smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)[C@@H]1Cc2ccccc2O1 748277785 WGJRVSSQSVFOKI-AWEZNQCLSA-N 401.400 -0.018 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccn(-c3ccccc3)n2)n(C)c1=O 765724035 HMSFZIRNDANGCX-UHFFFAOYSA-N 422.405 -0.919 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)nnn1-c1ccc2c(c1)OCCO2 816872677 NUXXWOCWTIQPTI-LBPRGKRZSA-N 424.421 -0.038 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)c1cc2n(n1)CCN(C)S2(=O)=O 1628576887 FGULCJRXDZOCQL-UHFFFAOYSA-N 409.424 -0.634 50 10 HBGE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NNC(=O)[C@H]1COCCO1 1682583131 VHVYVXLHKIGNTE-OAHLLOKOSA-N 412.468 -0.833 50 10 HBGE CCCN1C(=O)C(=CNNC(=O)CN2C(=O)COc3ccccc32)C(=O)NC1=S 2040476032 SZBWYVHXTZXFAM-UHFFFAOYSA-N 417.447 -0.430 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](Oc1ncc(Br)cc1B(O)O)C(N)=O 2217174711 XRPRAACQSDBASV-VIFPVBQESA-N 404.026 -0.719 50 10 HBGE O=C(NC[C@H]1CCCN(S(=O)(=O)c2sccc2B(O)O)C1)C(F)(F)F 2267615822 JLGOPCWKVHEEKH-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE CCN(C[C@@H](C)NC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267625630 SYQUPYRJPYAALT-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE CN(C)[S@](=O)(=NC(=O)[C@@H]1C[C@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2281868768 MOOIJANQYHKNCX-UKTFLOIMSA-N 404.298 -0.212 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)c3ccc(F)c(B(O)O)c3)C[C@@H]21 2282338324 QLQOQJQKBVRKCT-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE COc1ccc(S(=O)(=O)N(C)CCN(C)C(=O)OC(C)(C)C)cc1B(O)O 2282355769 KQGQJFOGVBHZKU-UHFFFAOYSA-N 402.278 -0.138 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2COCCN2Cc2ccccc2)sc1B(O)O 2282376953 LAFPFPDVHXXENN-OAHLLOKOSA-N 410.326 -0.084 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@H]1CNCCN1Cc1ccccc1 2282852818 URXKZCKORHWEQR-MRXNPFEDSA-N 409.342 -0.679 50 10 HBGE N#CC(=Cc1ccc(Br)cc1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 2329656746 FJTFOJVKPWVKDQ-SGPHBRAGSA-N 413.224 -0.728 50 10 HBGE Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)[C@H]1COCCO1 744653189 SCGILIFFQIPUFJ-CQSZACIVSA-N 400.457 -0.624 50 10 HBGE O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1COCCO1 745789940 SOAAUWJERAQQGE-INIZCTEOSA-N 405.455 -0.529 50 10 HBGE O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@@H]1COCCO1 745978282 JFSVYUJZINCFCD-AWEZNQCLSA-N 419.481 -0.804 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 800055650 LTDLMGMNHLKQNF-HUBLWGQQSA-N 412.468 -0.125 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 800837118 ATIDGWHIVKLEGC-AWEZNQCLSA-N 421.497 -0.558 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NCCSS(C)(=O)=O)CC2)cn1C 1455115802 QOFZWBOODYBALC-UHFFFAOYSA-N 424.570 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)COCC(=O)NCc1cccnc1 1471965078 VSXFBKXZTDOYDW-AWEZNQCLSA-N 421.454 -0.129 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@]2(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 1540476226 MMHHTCNNVRTNSK-PSTGCABASA-N 417.484 -0.548 50 10 HBGE COC(=O)[C@H]1CN(CC(=O)NNC(=O)C2CC2)CC12CN(C(=O)OC(C)(C)C)C2 1620615716 CWSAANBVIJNHMQ-CYBMUJFWSA-N 410.471 -0.114 50 10 HBGE CN1C(=O)CC[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 1682183848 RJGSTJODAXRNDY-MRXNPFEDSA-N 416.482 -0.324 50 10 HBGE CCCC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282065054 INIPYDWDXMCVJQ-NSHDSACASA-N 404.298 -0.538 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 2282082570 KHUXSOIEUMDSTM-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)[C@@H](CCNS(=O)(=O)c1c(B(O)O)cnn1C)NC(=O)OC(C)(C)C 2282091560 HKZJSXBMPQNIMO-GFCCVEGCSA-N 404.298 -0.682 50 10 HBGE Cn1cc(C(=O)N=[S@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)nc1B(O)O 2282245661 FQIYMKFMCFBHHM-BLBHWQHRSA-N 400.266 -0.747 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1F 2282363307 GETPQOKMRJRMEU-LLVKDONJSA-N 406.241 -0.988 50 10 HBGE CCC(CC)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282739064 