC1 782731934 FUCXSXGVGMYTQD-MAUKXSAKSA-N 413.465 2.344 10 20 HECD Cc1cc(C)n(-c2ccccc2CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785433541 MZLGHKXPAPCFRL-UHFFFAOYSA-N 405.502 2.488 10 20 HECD COc1cc([C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cc(OC)c1OC 785434507 ULVLWFTWTUWYNE-AWEZNQCLSA-N 415.490 2.272 10 20 HECD CN(Cc1ccc2c(c1)OCCO2)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788930469 SXJLFPPWWRDAOZ-UHFFFAOYSA-N 409.486 2.333 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C 789779699 ZHJWOFBWJUBIQP-DYVFJYSZSA-N 413.474 2.169 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3c(C)nsc3NC3CC3)nc12 796645857 ZSWYVSDOXVALDO-UHFFFAOYSA-N 417.447 2.308 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)N[C@@H](C)CCC3CC3)CC2)cc(OC)c1OC 809190594 IKSNFGNMQSAGBT-HNNXBMFYSA-N 419.522 2.056 10 20 HECD CC[C@@]1(C)NC(=O)N(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1=O 849366238 USYKGHPFMJMOBV-JOCHJYFZSA-N 405.410 2.121 10 20 HECD C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)Nc1ncccn1 913223986 HRMUZDVJFBFJMN-LLVKDONJSA-N 416.393 2.018 10 20 HECD COc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC 917917511 BZHPHJQUJTWEAP-UHFFFAOYSA-N 424.494 2.466 10 20 HECD O=C(NCC1CC1)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 918223758 KZKHAUPDHNKQSE-GOSISDBHSA-N 418.513 2.110 10 20 HECD C[C@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N1CCCCC1 919654476 LTTZEOBROGGKAV-IEBWSBKVSA-N 401.555 2.062 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(S(C)(=O)=O)C3)c2C)cc1 920294627 YVIFVPBBSUMGDQ-MRXNPFEDSA-N 405.520 2.257 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cccc4c3OCCO4)CC2)cc1 921304361 IASOEECUHULPOK-UHFFFAOYSA-N 411.502 2.409 10 20 HECD CCC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781755082 POSGIKCSYFNFMA-QVKFZJNVSA-N 405.495 2.057 10 20 HECD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3F)cc2)CCC1 1791167472 QHVMXMNDHTZQDB-KBPBESRZSA-N 421.519 2.339 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnnc1)c1cc(O)c(O)c(Cl)c1 1795023890 YGKUJVREDXJINY-BTTYYORXSA-N 402.838 2.107 10 20 HECD COc1ccc(N2CCN(C(=O)CN(C)CCOc3ccccc3OC)CC2)cc1 52451353 UUEPSDOUVNDMKR-UHFFFAOYSA-N 413.518 2.363 10 20 HECD Cn1cc(S(=O)(=O)N2CCC(NCc3ccc(N4CCCCC4)cc3)CC2)cn1 237799459 UWKYRRTVPIIVIV-UHFFFAOYSA-N 417.579 2.353 10 20 HECD Cc1c(CNC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)n(C)c2ccccc12 472272646 AJIIWMPOPZJCHL-MRXNPFEDSA-N 404.536 2.196 10 20 HECD Cc1c(CNC(=O)N[C@H]2CCCN(c3nccn(C)c3=O)C2)n(C)c2ccccc12 543650301 CKHWNCUXFWIZKD-INIZCTEOSA-N 408.506 2.049 10 20 HECD CCCc1nnc(S)n1CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 730235859 PTUHBIWLIWNRAI-UHFFFAOYSA-N 420.558 2.117 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OCC(N)=O)c3)cc2)CC1 731131963 WKHXOLXTSLOSOP-UHFFFAOYSA-N 424.501 2.042 10 20 HECD Nc1c(C(=O)CN(Cc2ccco2)Cc2ccccc2O)c(O)nc(=O)n1C1CC1 731844447 HWLKITNVXLEZGZ-UHFFFAOYSA-N 410.430 2.050 10 20 HECD COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@@H](C)N(C)Cc1ccccc1O 732203392 RXGDALXVJKXDEN-CQSZACIVSA-N 421.519 2.110 10 20 HECD CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)cc21 746039201 UJDNEPWTFAMOOM-UHFFFAOYSA-N 423.517 2.408 10 20 HECD CCOC(=O)C1(NCC(=O)N(C)Cc2ccc(N(C)C)cc2)Cc2ccccc2C1 749324280 LUZJBEARYHZYJZ-UHFFFAOYSA-N 409.530 2.401 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCN1Cc1ccccn1 749406367 OTHBFJXEIVYICU-JOCHJYFZSA-N 412.509 2.463 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(F)cc3OC)CC2)cc1F 754213829 WGGQJBCRQQYONB-UHFFFAOYSA-N 405.401 2.269 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1C 757273572 SUQOOCHPFFHGFZ-ZDUSSCGKSA-N 407.421 2.054 10 20 HECD Cc1c(NC(=O)[C@H](C)OC(=O)c2cccc(O)c2O)c(=O)n(-c2ccccc2)n1C 758560929 YTECYDLTPMTTRW-ZDUSSCGKSA-N 411.414 2.080 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 759577540 AVSXEJHUMVIOJB-GRWKNNQQSA-N 410.470 2.433 10 20 HECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCN(C[C@@H]2CCOC2)CC1 761357895 RNCKEUYWOBCABQ-AWEZNQCLSA-N 407.898 2.311 10 20 HECD CCOCCCN1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H](C)C1 765976822 AZHXAQWUGADPQX-KNQAVFIVSA-N 423.623 2.148 10 20 HECD CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 769385721 SQOZVSQXAUZTLG-MSOLQXFVSA-N 402.539 2.487 10 20 HECD C[C@@H](NS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 772485444 MFJTVOOEHSJCEL-CYBMUJFWSA-N 418.441 2.322 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(Br)cn(C)c1=O 784025707 IMEWPAVOZLYXBJ-UHFFFAOYSA-N 422.279 2.231 10 20 HECD COC(=O)c1cccc(NC(=O)COC(=O)c2sc3nc(C)cc(C)c3c2N)n1 787611055 XQOZEQWBHBPEDA-UHFFFAOYSA-N 414.443 2.472 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCOC2(CCCCCC2)C1 788323666 NGFIBKHTAYMVNF-UHFFFAOYSA-N 415.534 2.091 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)NCCC3CCCCC3)cc2)C1 788439327 ISWDYHUIZHHZAE-LJQANCHMSA-N 414.550 2.091 10 20 HECD CCOC(=O)C1(CC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 788823293 KEGXGODSLZDHSE-UHFFFAOYSA-N 403.523 2.057 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@@H](OC(F)F)C1 789859367 CFCIJBKUJPCQLC-MRXNPFEDSA-N 413.490 2.086 10 20 HECD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C[C@H](C2CC2)O1 792043471 GBUBBRAZQLSCDN-XFQXTVEOSA-N 400.523 2.097 10 20 HECD COCCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H]1CC[C@@H](C)C1 792466430 WTJDYLWBQNEIQK-BAGYTPMASA-N 405.583 2.315 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(F)c1 795066911 GKLOPKGSYQEGHX-UHFFFAOYSA-N 422.478 2.270 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(C(=O)N(C)OC)cc3)CC2)cc1 795264329 PFVOLJPQQDWZEH-UHFFFAOYSA-N 412.490 2.089 10 20 HECD O=C(COC(=O)[C@H]1Cc2ccc(F)cc21)NCc1ccc(N2CCOCC2)c(F)c1 796070242 YUZWFYRUBLTLJZ-SFHVURJKSA-N 416.424 2.301 10 20 HECD COc1ccc(CNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c(O)c1 797388258 VOEPHYMSMBNMJE-UHFFFAOYSA-N 400.822 2.495 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC[C@@H]1CCC[C@@H]1OC 804109667 NQLDAWZTKFZKLM-LRDDRELGSA-N 413.312 2.435 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 809363134 PKXGYSOHTPVRDS-WFASDCNBSA-N 424.339 2.245 10 20 HECD CN(c1ccc(CNC(=O)NCCCn2cc(CO)nn2)cc1)C1CCCCC1 812016321 CGCVOWSROXHVRJ-UHFFFAOYSA-N 400.527 2.429 10 20 HECD CN(CCC(=O)Nc1sccc1C(N)=O)Cc1ccc(N2CCOCC2)cc1 813734196 LQNQVDCCRBZYSR-UHFFFAOYSA-N 402.520 2.144 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1-c1ccccc1 916676652 NMTHDDFPJGQSSV-UHFFFAOYSA-N 424.526 2.346 10 20 HECD O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 917364966 UGRVINBBVSTRIQ-GUDVDZBRSA-N 414.502 2.465 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1 918433801 HVBMJIBSMFBQLH-UHFFFAOYSA-N 410.518 2.418 10 20 HECD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(C)c3NC(C)=O)nc12 918929122 ZZZARTRSYDNXSI-UHFFFAOYSA-N 412.402 2.235 10 20 HECD O=C(CNc1cc(Cl)ccc1C(=O)c1ccc(F)cc1)N[C@H]1CCS(=O)(=O)C1 1347019632 XEBBORZLSFAWFM-HNNXBMFYSA-N 424.881 2.425 10 20 HECD Cn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)nc(O)c4)cc3)CCC2)n1 1788424255 NOFZVAGUZDMSCB-UHFFFAOYSA-N 407.430 2.288 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769457 MZZCXMXHQAMFBF-HMZURLEKSA-N 422.909 2.391 10 20 HECD COCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1816876935 RAVKNKBPGLMJTB-CYBMUJFWSA-N 408.842 2.427 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2ccccc2O)C1 1842317774 RGJDWIXGGLFWEW-VQHVLOKHSA-N 410.426 2.039 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc3ncccc3c2)C1 1843635686 HMFFFQAPJJNXKC-UHFFFAOYSA-N 404.426 2.172 10 20 HECD Cc1cnn([C@H](C)C(=O)N2CCCC23CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)c1 1846590216 LTGQVLGGTAMPBB-CYBMUJFWSA-N 418.881 2.334 10 20 HECD Cc1cccc2c(=O)n(CC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cnc12 10907830 NSHVHSPAGCHUTK-UHFFFAOYSA-N 406.486 2.200 10 20 HECD CS(=O)(=O)N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 13789362 NCLCRFFYFHPGLL-UHFFFAOYSA-N 412.467 2.072 10 20 HECD O=S(=O)(Nc1ccc(N2CCCS2(=O)=O)cc1)c1cccc2nsnc12 19103160 ZUHYFFWRHHOXTC-UHFFFAOYSA-N 410.502 2.032 10 20 HECD CCNc1nc(NCC)n2c(SCC(=O)N(C)C(C3CC3)C3CC3)nnc2n1 50681808 QWKWSVIYUZPYBF-UHFFFAOYSA-N 404.544 2.122 10 20 HECD Cc1cccc2c(=O)n(CC(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cnc12 145588192 LOIKCEVKRMYKOP-QGZVFWFLSA-N 406.486 2.419 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)NC[C@@H](O)COc1ccc2c(c1)OCO2 149588079 DLDFCUOAMAGUMX-GOSISDBHSA-N 413.474 2.255 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)CC2)cc1 727057029 LWZNIZLFFMGHQR-OALUTQOASA-N 413.499 2.048 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 728944007 HWXLDYOKQRLJTF-CQSZACIVSA-N 418.494 2.406 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1 730066834 QKCVKTNECUPJMC-CYBMUJFWSA-N 408.476 2.244 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c(OC(F)F)c1 732478956 QORZBCVRGQTQSO-UHFFFAOYSA-N 408.357 2.377 10 20 HECD O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(n2cncn2)C1 732760208 GCKZPRJKQVRRAZ-VGOFMYFVSA-N 419.557 2.405 10 20 HECD CCS(=O)(=O)C[C@@H](C)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 733649073 YOFLRPMQZIVPMF-CYBMUJFWSA-N 419.494 2.379 10 20 HECD COc1ccc(N2CCN(CCNC(=O)Nc3cnn(-c4ccccn4)c3)CC2)cc1 743183245 KMPKMMLIXNDPAZ-UHFFFAOYSA-N 421.505 2.220 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@H](O)c3ccccc3)cc2)C1 745692593 XSBHMENTJWFLQW-FPOVZHCZSA-N 410.518 2.311 10 20 HECD CCN1CCN(C[C@@H](C)CNC(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 745861704 DTHJEJKXNSJIIJ-FQEVSTJZSA-N 417.598 2.191 10 20 HECD CN(C)CCn1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)n1 746364356 AWJPACHULYXNDF-UHFFFAOYSA-N 412.538 2.032 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)C(=O)c3cnn(C)c3)c2C)cc1 748434696 ZOMUKBHDRHXBPQ-UHFFFAOYSA-N 423.425 2.223 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CN(C(=O)OC(C)(C)C)C3)CC2)cc1F 753939107 HCZZJPVTYOZDDJ-UHFFFAOYSA-N 408.474 2.285 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCOCC3CC3)cc2F)C[C@H](C)O1 756047489 IDTRFNJFHATZFF-IRXDYDNUSA-N 407.530 2.414 10 20 HECD Cc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CC1 757865498 MOSDLWQKDUFFOO-UHFFFAOYSA-N 405.476 2.211 10 20 HECD CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 759206198 APWDQVCSYPOWNT-DLBZAZTESA-N 424.409 2.294 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)[C@@]12CCCO2 759321596 YAYIYHRAGRIZDF-ZVDOUQERSA-N 407.486 2.393 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCOCC4(CCC4)C3)cc2)C1 760096313 QMXUVTFABRKGGC-SFHVURJKSA-N 400.523 2.100 10 20 HECD CC1(CO)CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 762680414 HOKJPYQDKPDWHA-UHFFFAOYSA-N 410.517 2.489 10 20 HECD COc1ccc(N2CCN(C(=O)Cn3ccnc3[C@H](O)c3ccccc3)CC2)cc1 763171057 BJMWYOCQGIEBQO-JOCHJYFZSA-N 406.486 2.322 10 20 HECD C[C@H](NCCNS(=O)(=O)Cc1ccccc1)c1ccc(N2CCOCC2)c(F)c1 765278522 IVUTUIXZBGWWJY-KRWDZBQOSA-N 421.538 2.433 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(CCCOC(C)C)n3)CC2)cc1 771069614 YCVHIMCBSBKKFZ-UHFFFAOYSA-N 402.495 2.327 10 20 HECD Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)nn1 773374690 LUYWBXMJOJCFSI-UHFFFAOYSA-N 420.473 2.118 10 20 HECD O=C(NCc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774443007 PXPPFSGGOHZLNC-UHFFFAOYSA-N 419.884 2.373 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(O)c(O)c3)CC2)cc1 778922139 DJZDLXCMPLMXEA-UHFFFAOYSA-N 404.488 2.123 10 20 HECD COc1ccc(CCC(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc1 779503661 SCYNEMLQZAVYFH-WDZFZDKYSA-N 410.470 2.423 10 20 HECD COC[C@@H]1CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)O1 784069728 GHLUJFVFKGPDJE-DFGXFYAUSA-N 409.502 2.385 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H](C)S(C)(=O)=O 788282779 LKGIFCANVBLXFW-OLZOCXBDSA-N 422.469 2.227 10 20 HECD COc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)C2)cc1 788312059 BQCWMESHHCLTHJ-HXUWFJFHSA-N 423.513 2.164 10 20 HECD CC(C)(CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccccc1F 788324634 XCNHVZXYMFZIHT-UHFFFAOYSA-N 413.493 2.373 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2COc3c(cccc3OC)C2)cc1 788977460 LFONEMIOKHZXMQ-GOSISDBHSA-N 411.502 2.278 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)N3CCCSCC3)cc2F)C[C@@H](C)O1 789811717 GJNYZHJWJVPBBD-HUUCEWRRSA-N 409.527 2.021 10 20 HECD Cc1cnc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)s1 789856561 VYXSKUGEYUZKKL-AWEZNQCLSA-N 404.561 2.498 10 20 HECD C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 793932010 QVFGTCROFDSBKF-APWZRJJASA-N 412.509 2.460 10 20 HECD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)N(C)Cc1ccccc1 805944249 SCUFMLRGCXWXGO-LJQANCHMSA-N 406.530 2.316 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 807676421 GEXCMATZHXBSDD-OAHLLOKOSA-N 418.538 2.446 10 20 HECD CC[C@H]1CN(C(=O)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCO1 807769420 UHEXUBVEIDLGJN-ZBFHGGJFSA-N 411.449 2.010 10 20 HECD NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1NCc1ccc(N2CCOCC2)cc1 809350523 UHKYVVXTMIOTSU-UHFFFAOYSA-N 415.515 2.375 10 20 HECD Cc1ccc(S(=O)(=O)N(C)Cc2nnc(N(C)Cc3ccccc3O)n2C)cc1 809817237 YDFQFXJVFWISAV-UHFFFAOYSA-N 415.519 2.286 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NS(=O)(=O)c3c(C)cnn3C)ccc21 813989302 ASZNNRNOINBBLF-UHFFFAOYSA-N 404.492 2.065 10 20 HECD CNC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1C 914789652 PTCTVCUZDDHDJF-UHFFFAOYSA-N 421.460 2.217 10 20 HECD CC(C)[C@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCN(C)CC1 916258185 MUHCEAWNICRKKV-SFTDATJTSA-N 418.582 2.355 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1C 916595303 BEOQERYJZWCZET-UHFFFAOYSA-N 421.471 2.476 10 20 HECD CNC(=O)Cc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 918294722 TWSLNLFXTMLMRP-UHFFFAOYSA-N 421.453 2.441 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 918303619 CBOSBPMFNCNNPI-HXUWFJFHSA-N 424.501 2.467 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc(F)cc1F 918442691 RCDKCAHFKQSFFM-UHFFFAOYSA-N 403.429 2.428 10 20 HECD CCc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918464410 VGCXAEGWNDEMLW-GOSISDBHSA-N 408.502 2.206 10 20 HECD O=C(Cc1cccc2cccnc12)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918644331 XLQUJHSRVIRAIJ-UHFFFAOYSA-N 409.511 2.329 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])cn3)cc2F)C[C@@H](C)O1 919850551 YTLGRDHCAIMQQA-OKILXGFUSA-N 405.430 2.251 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nc(-c2ccco2)oc1C 1116570506 ADUIQFYCXSHJPG-HNNXBMFYSA-N 414.414 2.487 10 20 HECD C[C@@H](Nc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1798356094 UAKBJDMQGDRATR-NKGKWGDASA-N 410.474 2.245 10 20 HECD C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816727111 DTPQWTBXZLLABD-YRBGZSCZSA-N 402.476 2.221 10 20 HECD COc1ccc(N2CCN(C(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 8028246 RDPSJFIPUMSZFF-UHFFFAOYSA-N 412.446 2.072 10 20 HECD COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 141694020 JRYZBAPGIBREPL-HNNXBMFYSA-N 411.458 2.126 10 20 HECD CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(NC(=O)C3=S=CC=C3)cc2)o1 504607976 QOTPBDNVDBMVLL-UHFFFAOYSA-N 404.469 2.293 10 20 HECD O=C(O)c1cnc(O)c2cc(NS(=O)(=O)c3cccc4nsnc34)ccc12 567213142 ZQMVBMPUZCRWJQ-UHFFFAOYSA-N 402.413 2.444 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC(=O)Nc3cccnc3)cc2F)C[C@@H](C)O1 725863245 AXIKTZNJYNZUPZ-HUUCEWRRSA-N 415.469 2.272 10 20 HECD CNC(=O)CCN(C)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 729369448 ZNVQBXAZSZKBAU-QBFSEMIESA-N 411.574 2.324 10 20 HECD COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H](CS(N)(=O)=O)C3)c2C)cc1 731881131 FBDTYJLYPIKVFX-INIZCTEOSA-N 405.520 2.243 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCc3ccccc3)cc2)C1 733039089 JXWUTXDVOQANQR-NRFANRHFSA-N 424.545 2.135 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3cccc(F)c3)cc2)C1 734660408 PTTURHSIQNPDST-FXAWDEMLSA-N 414.481 2.060 10 20 HECD CN1CCCc2cc(CNC(=O)CN3C(=O)N[C@](C)(c4ccc(F)cc4)C3=O)ccc21 746814280 LEHSUXBXYONIKN-HSZRJFAPSA-N 424.476 2.292 10 20 HECD CC(=O)c1cc(F)cc(CN2CCN(CC(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)c1O 748050511 FJCLDRBLUUKPHK-HOTGVXAUSA-N 405.514 2.356 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCC[C@@H]1[C@@H](O)C(F)(F)F 750638726 PREQFLHYONUZIJ-IAGOWNOFSA-N 419.419 2.384 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 751307664 YTPDNGNXRYBEKT-UHFFFAOYSA-N 411.502 2.499 10 20 HECD O=S1(=O)CC[C@@H](N2CCN(Cc3ccc(OCc4ccccc4)cc3O)CC2)C1 753534948 AXCZIZXRIXMVKT-HXUWFJFHSA-N 416.543 2.276 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)cnc2N)cc1Cl 754748013 ZFYAOIPWGVHCOS-UHFFFAOYSA-N 411.292 2.143 10 20 HECD COCCNS(=O)(=O)c1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)c1 756590635 OMWFCTBYNABTMN-CYBMUJFWSA-N 409.464 2.076 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(=O)NC4CC4)cc3)cc2)C1 756938537 QJSJSQMJIXKNMY-IBGZPJMESA-N 420.513 2.211 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](c3ccsc3)N(C)C)CC2)cc1 758211384 UUFLUEMZGGWSDF-UNMCSNQZSA-N 418.607 2.132 10 20 HECD COc1cc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cc(OC)c1OC 760087842 QHHDXLBQHJPNDN-ALCCZGGFSA-N 414.458 2.486 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1scnc1C1CC1 763121280 YPVWBHKMLWZSNS-UHFFFAOYSA-N 414.531 2.484 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCCC4(C3)OCCO4)cc2F)CC1 768331274 WWIKBKRVRCDKTK-SFHVURJKSA-N 420.529 2.453 10 20 HECD COc1cccc(CNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)c1O 769609805 YQNDYVZPNUACJG-UHFFFAOYSA-N 408.401 2.276 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 770826563 JGFINJDULNROKC-RBUKOAKNSA-N 404.555 2.322 10 20 HECD COc1ccc(N2CCN(C(=O)Cc3noc(-c4ccc(OC)cc4O)n3)CC2)cc1 771084122 XFEFSQPGHNUGRQ-UHFFFAOYSA-N 424.457 2.351 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1 773322792 QZPDUIFYWYVUME-UHFFFAOYSA-N 423.469 2.345 10 20 HECD CN(C(=O)COC(=O)c1cccc(O)c1O)c1ccccc1C(=O)NCc1ccco1 776283048 FVMYWYRJYGSKCP-UHFFFAOYSA-N 424.409 2.441 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)Cc3c(C)noc3C)CC2)cc1 778230691 BXUDKXQKBYYDRV-MDZDMXLPSA-N 412.490 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)c3nc(C)cs3)CC2)cc1 778268711 NBNROEXTLLCJTN-HJWRWDBZSA-N 400.504 2.328 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3cccc4c3OCCC4=O)CC2)cc1 780047751 LROMBVVOUMBJHB-UHFFFAOYSA-N 423.469 2.338 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](O)C(C)(C)C3)cc2F)C[C@@H](C)O1 782583856 OJUNMDYCYQGCDY-JXXFODFXSA-N 407.530 2.148 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(-n2cnnn2)c1 783315614 ZXXZYNJKQWQRNN-UHFFFAOYSA-N 407.478 2.104 10 20 HECD Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 784286337 QYMZEKQLBUKPMR-UHFFFAOYSA-N 406.552 2.471 10 20 HECD CN(C)CCN(Cc1cccc(F)c1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422104 IHFCVPAOQNFAQK-UHFFFAOYSA-N 400.498 2.098 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)cc1 788955399 RGTKUISSHHNXGH-KRWDZBQOSA-N 403.523 2.339 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)C(=O)N3CCS[C@H](C)[C@H]3C)cc2F)C[C@@H](C)O1 789826673 QCCGVHDNPNQBPY-QKPAOTATSA-N 423.554 2.408 10 20 HECD C[C@H](O)C[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855662 VOWVWXHKIXDYGY-LPHOPBHVSA-N 405.564 2.008 10 20 HECD COc1ccc(O)c([C@@H](C)N[C@H](C(=O)N(C)Cc2nnc3n2CCC3)C(C)C)c1 794830734 KIXCHHGRKQJUSH-VLIAUNLRSA-N 401.511 2.272 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)c(F)c1 795061475 XLTNLZYMPULRSM-UHFFFAOYSA-N 408.451 2.132 10 20 HECD O=C(CN1CCOC[C@@H]1[C@H]1CCCO1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 796344015 FQYWJOMUENIZEK-NHCUHLMSSA-N 420.465 2.280 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(OC(F)F)nc3)CC2)cc1 802550999 LSEBRVNIFJVILD-UHFFFAOYSA-N 420.416 2.369 10 20 HECD CN(C)Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 803662617 YYSYYEXZDVGTDC-UHFFFAOYSA-N 400.498 2.228 10 20 HECD CC[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 805007908 UOUHEPPRUJSLTR-MJGOQNOKSA-N 404.530 2.279 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCC3(C)C)cc2F)CC1 805008712 AGFDPVPEEOPIGF-LJQANCHMSA-N 404.530 2.279 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 806457402 LIULXKZNCQOZRA-GJZGRUSLSA-N 419.419 2.365 10 20 HECD CON(C)C(=O)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 813037700 YKPOTHZBSQYJNC-UHFFFAOYSA-N 406.552 2.181 10 20 HECD CS(=O)(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1 919790669 WNVAIVQYWFIDGG-UHFFFAOYSA-N 404.492 2.216 10 20 HECD O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 919969997 NSEWCFZPJNTTGU-NRFANRHFSA-N 409.486 2.301 10 20 HECD Cc1nnc(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)o1 1317692807 DNRVRURJDUSXBC-UHFFFAOYSA-N 406.489 2.408 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)Oc1ccc(F)c(F)c1 1320399662 REGDHTALVSMHQJ-BZNIZROVSA-N 409.385 2.434 10 20 HECD C[C@H](CN)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821293736 NZNNSWWXAPXSAP-YGRLFVJLSA-N 421.885 2.375 10 20 HECD O=C(c1cnco1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827424527 ZWUMDRVMYBRZIN-OAHLLOKOSA-N 400.435 2.028 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CC(N)=O)C2)cc1 1841658478 RGIZWAJJCBKNNS-INIZCTEOSA-N 422.529 2.423 10 20 HECD COc1ccc(Cn2nnnc2SCC(=O)NCc2ccc(N(C)C)cc2)cc1 16369409 IJNAWYULQRIKOK-UHFFFAOYSA-N 412.519 2.205 10 20 HECD COCCn1c(C)c(C)c2cc(C(=O)NC3CCC4(CC3)NC(=O)NC4=O)ccc21 578348524 OBSXNSLDXXIRFL-UHFFFAOYSA-N 412.490 2.155 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3cnn(C)c3C(F)F)CC2)cc1 727367255 GSOVOVAWWVUHIW-UHFFFAOYSA-N 407.465 2.308 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccnc1OCCOC 728139741 JKYWBZCVLBUCLQ-UHFFFAOYSA-N 400.479 2.160 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1 728979356 FIOSRWWIEMIPPJ-GTJPDFRWSA-N 415.421 2.184 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCCOC3)CC2)cc1 730905833 VAGLZQKMAONKCP-IBGZPJMESA-N 404.555 2.275 10 20 HECD CCn1cc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 734048341 QNXAMFNFTNGBJM-GASCZTMLSA-N 418.469 2.129 10 20 HECD NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 741077362 QESSNSOLEUSBKX-QFIPXVFZSA-N 419.529 2.117 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CN(Cc2ccccc2)CCO1 741180994 NFZJGVAOSNKECP-JOCHJYFZSA-N 413.493 2.180 10 20 HECD COc1ccc(N2CCN(C(=O)C[S@](=O)Cc3sc(C)nc3C)CC2)cc1 742440299 ONWGOTSFYFGBSF-HHHXNRCGSA-N 407.561 2.366 10 20 HECD CCN(CC(=O)NN1C(=O)N[C@@](C)(CCc2ccccc2)C1=O)c1ccc(OC)cc1 746109519 RVPCEAWWFWVOIR-QHCPKHFHSA-N 424.501 2.496 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(N2CCOCC2)cc1 746372043 HINAGNNLJQQVME-UHFFFAOYSA-N 415.515 2.010 10 20 HECD O=C(NC[C@]1(O)CCSC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747584942 DKCYMQCUJNUSKR-SCLBCKFNSA-N 401.479 2.424 10 20 HECD Cc1noc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 751059958 CCXJDWMDRMLINY-VIFPVBQESA-N 408.461 2.437 10 20 HECD Cn1cc(N2CCC[C@H](OC(=O)c3csc(Cc4ccc(N)cc4)n3)C2=O)cn1 751932171 XQYSRDMMJBVOQQ-KRWDZBQOSA-N 411.487 2.402 10 20 HECD COc1ccc(N2CCN(C(=O)Nc3cccc(-n4nnnc4C)c3)CC2)cc1F 753878898 MVCQGLXQUPHXDM-UHFFFAOYSA-N 411.441 2.473 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cnn(C)c3)cc2F)C[C@@H](C)O1 754772045 KFVKHQOPPPCNTH-OWCLPIDISA-N 403.502 2.140 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCS[C@H](C)CC3)CC2)cc1 757662910 JIXDIOCEOBOVLY-ZPUOCTKUSA-N 403.548 2.254 10 20 HECD O=C(CNC(=O)c1ccc(O)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771059441 RIFVYLMJZMZXJR-KRWDZBQOSA-N 417.893 2.262 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(-c4nc[nH]n4)cc3)cc2)C1 771232486 CSJDCBTXNPGUBF-GOSISDBHSA-N 404.474 2.103 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CC(=O)N(C2CCCCC2)C1 772439232 DIDMSLLFZDZNHA-KRWDZBQOSA-N 418.513 2.395 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1 772641506 RICVNPMCTYBRAK-ZDUSSCGKSA-N 411.466 2.456 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn(CC4CC4)c3)CC2)cc1 778299468 WWVNZDQGOUOKAF-HJWRWDBZSA-N 409.490 2.145 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NCC[C@H]3CCCCO3)CC2)cc1 780057886 ZOEVOQLYMLCIBF-OAQYLSRUSA-N 404.555 2.466 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cnn(C)c3)cc2F)C[C@H](C)O1 780397406 LDCYEIUFULACNK-KBPBESRZSA-N 412.469 2.493 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N=c3cc[nH]cc3[N+](=O)[O-])cc2F)CC1 781456319 XQQJJGHBHKWTCE-UHFFFAOYSA-N 402.430 2.014 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccncc2OCC(F)(F)F)cc1 785428808 SIOKEARDJIATBJ-UHFFFAOYSA-N 410.396 2.021 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)CNC(=O)c3cc(C)cc(C)c3)cc2)CC1 786263708 ZLFDRGSPGAQZHM-UHFFFAOYSA-N 422.529 2.018 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)OC)[C@@H]3C)cc2F)CC1 786754429 UJOURMDNNXTUGB-RDJZCZTQSA-N 406.502 2.061 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2CCC=CO2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 787038966 WUKDKXCFXDSXNW-IBGZPJMESA-N 418.471 2.160 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CN(C)C(=O)c2ccccc21 787105059 UGYWETKQKKGLFK-HXUWFJFHSA-N 409.486 2.124 10 20 HECD CSCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789826285 PISGJBAKKMRDSG-SOUVJXGZSA-N 411.543 2.313 10 20 HECD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC(C)(C)O1 789863829 JMGBPIARPBGONL-UHFFFAOYSA-N 405.564 2.272 10 20 HECD COc1cc(N2CCN(S(=O)(=O)CCC(F)(F)F)CC2)cc(OC)c1OC 790273082 CNVIWFCROGAWMG-UHFFFAOYSA-N 412.430 2.117 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@](C)(O)CC3)cc2F)C[C@@H](C)O1 791625527 ASXWZMKVHPRXPP-YVHKJVDXSA-N 407.530 2.292 10 20 HECD COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797388072 SYSCRRIMOGGOTG-UHFFFAOYSA-N 404.444 2.381 10 20 HECD CN(C)C(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1 799761791 FLUMONTVXQTQSU-UHFFFAOYSA-N 419.572 2.420 10 20 HECD C[C@@H](NC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1)c1ccc(N(C)C)cc1 804106953 XCBVTQSDCRVJKO-QGZVFWFLSA-N 405.502 2.474 10 20 HECD O=C(NCCCN1CCCCC1=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 804779249 XETYPBBQVUOWAA-UHFFFAOYSA-N 413.474 2.033 10 20 HECD COc1cccc(N2CCC[C@H](NC(=O)C(=O)NCc3ccc(N(C)C)cc3C)C2)c1 805475174 LTMCOAPCMYSWCC-IBGZPJMESA-N 424.545 2.471 10 20 HECD C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 806518737 GYMNGFCZVNCOFY-OAHLLOKOSA-N 406.527 2.131 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NC2CCN(c3cccnn3)CC2)cc1 807746145 YACJJFYHGJBFDD-UHFFFAOYSA-N 424.549 2.066 10 20 HECD C[C@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 808853908 KEGVNSVPSZTJLY-RBUKOAKNSA-N 412.578 2.482 10 20 HECD O=C1N=C(N2CCOCC2)S/C1=C/c1cn(-c2ccccc2Br)nn1 811687827 JOMVBLNTEWVAGR-NTEUORMPSA-N 420.292 2.332 10 20 HECD COCCOc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1C 914876984 MCXOIDDFLWDABM-UHFFFAOYSA-N 414.505 2.193 10 20 HECD CCOc1ccc(N2CCN(C(=O)c3ccccc3NS(C)(=O)=O)CC2)cc1 1319397132 IEULQOMFAROQIP-UHFFFAOYSA-N 403.504 2.419 10 20 HECD COC(=O)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1Cl 1321909793 XFSMSINSMZESMK-OAHLLOKOSA-N 413.835 2.488 10 20 HECD CCOc1ccc(N2CCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)CC2)cc1 1325636014 ZZBKCQIXULTILU-UHFFFAOYSA-N 403.429 2.442 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 23397975 JZYQGFNNOAKPOT-UHFFFAOYSA-N 405.841 2.421 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NC[C@H](OC)C(F)(F)F)cc2F)CC1 733356489 TZPGFNCKZHXJQG-INIZCTEOSA-N 406.424 2.344 10 20 HECD COc1ccc(N2CCCN(C(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)CC2)cc1 734284119 RRDZOTUYTGNVQT-LJQANCHMSA-N 415.582 2.085 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N(C)C[C@@H]3CCCN(C)C3)cc2F)CC1 734669933 XLWVWCHDWOVTMW-LJQANCHMSA-N 405.562 2.451 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccccc2OCCN2CCOCC2)cc1 744269802 VZACRLYUOGYJQG-UHFFFAOYSA-N 412.534 2.463 10 20 HECD Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)[C@H](NC(=O)C2CC2)[C@@H](C)O)c1C 745742586 AJYJVSRCRPPHLB-IIBYNOLFSA-N 412.486 2.404 10 20 HECD COC(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903831 IVSIIFLPWBMRPZ-CQSZACIVSA-N 412.437 2.350 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCNS(=O)(=O)c2cccs2)cc1 746714662 CLOLLHHESGBXND-UHFFFAOYSA-N 410.565 2.372 10 20 HECD COC(=O)c1cccc(S(=O)(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 751227075 CIAYQESLQRZVLD-UHFFFAOYSA-N 422.478 2.052 10 20 HECD Nc1ccc(Cc2nc(C(=O)OCCc3ccc(S(N)(=O)=O)cc3)cs2)cc1 751935523 BJIIRIMAGKDQJB-UHFFFAOYSA-N 417.512 2.363 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(-c4ccccc4)n3)cc2)C1 757855217 NFEUAESQACCCBS-KRWDZBQOSA-N 419.489 2.291 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3cccc(-n4cccn4)c3)CC2)cc1 758232879 UGXUARTYQWKMFC-NRFANRHFSA-N 408.502 2.443 10 20 HECD CN(CCCNC(=O)C1CCC1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 758397703 JDZYEUHKVTYLHA-UHFFFAOYSA-N 406.502 2.110 10 20 HECD COc1cc(N2CCN(C(=O)C(=O)Nc3ccccc3C)CC2)cc(OC)c1OC 759413445 PRJZKISRTKITSA-UHFFFAOYSA-N 413.474 2.308 10 20 HECD Cc1cc(C(=O)NCC(=O)NCc2cccc(Br)c2O)ccc1[N+](=O)[O-] 765731108 GRBVEJACBAADQR-UHFFFAOYSA-N 422.235 2.418 10 20 HECD Cc1cc(O)c(CN2CCN(S(=O)(=O)c3ccc4nc(O)[nH]c4c3)CC2)cc1C 768218652 RNQHMBPNTVMWGS-UHFFFAOYSA-N 416.503 2.097 10 20 HECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1C(=O)NC(C)C 769783383 ASZXGGASYHJZBM-UHFFFAOYSA-N 405.476 2.463 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H]3CCO[C@H](C)C3)CC2)cc1 770826567 JGFINJDULNROKC-RTBURBONSA-N 404.555 2.322 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O 773739342 FOBCIDGYCJKMPQ-QWHCGFSZSA-N 404.488 2.169 10 20 HECD O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)NCc1ccccc1F 774803546 OMFYFHYXCJFSIQ-UHFFFAOYSA-N 424.520 2.290 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1O 774876556 AQIQUVIGKLFCAB-NVXWUHKLSA-N 420.510 2.122 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1nc(C(F)(F)F)n[nH]1 776117189 GMYWGFKCONBZHK-UHFFFAOYSA-N 412.416 2.032 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC[C@H](c4cc[nH]n4)C3)CC2)cc1 778244064 OPOLFLPWQANWRA-BLGFXRMMSA-N 423.517 2.029 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cc(F)ccc3F)CC2)cc1 778264102 WICPKSFLTYCBCF-HJWRWDBZSA-N 415.440 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@]3(C)CCCS3)CC2)cc1 778323788 LEFUSHPLKFBHDX-HEDKFQSOSA-N 403.548 2.302 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H](O)Cc3cccc(OC)c3)cc2F)CC1 785587091 DCMFBOJPQANMJF-QFIPXVFZSA-N 415.509 2.196 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCc1cccc(N2CCCC2=O)c1 788225358 QLSJOCLXJNWXBT-UHFFFAOYSA-N 418.544 2.185 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC[C@@H]2CCN(C3CC3)C2)cc1 788801489 AKEAOABKZCAKFZ-IBGZPJMESA-N 424.545 2.475 10 20 HECD Cn1nc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c2ccccc21 789855112 KBGOOTRUNOUFJA-UHFFFAOYSA-N 423.542 2.059 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c1 792495121 JXJNNYNGJCNTJQ-MRXNPFEDSA-N 403.504 2.016 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1F 804853737 UCHUCRMXJUOITB-IEBWSBKVSA-N 404.530 2.231 10 20 HECD COCc1csc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 806844400 OVYQWDYLRANANW-HNNXBMFYSA-N 405.476 2.141 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCC2(N(C)C)CCC2)cc1 807025299 SCILDESRNYZFSU-UHFFFAOYSA-N 412.534 2.475 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 807098366 UZKZYBVPLOKBOU-UHFFFAOYSA-N 424.545 2.172 10 20 HECD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O 807653343 BQCBIMJXQQTTGW-APWZRJJASA-N 409.486 2.441 10 20 HECD CN(CCO)S(=O)(=O)c1ccccc1CNCc1ccc2ccccc2c1O 816550305 NUNMLBZAVHHCFO-UHFFFAOYSA-N 400.500 2.448 10 20 HECD CCC(CC)N1C[C@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 915580660 AHSHHYCTNSCLOW-QGZVFWFLSA-N 403.523 2.291 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CCN(CC2CC2)CC1 918080963 IMILYXFMVUPUDA-UHFFFAOYSA-N 404.530 2.460 10 20 HECD COC(=O)COc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 919970111 OYANBCGIKBAZRF-UHFFFAOYSA-N 412.486 2.377 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 1320519708 KZXBALYHJGWFGO-AWEZNQCLSA-N 424.356 2.388 10 20 HECD CN1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1 1788425438 PVRIRCXRDVITRK-KRWDZBQOSA-N 410.474 2.335 10 20 HECD Cc1c[nH]cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817525390 VHWDJVPHDAJAGH-NSHDSACASA-N 