CSKSQMXGGXLYRY-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2365422750 YUMFPBVTCWEBEH-SNVBAGLBSA-N 406.241 -0.677 50 10 HBGE Cc1c(C(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)nnn1-c1nonc1N 27519303 UCSNUEIIERLWFB-AYSLTRBKSA-N 401.299 -0.058 50 10 HBGE O=C(NN=Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1ccccc1O 254750572 DAYZDXAEXUWALV-BFMVXSJESA-N 418.402 -0.665 50 10 HBGE Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 728372957 VZJYEWDKNYJACN-GFCCVEGCSA-N 403.482 -0.754 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)(F)F)[C@H]1COCCO1 794867216 VQVAOQZOERMBEI-MRVPVSSYSA-N 418.371 -0.295 50 10 HBGE COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@H]3COCCO3)C2=O)c(OC)c1 805165520 LZMZMKUWWUOMCR-GDBMZVCRSA-N 422.438 -0.450 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc(F)ccc2Cl)n(C)c1=O 814316751 HDLMTYCIWSCXOY-UHFFFAOYSA-N 408.777 -0.313 50 10 HBGE O=C(NNC(=O)[C@H](O)[C@](O)(c1ccccc1)C(F)(F)F)[C@H]1CCS(=O)(=O)C1 1440705206 PJMUFNMWAVQTQL-NURSFMCSSA-N 410.370 -0.621 50 10 HBGE COc1ccccc1-c1cc(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)n[nH]1 1598299526 SUHLAQBFOWYSDR-UHFFFAOYSA-N 408.436 -0.093 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267611065 NUMRTIDWSTUOFN-UHFFFAOYSA-N 406.291 -0.876 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)c2cscc2B(O)O)C1 2267622234 OCKVNFHODQDDNU-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NC(=O)c2ccc(B(O)O)s2)C1 2281618058 DPLJJSWIDGOZKS-KOLCDFICSA-N 418.302 -0.810 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cccc(B(O)O)c1 2282098450 SLNUQHIZLGZJRM-ZDUSSCGKSA-N 400.262 -0.072 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282362568 HROYEZWAUIYKPN-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282384293 LGMFYTCPMFEBDJ-MNOVXSKESA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@@](C)(=O)=NC(=O)c2cnsc2B(O)O)C1 2337340294 DUOLQERFFVGIFC-AREMUKBSSA-N 403.291 -0.072 50 10 HBGE Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)[C@@H]1COCCO1 744653188 SCGILIFFQIPUFJ-AWEZNQCLSA-N 400.457 -0.624 50 10 HBGE COc1cc(C=NNC(=O)[C@@H]2COCCO2)ccc1OCC(=O)N1CCOCC1 745206695 AUFHAGJDVXXLIJ-KRWDZBQOSA-N 407.423 -0.202 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CN([C@H]4CCOC4)C3)cc2)CC1 1137652013 WNKLQZCFQVURJQ-KRWDZBQOSA-N 423.539 -0.214 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1cc[nH]n1 1147064738 JTKBKEHPLQWTNA-UHFFFAOYSA-N 408.259 -0.027 50 10 HBGE C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1nnc2c(=O)n(C)ccn12 1254666014 IKZAQKGZDHVNCB-SNVBAGLBSA-N 403.374 -0.135 50 10 HBGE CNS(=O)(=O)CCNC(=O)NNC(=O)COc1ccccc1Br 1469833684 NQRLJMSYHPCIFP-UHFFFAOYSA-N 409.262 -0.293 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3[nH]cnc3C)CC2)cc1 1587964473 SNRZOLKDHRRFQY-UHFFFAOYSA-N 420.495 -0.206 50 10 HBGE O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CC(=O)NC(=O)N1 1622159672 WIVVTXNSHHKKIO-AWEZNQCLSA-N 422.873 -0.797 50 10 HBGE CSCCNC(=S)NNC(=O)[C@H](CC(N)=O)NC(=O)Cc1cccc(F)c1 1631879436 GKTQOYLGIYQKBP-LBPRGKRZSA-N 415.516 -0.413 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 1641247127 PLYLGERBXYQAOC-SDDRHHMPSA-N 407.489 -0.402 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2sccc2B(O)O)C1 2267201460 OVEZJPCWWKJOSO-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H](CO)CNC(=O)OC(C)(C)C)c1B(O)O 2267388590 ALKZNTCBEMYKMX-JTQLQIEISA-N 408.307 -0.791 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2267392745 NMBHWYTYVHVPPR-NXEZZACHSA-N 405.307 -0.360 50 10 HBGE O=C(N1CCC[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1)C(F)(F)F 2267620544 KQRZTFJCRGXORH-QMMMGPOBSA-N 400.209 -0.493 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C1CC1 2282078787 NHHYTUOJZVOUQU-OAHLLOKOSA-N 402.282 -0.928 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CCCCN1C(=O)OC(C)(C)C 2282083997 SIDITGUEPYIOTF-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282380612 LRLXGPKBPDOETL-UHFFFAOYSA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3cc(B(O)O)cs3)[C@@H]2C1 