413.459 2.125 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)C1 1845806056 XQBAYTZTXIBUTQ-SGIREYDYSA-N 406.891 2.443 10 20 HECD CN(C)CCNS(=O)(=O)c1ccc(NCc2ccc(N(C)C)cc2)c([N+](=O)[O-])c1 7366250 JUROIGJZBBXXCG-UHFFFAOYSA-N 421.523 2.113 10 20 HECD CNC(=O)C[C@@H](NC(=O)C(=O)NCc1c(C)c2ccccc2n1C)c1ccccc1 569641630 UDYOSYPZYGYJMA-GOSISDBHSA-N 406.486 2.097 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1 729279036 YPZISCZMPMBQIZ-IUODEOHRSA-N 410.517 2.493 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CNCC2CCN(S(=O)(=O)C(F)F)CC2)c1O 732985706 OKIVYBUSCXWFOY-UHFFFAOYSA-N 413.830 2.308 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)cc2F)C[C@@H](C)O1 733840427 DRWKQAHICOAJPK-CDUMDVBJSA-N 420.481 2.166 10 20 HECD COC(=O)CNC(=O)c1ccc(NCc2ccc(N(C)C)cc2C)c([N+](=O)[O-])c1 734482765 UYDRDCFDVYSRLF-UHFFFAOYSA-N 400.435 2.484 10 20 HECD COc1ncccc1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743975014 KWWPRHBASFNLGS-ZDUSSCGKSA-N 420.416 2.415 10 20 HECD CCCN(C)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 745690318 ASPGZCWXAFGXIQ-VQTJNVASSA-N 415.582 2.262 10 20 HECD Cc1nccn1-c1ccc(NC(=O)C(=O)NCCCSc2nccs2)cn1 749730067 HYWUTNBIMVTUFV-UHFFFAOYSA-N 402.505 2.269 10 20 HECD COCCN(CC(=O)OC)CC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 749845674 STLXTDJEEUDJQY-UHFFFAOYSA-N 416.474 2.169 10 20 HECD CCOC(=O)c1c(C)oc2nc(COC(=O)c3ccc(C)c(O)c3O)nc(N)c12 750618648 JGOKSMNQVWBDPG-UHFFFAOYSA-N 401.375 2.367 10 20 HECD C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1nccs1 754310883 YNILTIQIMNFYND-HOCLYGCPSA-N 401.536 2.448 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCN(Cc2ccsc2)CC1 759592443 HAPOZUZSSMIUHM-DUXPYHPUSA-N 402.472 2.060 10 20 HECD COc1ccc(C(=O)CNC(=O)CCC(=O)N[C@H](C)c2cc(OC)ccc2O)cc1 761973980 SAUOPAQVQKFOSZ-CQSZACIVSA-N 414.458 2.366 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3ccc(N4CCCC4)cn3)no2)c1 762078969 AQYHZWNDCKVPAA-UHFFFAOYSA-N 401.448 2.476 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC3(N4CCOCC4)CC3)cc2F)C[C@@H](C)O1 764762410 FIQFEBREKDICTA-CALCHBBNSA-N 420.529 2.103 10 20 HECD CC[C@]1(c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2)CCC(=O)NC1=O 765060597 JFIUWYUSHUJZJE-LJQANCHMSA-N 414.443 2.108 10 20 HECD COc1cc(N2CCN(C(=O)NCCCC(=O)OC(C)C)CC2)cc(OC)c1OC 765904662 AVMHCRDLSIJOOW-UHFFFAOYSA-N 423.510 2.276 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(C)=O)cc1F 766047461 JKAQGWGNHLTMDW-UHFFFAOYSA-N 416.452 2.296 10 20 HECD COc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)CC2)cc1F 769157512 WHXJCECJFDWBOW-PMACEKPBSA-N 420.529 2.044 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)c1O 774913218 GLRYPCINPVFLRK-UHFFFAOYSA-N 407.448 2.091 10 20 HECD COc1cc(O)c(CNCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1OC 776000171 LEMSGZDXZYNABB-UHFFFAOYSA-N 410.467 2.378 10 20 HECD COCCN(CC(C)C)C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 778231441 FTCOUJYBQWTFBL-KTKRTIGZSA-N 403.523 2.031 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCSCC(C)C)CC2)cc1 778394531 JIZPBRKDYGSVRT-HJWRWDBZSA-N 405.564 2.405 10 20 HECD CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 779331447 FYTXVRCLJJWXBT-PXNSSMCTSA-N 404.530 2.413 10 20 HECD COc1ccc(/C=C2\SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cn1 780144665 YUWURZBCKCHBNM-ZSOIEALJSA-N 421.525 2.139 10 20 HECD COCCCn1ccc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)n1 783315267 BWCWOGNZSNYKGQ-UHFFFAOYSA-N 401.511 2.361 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1ncnn1-c1ccccc1 786998024 BHLQGYMXYFWTHP-UHFFFAOYSA-N 420.517 2.475 10 20 HECD COc1ccc(N2CCN(C[C@H](O)COc3ccc(-c4ncnn4C)cc3)CC2)cc1 790137092 BOMCZZCWAZSJPH-FQEVSTJZSA-N 423.517 2.053 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 802610209 VOVXNGXRMYEFSH-UHFFFAOYSA-N 416.499 2.489 10 20 HECD C[C@H](NC(=O)C(=O)N[C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 803310831 KDDJLUFVBRWYMP-HQRMLTQVSA-N 417.550 2.410 10 20 HECD CCn1ccnc1[C@@H]1CCCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661925 OPQMCMTXSJWYKF-SFHVURJKSA-N 401.486 2.478 10 20 HECD CN(c1ccc(CNC(=O)C(=O)NCc2ccc(C(N)=O)cc2)cc1)C1CCCCC1 803677249 KGQRWZBEBDRUMH-UHFFFAOYSA-N 422.529 2.487 10 20 HECD O=C(NCCNS(=O)(=O)c1cccc(Cl)c1Cl)c1cccc(O)c1O 804352543 ODIFCTRUZVBUQO-UHFFFAOYSA-N 405.259 2.113 10 20 HECD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)cc1 804729080 DBGQLIZEOUDBDO-FQEVSTJZSA-N 424.545 2.475 10 20 HECD C[C@H](O)C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 807291242 VFVLZRLIOXNNRB-GHTZIAJQSA-N 407.514 2.350 10 20 HECD Cc1noc(C)c1CO[C@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 807672880 JVMHKQJOBDIUCZ-LIRRHRJNSA-N 414.506 2.352 10 20 HECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 808094893 IYUXMXXOUDYFOL-UHFFFAOYSA-N 417.911 2.468 10 20 HECD CN(C)c1ccc(CN(C(=O)COc2nsnc2N2CCOCC2)C2CC2)cc1 915117732 DUXPXTMREFDUOM-UHFFFAOYSA-N 417.535 2.011 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3N3CCCC3=O)cc2)CC1 1116883895 XXSMKUBZYWXQLJ-UHFFFAOYSA-N 420.513 2.412 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCc3c(O)nnc(C)c3C)cc2F)CC1 1318549824 HQRBTHTVKHAWBP-UHFFFAOYSA-N 416.501 2.079 10 20 HECD CC1=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CCO1 1827281947 IUGOEIRLZLMNGZ-SFHVURJKSA-N 415.490 2.420 10 20 HECD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)COc2cccnc2)C1 1841957287 SWGFAJDWYFIEDY-UHFFFAOYSA-N 417.849 2.042 10 20 HECD CCn1nc(C)cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501274 VJCKVLNEMOFASW-UHFFFAOYSA-N 418.881 2.407 10 20 HECD COC(=O)[C@H](CC(C)C)NC(=O)COC(=O)c1sc2nc(C)cc(C)c2c1N 28996967 XAORSBVJDHILCS-LBPRGKRZSA-N 407.492 2.356 10 20 HECD COc1cc(CNC(=O)NCc2c(C)c3ccccc3n2C)ccc1OCC(N)=O 471663713 QYYOJDFHKOWFCU-UHFFFAOYSA-N 410.474 2.359 10 20 HECD Cc1c(CNC(=O)C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)n(C)c2ccccc12 571952594 IZZJNFCWFOBNHV-QGZVFWFLSA-N 412.534 2.114 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)N3CCC(C)CC3)CC2)cc1 726248488 XIIKWKGVZBGDID-FQEVSTJZSA-N 417.598 2.237 10 20 HECD COc1ccc(N2CCC(NC(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 728212096 SAKSDXIGRNXUPG-HNNXBMFYSA-N 421.501 2.475 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)c1 728981427 ZIWDGWMHWGVZBH-CYBMUJFWSA-N 420.487 2.149 10 20 HECD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729502509 ANEWPLJHHHELRB-MJGOQNOKSA-N 424.492 2.419 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccc(N4CCCC4)nn3)cc2F)CC1 730194960 STEDAVLHOHLTKE-UHFFFAOYSA-N 412.513 2.288 10 20 HECD C[C@H]1CCCC[C@H]1OCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 733567992 JLXAORZHBBYYMM-OXJNMPFZSA-N 422.497 2.417 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1O 737278295 HNFBPJWAQDUIIZ-UHFFFAOYSA-N 420.425 2.303 10 20 HECD CN(C)c1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1F 746805311 QPUQZHPJJBTCGW-UHFFFAOYSA-N 420.510 2.004 10 20 HECD O=C1COc2ccc(S(=O)(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2N1 751136905 NPLBMUDNPFBAET-OAHLLOKOSA-N 418.471 2.093 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC(F)(F)[C@H](C)C3)CC2)cc1 753027077 YYFYYRGRFUGITF-XITLMJRVSA-N 407.461 2.404 10 20 HECD CCc1nc(CN(C)C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cs1 754018432 LXKIYQJSKPHKBP-LJQANCHMSA-N 404.580 2.329 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@@H]3CCC[C@@H]3O)CC2)cc1 755053394 JYCCCZIPHYOYKX-RXVVDRJESA-N 404.555 2.010 10 20 HECD CCOc1ccc(N(CC)CC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)cc1 759698097 VUHKPYUQSDGUJH-UHFFFAOYSA-N 407.492 2.206 10 20 HECD NS(=O)(=O)c1ccc(NCc2cccc(Br)c2O)c([N+](=O)[O-])c1 764933371 CMCAHQOCCZZEHM-UHFFFAOYSA-N 402.226 2.322 10 20 HECD COc1cccc(CNC(=O)[C@H](CCSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1O 769506965 DBZAKDZGZJVJTI-OAGGEKHMSA-N 420.531 2.314 10 20 HECD COCCNC(=O)CSc1ccccc1C(=O)N1CCSC2(CCOCC2)C1 771581316 VRPJEIBVGUEAHF-UHFFFAOYSA-N 424.588 2.280 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3CCN(C)CC3)cc2Cl)C1 774853522 JQEMMMIORQLNEW-HNNXBMFYSA-N 406.958 2.403 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)OC)cc2)cc1 777610014 NUJTYVWJQUVNLV-UHFFFAOYSA-N 413.477 2.427 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)c2)CC1 781045084 CNWUBTRCHBYMFA-UHFFFAOYSA-N 412.402 2.244 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cnc2c(c1)CCCC2 782777309 XUYYFQUGOCXACE-UHFFFAOYSA-N 412.465 2.191 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(O[C@H]4CCOC4)cc3)cc2)CC1 788774819 MJEYKWYPZDBVFW-QHCPKHFHSA-N 423.513 2.453 10 20 HECD COc1cccc(N2CC[C@H](NC(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)c1 788911110 OQKAIOASSRLPEW-IBGZPJMESA-N 422.529 2.307 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1COC2(CCCCCC2)O1 788938584 SRPYTCGKTKRDQE-HXUWFJFHSA-N 415.534 2.485 10 20 HECD C[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)N1CCc2sccc2C1 789726249 WCDYRUPYEGTQPZ-MRXNPFEDSA-N 414.575 2.336 10 20 HECD COc1cc(F)cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)c1 789861652 QWUSGADLSHEIMX-UHFFFAOYSA-N 417.506 2.320 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)c3ccnn3CC(F)F)CC2)cc1 789875648 WVRFKWRTBZHDEX-UHFFFAOYSA-N 407.465 2.099 10 20 HECD COc1ccc(N2CCN(C(=O)/C(=C/c3ccc(F)cc3)n3nnnc3C)CC2)cc1 818024449 LWSNVFYGAXGOTO-QNGOZBTKSA-N 422.464 2.476 10 20 HECD COc1ccc(CCN2C[C@@H](C(=O)N(C)Cc3ccccc3O)CC2=O)cc1OC 917307223 GKXAUTDPRLWSIQ-SFHVURJKSA-N 412.486 2.459 10 20 HECD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1OC 917759800 ZUSYGPQETNLAND-UHFFFAOYSA-N 420.490 2.017 10 20 HECD C[C@@H](NC(=O)N1CCN(C[C@H]2CCCO2)CC1)c1ccc(N2CCOCC2)cc1 920921586 MOTYTBBNJVZTSO-WIYYLYMNSA-N 402.539 2.090 10 20 HECD COc1ccc(C(=O)Nc2c(Cl)ccc3nonc23)cc1S(=O)(=O)N(C)C 1320946797 MXGSLPMZDBGDGD-UHFFFAOYSA-N 410.839 2.387 10 20 HECD C[C@@H](NC(=O)NC[C@@H](CO)CC1CCOCC1)c1ccc(N2CCOCC2)cc1 1343834262 CIBRLFIZPQCTOS-MJGOQNOKSA-N 405.539 2.309 10 20 HECD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1O 1794864918 HHORVLQNQKWZPM-XFLCEESOSA-N 424.453 2.474 10 20 HECD COCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826450387 JAYRMPISNZHRNG-JKNJVXJCSA-N 418.490 2.083 10 20 HECD CC(C)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1827018850 GLNQBZHYWYFEEL-GOSISDBHSA-N 418.538 2.114 10 20 HECD O=C(c1cnccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249138 AGLYOJRPZITTFG-UHFFFAOYSA-N 422.363 2.037 10 20 HECD Cc1c(CNC(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)n(C)c2ccccc12 472167606 CYJWQYHNTOEJFI-UTKZUKDTSA-N 408.506 2.300 10 20 HECD CC(C)CS(=O)(=O)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726568109 WONFQNTYEWGPNE-UHFFFAOYSA-N 404.479 2.444 10 20 HECD CCN(CC)S(=O)(=O)c1cc(C(=O)NCc2cccc(OC)c2O)ccc1OC 727760931 DZJXWHMNSXRRIO-UHFFFAOYSA-N 422.503 2.370 10 20 HECD Cc1ocnc1C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 733527010 WTRAHMCXHDGPER-CHWSQXEVSA-N 405.426 2.209 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(c2cccc(F)c2)CC1 734423954 YNVNAYHMNCZMFW-UHFFFAOYSA-N 402.491 2.409 10 20 HECD O=C(NC[C@H](O)C1CCOCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 737049959 SCGLRYVUPOHRQS-SFHVURJKSA-N 413.465 2.344 10 20 HECD COc1cccc(CNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1O 737279109 UXGNXEACOICODD-UHFFFAOYSA-N 421.457 2.251 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 741281920 FLSMBGBWOKITPP-UHFFFAOYSA-N 405.495 2.210 10 20 HECD C[C@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 747615871 ANZNHTGBUWNBMR-QWHCGFSZSA-N 410.517 2.488 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)c1c(F)cccc1Cl 748396457 OMHKOMIITNIZFE-XXFAHNHDSA-N 416.858 2.408 10 20 HECD COC(=O)c1sccc1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 751044005 NZJFRCGCEFQUKG-CYBMUJFWSA-N 410.517 2.411 10 20 HECD O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc2c(c1)OCCO2 751227073 CEWZRHBLPZMZNO-UHFFFAOYSA-N 422.478 2.037 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(C)c([N+](=O)[O-])c1 753807047 PXVJVBIZSRKYJG-UHFFFAOYSA-N 414.418 2.011 10 20 HECD C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cc(Br)ccc1O 756416047 GWZUEYLYGXGABF-LLVKDONJSA-N 406.280 2.221 10 20 HECD Cn1cc([C@@H](CO)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 757652960 ARBBGQBVPSREQJ-WMLDXEAASA-N 409.437 2.023 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(CCN(C)C)C3CCCC3)CC2)cc1 758718987 PDRDTDIUIGXUEH-UHFFFAOYSA-N 417.598 2.333 10 20 HECD CO[C@H](C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 770630148 FYYAOOBCUXQWHF-AVYPCKFXSA-N 410.486 2.270 10 20 HECD Cn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1-c1ccccc1 775525141 XOJBKIFPUPZDHH-UHFFFAOYSA-N 424.526 2.252 10 20 HECD COc1ccc(O)c(CNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1 776348674 CIXRMERMJQKEIM-QGZVFWFLSA-N 404.467 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cccc(N(C)C)c3)CC2)cc1 778251840 LNYYIEWARZDWRM-VAWYXSNFSA-N 422.529 2.282 10 20 HECD Cc1cnn(-c2c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c(C)nn2C)c1 778327732 CBGQUIOLKCZXAH-UHFFFAOYSA-N 408.506 2.331 10 20 HECD CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1 780704397 VEEVRYIEFZHMAM-UHFFFAOYSA-N 424.529 2.256 10 20 HECD Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296846 JMJNCAKXHKSUHC-CYBMUJFWSA-N 413.430 2.049 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCN(Cc2ccccc2)C1 785428815 SJTFELTYZHSRIM-NQIIRXRSSA-N 408.546 2.396 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCNC(=O)OC(C)(C)C 786704435 PROAVTIRQIMOQO-UHFFFAOYSA-N 406.527 2.131 10 20 HECD Cc1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nnn1CC1CCCC1 788743603 VVRWPLRYZOZRIS-IBGZPJMESA-N 424.549 2.408 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccc3c(c2)CCN(C(C)=O)CC3)c1 790216501 DPYBNOJZTRNHQN-AWEZNQCLSA-N 418.515 2.387 10 20 HECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc2c(c1)nnn2C 791249141 DEWDGCNOUXMZSW-UHFFFAOYSA-N 410.478 2.366 10 20 HECD COc1ccc(CNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)c(O)c1 794389985 VJYXCHTYHUZXRB-UHFFFAOYSA-N 420.487 2.124 10 20 HECD CCn1ncc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)c1C(F)(F)F 799253425 SKYVUVNVTZJLEH-SECBINFHSA-N 400.357 2.452 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCN1CCCc2ccccc21 804001308 VATIMVHNNSOFOH-UHFFFAOYSA-N 404.561 2.311 10 20 HECD CCOCCN(CC)C(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 807769617 HYIIOUQJXJFBNO-OAHLLOKOSA-N 413.465 2.258 10 20 HECD C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NOC3CCOCC3)cc2Cl)C1 807953445 SKQKFEKVOWOVBG-AWEZNQCLSA-N 409.914 2.419 10 20 HECD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1C[C@@H]2CNC[C@@H]2C1 842516910 DPRQNFLKYNIKEM-GXKFLXMZSA-N 407.586 2.407 10 20 HECD CCNC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cc1 915778851 RZWGEWOWOKLWDX-UHFFFAOYSA-N 424.501 2.057 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCC(=O)N3CCCCC3)cc2F)C[C@@H](C)O1 918213087 NMCXOMOTEVGZMT-IYBDPMFKSA-N 406.502 2.251 10 20 HECD Cc1cc(CCNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1 920240169 KTVIISPYKIITCL-IBGZPJMESA-N 418.563 2.360 10 20 HECD COc1ccc(N2CCN(C(=O)c3ccc(CN4C(=O)CCC4=O)cc3)CC2)cc1 921160534 XOOQIYDZIGPEIY-UHFFFAOYSA-N 407.470 2.307 10 20 HECD CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1337049237 APYPQZXNSXRTKP-OAHLLOKOSA-N 420.487 2.456 10 20 HECD Cc1nc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)s1 1795050248 MCHXPOXLUMQWEW-BTTYYORXSA-N 402.476 2.132 10 20 HECD C[C@H](Oc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602917 ZXOPJBPVUWTMER-LLLHUVSDSA-N 411.458 2.212 10 20 HECD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1)c1cc(O)nc(O)c1 1827286728 YYDQQBMTYYFSGY-CMPLNLGQSA-N 420.516 2.071 10 20 HECD C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCCC[C@H]1C 726615842 HETNIIZACXPNJC-HZPDHXFCSA-N 420.529 2.376 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3cscn3)cc2F)C[C@@H](C)O1 728339323 VCNWNYIGPDQBOD-CHWSQXEVSA-N 407.467 2.369 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)c1 728981103 SBTOWVLLZORBTK-LBPRGKRZSA-N 408.476 2.151 10 20 HECD CCCN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 738527168 TXBSIOURNFPXGJ-UHFFFAOYSA-N 421.475 2.360 10 20 HECD COCc1cccc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 738898010 ZIJWNTKNQJTCJL-UHFFFAOYSA-N 403.504 2.390 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1 740494278 BGPQRUIMMKUBNI-GUYCJALGSA-N 400.431 2.384 10 20 HECD CN(C)S(=O)(=O)c1c[nH]c(C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 743429855 BGWONLPCRYJVDN-UHFFFAOYSA-N 403.460 2.406 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc(-c2cccc(F)c2)no1 743800149 SSOCYDJYTHIWGP-JTQLQIEISA-N 420.422 2.444 10 20 HECD CCN1CCN(c2ccc(CNS(=O)(=O)c3ccccc3C=O)cc2F)CC1 751074125 DQQMKIVQZIGLIC-UHFFFAOYSA-N 405.495 2.259 10 20 HECD O=S(=O)(NCc1ccccc1O)c1cccc(S(=O)(=O)N2CCCCC2)c1 751149053 KYNATKYFSMRNQA-UHFFFAOYSA-N 410.517 2.045 10 20 HECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Cl)c1 751327041 VYMUHBFPLKFUJD-JTQLQIEISA-N 419.908 2.497 10 20 HECD Cc1ccc(C(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)c(O)c1O 751538599 SKYWBRZUJYYNAR-SFHVURJKSA-N 410.518 2.476 10 20 HECD COCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCCO1 752850592 KNCMVJQUBIMRBW-HXUWFJFHSA-N 415.538 2.467 10 20 HECD CNC(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)CC1 753423685 DXVFADSTTFXRTE-UHFFFAOYSA-N 412.490 2.020 10 20 HECD CCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1F 753521294 LMOOAISMAMOXCK-UHFFFAOYSA-N 419.412 2.002 10 20 HECD CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1cc3c(cc1O)OC[C@@H]3O)CCC2 768462599 OAWJQIXRKJOLQF-IBGZPJMESA-N 404.488 2.021 10 20 HECD COCc1ccc(NC(=O)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 773382744 PGGCJONYJOGPLC-UHFFFAOYSA-N 401.438 2.268 10 20 HECD C[C@H](NC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 773627290 XEWQXXIZPPPPLV-AWEZNQCLSA-N 420.491 2.495 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2c(c1)C(=O)N(C)C2=O 777825994 DJPADQORYHKGFM-UHFFFAOYSA-N 416.817 2.087 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(NC(C)=O)c3)CC2)cc1 778220696 LCKVJWXQFPMIQY-KHPPLWFESA-N 422.485 2.497 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H](O)c3cccc(C)c3)CC2)cc1 778389605 MMZQIEBCDJPHDS-YRBAHSOBSA-N 423.513 2.058 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)c3cnccc3C)CC2)cc1 778420262 UDIDEHSIXQOBKP-CNZFZVQHSA-N 408.502 2.481 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cnn(C)c3)cc2F)C[C@@H](C)O1 780397411 LDCYEIUFULACNK-OKILXGFUSA-N 412.469 2.493 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1 785439250 NBXDBJYTNREFOD-HXUWFJFHSA-N 408.502 2.023 10 20 HECD COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c(OC)c1 785546751 AYXBTXSTQHNFQQ-UHFFFAOYSA-N 408.461 2.140 10 20 HECD CCC(=O)Nc1cccc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 787083175 ODBKFHMQRDCSBI-UHFFFAOYSA-N 406.486 2.344 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3c(C(F)(F)F)n[nH]c3C)cc2)CC1 787323441 YDECMCMUNZHJDS-UHFFFAOYSA-N 409.412 2.335 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)cc1 787435399 XCSXCOFIEKODTD-UHFFFAOYSA-N 423.561 2.325 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)NC2CCCCC2)cc1 788928922 ODXBXNVNQYDFPI-UHFFFAOYSA-N 402.539 2.104 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCC1CCN(c2ccncc2)CC1 788939436 UFIBMYVHSPJGAG-UHFFFAOYSA-N 421.545 2.331 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCN(c3ccccc3)C2)c1 790227198 CXRHHMYZRCSGSW-OAHLLOKOSA-N 403.504 2.410 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H](C)CN3CCC[C@@H](C)C3)CC2)cc1 793901174 LJVAHAOFXJFIHV-MSOLQXFVSA-N 416.566 2.017 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2nc(-c3cccc(F)c3)no2)cc1F 803663603 UVTWYOTXSYEIHP-UHFFFAOYSA-N 415.400 2.013 10 20 HECD COCCN(CCOC)C1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 805145300 PUVJTKMANRIZGH-UHFFFAOYSA-N 416.566 2.332 10 20 HECD C[C@H](OC(=O)[C@](C)(O)C1CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 805581641 ZLYKKLGBZVEGJZ-DAOPMYJZSA-N 407.422 2.493 10 20 HECD C[C@@H]1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(=O)N1c1cnn(C)c1 806884109 QPDXNOVGCOCNJI-OTYXRUKQSA-N 412.277 2.426 10 20 HECD C[C@@H](NC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1ccc(N(C)C)cc1 807141069 PWTPQMFCFWAYFA-HZPDHXFCSA-N 408.568 2.317 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCC[C@@H]3CCO[C@H](C)C3)CC2)cc1 807973773 YWDKADVBDFMLST-QZTJIDSGSA-N 403.523 2.055 10 20 HECD COc1ccc(O)c([C@H](C)NC2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1 813331805 VGKCIJKPKRVKJA-LBPRGKRZSA-N 408.524 2.245 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3Cc4ccccc4CO3)CC2)cc1 813699141 QHPHULICRAFBJV-KHPPLWFESA-N 407.470 2.374 10 20 HECD COc1ccc(N2CCN(CCCNS(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc1 906481147 UBEWVYNNAKNGCE-KDURUIRLSA-N 424.611 2.020 10 20 HECD Cn1cnnc1Sc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1[N+](=O)[O-] 917355546 HONQRNJFTLSIGX-UHFFFAOYSA-N 415.431 2.258 10 20 HECD Cn1ncc2c1CCC[C@H]2NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 918211391 MOWZPVHEXFNHOE-GOSISDBHSA-N 401.486 2.397 10 20 HECD Cc1ccccc1CCNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918778065 WNZCBMKKMBUKAR-UHFFFAOYSA-N 401.532 2.272 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nc4ccccc4[nH]3)CC2)cc1 920253153 RVJHVMYDWZPLCI-KHPPLWFESA-N 405.458 2.415 10 20 HECD CC(C)CN1C(=O)/C(=C/Nc2cc(Cl)ccc2-n2cncn2)C(=O)NC1=S 920980016 RZBJMYCDOGZXHR-WUXMJOGZSA-N 404.883 2.116 10 20 HECD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCCCC1 1795432219 NJSUUVTYNURJOB-QDMKHBRRSA-N 409.577 2.065 10 20 HECD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)sc1C 1796601417 GBEZDWNZOMFOSO-BTTYYORXSA-N 402.476 2.132 10 20 HECD CC(C)c1csc(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)n1 1842148662 CAVSCWRDKBRTOW-UHFFFAOYSA-N 402.476 2.204 10 20 HECD Cc1cccc2cc(C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)[nH]c12 1844030444 FCBQYJYSLWVMGB-UHFFFAOYSA-N 406.442 2.413 10 20 HECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCNC(=O)c1cccs1 36784854 BYVJAKZBFWCKSJ-UHFFFAOYSA-N 403.504 2.136 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N(C)C[C@H]3CCCOC3)CC2)cc1 730905834 VAGLZQKMAONKCP-LJQANCHMSA-N 404.555 2.275 10 20 HECD COC(=O)c1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)c(F)cc1F 734703601 QJILUCSKLHEWRC-UHFFFAOYSA-N 405.401 2.381 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)cc1 735496491 XZBRCQUEPPTHEF-UHFFFAOYSA-N 403.504 2.193 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CCCS1 743316691 GMIJPTJVHGIJOF-SFHVURJKSA-N 401.511 2.454 10 20 HECD Cn1cc([C@@H](O)CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 745906367 ZOBLFBWFQGLWGH-YOEHRIQHSA-N 409.437 2.023 10 20 HECD O=S1(=O)CCN(c2ccc(CNS(=O)(=O)c3cc4ccccc4o3)cc2)CC1 754028535 VHIVODVDIIZUJE-UHFFFAOYSA-N 420.512 2.146 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 754133377 HXYUXCNEIOUPHV-DYESRHJHSA-N 414.506 2.437 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cnn(C)c3)cc2F)C[C@H](C)O1 754864933 CPMOVCRDZUFZBV-HOTGVXAUSA-N 417.529 2.314 10 20 HECD COC(=O)c1ccc(O)c([C@H](C)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1 756707715 NKURAZDTTCOJSO-NSHDSACASA-N 406.451 2.094 10 20 HECD C[C@H](NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1O 756711445 KOTBXYGUTLVRMG-JTQLQIEISA-N 401.391 2.208 10 20 HECD CCC[C@H]1CN(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)CCO1 759230394 AIHWUAXTSWIEGV-NRFANRHFSA-N 404.555 2.418 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)OC[C@@H]3CCCCO3)CC2)cc(OC)c1OC 759241562 SKNHBYXFRCOVRR-AEFFLSMTSA-N 422.522 2.335 10 20 HECD CN(C)c1ccc(CNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1 763492814 WTZLVHIQBVSVRD-UHFFFAOYSA-N 402.520 2.292 10 20 HECD CC1(C)C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C(=O)O1 765142427 LROZSNUHBKSROG-GFCCVEGCSA-N 410.473 2.078 10 20 HECD O=C(NCc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769165965 XNQBDSZIVULULI-UHFFFAOYSA-N 424.520 2.290 10 20 HECD CCOc1cc(C(=O)N(C)C)ccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769952998 IZMQFIHREMSRFB-UHFFFAOYSA-N 421.475 2.117 10 20 HECD COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 770230281 NCYVKQFMCNFRAJ-CQSZACIVSA-N 422.478 2.488 10 20 HECD CO[C@H](C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C)C(C)C 770637159 XWXDGQMYOHQOCZ-IBGZPJMESA-N 422.503 2.138 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1cccc(Cl)c1 774554424 VPSQEWVDERODRL-UHFFFAOYSA-N 401.894 2.451 10 20 HECD CCOC(=O)C[C@@](C)(NCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 775891545 LSFORUUPDSBTIU-JOCHJYFZSA-N 405.539 2.301 10 20 HECD CCOC(=O)N1CCC[C@@H](C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)C1 777828216 JWIIZGTZNGCCOK-CYBMUJFWSA-N 412.870 2.416 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@H]3CC(C)C)CC2)cc1 778277458 HPCGZSHCLOOJQW-ZTBDEIDFSA-N 415.534 2.174 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)C3CCC(OC)CC3)CC2)cc1 778280820 YAMTUSZNIYBVGR-SEYXRHQNSA-N 415.534 2.316 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)cc1 778458265 UTJOWPBZUUNAAY-VYENPZKTSA-N 415.534 2.362 10 20 HECD CS(=O)(=O)c1cc(Br)cc(C(=O)NCc2ccc(O)c(O)c2)c1F 778926667 XFQKNPZHCRMRDX-UHFFFAOYSA-N 418.240 2.333 10 20 HECD Cc1nc(O)nc(O)c1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 778963526 YEGCUSUIDWOCPV-UHFFFAOYSA-N 422.444 2.016 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CO)c3ccc(C(F)(F)F)cc3)nc12 782086369 AVZXQVKDVKIDPY-HNNXBMFYSA-N 424.379 2.454 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@H]1Cc1ccccc1 788324290 SBUPFQLMVBQTIS-QFIPXVFZSA-N 407.514 2.373 10 20 HECD CC(=O)Nc1cccc(NC(=S)NNc2ccccc2S(=O)(=O)N(C)C)c1 793326112 IZPQQFSEKRGLLW-UHFFFAOYSA-N 407.521 2.209 10 20 HECD COc1ccc(N2CCN(C(=O)CN[C@]3(CO)CCCc4ccccc43)CC2)cc1 799336681 OVOWXDISYRAKSX-DEOSSOPVSA-N 409.530 2.158 10 20 HECD CCN1CCN(c2cccc(NS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)c2)CC1 799644382 OBVQWVBCNQAGKO-UHFFFAOYSA-N 416.547 2.331 10 20 HECD COC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)c1ccc(C)o1 803309649 BTLPUKCNLUKOJE-QFBILLFUSA-N 415.490 2.106 10 20 HECD Cc1ccc(CS(=O)(=O)NC(=O)c2ccc(NC(=O)C3=S=CC=C3)cc2)cc1 809063533 SPYZZGKNZVWJFA-UHFFFAOYSA-N 414.508 2.471 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNS(=O)(=O)c1cccnc1 809974784 KQWHAQBTSJCVEG-UHFFFAOYSA-N 402.520 2.009 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](O)C34CCCC4)cc2F)C[C@@H](C)O1 814665831 SOMFWUQZVPFCNW-CBGDNZLLSA-N 419.541 2.435 10 20 HECD NC(=O)C1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 914070261 ZDIKGVAARSHOCX-KAMYIIQDSA-N 423.585 2.453 10 20 HECD C[C@H]1CN(CCCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 916249796 KYASQACWLRTOLV-OALUTQOASA-N 404.555 2.164 10 20 HECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O 917356092 NSJMCIHWQMNKTG-UHFFFAOYSA-N 423.446 2.448 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 1321703265 WGJXVCKEBXLZIP-AHMITGRASA-N 417.380 2.044 10 20 HECD CN1CCN(c2ccc(CNCCS(=O)(=O)CCc3ccccc3)cc2F)CC1 1322639425 AOULYGBNLRQGJN-UHFFFAOYSA-N 419.566 2.325 10 20 HECD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)CC1 1832898646 UISDQSKEKKKWAK-OAHLLOKOSA-N 423.604 2.267 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cccc3nscc23)C1 1845667262 NJARWGAYEVRNBL-UHFFFAOYSA-N 410.455 2.233 10 20 HECD COc1ccc(CCNC(=O)C(=O)NCc2c(C)c3ccccc3n2C)cc1OC 559351733 CCPDWJLKMXMYTJ-UHFFFAOYSA-N 409.486 2.479 10 20 HECD CN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 726722955 ZEVRQIVPCQYLKS-OAHLLOKOSA-N 417.478 2.085 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CSC[C@@H]3CCCCO3)cc2)C1 727308619 QBUWRDASRSPELI-HKUYNNGSSA-N 405.564 2.307 10 20 HECD Cc1cccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)N[C@H]3CCS(=O)(=O)C3)c2C)c1 728985446 WLZUKXCEPBEPQR-SJORKVTESA-N 418.515 2.251 10 20 HECD COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3cnnc3[S@](C)=O)c2C)cc1 729242162 QSKFNTWTSYDARL-NDEPHWFRSA-N 400.460 2.093 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1 734669241 OIZOYBFBLOZMNY-UHFFFAOYSA-N 405.520 2.343 10 20 HECD COc1ccc(N2CCN(C(=O)CN3CCCN(C4CCCC4)CC3)CC2)cc1 738335034 LWEHLPKYTWRFLF-UHFFFAOYSA-N 400.567 2.294 10 20 HECD C[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)N1[C@H](C)CC[C@H]1C 741015520 BZBGFQKWRSYXPT-ZACQAIPSSA-N 421.513 2.083 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 742927318 ODGXVJXPBHCTRL-UHFFFAOYSA-N 408.502 2.132 10 20 HECD CC(C)(C)C(=O)Cn1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1 748040649 NAOGVMBFUQUWNF-INIZCTEOSA-N 400.479 2.420 10 20 HECD Cc1ccc(OCC(=O)N2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 748819499 JPEMUOOQLCEWDF-UHFFFAOYSA-N 410.518 2.494 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](O)COCC3CC3)cc2F)C[C@@H](C)O1 749009295 KFTYTZKGXMYQHM-RVKKMQEKSA-N 409.502 2.026 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3COC4=O)CC2)cc1 752862574 DXIBIUZJIIIKDH-MDZDMXLPSA-N 421.453 2.209 10 20 HECD COC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)c(F)c3)CC2)cc1 753857135 LMMVZODEQQOGQI-SFHVURJKSA-N 418.465 2.183 10 20 HECD COc1cc(N2CCN(C(=O)N[C@H]3C[C@H](OC)C3(C)C)CC2)cc(OC)c1OC 759281222 PLKMNQMIHIPULS-ROUUACIJSA-N 407.511 2.358 10 20 HECD Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NCc1ccc(O)c(O)c1 768915115 ZAQWEOTXCRWKIF-UHFFFAOYSA-N 400.460 2.170 10 20 HECD COc1ccc(-n2cnnc2SCC(=O)NCc2cc(OC)ccc2O)cc1 769543138 OBDNKGADXQZLGA-UHFFFAOYSA-N 400.460 2.399 10 20 HECD CN(C)CCN(CCc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769706410 RTPLHZYQNHGHOM-UHFFFAOYSA-N 405.520 2.010 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC[C@H](CO)C3)cc2Cl)C1 774241119 CXVGQIMSYNLZCJ-WBVHZDCISA-N 407.942 2.423 10 20 HECD Cc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1F 776038647 KEYPZWNYLBCAPR-MRXNPFEDSA-N 412.465 2.091 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc4oc(O)nc4c3)CC2)cc1 778238870 QQJWZHDDLLQLCO-HJWRWDBZSA-N 422.441 2.386 10 20 HECD CC[C@@H]1C[C@H](CC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)CCO1 781762627 DOSIUZVRJOSZOF-IEBWSBKVSA-N 404.507 2.482 10 20 HECD CC(C)NC(=O)c1cnn2c1C[C@H](CNCc1ccc(N3CCN(C)CC3)cc1)CC2 785563165 LGQXZZYQKWSKNY-HXUWFJFHSA-N 424.593 2.125 10 20 HECD CCOc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 788312289 GPZNPJKIQMYKPL-UHFFFAOYSA-N 411.502 2.197 10 20 HECD Cc1ccc(CN(CCN(C)C)C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)o1 788909962 IWWOMLOGCHAFPN-UHFFFAOYSA-N 412.534 2.395 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O 792180559 ZMVNUKHDLISULQ-LJQANCHMSA-N 411.424 2.309 10 20 HECD COc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(Cl)cc1C(N)=O 793032766 ILCFRUIPGYUORB-NSHDSACASA-N 418.881 2.329 10 20 HECD O=C(C[C@H]1CCCOC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 793155963 COTZIPHOHNUQEO-GOSISDBHSA-N 413.497 2.375 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc([N+](=O)[O-])c(F)cc1N 801937249 IIVFHJXSRITXBX-UHFFFAOYSA-N 411.773 2.491 10 20 HECD O=C(NC1CCN(CC(F)F)CC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803650279 CGZJBUZBUVURSC-UHFFFAOYSA-N 421.444 2.360 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](c1nnc2ccccn12)C(C)C 804101516 PQGLXLAGPZQRDQ-LJQANCHMSA-N 408.506 2.233 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)NOCc3ccccc3OC)CC2)cc1 804318825 CZIDAJZDPVRCEG-UHFFFAOYSA-N 413.474 2.037 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCCN(C2CCC2)C1 807289811 JSRUFSXNSLAFCX-QUCCMNQESA-N 410.562 2.448 10 20 HECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1 807695493 USHZTMUFWHIXJW-FQEVSTJZSA-N 421.545 2.425 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCC1(COC)CCC1 809520844 QMKOXPWEJNUSGQ-UHFFFAOYSA-N 413.312 2.436 10 20 HECD CN1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)N[C@@H]3CCOC3)cc2)CC1 809710478 XFAMYHYALTXQIB-IFMALSPDSA-N 416.566 2.308 10 20 HECD Cc1cc(C(=O)N2CCC(O)(C(N)=O)CC2)c(C)n1-c1ccccc1Br 819692111 GNZFJXLFSCYGPY-UHFFFAOYSA-N 420.307 2.309 10 20 HECD Cc1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c(F)cc1[N+](=O)[O-] 820787322 PSNRWSIEKNNXBJ-UHFFFAOYSA-N 409.439 2.357 10 20 HECD CN(CCOc1ccc(F)cc1)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 916971021 YHCRWYGUHWLKSX-UHFFFAOYSA-N 419.472 2.428 10 20 HECD CCn1cc([C@H]2C[S@@](=O)CCN2Cc2ccc(N3CCN(C)CC3)c(F)c2)cn1 1343627830 VOQKNXFFBZNFOG-PBBNMVCDSA-N 419.570 2.100 10 20 HECD O=C(c1cocn1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426700 AEDLNTSRDMEHEV-MRXNPFEDSA-N 400.435 2.028 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)COc2cccc(Cl)c2)C1 1841204004 OMXDVLJLAHFSBP-UHFFFAOYSA-N 417.849 2.042 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)NC=O)C2)cc1 1845180018 CWFMXGPURCYQOV-GOSISDBHSA-N 408.502 2.046 10 20 HECD C[C@@H](OC(=O)c1cnn(C)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 12851332 KSLXUBLXQVYPBU-GFCCVEGCSA-N 403.394 2.380 10 20 HECD COc1ccc(N2CCN(CCNS(=O)(=O)c3cc(F)cc(F)c3)CC2)cc1 49512239 UUSYYAQHGPHXGQ-UHFFFAOYSA-N 411.474 2.074 10 20 HECD COc1ccc(N(CC(=O)NCc2ccc(OCC(N)=O)cc2)C(C)C)cc1F 725816139 JFXDPTVICKKNJL-UHFFFAOYSA-N 403.454 2.230 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)cc1F 726292905 MXXXPHSBMMISCN-UHFFFAOYSA-N 400.332 2.266 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1 729053567 NHEOJFFBKSTJQQ-XUSGNXJCSA-N 412.446 2.016 10 20 HECD CCN1CCN(c2ccc(CNC(=O)c3ccnc(-n4ccnc4)c3)cc2F)CC1 730235026 JSEPEZXZLKVAIX-UHFFFAOYSA-N 408.481 2.478 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(CCO)CC3)cc2F)C[C@@H](C)O1 730261220 VQCWANIPWUSPHL-IAGOWNOFSA-N 407.530 2.150 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](N3CCCCC3)C2)c1 730806284 GMMCAQIPHOCPNV-JOCHJYFZSA-N 401.551 2.487 10 20 HECD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)[C@H]4CCCO4)CC3)cc2)CC1 731120728 AQTFJYLLYRVJGS-OAQYLSRUSA-N 414.550 2.456 10 20 HECD CC[C@@H]1CCCCN1CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 733351469 FXIXQBUYCSXTLA-VQTJNVASSA-N 415.582 2.452 10 20 HECD CS[C@@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 740469513 RBHDLQJEGGYUBA-WBMJQRKESA-N 421.485 2.454 10 20 HECD CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 742953188 YNPRWAPXKIJWNU-UHFFFAOYSA-N 409.895 2.353 10 20 HECD COCCN1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745906119 WTSKNMDAYAGZLV-MRXNPFEDSA-N 412.481 2.230 10 20 HECD Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCCCSc1nccs1 749730401 ORUULBDMPDTICW-UHFFFAOYSA-N 406.533 2.390 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1cccc(C(=O)NC2CC2)c1 749731450 PPXOHAOSCOAUQI-UHFFFAOYSA-N 404.517 2.272 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1 751282580 DWWBCRZFWLRPFG-UHFFFAOYSA-N 413.499 2.185 10 20 HECD COc1cc(N2CCN(C(=O)NCCCn3ccnc3C)CC2)cc(OC)c1OC 759222721 VINZHGZDRMKXPL-UHFFFAOYSA-N 417.510 2.139 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O 773745048 ISVNRRUBPYDUCQ-YEJXKQKISA-N 403.479 2.036 10 20 HECD CCNC(=O)COc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773857655 MVJBTDPLLUYCFP-HNNXBMFYSA-N 412.490 2.083 10 20 HECD COc1cc(OC)cc(C(=O)N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1 779499412 MICXRMPVVZWURR-XQRVVYSFSA-N 412.442 2.113 10 20 HECD COc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1S(=O)(=O)NC1CC1 779521680 UGLQRQZRHOQEEY-YCRREMRBSA-N 404.444 2.199 10 20 HECD CCO[C@@H]1C[C@@](CO)(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1(C)C 780337598 DXTCTDKGCFBASX-PERKRYKHSA-N 405.539 2.450 10 20 HECD CC(=O)N1CCN(c2cccc(NC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)N4C)c2)CC1 781045597 LSOHSVLPCOCUIF-OAHLLOKOSA-N 421.501 2.384 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)cc3)cc2)CC1 786657568 ZVLSDTAJSCORJQ-UHFFFAOYSA-N 422.529 2.122 10 20 HECD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cnn(Cc2ccccc2)c1 788821775 ZIXSHNBUXYOTSF-UHFFFAOYSA-N 417.513 2.464 10 20 HECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CC(c2cccnc2)=NO1 790848759 NMPFMXCLSWSDJL-KRWDZBQOSA-N 403.822 2.135 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](Cc1ccccc1)CN(C)C 793723944 OPUMWJUBJKUQOK-OAQYLSRUSA-N 410.562 2.390 10 20 HECD O=C(NCCCSc1nccs1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1 796909460 IEWMBOLWXFCEQA-UHFFFAOYSA-N 424.479 2.476 10 20 HECD CO[C@@H]1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)[C@@H](C(=O)O)C1 797709672 GIUCZZBNFQEYHP-QRCPMIHRSA-N 423.485 2.213 10 20 HECD O=C(NCCOC1CCC1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 803451149 ZUCQLYAYRMEJNQ-UHFFFAOYSA-N 411.449 2.058 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCCCCC(=O)OC(C)(C)C)ccc21 803687689 OUPJJJXATIUHNZ-UHFFFAOYSA-N 403.523 2.313 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cccc(-n2cncn2)c1 805748939 UAMDSGCYHRKRBW-UHFFFAOYSA-N 407.474 2.418 10 20 HECD C[C@@]1(CNC(=O)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCCO1 805758487 MKTPXGPDYSZRTN-XOBRGWDASA-N 411.449 2.058 10 20 HECD Cc1cc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)sn1 806841975 CKLXBPAFPLLZRL-CHWSQXEVSA-N 406.483 2.459 10 20 HECD O=[N+]([O-])c1cc(Cl)cc(CN2CCC[C@H](CNS(=O)(=O)C3CC3)C2)c1O 809784523 LDVSFXIFWXBIRL-LLVKDONJSA-N 403.888 2.248 10 20 HECD C[C@](O)(C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CCC1 812676171 KGPRWUQQXBMGQJ-HSZRJFAPSA-N 407.422 2.495 10 20 HECD CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 918245807 GMHGMFXGLNWBMW-UHFFFAOYSA-N 402.882 2.363 10 20 HECD CN(C)c1ccc(CN(C(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)C2CC2)cc1 918456613 MVNIPKXJWIEZJM-UHFFFAOYSA-N 404.474 2.463 10 20 HECD CC(C)(Oc1ccccc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1118721357 QZANSSNQBPVWJW-UHFFFAOYSA-N 402.516 2.395 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nc(S)oc2c1 1321048156 DKUJNQJMBPUGIO-ZDUSSCGKSA-N 402.428 2.432 10 20 HECD COCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291225 VRMSECUABKMJKV-CYBMUJFWSA-N 408.842 2.427 10 20 HECD COc1cc(Br)cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c1O 2834387 VQJSYFMXNHPXHS-OQFOIZHKSA-N 404.263 2.449 10 20 HECD Cc1nnc(S[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1N 5993189 GPJYGWMPIAHYKX-SNVBAGLBSA-N 407.455 2.195 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(C)c3)CC2)cc1 12069497 GVUWDGPVPPAFSL-UHFFFAOYSA-N 410.518 2.271 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C[C@H]2CCCN2CC)C1 729628353 SCHLFMQYRXZFRP-TZIWHRDSSA-N 400.567 2.434 10 20 HECD CCOC(=O)CN(C)C(=O)CSc1ncc(-c2ccc3c(c2)OCCO3)n1CC 731836377 BQFNBPRSJMSWDJ-UHFFFAOYSA-N 419.503 2.455 10 20 HECD CC[C@@H](C)[C@](C)(O)CNC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 732883328 RBFXZDXLMNRIIP-XMSQKQJNSA-N 406.571 2.304 10 20 HECD C[C@H](CN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1)NC(=O)/C=C/c1cnn(C)c1 733955238 CVMIUZJANSBYLK-ZLMUKFPWSA-N 418.501 2.418 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](C)CN3CCOCC3)cc2F)C[C@@H](C)O1 738978682 WMQVPVSHALNABM-KURKYZTESA-N 422.545 2.207 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cnn(-c4ccccn4)c3)cc2)C1 743186090 NKAJMWQEFLNEIR-QGZVFWFLSA-N 419.489 2.291 10 20 HECD Cn1cnc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc21 743887499 CUOPMNALMVQZQH-QGZVFWFLSA-N 408.458 2.425 10 20 HECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccc(OCc3ncnn3C)cc2)cc1 746613037 VCSOCPBKZFVFGV-UHFFFAOYSA-N 415.519 2.281 10 20 HECD COC[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccco1 746757928 SBSJNASVUMTONO-FUHWJXTLSA-N 400.479 2.168 10 20 HECD COC(=O)c1csc(S(=O)(=O)N2CCN(Cc3cc(C)cc(C)c3O)CC2)c1 748297319 MXUKAIOOYXBVDT-UHFFFAOYSA-N 424.544 2.364 10 20 HECD C[C@]1(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCC[C@H]1O 748619682 UNDUDAWBTWOZGY-SFGWALBWSA-N 402.539 2.129 10 20 HECD CCc1nn(C)c(CC)c1S(=O)(=O)N1CCCN(c2ccc(OC)cc2)CC1 753998619 IZSQDBKHGADOKK-UHFFFAOYSA-N 406.552 2.455 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(C)cc3OC)CC2)cc1F 754211066 DIGHVQITILRNMA-UHFFFAOYSA-N 401.438 2.439 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3Cc4ccccc4OC[C@@H]3C)CC2)cc1 754272282 SDDASZFUAHQKKU-SIKLNZKXSA-N 411.546 2.461 10 20 HECD COCC(=O)N(C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 758785499 KMZMCMKTZAPGRP-UHFFFAOYSA-N 404.438 2.372 10 20 HECD COC(=O)C1=C(C)O[C@@H](CN2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1 759885364 CSDFBDJFQZMLME-MRXNPFEDSA-N 406.479 2.070 10 20 HECD CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 767296813 BORARCRVZLFTOI-KRWDZBQOSA-N 424.501 2.198 10 20 HECD CCc1nn(C)c(Cl)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 767300347 WJBRYVHXXRVEPB-CQSZACIVSA-N 403.914 2.268 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)CONC(=O)C3CCCC3)cc2F)C[C@@H](C)O1 768517365 PQCFJOMTUNADFY-HUUCEWRRSA-N 407.486 2.294 10 20 HECD CCN1CCN(c2cccc(NC(=O)c3ccc(OC)c(-n4cnnn4)c3)c2)CC1 770145862 ARNLJTUAZULQLW-UHFFFAOYSA-N 407.478 2.065 10 20 HECD COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 772484555 HFSXVYGWFSSPNK-LZQZEXGQSA-N 410.536 2.235 10 20 HECD CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc(N(C)C)cc2)c1 772960222 OPMBYMTUERGLJL-GJZGRUSLSA-N 404.536 2.339 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 773740269 JHBSMEYKMHLYRJ-CQSZACIVSA-N 418.515 2.219 10 20 HECD Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(=O)n(-c2ccccc2)n1C 773847725 SMYQILYSGHSAJY-OAHLLOKOSA-N 421.501 2.366 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC(n3cnc(C(N)=O)c3N)CC2)cc1 774275620 XAJAIWVHUIYGSO-UHFFFAOYSA-N 406.490 2.449 10 20 HECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 776078618 ZXQNHFYYEISNCL-RXVVDRJESA-N 423.579 2.409 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COC(C)(C)C)cc2F)C[C@@H](C)O1 778153963 WQBARTSYMLMOFL-GASCZTMLSA-N 410.486 2.414 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)Cc3c(C)noc3C)CC2)cc1 778230689 BXUDKXQKBYYDRV-KTKRTIGZSA-N 412.490 2.163 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3ccc(O)c(F)c3)CC2)cc1 778390322 NYXVORPBZSUJCC-CMDGGOBGSA-N 413.449 2.061 10 20 HECD O=C(CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)NCC(F)(F)F 779662612 XZIXHZSORGYBEF-UHFFFAOYSA-N 409.355 2.442 10 20 HECD CC[C@H](C)NC(=O)COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 785412666 KQKLOXKSJXZDDY-NSHDSACASA-N 412.489 2.326 10 20 HECD C[C@@H](c1ccncc1)N1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785424196 MMPVZIFABKTQSC-KRWDZBQOSA-N 409.534 2.106 10 20 HECD Cc1cc(C(=O)COC(=O)[C@@H]2NC(=O)O[C@@H]2C)c(C)n1-c1ccc2c(c1)OCCO2 786069275 MTGUPXOFGFDDJW-BFUOFWGJSA-N 414.414 2.088 10 20 HECD CN(C)CCOCCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 788015494 BNJJMCIBOAHLFN-HNNXBMFYSA-N 400.470 2.134 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cn(C)c3c(cnn3C)c2=O)cc1 791338940 CPSAOWDIJBXDQV-GOSISDBHSA-N 423.517 2.159 10 20 HECD C[C@@H]1c2nncn2CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 792379443 HIVJNPBVEFDCRU-CYBMUJFWSA-N 401.426 2.069 10 20 HECD C[C@@H]1CN(c2ccc(CNS(=O)(=O)C[C@@H]3CCCOC3)cc2F)C[C@@H](C)O1 792749221 QLHVRQMUAFUZTB-BFYDXBDKSA-N 400.516 2.285 10 20 HECD Cc1ccc([C@@H](CNC(=O)C(=O)NCCCSc2nccs2)N(C)C)cc1 793723407 WQOZUYFWOVCRRF-MRXNPFEDSA-N 406.577 2.469 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccc(OC)cc1OC 793862629 GAWWJGCNWLQVAC-UHFFFAOYSA-N 413.518 2.477 10 20 HECD COc1cccc(CNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)c1O 798334412 XNVLNAASYWMXAC-UHFFFAOYSA-N 416.455 2.402 10 20 HECD C[C@H](NC(=O)C(=O)NCC[C@H]1CCO[C@H](C)C1)c1ccc(N2CCOCC2)cc1 803298820 XAKAMGHWSKQTEI-SQNIBIBYSA-N 403.523 2.022 10 20 HECD C[C@H](NC(=O)C(=O)N1CCSC(C)(C)CC1)c1ccc(N2CCOCC2)cc1 803307828 NQFIATTYOSKHNU-INIZCTEOSA-N 405.564 2.445 10 20 HECD O=C(NCc1ccc(F)cn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 806722921 VCOJEMCIWNXVMQ-OAHLLOKOSA-N 422.407 2.224 10 20 HECD Cc1ncc(CCNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 807932232 UPNVQPRXNVNIDN-INIZCTEOSA-N 403.504 2.024 10 20 HECD O=C(COC(=O)CCc1ncccn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 812607396 OHJVSNBDVPSELX-UHFFFAOYSA-N 415.405 2.367 10 20 HECD Cc1cc(CN2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)ccc1N(C)C 815010851 QAUQYUSVPRJPIK-UHFFFAOYSA-N 418.519 2.476 10 20 HECD CN(C)c1ccc(CNC(=O)Cn2nnc(-c3ccc(Br)o3)n2)cc1 914687063 FBMOLWKNNGNPAI-UHFFFAOYSA-N 405.256 2.078 10 20 HECD COc1ccc(C)cc1S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917930833 WBMOLWZPZJDZCG-KRWDZBQOSA-N 417.531 2.184 10 20 HECD CN(C)[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccco1 918118533 TYPQUGJHJAPRTO-MJGOQNOKSA-N 413.522 2.083 10 20 HECD COc1cccc(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918340498 PZEBPNRYWMTJTD-UHFFFAOYSA-N 402.516 2.179 10 20 HECD COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(Br)cc(Br)c1O 1319827778 WAAJTVXRQXMIQK-KOLCDFICSA-N 409.074 2.025 10 20 HECD COC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824604364 QHYJXQNGYISJOM-YOEHRIQHSA-N 405.495 2.009 10 20 HECD Cc1oc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1S(=O)(=O)N1CCCC1 437009419 HVVMNNMZDSEZRA-UHFFFAOYSA-N 419.503 2.478 10 20 HECD COCCO[C@H]1COCC[C@H]1NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 485543413 JLCYCSLAWHRTPP-CTNGQTDRSA-N 404.507 2.455 10 20 HECD Cc1nc(C2(NCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)CCCC2)no1 725800879 RTSXRFMIRCHLCB-UHFFFAOYSA-N 417.485 2.029 10 20 HECD CN(C)c1ccc(CNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1F 728294496 DJJNIZDTBFEQSM-UHFFFAOYSA-N 411.411 2.050 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1 728943063 FLXNYSJAZUMXOH-CYBMUJFWSA-N 404.467 2.016 10 20 HECD CN(CC(=O)NCCOc1ccc(F)cc1)Cc1ccc(N2CCOCC2)cc1 738298997 LJDJOIMMZUOIHY-UHFFFAOYSA-N 401.482 2.289 10 20 HECD COc1ccc(N2CCN(CCNC(=O)NC[C@H](O)c3ccc(C)cc3)CC2)cc1 742939972 NQSZZMDQGPSHHF-QFIPXVFZSA-N 412.534 2.158 10 20 HECD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 747901926 DRBQKABGPXQVBP-ZDUSSCGKSA-N 422.388 2.143 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3cccn3Cc3ccncc3)CC2)cc1 751386132 QWSASELBRBUABY-UHFFFAOYSA-N 419.529 2.492 10 20 HECD C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(Br)cc1O 756562699 IJKKRRAXBDTGTB-GFCCVEGCSA-N 405.358 2.314 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N(C)C[C@@H]1COc2ccccc2O1 759594734 IDWKAINFTHOHDW-YBZQBRCDSA-N 413.426 2.341 10 20 HECD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F 774374986 HIOOSYCVXRQOHT-UHFFFAOYSA-N 402.394 2.348 10 20 HECD CN(C)C1(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCCCC1 774814475 JHOSLAOCGPMINI-IBGZPJMESA-N 417.550 2.281 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1O 774876555 AQIQUVIGKLFCAB-DOTOQJQBSA-N 420.510 2.122 10 20 HECD C[C@H](NC[C@@H](O)Cn1c(-c2ccccc2)noc1=O)c1ccc(N2CCOCC2)cc1 775262185 ZHCWVGDHNRJJMB-LAUBAEHRSA-N 424.501 2.052 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3nc(C4CC4)no3)C(C)C)nc12 776018359 GNMNFNFVJYPKCG-OAHLLOKOSA-N 400.439 2.359 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4c[nH]nc4c3)CC2)cc1 778225504 IIQVKDSMVDYWNF-CMDGGOBGSA-N 405.458 2.415 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@@H]3CCCC[C@@H]3O)CC2)cc1 779338450 UUWMDAXXYGQXES-RXVVDRJESA-N 404.555 2.010 10 20 HECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 779496113 JYOFUZSGDCZDKE-DJWKRKHSSA-N 403.416 2.065 10 20 HECD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](OCC4CC4)C3)cc2)C1 779536200 KRZFPZHFNMVTCQ-TZIWHRDSSA-N 414.550 2.489 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](Oc4cccc(F)c4)C3)nc12 784483694 KLBXAJFMLURSOM-MRXNPFEDSA-N 400.410 2.404 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@@H]1CCN2CCCC[C@H]12 790278166 KEYCMEIJDPCDOR-HZPDHXFCSA-N 424.339 2.246 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@@H](C)OC3(CCOCC3)C2)c1 790407296 ZSUSXCMJQJTXSV-QGZVFWFLSA-N 418.534 2.197 10 20 HECD CN1CCC2(CCCN(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)C2)CC1 799178440 VFFOXJTWSBJHLW-UHFFFAOYSA-N 418.557 2.086 10 20 HECD O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCOC[C@]13CCOC3)c2[N+](=O)[O-] 799428701 BHDXCBJELYRPQW-JOCHJYFZSA-N 422.393 2.002 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 803644099 HGDJBWVMZFKGPO-NRFANRHFSA-N 422.573 2.358 10 20 HECD Cc1cnccc1OC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 803664256 IIWBMMWRIDVDPY-UHFFFAOYSA-N 414.481 2.281 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 804278257 RXVRVQJZPYQJJU-KRWDZBQOSA-N 418.588 2.380 10 20 HECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804315064 DOOMDYZQDGYTAF-UXHICEINSA-N 417.550 2.490 10 20 HECD CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCC[C@@H](C(=O)N(C)C)C1 806178564 HRKLYCFBIBGTHM-AEFFLSMTSA-N 403.523 2.284 10 20 HECD CC1(C)C[C@@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C(C)(C)O1 806952096 VJKAHURNBCFJQF-SJLPKXTDSA-N 404.507 2.362 10 20 HECD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(Cc2ccsc2)CC1 807287253 ICBCHMBTAISQJY-UHFFFAOYSA-N 410.543 2.085 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCN(C(=O)N2CCCC2)CC1 917708694 NQXZCRSFWNLFEH-UHFFFAOYSA-N 418.513 2.206 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)C3(NC(C)=O)CCCCC3)CC2)cc1 918482193 VWELTRRHMPKGLV-UHFFFAOYSA-N 416.566 2.163 10 20 HECD COc1ccc(N(C)CC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)cc1OC 920418275 GOUXZDRLGJKMLH-GOSISDBHSA-N 424.563 2.488 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1 920901791 ZIPHASLTQXACSU-UHFFFAOYSA-N 413.430 2.417 10 20 HECD CNC(=O)c1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 1323920600 DBELVRISQIUGNU-OKILXGFUSA-N 400.454 2.124 10 20 HECD CCc1oncc1C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)c3)CC2)C1 1808761807 CAGFGLRZDYWMQG-UHFFFAOYSA-N 414.462 2.202 10 20 HECD CC(C)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827425980 FUYJVUQICOIDMO-GOSISDBHSA-N 418.538 2.114 10 20 HECD Cc1n[nH]c(C)c1C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1844415620 ZVBLVLDVJXRKGJ-UHFFFAOYSA-N 404.854 2.222 10 20 HECD CSCC(C)(C)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847035403 YFNCCCZMVBBJKB-SOFGYWHQSA-N 420.531 2.409 10 20 HECD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(Cl)c2)cc1C(=O)O 728015819 WQUVACGIIAQORE-UHFFFAOYSA-N 404.853 2.211 10 20 HECD CCN(CC)c1ccc(CN(C)C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)cc1 729507371 SGSTWHAEAKVEEH-LJQANCHMSA-N 403.571 2.262 10 20 HECD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)cc2F)CC1 730193706 RTXUNQMHOQSRIH-LJQANCHMSA-N 416.541 2.232 10 20 HECD C[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N1CCc2ccccc2C1 732274057 BTDZJZNQGGFDHD-AVRDEDQJSA-N 420.557 2.451 10 20 HECD Cc1ccc([C@@H]2COCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)o1 735078381 KLEHWRCZUONIFT-FQEVSTJZSA-N 417.481 2.253 10 20 HECD CN1CCC(O)(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 741084194 JNNPDLMUUAQYFN-UHFFFAOYSA-N 412.481 2.013 10 20 HECD CN(CCCC(=O)NCc1ccc(N(C)C)cc1)C1=NS(=O)(=O)c2ccccc21 741887311 BXTKLVAEOKIGCE-UHFFFAOYSA-N 414.531 2.230 10 20 HECD O=C1C[C@@H](Cc2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)C(=O)N1 743339797 YQPFCDZSJATIKS-WOJBJXKFSA-N 422.481 2.419 10 20 HECD O=C(NC[C@@H](O)C1CCOCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904074 LCCSHVZQDMYQDB-CRAIPNDOSA-N 413.465 2.344 10 20 HECD Cc1ccc(Cn2nccc2NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)o1 746419876 NVVAMWGGCLQLSL-UHFFFAOYSA-N 405.458 2.464 10 20 HECD CN(C)c1ccc(CNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)cc1F 746864690 TUXOIJMOPVMUNX-UHFFFAOYSA-N 411.437 2.047 10 20 HECD COC(=O)c1csc(S(=O)(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 749254275 CQOXFNVJEUIOQL-UHFFFAOYSA-N 410.517 2.192 10 20 HECD COc1ccc(N2CCN(C(=O)CNc3ccc(C)c(C(=O)N(C)C)c3)CC2)cc1 751273388 QKNZBJBATJTPRN-UHFFFAOYSA-N 410.518 2.466 10 20 HECD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)c3ccc(C)c(O)c3O)CC2)cc1 751534322 XVBCZQIADNKPOO-UHFFFAOYSA-N 404.488 2.298 10 20 HECD CC[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](CC)CN1C(C)=O 752901582 CLDYHAXSBNTFTL-WOJBJXKFSA-N 402.539 2.454 10 20 HECD COC(=O)c1cc(S(=O)(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(C)o1 754803650 STPBRYVMNJPCOX-UHFFFAOYSA-N 408.476 2.331 10 20 HECD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cnc(C3CCC3)s2)SC1=S 760215519 JVUWCYQILSLCCQ-YRNVUSSQSA-N 403.576 2.161 10 20 HECD CN(C)c1ccc(CNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1 760798481 GNVJITIZRUOCMZ-GOSISDBHSA-N 418.538 2.275 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)N3CCOC[C@@H]3C3CC3)CC2)cc1 760821761 VTFIRRWIOYMTKU-OAQYLSRUSA-N 402.539 2.028 10 20 HECD CS(=O)(=O)Nc1cccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 760981871 QXZAIDPUCHPZIS-UHFFFAOYSA-N 423.878 2.382 10 20 HECD COc1ccc(NC(=O)C(=O)NCc2cccc(Br)c2O)c(OC)c1 765903179 HDGAHXMZQKGTNX-UHFFFAOYSA-N 409.236 2.427 10 20 HECD COc1cc(CN2CCN(S(=O)(=O)N(C)C3CCCCC3)CC2)c(O)cc1C 768440108 DCYVNQFXJVRMLG-UHFFFAOYSA-N 411.568 2.336 10 20 HECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)c1ccc(NS(C)(=O)=O)cc1 772774103 GSYCHYLYSIURTB-YCGNWBHESA-N 405.428 2.297 10 20 HECD COc1ccc([C@H](OC)[C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 772881056 JANGBIRMNOJGCQ-KZULUSFZSA-N 408.476 2.278 10 20 HECD Cc1cn2cc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)ccc2n1 774124249 MSUIXYNIMPQJMW-UHFFFAOYSA-N 407.474 2.076 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCCO[C@@H]3CC(C)C)CC2)cc1 775870482 MOFRANTYFDODBW-AKIFATBCSA-N 405.583 2.361 10 20 HECD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H]3C[C@](C)(OC)C3(C)C)CC2)cc1 779223050 ZQOAECXPKBGTGP-LSWJPFSZSA-N 405.583 2.314 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCc1c(F)cccc1Cl 786911937 HQMIBOPNRUNFKG-UHFFFAOYSA-N 423.847 2.387 10 20 HECD COc1ccc(N2CCCN(C(=O)C(=O)NCCO[C@H]3CCCC[C@@H]3C)CC2)cc1 787991260 UOAYXYFKIXMPEG-RXVVDRJESA-N 417.550 2.445 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(O[C@@H]4CCOC4)cc3)cc2)C1 788741447 GYBTYFZHNMAVDS-SIKLNZKXSA-N 423.513 2.486 10 20 HECD COc1ccc(C)cc1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 789374086 LDZYDTAPPMDZQU-QGZVFWFLSA-N 411.502 2.334 10 20 HECD C[C@@H]1OCC[C@@]12CN(CC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)CCO2 791584504 HKSRRPMVOWIWQQ-IZHWHUGBSA-N 420.465 2.280 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCc2cc(F)ccc21 802550014 HDXHSITUZCHDEQ-UHFFFAOYSA-N 401.413 2.007 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1F 804853469 QFFGFPDSKCRXEV-MLGOLLRUSA-N 419.419 2.466 10 20 HECD CCN1CCN(c2ccc(CNC(=O)C(=O)NC[C@H]3CCC[C@@H]3C)cc2F)CC1 805007958 WGFMASUNEYLZRS-FUHWJXTLSA-N 404.530 2.136 10 20 HECD CCCN1CCCN(C(=O)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1=O 805025440 PLSLYSYBYHVADK-UHFFFAOYSA-N 414.550 2.010 10 20 HECD CC1CCC2(CC1)OC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)O2 806706274 IBRVWEANAUFSHB-FLCYSFGSSA-N 403.523 2.368 10 20 HECD CC[C@H]1C[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808852470 UQQLFBOIWXUQDX-RXVVDRJESA-N 412.578 2.482 10 20 HECD COC(=O)[C@@H]1[C@H]2CN(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C[C@H]21 813622264 NDLNXHSRWNHICJ-FVQHAEBGSA-N 409.433 2.317 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1nnc(C(C)(C)C)s1 918311541 SYUJJRJOBRNKLL-UHFFFAOYSA-N 417.535 2.269 10 20 HECD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1 918444307 OXOIMMLEHAROQN-UHFFFAOYSA-N 418.453 2.314 10 20 HECD COc1ccc(CN[C@@H]2CC[C@H](CNC(=O)[C@@H]3OC[C@@H]4COCC[C@@H]43)C2)cc1C 1086765779 GPNQYNSKOVOTNF-SXFAUFNYSA-N 402.535 2.430 10 20 HECD O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1806837926 QMVOUDILPMRDDD-SJCJKPOMSA-N 424.379 2.160 10 20 HECD CC1(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CCC1 1807992202 MAXNAGNLFOZPPR-BEFAXECRSA-N 410.474 2.398 10 20 HECD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1cc(O)nc(O)c1 1817847711 UFUOQVMHVHZQMI-INIZCTEOSA-N 422.445 2.160 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(Cl)cc3N)CC2)cc1 3555450 RFOJWECDNZXUSN-UHFFFAOYSA-N 403.866 2.436 10 20 HECD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C2=O)cc1 7228461 POQVIHQJOKLFRS-HSZRJFAPSA-N 424.501 2.187 10 20 HECD Cc1ccc(C(=O)OCC(=O)NCc2ccccc2CN2CCCC2=O)c(O)c1O 727004392 UUOHGHQLYBUYNQ-UHFFFAOYSA-N 412.442 2.002 10 20 HECD C[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(=O)C1CCCC1 727165123 WQPCAOXDUOKVTL-HNNXBMFYSA-N 405.514 2.488 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)C(=O)NC4=O)cc2F)C[C@@H](C)O1 729286173 ZOGAAEVPTKYFLG-BETUJISGSA-N 411.433 2.253 10 20 HECD COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741090694 LVGAMONPGRQIDY-PKOBYXMFSA-N 400.523 2.136 10 20 HECD CC1(C)[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]2CCO[C@H]21 741278628 FQCYEKZFIMAYEH-GDAAHCPNSA-N 400.523 2.001 10 20 HECD CC(=O)NC[C@@H]1CCCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 742615584 UXELXNSPENIWJW-INIZCTEOSA-N 419.481 2.249 10 20 HECD C[C@@H](NC(=O)N1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(N2CCOCC2)cc1 749011084 XWUVDOQAPLZMHX-UTKZUKDTSA-N 408.502 2.467 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccc(C(N)=O)o3)cc2F)C[C@@H](C)O1 752003899 CYFUQWABFBSSCP-CHWSQXEVSA-N 404.442 2.131 10 20 HECD CC(C)N(C)S(=O)(=O)c1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1 753641100 ZCVQEOBNUXHDAY-CQSZACIVSA-N 406.504 2.488 10 20 HECD COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccccc3)n3nnnc3C)CC2)cc1F 753741485 GSSZJCCHXNGWOI-HXUWFJFHSA-N 424.480 2.262 10 20 HECD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 755125322 BWNKNSUQSPWBOK-RAUXBKROSA-N 410.518 2.139 10 20 HECD Cc1cc(NC(=O)NCCCSc2nccs2)n([C@H]2CCS(=O)(=O)C2)n1 758520473 XFHHCCQCJKOKLI-LBPRGKRZSA-N 415.566 2.312 10 20 HECD Cc1cc(O)cc(=O)n1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 759800713 AKPXZEXEMBWLIX-CQSZACIVSA-N 407.417 2.249 10 20 HECD Cc1ccc([C@H](C)[C@@H](O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 764859543 QBOKNFVHSMEVMK-RBDMOPTHSA-N 409.530 2.478 10 20 HECD CCOc1ccc(O)c(CN2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1 768805508 XWDQOAHRPCMBLG-UHFFFAOYSA-N 401.488 2.058 10 20 HECD C[C@@H](NC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1)c1ccc(N(C)C)cc1 773610723 FTIAVVOQWJBOER-LJQANCHMSA-N 423.561 2.457 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(CC(=O)Nc3ccccc3)CC2)c1O 774824871 DBCBPADNKCIPDO-UHFFFAOYSA-N 400.435 2.065 10 20 HECD Cc1cnn(-c2c(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c(C)nn2C)c1 778869225 AACLJUXAUDOOOL-UHFFFAOYSA-N 422.533 2.361 10 20 HECD COc1ccc(CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C2CC2)cc1 788321562 XNDOXDGSZIXAQX-UHFFFAOYSA-N 423.513 2.339 10 20 HECD CN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCN(Cc2ccccc2)C1=O 788746735 JRXSOVKYOGWYSD-JOCHJYFZSA-N 422.529 2.466 10 20 HECD C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788928687 BOOICBJIDGVUDY-OTWHNJEPSA-N 400.567 2.386 10 20 HECD Cc1cc(C)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C=O 793125418 RTOLPEDNZCAFDN-UHFFFAOYSA-N 400.500 2.281 10 20 HECD CN1CCN(c2ccc(CN3CCN(C)C[C@H]3CNC(=O)OC(C)(C)C)cc2)CC1 793604044 NEWSMCFCKJGUFX-OAQYLSRUSA-N 417.598 2.079 10 20 HECD CCN(CC)[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)c1ccco1 793843981 MAXNWHIJHJSILQ-HXUWFJFHSA-N 410.518 2.471 10 20 HECD C[C@@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN(C2CCC2)C1 795122944 SQRNHLBPNUVKPQ-GOSISDBHSA-N 418.557 2.085 10 20 HECD CO[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)[C@H](C)C1 799344098 RZGOJJARWHEFQW-RDTXWAMCSA-N 419.547 2.424 10 20 HECD CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(=O)NC)C1 802014585 SAUJMROQNPZLLN-IBGZPJMESA-N 408.506 2.324 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(CCO)C(C)(C)C3)cc2F)C[C@@H](C)O1 806457561 OJDCVBSWGYBIFN-CALCHBBNSA-N 422.545 2.037 10 20 HECD COCCC1(CNC(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCC1 809295684 DNJPMPWOLBCGLY-UHFFFAOYSA-N 403.523 2.057 10 20 HECD CCC1(CC)[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1OC 809438381 PZRFBKQRKAAWDH-VQTJNVASSA-N 417.550 2.192 10 20 HECD NS(=O)(=O)c1ccc2nc(NCc3ccc(N4CCC(CO)CC4)cc3)[nH]c2c1 820629499 LKBXJDPUKGJTIE-UHFFFAOYSA-N 415.519 2.031 10 20 HECD CC(C)N(CC(=O)Nc1cccc(S(N)(=O)=O)c1)Cc1ccc(N(C)C)cc1 917416970 FEMRFSSCARCWEG-UHFFFAOYSA-N 404.536 2.249 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 918303818 KPQXBQAFDGNSHQ-UHFFFAOYSA-N 410.518 2.371 10 20 HECD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(Cn2ccnc2)cc1 919839437 JQCMOSKQALLQML-UHFFFAOYSA-N 410.499 2.419 10 20 HECD CC(C)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N1CCCC[C@@H]1C 920636679 WMXJUFZQCHXHED-SUMWQHHRSA-N 412.508 2.346 10 20 HECD CN1CCN(c2ccc(CN3CCC(CNC(=O)C(F)(F)F)CC3)cc2F)CC1 1116900597 PJHWJKGMRSDLBV-UHFFFAOYSA-N 416.463 2.468 10 20 HECD COC(=O)[C@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1ccc(OC)c(O)c1 1326281050 WISDWCHUYYTYLF-OAQYLSRUSA-N 417.481 2.296 10 20 HECD C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807999172 RQJJDBIUAGUYCR-MMDDYWAUSA-N 408.458 2.340 10 20 HECD CCSc1cccnc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1844846591 ZKSSITVUCIUPDN-UHFFFAOYSA-N 414.487 2.131 10 20 HECD CCCC(=O)Nc1cccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 55280527 XFIRKPSGSKVAKT-UHFFFAOYSA-N 405.476 2.432 10 20 HECD Cc1c(CNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)n(C)c2ccccc12 473275677 RNYQSLKDPJFTMC-UHFFFAOYSA-N 418.383 2.443 10 20 HECD COCc1cc(N2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)n2ncnc2n1 480823391 SHDLQYZNYJYMHF-UHFFFAOYSA-N 418.457 2.094 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CCC(CN(C)C)CC3)cc2F)CC1 730133564 ABYUOQOWZARZNU-UHFFFAOYSA-N 405.562 2.451 10 20 HECD Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)c1ccc(C(N)=O)s1 732616049 DJBKESZQWHQKGI-UHFFFAOYSA-N 409.514 2.435 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c1 734072981 YEUOBCXBLNXQCM-UHFFFAOYSA-N 419.865 2.447 10 20 HECD COC(=O)[C@](C)(NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CC1 736051770 JRCKYJSGLXGLKD-JOCHJYFZSA-N 422.393 2.442 10 20 HECD CC1CCN(c2cccc(NS(=O)(=O)c3cccc(S(N)(=O)=O)c3)c2)CC1 740606095 ZYQQGLVUBTZKKP-UHFFFAOYSA-N 409.533 2.371 10 20 HECD CCN1CC[C@H](N(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 740883385 OFVSQODQPPOPMP-HKUYNNGSSA-N 406.546 2.083 10 20 HECD COc1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)ccc1Br 746799567 ZXMCKLMZKFDKPD-UHFFFAOYSA-N 409.236 2.427 10 20 HECD NC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(F)c1 747549291 CLCTVTMZNFGUEU-UHFFFAOYSA-N 404.417 2.347 10 20 HECD CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N2CCN(c3ccc(OC)c(F)c3)CC2)C1 753862400 ZIZFWQSKJWEVSI-DLBZAZTESA-N 421.513 2.147 10 20 HECD CCO[C@@H]1C[C@@H](N(C)C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1(C)C 754041589 CNUYCGHZYOLIPO-KSEOMHKRSA-N 405.583 2.314 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCC4(CCOCC4)C3)CC2)cc1 754049074 HBKSFKONZNSARS-OAQYLSRUSA-N 403.567 2.071 10 20 HECD CCn1cc([C@@H]2C[S@](=O)CCN2Cc2ccc(N3CCOCC3)c(F)c2)cn1 754153953 KYJFLYWHUQEEKZ-WTYVLRPYSA-N 406.527 2.184 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cn(-c2ccccc2)nn1 755222546 MHSKRFPQJRXYJA-UHFFFAOYSA-N 406.490 2.446 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)ccc21 758987684 IXOKMMALMOUSAG-UHFFFAOYSA-N 408.437 2.044 10 20 HECD COc1cc(N2CCN(C(=O)c3cnc4nccnc4c3)CC2)cc(OC)c1OC 759223696 VKWZQCYQDMPDHO-UHFFFAOYSA-N 409.446 2.013 10 20 HECD CNS(=O)(=O)c1ccc(CNC(=O)NCCCSc2nccs2)s1 759554883 TXIRZWLBPBGZQQ-UHFFFAOYSA-N 406.580 2.094 10 20 HECD COc1ccc(N2CCN(CCCNC(=O)Nc3nc4ccccn4n3)CC2)cc1 760034735 OPEVEMFEARXWFJ-UHFFFAOYSA-N 409.494 2.072 10 20 HECD Cn1cc(-n2cc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc2=O)cn1 760924649 LVEGNRBFPCMKAF-LJQANCHMSA-N 408.458 2.098 10 20 HECD Cc1cc(C(=O)CN2CCOC(C)(C)[C@H]2C)c(C)n1-c1ccc(S(N)(=O)=O)cc1 763627507 KGKXMVDPJCDTBT-MRXNPFEDSA-N 419.547 2.424 10 20 HECD CC(=O)N1CCN(c2ccc(CNc3cc(N4CCSCC4)ncn3)cc2)CC1 764917424 YNWAVRPDPNIGQC-UHFFFAOYSA-N 412.563 2.310 10 20 HECD C[C@H](C(=O)Nc1cccc(NS(=O)(=O)c2cccc3nonc23)c1)n1cccn1 765050530 ZLGVPFQHBOAHLX-GFCCVEGCSA-N 412.431 2.420 10 20 HECD CS/C=C\C(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 767652394 LBKVBSRYFGRBHZ-HJWRWDBZSA-N 408.501 2.344 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)Nc1cccc(-n2ccnn2)c1 768714926 CXZUPIFQESUPLX-UHFFFAOYSA-N 422.514 2.075 10 20 HECD COc1cccc(O)c1CN1CCC[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C1 769192034 GTWUFOUGINDXHG-OAHLLOKOSA-N 407.511 2.254 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N(C)C3CCC(CO)CC3)CC2)cc1 772602362 MJHHQLCQAROWOM-UHFFFAOYSA-N 404.555 2.010 10 20 HECD COc1cc(C)c(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1F 773207056 MONRKWNOUGPDTB-UHFFFAOYSA-N 419.428 2.373 10 20 HECD CC1CCN(C[C@@H]2CCCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)C2)CC1 785429013 VKKMZVOQSGXGGI-FQEVSTJZSA-N 400.567 2.339 10 20 HECD C[C@H](OC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)C(=O)NC[C@H]1CCCO1 789009129 GUPJUNDKGFMVJQ-UONOGXRCSA-N 407.422 2.303 10 20 HECD CCOc1ccc(CNc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c(O)c1 796391131 FPEJOOFSIIZAGS-UHFFFAOYSA-N 422.503 2.433 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)[C@@H]3O[C@H](C)C[C@@H]3C)cc2F)C[C@@H](C)O1 800296900 ZWKMJCXAASRUOH-YZLPMWMCSA-N 422.497 2.412 10 20 HECD COCCOc1cncc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)c1 801183207 ZAPPVFYGJLGCQK-UHFFFAOYSA-N 408.838 2.281 10 20 HECD C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686336 HVKCWPKFFXOHKQ-OJWCNPDFSA-N 413.562 2.473 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCO[C@@H](C(C)C)C3)CC2)cc1 804315957 WIIVDPFSQLHYLI-FXAWDEMLSA-N 403.523 2.100 10 20 HECD CCN(CCc1ccccn1)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804318070 XZUFXHZKGWXVLF-UHFFFAOYSA-N 410.518 2.266 10 20 HECD C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)[C@@H](C)N1CCOCC1 804774043 ALNGGEHCZVDJFM-ZWKOTPCHSA-N 417.550 2.279 10 20 HECD CCN(CC)c1ccc(CNC(=O)N2CCC[C@H]2C[C@@]2(C)NC(=O)NC2=O)cc1 806464956 PBPLJLSONGTBJW-LAUBAEHRSA-N 401.511 2.195 10 20 HECD Cn1cc(-c2ccccc2CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)cn1 807287550 KGRHEKSRPHNSKI-UHFFFAOYSA-N 415.497 2.396 10 20 HECD C[C@H](NC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccc(N(C)C)cc1 807674997 SKMAAQXBUMPBNZ-RDJZCZTQSA-N 405.564 2.491 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 807676426 GKDJCRYIEAOBLR-HUUCEWRRSA-N 406.527 2.301 10 20 HECD CN(CCn1cc(Br)cn1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 808800576 CJJREZPCTBTZKM-UHFFFAOYSA-N 408.344 2.302 10 20 HECD COC(=O)N(C)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 919286775 AOLNEOPJCOZJLV-LBPRGKRZSA-N 424.409 2.030 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1csc([C@@H]2CCCO2)n1 1116591588 DBTAJAXCWHOECN-LRDDRELGSA-N 406.460 2.310 10 20 HECD Cc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1N1CCN(C)CC1 1319716658 YVSDMJXSZDHWKP-UHFFFAOYSA-N 418.519 2.076 10 20 HECD Cc1cccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)C2 1793767781 SOTRKSRQQZKNPN-FJXIAYRNSA-N 423.469 2.472 10 20 HECD Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cs1 1810543046 OIZBQSRWJSRAEY-UHFFFAOYSA-N 416.503 2.416 10 20 HECD C/C=C/C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814165392 FLTKNDZJGCDBRT-IUOOSVRPSA-N 423.469 2.494 10 20 HECD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)ccc2F)C1 1841174514 DVSBHGDSQVNOOT-UHFFFAOYSA-N 405.813 2.416 10 20 HECD COc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251310 SDGALRHKHQAGAL-UHFFFAOYSA-N 417.849 2.286 10 20 HECD CC[C@H](C)NC(=O)COC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 6428492 UUCHDZLIIHASCW-NSHDSACASA-N 410.382 2.442 10 20 HECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc(N2CCCS2(=O)=O)c1 437021348 SDTKYCHLKLXUSW-UHFFFAOYSA-N 401.488 2.332 10 20 HECD CCN(CC)CCO[C@H]1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1 564363819 MKFNRBUHKCBYIC-SFHVURJKSA-N 414.550 2.062 10 20 HECD CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1O[C@@H](C)C(=O)N(C)C 728697100 CPFUKXBXZVSYHI-LUJRCDHRSA-N 423.469 2.402 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)CO[C@H]3CCC[C@H](C)C3)CC2)cc1 733016258 AVCUGSVTQSVXRE-PXNSSMCTSA-N 404.507 2.482 10 20 HECD Cc1ccoc1C(=O)NCCCNC(=O)NCc1ccc(N2CCOCC2)cc1 738461408 TZOSCBPEAKZVPZ-UHFFFAOYSA-N 400.479 2.044 10 20 HECD COc1cc(N(C)CC(=O)N[C@@H](Cc2ccccc2)C(C)=O)cc(OC)c1OC 741795975 XNNPIBNNFVPVTA-SFHVURJKSA-N 400.475 2.465 10 20 HECD CN(C)c1ccc([C@H](CNC(=O)CCN2CCOCC2)NC(=O)OC(C)(C)C)cc1 742753866 MGKXBUBWEZTZFT-IBGZPJMESA-N 420.554 2.157 10 20 HECD COC(=O)C(C)(C)c1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 743641467 JKPUCJXVBPEJBW-UHFFFAOYSA-N 406.460 2.467 10 20 HECD CN(C)c1ccc(CNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1 748661851 QAIRJTJOKLPODI-UHFFFAOYSA-N 412.490 2.312 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1 751093664 SRRONXKTJNWLFK-UHFFFAOYSA-N 417.598 2.487 10 20 HECD COC(=O)c1cc(Br)cc(S(=O)(=O)NCc2ccccc2O)c1 751148992 HBLPMZJQAKBHGV-UHFFFAOYSA-N 400.250 2.420 10 20 HECD COc1ccc(N2CCN([C@@H]3CC(=O)N([C@H](C)c4cccnc4)C3=O)CC2)cc1F 753976846 BVAGGKHLKQMCIT-DNVCBOLYSA-N 412.465 2.240 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCCO[C@H]3CCOC3)cc2F)C[C@@H](C)O1 756924781 PVXLCYQNLBZVEH-JZXOWHBKSA-N 409.502 2.434 10 20 HECD COc1ccc(N2CCN(CCCN3C(=O)[C@H]4CCCCCN4C3=O)CC2)cc1 760952481 SMCWKEXXGGGVDB-HXUWFJFHSA-N 400.523 2.414 10 20 HECD COc1ccc(N2CCN(CCCNC3CCN(c4cnccn4)CC3)CC2)cc1 764682726 HNEUPAGKZJWMKW-UHFFFAOYSA-N 410.566 2.256 10 20 HECD CCc1cccnc1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 767051744 CBXDDKYXBFCPMF-UHFFFAOYSA-N 401.438 2.093 10 20 HECD CN(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CCC(CO)CC1 772602295 LNTNKINYMYIMAK-JLAWEPINSA-N 402.539 2.081 10 20 HECD CCCCCCn1cc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c(O)nc1=O 772640287 UZYFMIPHLCYEEP-UHFFFAOYSA-N 408.524 2.074 10 20 HECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NC(=O)c1ccc(OC(F)F)cc1 772770789 SRLYQTVFNBVLQE-KRXBUXKQSA-N 407.325 2.212 10 20 HECD CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cn1 773860350 ZUMAVVQYRXKNHJ-AWEZNQCLSA-N 415.494 2.063 10 20 HECD Cc1cc(CNC(=O)NCc2ccc3c(c2)CCCN3C)ccc1S(N)(=O)=O 775221147 FPDCPJCVGNLICN-UHFFFAOYSA-N 402.520 2.024 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ncccn1 775526775 JJZXOUFXVGZVQO-UHFFFAOYSA-N 421.505 2.415 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)NC(=O)CC(C)(C)C)CC2)cc(OC)c1OC 779092414 ZLDRZVILXIKIGL-OAHLLOKOSA-N 421.538 2.302 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1 785293729 AHAONSLEMVIVHN-LSDHHAIUSA-N 413.474 2.009 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(Br)c[nH]3)cc2)CC1 786259927 SJVRHJHKTQVOIH-UHFFFAOYSA-N 405.296 2.376 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3Oc4ccccc4O[C@H]3C)cc2)CC1 786660523 ZDXPHVHEVMUVQK-KSFYIVLOSA-N 409.486 2.200 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H]3CCC(=O)c4cccn43)CC2)cc(OC)c1OC 788767485 AVFRIGVCTHHCNB-KRWDZBQOSA-N 413.474 2.380 10 20 HECD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCCN(c3nccs3)CC2)cc1 788952202 RDGFBHKRGNNHMR-UHFFFAOYSA-N 415.563 2.344 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cccc(N2CCOC2=O)c1 789568623 VDHDGYHAVWDLNT-UHFFFAOYSA-N 424.501 2.374 10 20 HECD Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 792209063 BDHAGRRQEFCEQV-UHFFFAOYSA-N 421.501 2.335 10 20 HECD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2C[C@H](N3CCCC3)C[C@@H]2C)c1 795707136 YABCXUXRWPQKOG-HTAPYJJXSA-N 401.551 2.486 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](C(=O)O)C3CCOCC3)cc2F)C[C@@H](C)O1 797710278 WNHHLKDZKYXVEP-LPMFXHHGSA-N 423.485 2.118 10 20 HECD CCN(CCc1ccccn1)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803302690 SQFPIVRUJHZEPO-GOSISDBHSA-N 410.518 2.187 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)CC[C@H]1CCCCN1C)c1ccc(N2CCOCC2)cc1 803310023 FMHKDGMAAQYGDQ-UYAOXDASSA-N 416.566 2.033 10 20 HECD C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 803686337 HVKCWPKFFXOHKQ-SAIGTISXSA-N 413.562 2.473 10 20 HECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1COc2c(cccc2OC)C1 804673432 BZWDZIYUMXBPFI-SFHVURJKSA-N 411.502 2.230 10 20 HECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 809184386 GIAPCTKQSWGXLJ-IAOVAPTHSA-N 405.882 2.457 10 20 HECD CN(C)c1ccc(CN(C(=O)CNS(=O)(=O)c2cccc(F)c2)C2CC2)cc1 810064508 IAZQLZXBMNYFGH-UHFFFAOYSA-N 405.495 2.361 10 20 HECD C[C@@H](NS(C)(=O)=O)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccs1 812359501 IHRXKNDHKODOFY-CYBMUJFWSA-N 421.548 2.340 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3noc4c3CCCC4)CC2)cc1 813821399 TYUOGJAEAWXQPY-KHPPLWFESA-N 424.501 2.083 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)NCCNC(=O)c3ccco3)cc2F)C[C@H](C)O1 918203147 VDPBEKCCDZMVBC-GJZGRUSLSA-N 418.469 2.262 10 20 HECD Cc1ncc2c(n1)CC[C@H](NC(=O)NCc1ccc(N3CCC(CO)CC3)cc1)C2 918204067 OPRADKLDCFHYSY-FQEVSTJZSA-N 409.534 2.350 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H](c1ccccc1)N1CCOCC1 919790803 QVCGQYZHJXJVOK-HSZRJFAPSA-N 424.545 2.396 10 20 HECD CCN1CCN(c2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)CC1 919809541 ULPOAVKXGBJKJY-UHFFFAOYSA-N 418.519 2.158 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccoc2C1)c1cc(O)nc(O)c1 1793285764 CYNIFIXIOPAUTJ-LLLHUVSDSA-N 411.458 2.143 10 20 HECD C[C@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797296155 HSWRXTRKXAPFLM-HMZURLEKSA-N 422.909 2.391 10 20 HECD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993073 SGOSUFWQDPGKFK-JWVYWZTKSA-N 422.485 2.254 10 20 HECD O=C(NC[C@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1808001925 RLPKBYHRRQHRMV-IIBYNOLFSA-N 410.474 2.398 10 20 HECD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2c(C)c3ccccc3n2C)C12CCOCC2 673314927 BPDNKUSESCRNBH-WOJBJXKFSA-N 413.518 2.193 10 20 HECD Cn1nccc1S(=O)(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2 727350475 NRRKDIXEMKBRJM-GFCCVEGCSA-N 424.548 2.070 10 20 HECD O=C1Cc2cc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)ccc2N1 733849902 HSKKYLJVKSVWPB-QGZVFWFLSA-N 409.442 2.033 10 20 HECD Cc1noc(COc2ccc(NC(=O)C(=O)NCc3ccc(N(C)C)cc3)cc2)n1 734073166 DWSBJIFWFCPWRV-UHFFFAOYSA-N 409.446 2.278 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)O[C@H]2CCCN(c3ccccc3)C2=O)c1 734577628 GXTYWXSIOXIBEH-KRWDZBQOSA-N 404.444 2.116 10 20 HECD Cc1cc(NC(=O)NCc2ccc(N(C)C)cc2C)n([C@@H]2CCS(=O)(=O)C2)n1 734643211 WUDFRQXGRGOQOT-QGZVFWFLSA-N 405.524 2.247 10 20 HECD CC(C)N1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 748025758 YKGPIQFILCEEEJ-UHFFFAOYSA-N 409.533 2.421 10 20 HECD CCn1nc(NC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C1CC1 750629861 QLFSMMRFYRLRRS-UHFFFAOYSA-N 417.535 2.337 10 20 HECD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@H]1CC(=O)N(C2CC2)C1 750649550 CBURGVAUSLMUJH-KBPBESRZSA-N 408.449 2.319 10 20 HECD O=C1OCc2c1cccc2S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751120158 CJMFHDSNMWQXRR-HNNXBMFYSA-N 403.456 2.433 10 20 HECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1 753643381 JMVYYTAAZDEHAH-JKSUJKDBSA-N 401.482 2.495 10 20 HECD COc1ccc(N2CCN(C(=O)C(=O)Nc3nc(C(C)(C)C)ns3)CC2)cc1F 754212975 HPWKASUYZNNXBU-UHFFFAOYSA-N 421.498 2.271 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2nnc(O)n2c1 754402089 ALPGHONAOIHVEL-UHFFFAOYSA-N 421.379 2.220 10 20 HECD CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@]12CCCO2 759221415 PXNVUUAGRFVVDL-ZVDOUQERSA-N 407.486 2.188 10 20 HECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CCN(c2cccnn2)CC1 759630532 KCATYMCRRQGQMJ-UHFFFAOYSA-N 410.522 2.124 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN(C)CCN3CCCC3)cc2F)C[C@@H](C)O1 760834286 WLBPADNOMNAULG-HDICACEKSA-N 406.546 2.083 10 20 HECD C[C@@H](NC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21)c1ccc(N2CCOCC2)cc1 763021921 YMARWZAESOOQGC-DNVCBOLYSA-N 415.515 2.412 10 20 HECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 763282581 GIJFBLIUYOPPFO-CRAIPNDOSA-N 418.515 2.388 10 20 HECD Cc1cc(Cl)ncc1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 766341682 CTPKRYXFPLIRRW-UHFFFAOYSA-N 402.882 2.477 10 20 HECD CC(=O)[C@H](Cc1ccc(F)cc1F)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 768631821 OCUKUSJWLIEKAD-KRWDZBQOSA-N 413.398 2.399 10 20 HECD O=C(CN1CCCC1)N1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769315374 AJVOTYMYRXFLRA-UHFFFAOYSA-N 415.538 2.325 10 20 HECD CCn1cnnc1-c1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 769685075 BCGQAWSIFLCLCQ-UHFFFAOYSA-N 401.448 2.294 10 20 HECD COC(=O)[C@H]1CCCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769721502 AMLJURPXGHBNHI-CQSZACIVSA-N 424.500 2.422 10 20 HECD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCO[C@H](C(C)C)C3)CC2)cc1 771953565 QQWZUWRAVKPVGC-RXVVDRJESA-N 404.555 2.320 10 20 HECD CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1(C(N)=O)CCCC1 772233722 XNJZEITZHYGEMX-UHFFFAOYSA-N 405.454 2.130 10 20 HECD COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1 773768418 VERFRWHYRINABJ-KBPBESRZSA-N 407.488 2.264 10 20 HECD COc1cccc([C@@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)N(C)C)c1 774947624 OMKXQPXKEAQGQS-JOCHJYFZSA-N 422.529 2.107 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CCN(CC(F)(F)F)CC3(C)C)nc12 775564294 XEVDOYZGQZPJJT-UHFFFAOYSA-N 415.416 2.070 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc4nc[nH]c4c3)CC2)cc1 778250140 RJQWQEDYYOJBNW-CMDGGOBGSA-N 405.458 2.415 10 20 HECD C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(-n2cncn2)cc1 785395545 MHFCJOMDQMVNCE-QGZVFWFLSA-N 418.501 2.361 10 20 HECD Cc1nc2ccccc2n1CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 785498046 VXBGOFNAXCCJHH-UHFFFAOYSA-N 405.502 2.378 10 20 HECD CCOC(=O)[C@@H](CC)N(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 787350773 GCXXGLMXFVPPOY-HXUWFJFHSA-N 403.523 2.150 10 20 HECD CCN1CC[C@H](N(C)C(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H]1C 789863840 JZJNENUGXZGSPV-PXNSSMCTSA-N 418.607 2.187 10 20 HECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1 790410082 ZZRBSUJPYLBJQT-UHFFFAOYSA-N 412.489 2.032 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@](C)(O)CC3)cc2F)C[C@@H](C)O1 791625525 ASXWZMKVHPRXPP-JKSBSHDWSA-N 407.530 2.292 10 20 HECD C[C@@H](NC(=O)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)c1ccc(N(C)C)cc1 793644657 IHORWEZDIDCMCP-KDOFPFPSSA-N 418.538 2.349 10 20 HECD COCn1nccc1S(=O)(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 795119675 NWOSVESVINYSGG-ZDUSSCGKSA-N 416.450 2.036 10 20 HECD CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)N(C)Cc2ccccc2O)c1 800915825 UCXMMTWYVRJOEK-UHFFFAOYSA-N 412.533 2.243 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCOCC2(CCCC2)C1)c1ccc(N2CCOCC2)cc1 803297896 JNRYGICTYCPXLC-GOSISDBHSA-N 415.534 2.120 10 20 HECD CS(=O)(=O)C1(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CCCC1 804200076 UBGDVFWBFOKTNX-UHFFFAOYSA-N 400.884 2.167 10 20 HECD CC(=O)Nc1ncc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)s1 804957449 WBLSYTJZERKUPA-UHFFFAOYSA-N 412.562 2.133 10 20 HECD Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 806385566 ADWAMDKFBPQSEF-DYVFJYSZSA-N 401.463 2.382 10 20 HECD C[C@H](CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCCCC1 807701759 KXSOSYGPCUPXTA-QUCCMNQESA-N 417.550 2.281 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3Cc4cnn(-c5ccccc5)c4C3)nc12 815309003 RZLZTUNNUXJQTA-UHFFFAOYSA-N 404.430 2.313 10 20 HECD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(C2CC2)n1 815397448 WEDLQLFNAMWGSG-UHFFFAOYSA-N 412.465 2.314 10 20 HECD CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc1C 917709276 SEHHICGKKXYMNT-UHFFFAOYSA-N 401.438 2.472 10 20 HECD COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 917918068 KLXAKMRTYSPCEY-UHFFFAOYSA-N 422.478 2.236 10 20 HECD Cc1c(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)c(=O)n(-c2ccccc2)n1C 918305495 JIFBASHAWWAORG-UHFFFAOYSA-N 421.501 2.148 10 20 HECD CNC(=O)c1cccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 1323920602 DBELVRISQIUGNU-ZIAGYGMSSA-N 400.454 2.124 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1)[C@@H](O)c1ccco1 1800713159 GUUKJNAOTLNIJB-YFQWEKLQSA-N 420.849 2.330 10 20 HECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CNC(N)=O)cc1 1804474636 UQLYYKSVHPIUHZ-FNLKRUPLSA-N 423.517 2.014 10 20 HECD Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807993780 LPBXAMGNLZNSAL-QRWLVFNGSA-N 421.457 2.158 10 20 HECD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cscn1 1816487533 YZQPOECYVXXIGQ-CYBMUJFWSA-N 414.447 2.292 10 20 HECD O=C(c1ccc(-c2cc[nH]n2)cc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250636 VFUDNHSEIYTOKR-UHFFFAOYSA-N 419.441 2.014 10 20 HECD CNC(=O)c1ccc(Cl)c(NCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 110933456 SADCUSLIZHSFRE-UHFFFAOYSA-N 416.909 2.469 10 20 HECD Cc1csc([C@@H]2CN(C(=O)C(=O)NCc3c(C)c4ccccc4n3C)CCO2)n1 673315620 MJAQYTDWAPTPJD-SFHVURJKSA-N 412.515 2.468 10 20 HECD COc1cc(Br)cc(CNC[C@@](O)(c2nccn2C)C(F)(F)F)c1O 725849532 POJOBHQBGLDMNK-CQSZACIVSA-N 424.217 2.437 10 20 HECD COCCCN1CCC(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 727033329 AWEANHZZYCQNKA-UHFFFAOYSA-N 418.582 2.195 10 20 HECD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 728203147 HAWFCRDPCAFLOF-INIZCTEOSA-N 421.501 2.176 10 20 HECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)c1 729062340 QMUKOWMAZGXRNX-CHWSQXEVSA-N 415.446 2.190 10 20 HECD COc1cccc(CNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c1O 730282035 BRAWMZQLPRTHHE-CQSZACIVSA-N 421.519 2.090 10 20 HECD O=C(COC(=O)c1cc(O)cs1)NCC(=O)Nc1ccccc1Br 731910986 YHXRZJCJMFFTOW-UHFFFAOYSA-N 413.249 2.128 10 20 HECD CCO[C@H]1CCCN(CC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1 738318275 BZQFJSVAVDICOX-SFHVURJKSA-N 419.547 2.425 10 20 HECD COC(=O)C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ccccc21 743501986 UXHPEWVEKXBGDS-GFCCVEGCSA-N 404.444 2.071 10 20 HECD CCO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 743559652 LLRABJXNCZDQCW-OAHLLOKOSA-N 403.483 2.345 10 20 HECD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2c(O)ccc3c2CCCC3)CC1 743958492 ZWUOVDLGGJHXLD-UHFFFAOYSA-N 422.529 2.278 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)NCC3(CO)CCOCC3)cc2F)C[C@@H](C)O1 749176284 RQIQPHIYNZNAHY-HZPDHXFCSA-N 409.502 2.028 10 20 HECD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3cnccc3=O)c2C)c1 749680193 AFAIZDZPOCUVRW-UHFFFAOYSA-N 423.425 2.107 10 20 HECD CO[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C[C@H]1OC 753806001 IIQKWYVRQTWUCR-GBLZOACLSA-N 408.454 2.135 10 20 HECD COC(=O)c1sc(S(=O)(=O)Nc2ccc(O)cc2F)c(C(=O)OC)c1C 758168946 IEIAEIHKKCEHLA-UHFFFAOYSA-N 403.409 2.275 10 20 HECD COc1cccc([C@H](O)C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 760086315 UFKNTHZSVYVUGD-FQEVSTJZSA-N 416.474 2.103 10 20 HECD Cc1nn(CC(F)F)c(C)c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 760849460 WCISHOMKOJUTTD-MRXNPFEDSA-N 419.476 2.397 10 20 HECD CS(=O)(=O)c1ccc(OCCCCC(=O)NCCc2ccc(O)c(O)c2)cc1 762268609 OEMLNUQKCXOTCJ-UHFFFAOYSA-N 407.488 2.409 10 20 HECD C[S@@](=O)Cc1ccccc1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 762533952 MQDYEIVAGNTSCI-GDLZYMKVSA-N 419.522 2.269 10 20 HECD CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 766997854 DTLSUXHTRFGSGS-UHFFFAOYSA-N 408.545 2.290 10 20 HECD COc1ccc(N2CCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)CC2)cc1 767415912 SNHGEFHTEJNHAE-SFHVURJKSA-N 407.511 2.274 10 20 HECD CCN(CC)c1ccc(CN2CCC(C(=O)N3CCC(C(N)=O)CC3)CC2)cc1 768347822 VNGFISSEYOIVIZ-UHFFFAOYSA-N 400.567 2.469 10 20 HECD COC(=O)[C@@H](C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 769941649 GMVVQIUDCGXPMS-SJCJKPOMSA-N 406.460 2.044 10 20 HECD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCN(Cc2ccccc2)C1 785427230 BAUDYICUZYTFAI-JOCHJYFZSA-N 408.546 2.492 10 20 HECD Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439003 JRHJKPIYNUAPIX-UHFFFAOYSA-N 405.502 2.488 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)NCc2ccccc2CN2CCCC2)cc1F 785579053 FDIZEYLZJHPGAW-UHFFFAOYSA-N 412.509 2.420 10 20 HECD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)C3CCCCC3)cc2)CC1 786263208 UOWQWRISVSPWPG-QGZVFWFLSA-N 414.550 2.056 10 20 HECD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCc2ccccc2C1 788320849 PZBWRBSLPWWNEX-IBGZPJMESA-N 407.514 2.061 10 20 HECD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCC[C@]2(CCCOC2)C1 789856546 VSRJBNKMKNZVHP-QFIPXVFZSA-N 417.575 2.275 10 20 HECD CN(C)c1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)NC(=O)OC(C)(C)C)cc1 796730504 RRHTUXLWBQBPAR-OAHLLOKOSA-N 418.454 2.380 10 20 HECD O=C(NCCCSc1nccs1)C(=O)NCCc1ccn(-c2ccccc2)n1 804107391 RGAABNNPHKWNAS-UHFFFAOYSA-N 415.544 2.286 10 20 HECD CC1(C)[C@H](NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@H]2CCCO[C@H]21 807610872 MUTVVLKLJLKTSU-ONCXSQPRSA-N 416.518 2.220 10 20 HECD COC(=O)c1cccc2c1N(S(=O)(=O)c1cccc3nsnc13)[C@H](C)C(=O)N2 808584332 YEWBCZBUNLIMSE-SECBINFHSA-N 418.456 2.014 10 20 HECD Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)o1 808854731 IQDYUTBEZGEVNU-UHFFFAOYSA-N 424.545 2.395 10 20 HECD CS(=O)(=O)NCC1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 809693838 FCOLZNKHZMUOSH-UHFFFAOYSA-N 410.540 2.346 10 20 HECD CCN1CCN(c2ccc(CNC(=O)N3CC[C@]4(CCN(C)C4)C3)cc2F)CC1 813632656 LFFUQNOKRCVSHN-QFIPXVFZSA-N 403.546 2.205 10 20 HECD CC[C@@H]1CO[C@H](C)CN1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 916199414 WWODZTJYNPVLSL-RTBURBONSA-N 404.555 2.416 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)N3CCC4(CC3)OCCO4)cc2F)C[C@@H](C)O1 918220553 KZFGGVUCFWCPDS-HZPDHXFCSA-N 407.486 2.488 10 20 HECD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(-c2ccco2)on1 918642498 CBNPQLLCYGEOQX-UHFFFAOYSA-N 401.444 2.099 10 20 HECD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 997639424 FQBCYGWYZVHZNY-KMSCNQLFSA-N 423.473 2.134 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)Oc1ccc(F)c(F)c1 1320399663 REGDHTALVSMHQJ-ZBEGNZNMSA-N 409.385 2.434 10 20 HECD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC3(C4CC4)CCOCC3)cc2)C1 1338070217 CFBJMAQLQTZZPX-KRWDZBQOSA-N 400.523 2.147 10 20 HECD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1(O)CCC1)c1cc(O)c(O)c(Cl)c1 1803363530 KUASREURYOINQX-BTTYYORXSA-N 408.882 2.308 10 20 HECD C/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361719 CVMDBNNEAAOLQI-NHEDYWLLSA-N 423.498 2.424 10 20 HECD CCN1CCN(c2ccc(CNC(=O)NCCN3CCC[C@@H](C)C3)cc2F)CC1 730116435 CSEPCQLCYYZLOT-GOSISDBHSA-N 405.562 2.499 10 20 HECD COc1ccc(O)c(CNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)c1 734073261 ITCPGNQQLBZZIP-GASCZTMLSA-N 413.474 2.269 10 20 HECD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1 741216814 MXVDVSKCKCNSBB-XMMPIXPASA-N 423.557 2.413 10 20 HECD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1cnn(C2CCOCC2)c1 749920495 RCWOQYLCRYWHLR-UHFFFAOYSA-N 422.576 2.266 10 20 HECD Cc1cc(CC(=O)N(C)C[C@H](O)CN2CCOCC2)c(C)n1-c1ccc(Cl)cc1 751432406 WQVSOSAMEUFRQN-NRFANRHFSA-N 419.953 2.442 10 20 HECD COc1ccc(N2CCN(C[C@@H](O)CN3CCCN(C4CCCC4)CC3)CC2)cc1 754041497 BCILCUMQUGJYTI-QHCPKHFHSA-N 416.610 2.128 10 20 HECD COCC1(O)CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 759495407 CJGYDZAHBDJGOK-OAHLLOKOSA-N 413.465 2.440 10 20 HECD COc1cc(N2CCN(C(=O)[C@@H](C)NC(=O)C3CCCC3)CC2)cc(OC)c1OC 760084664 ORVQAXMBHZENLR-OAHLLOKOSA-N 419.522 2.056 10 20 HECD CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 764106884 GIISDELIMNUTPO-UHFFFAOYSA-N 405.520 2.488 10 20 HECD CCC[C@](C)(O)C(=O)OCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 770215599 ZJZOLTMEBXRZPI-PZPWOCDFSA-N 410.486 2.150 10 20 HECD Cc1sc2nc(COC(=O)c3cc(NS(C)(=O)=O)ccc3O)nc(N)c2c1C 771933975 OIPBACPPGQDYDJ-UHFFFAOYSA-N 422.488 2.324 10 20 HECD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)COc3ccc(F)cc3)CC2)c1O 774839296 IRWLWFXTPVHCPG-UHFFFAOYSA-N 419.409 2.171 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC[C@H](O)c3ccccc3)CC2)cc1 778296122 WZIIBUKAIUQCLL-LEQVUBRHSA-N 423.513 2.140 10 20 HECD COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1cc(Br)cc(Br)c1O 783704109 JKAFQZYLANWXML-RYUDHWBXSA-N 423.101 2.416 10 20 HECD O=C(CN1CCC([C@@H]2CCOC2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 784344286 UYBSRCRGRGFEFU-LJQANCHMSA-N 405.514 2.027 10 20 HECD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 785432325 ANAWOTNQHWBHQA-IAGOWNOFSA-N 418.538 2.321 10 20 HECD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(F)nc3)cc2F)C[C@@H](C)O1 785641368 WQLRXPFJRMLSHB-ZIAGYGMSSA-N 419.428 2.447 10 20 HECD Cn1nccc1[C@@H]1CCC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 790486163 MRUUHDFTVBFYPC-RTBURBONSA-N 402.564 2.471 10 20 HECD COc1cccc(CNC(=O)[C@H](C)[C@@H](C)C(=O)NCc2cccc(OC)c2O)c1O 790787392 DBVDKLYBQKOQGW-ZIAGYGMSSA-N 416.474 2.320 10 20 HECD COc1ccc(N2CCC(NC(=O)C(=O)Nc3cnc(CC(C)C)nc3)CC2)cc1 792345473 ZOPQSIZTPSTUGH-UHFFFAOYSA-N 411.506 2.407 10 20 HECD C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C[C@@]2(CCCOC2)O1 797432514 GZARKDLOXRZANQ-KSFYIVLOSA-N 421.513 2.266 10 20 HECD CC1CCN([C@@H](C)CNC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 803541178 AIIQTJPNYAHGMI-SFHVURJKSA-N 400.567 2.480 10 20 HECD COc1ccc(N2CCN(CCNC(=O)C(=O)N[C@H]3CCCC(C)(C)C3)CC2)cc1 803746871 ISRMNNOZFMYDTG-SFHVURJKSA-N 416.566 2.018 10 20 HECD C[C@@H](NC(=O)C(=O)N1CCC[C@H](OCC(F)(F)F)C1)c1ccc(N(C)C)cc1 807674436 KVTDQZZRYMZQLN-CJNGLKHVSA-N 401.429 2.500 10 20 HECD C[C@@H](NC(=O)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(N(C)C)cc1 807676048 CGTKDAHBXVALNZ-DYESRHJHSA-N 422.529 2.189 10 20 HECD CCc1cc(N2CCC(NC(=O)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)ncn1 807679471 SEWIXTLPTYTEIF-MRXNPFEDSA-N 424.549 2.067 10 20 HECD C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(C)C3)cc2Cl)C1 807955182 PYXUYKJOWYSQMC-WBVHZDCISA-N 406.958 2.403 10 20 HECD COc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2O)cc1S(=O)(=O)NC1CC1 809684267 VONBGHLXIFPEKO-UHFFFAOYSA-N 423.447 2.370 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(=O)n(-c2ccccc2)n1 917708715 OMHHVWGEXAOYMC-UHFFFAOYSA-N 408.433 2.138 10 20 HECD CN(C)S(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccco3)cs2)cc1 917898355 RCKUHHKOUJZOJJ-UHFFFAOYSA-N 413.502 2.454 10 20 HECD COC(=O)COc1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 919969688 CTIYTHRFGMPHLY-UHFFFAOYSA-N 412.486 2.377 10 20 HECD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(C)nn(C)c2s1 1116591644 FRKDVCRYMWBAMO-ZDUSSCGKSA-N 403.460 2.259 10 20 HECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccnn1C[C@@H]1CCOC1 1320718816 XVWHIXFIMGBFJI-INIZCTEOSA-N 403.458 2.217 10 20 HECD COc1ccc(N2CCN(C(=O)COC(=O)c3c4ccccc4nn3C)CC2)cc1 1324107673 YXXAGHHZIRMYDE-UHFFFAOYSA-N 408.458 2.088 10 20 HECD COc1ccc([C@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)cc1 1847465990 KPKXNYMYIOCIHC-KKXDTOCCSA-N 411.458 2.121 10 20 HECD COc1ccc(N(C)CC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1OC 63616850 DYLQETZKKOJEBZ-UHFFFAOYSA-N 407.492 2.029 10 20 HECD C[C@H](NC(=O)Cn1cc(Br)ccc1=O)c1ccc(N2CCOCC2)cc1 109180350 SLHJCBZTEACEIJ-AWEZNQCLSA-N 420.307 2.325 10 20 HECD COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(C3=S=CC=C3)o2)cc1 542113821 BYFQRWMNEOCBGM-ZDUSSCGKSA-N 420.512 2.471 10 20 HECD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)C3(C)CCOCC3)cc2F)C[C@@H](C)O1 726839838 SAQYCZUAXNKRNZ-IYBDPMFKSA-N 422.497 2.415 10 20 HECD CNC(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1 728516311 JQBATXGLVNAJQP-UHFFFAOYSA-N 422.407 2.227 10 20 HECD Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 734075347 YCXOZYFXNAVZQH-UHFFFAOYSA-N 415.515 2.036 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1 734521913 JQJCFTKYPWOQFI-UHFFFAOYSA-N 424.954 2.492 10 20 HECD COc1c([N+](=O)[O-])cc(N(C)CCN2CCOCC2)c([N+](=O)[O-])c1Br 737405473 CAHHHDHUKZOJHP-UHFFFAOYSA-N 419.232 2.043 10 20 HECD COC[C@H]1CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCO1 741796210 XLAFENOFTKZYGJ-GDBMZVCRSA-N 408.454 2.136 10 20 HECD COc1ccc(N2CCN(CCNC(=O)CSc3nc(C)cc(C)n3)CC2)cc1 742917249 VGYQLDVTUMWDHK-UHFFFAOYSA-N 415.563 2.133 10 20 HECD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(-n2cccn2)cc1 743817469 VLZLEYWLHRFMFF-ZDUSSCGKSA-N 400.460 2.440 10 20 HECD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](N(C)Cc4ccccc4)C3)nc12 746485644 ZKWZAFLFEIVXHH-GOSISDBHSA-N 409.490 2.318 10 20 HECD COc1ccc(N2CCN(S(=O)(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc1F 754040823 ZBWURXCNXLGRPI-UHFFFAOYSA-N 421.494 2.047 10 20 HECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1ccn(CCc2ccncc2)n1 759031328 KFZDZHRFXZBWNE-UHFFFAOYSA-N 419.485 2.360 10 20 HECD CC(C)[C@H](CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O)N1CCN(C)CC1 760989839 HRCVBPGKZAWKAF-KRWDZBQOSA-N 408.930 2.082 10 20 HECD CC(C)Oc1cc(O)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1 761999692 IIIFJZHFKWHUHZ-UHFFFAOYSA-N 414.505 2.231 10 20 HECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1 768078523 IQVATECHUYBLTE-NSHDSACASA-N 413.386 2.453 10 20 HECD Cc1cccc(NC(=O)CN2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c1C 768441425 HVKHDYDPBKEVPH-NRFANRHFSA-N 411.502 2.191 10 20 HECD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Br)cc2O)c1 769688770 DISILVJDDHAUBD-UHFFFAOYSA-N 401.238 2.484 10 20 HECD CCNC(=O)c1cc(Cl)ccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769791278 BAKUGBHUKJPAEZ-UHFFFAOYSA-N 411.867 2.419 10 20 HECD O=C(OCC(=O)N(c1ccc(F)cc1)[C@@H]1C=CS(=O)(=O)C1)c1cc(O)cs1 770019682 UZZXMRRUGWWBID-CYBMUJFWSA-N 411.432 2.094 10 20 HECD CCC[C@@](C)(O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 770884850 ZJQFVJYGWWIEBY-OAQYLSRUSA-N 401.486 2.110 10 20 HECD COc1ccc(N2CCN(CCNC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])CC2)cc1 771350296 WPXMMVFVYPSGFV-UHFFFAOYSA-N 416.482 2.002 10 20 HECD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCC(F)(F)C1 776615813 BSMVEGUEDFZCLY-UHFFFAOYSA-N 420.439 2.493 10 20 HECD COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(CO)ccc3C)CC2)cc1 778389765 PCNUAEURKHNVSO-KTKRTIGZSA-N 409.486 2.339 10 20 HECD O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 778916913 RRSYWEPGOBGMNS-UHFFFAOYSA-N 410.879 2.466 10 20 HECD CC(=O)N1CCN(c2cccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)c2)CC1 780407579 MAOIOAFKAXWDCR-UHFFFAOYSA-N 418.475 2.373 10 20 HECD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccc(Cn4cccn4)cc3)ccc21 788459365 MJGGSHPLWHKMJQ-UHFFFAOYSA-N 417.513 2.246 10 20 HECD C[C@H]1[C@@H](C)SCCN1C(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789826672 QCCGVHDNPNQBPY-LVQVYYBASA-N 423.554 2.408 10 20 HECD Cc1nn(C)c(C)c1CCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 789879970 JBAXEHKUKDXLOD-UHFFFAOYSA-N 410.474 2.223 10 20 HECD O=S(=O)(C[C@@H]1CCCOC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792747367 JRXVTRZLCGJDNS-CQSZACIVSA-N 422.469 2.388 10 20 HECD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2csc(-c3ccccc3)n2)cc1 797431494 QJAWBWIDYCXSRG-UHFFFAOYSA-N 424.529 2.487 10 20 HECD COC(=O)c1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cc1OC 798433712 UWTZWCYXBJDIAE-UHFFFAOYSA-N 404.488 2.343 10 20 HECD O=C(NCCOC[C@H]1CCCO1)C(=O)N(Cc1ccccc1O)C1CCCCC1 803560320 GCSTUSCHJQQALK-LJQANCHMSA-N 404.507 2.365 10 20 HECD CC1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cnc(N(C)C)nc3)cc2)CC1 805023413 HBAOKEBWLFCCSK-UHFFFAOYSA-N 424.549 2.054 10 20 HECD CC(C)[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1nncn1C 805766475 KNGAQAXBEYAIBR-IBGZPJMESA-N 400.527 2.220 10 20 HECD COc1ccc(N2CCC(NC(=O)N3C[C@H](N4CCOCC4)C[C@@H]3C)CC2)cc1 806683785 MSGOMNDIPRRYQR-FXAWDEMLSA-N 402.539 2.169 10 20 HECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 807096783 KGNLMDZDJLDMLW-MRXNPFEDSA-N 416.472 2.351 10 20 HECD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)N[C@H](COC)C(C)C 807451254 QAVPLASHVLEHHO-CQSZACIVSA-N 401.301 2.290 10 20 HECD COc1ccc(N2CCN(CCNc3ccc(S(C)(=O)=O)cc3F)CC2)cc1 807945323 LMAJPCQKZHVJKJ-UHFFFAOYSA-N 407.511 2.472 10 20 HECD COC(=O)C(C)(C)CS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 808283380 IUIOQPBEIVFNKD-OKILXGFUSA-N 416.515 2.058 10 20 HECD CS(=O)(=O)c1ccc(N(CCN)Cc2cc(Cl)c(F)cc2O)c([N+](=O)[O-])c1 816610500 MRCUPKBFVZUHHZ-UHFFFAOYSA-N 417.846 2.462 10 20 HECD O=C(Cn1nnc2c1CCCC2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857473496 ZENUYXWXSZPPRI-INIZCTEOSA-N 403.914 2.297 10 20 HECD CCCNC(=O)CN1CCC(NC(=O)NCc2ccc(N(CC)CC)cc2)CC1 918212648 QSLZNINXSNPKTD-UHFFFAOYSA-N 403.571 2.323 10 20 HECD Cc1nn(C)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1[N+](=O)[O-] 919986173 YRQMFPGPPZLEKZ-TXEJJXNPSA-N 405.430 2.319 10 20 HECD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1 1324192694 PSPQMYAGKMLSNF-UXHICEINSA-N 420.575 2.475 10 20 HECD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccccc2Cl)C1 1844861940 AZZWJIWDMCKRLY-UHFFFAOYSA-N 423.947 2.017 10 20 HECD