2282704443 KBMTUNLAKDCPMP-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cscc2B(O)O)[C@H](CO)C1 2282742167 YTAVRYRQHWZESL-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1ccccc1B(O)O 2283954154 BKCGQTPTZGUDKV-ZDUSSCGKSA-N 400.262 -0.367 50 10 HBGE Cc1cc(C(=O)NNC(=O)c2ccc(C(=O)NNC(=O)c3cc(C)n[nH]3)cc2)[nH]n1 100061612 YUGHLPIKLODYLA-UHFFFAOYSA-N 410.394 -0.101 50 10 HBGE O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)[C@H]1COCCO1 744649528 SVYFACBKKPJUQB-GDBMZVCRSA-N 402.407 -0.975 50 10 HBGE CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)[C@@H]1COCCO1 778828760 LBAHATVGVPQCQV-ZDUSSCGKSA-N 401.366 -0.192 50 10 HBGE CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 814484239 QBDIESDRJSCHBN-LLVKDONJSA-N 407.456 -0.056 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 816872120 BUDHPAPIHPHZFS-LLVKDONJSA-N 422.442 -0.119 50 10 HBGE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cn(C)nn2)c(OC)c1 1300746680 FVPDUWABDAFUKZ-CQSZACIVSA-N 402.411 -0.102 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)CN2CCOC3(CCS(=O)(=O)CC3)C2)c1 1460957742 XSCYCHSLAYLZSO-UHFFFAOYSA-N 406.464 -0.401 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)ccc1=O 1463160449 YHQOCILAHPMZMK-LJQANCHMSA-N 415.381 -0.247 50 10 HBGE O=C(NNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)[C@H]1C(=O)Nc2ccccc2C1=O 1637585406 ZMBIBDUNVOUEMM-JLLWLGSASA-N 401.297 -0.069 50 10 HBGE O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1638870978 NJNBGZQEDIOZOI-AWEZNQCLSA-N 407.471 -0.358 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNc1ncc(Br)cn1 1683460117 PSBUBVIEVHJZST-CYBMUJFWSA-N 401.221 -0.507 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)n1 2266888546 QJGSAMZOACJFAT-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1cc(B(O)O)cs1)NC(=O)OC(C)(C)C 2267611757 COFVEBRKEUBAQY-LLVKDONJSA-N 408.307 -0.364 50 10 HBGE Cn1nc(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)c(B(O)O)c1Cl 2281656844 QNHVBCQJWPSICZ-UHFFFAOYSA-N 420.684 -0.388 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2281919935 LEIFDUBMWNFFQV-MHZLTWQESA-N 402.282 -0.312 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282378182 BPTVWRSKJNTLFV-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE COC[C@]1(NS(=O)(=O)c2ccc(B(O)O)s2)CCN(C(=O)OC(C)(C)C)C1 2282711911 IZGWHAJPQQDNOZ-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(B(O)O)s1)[C@H](O)C(F)(F)F 2284060017 KAKSKQXDLAYAJB-ZJUUUORDSA-N 412.195 -0.139 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369896656 DGXQOSZHOMDQAF-XXILOJSOSA-N 420.680 -0.961 50 10 HBGE CC(=O)NCC(=O)NCC(=O)NN=c1cc(C(F)(F)F)[nH]c(-c2ccncc2)n1 736710891 ZKDJRLQNUAKITM-UHFFFAOYSA-N 411.344 -0.325 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 755354237 OJVWHFJEVVGUFI-AWEZNQCLSA-N 414.440 -0.724 50 10 HBGE Cn1nc(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)c2ccccc2c1=O 1231335766 VMXNPHKDKPJUEM-UHFFFAOYSA-N 407.452 -0.298 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1OC 1252878345 QQJRNYRIZDTPEM-ZYHUDNBSSA-N 403.482 -0.070 50 10 HBGE CCn1nc(C(=O)NNC(=O)CN2CCCCS2(=O)=O)c2ccccc2c1=O 1538589430 YOHMFSFEKKAAGK-UHFFFAOYSA-N 407.452 -0.397 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1 1641668054 YZZQYAPHNGMHSG-HNNXBMFYSA-N 404.448 -0.385 50 10 HBGE CCNS(=O)(=O)c1cccc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1 1673503599 SJWKPNPLDSOXLG-HNNXBMFYSA-N 404.514 -0.134 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 1682008388 IQJNASJNVCNGRR-ONGXEEELSA-N 406.411 -0.002 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC1(CNC(=O)OC(C)(C)C)COC1 2267392403 XEHMSPIXEJXKIM-UHFFFAOYSA-N 406.291 -0.692 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267719913 HBFCRFPGKUBYFD-SNVBAGLBSA-N 403.291 -0.582 50 10 HBGE CN(CC(C)(C)CNC(=O)OC(C)(C)C)S(=O)(=O)c1cncc(B(O)O)c1 2282094073 LCFAOOUYNQTSEK-UHFFFAOYSA-N 401.294 -0.067 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N(CCO)CCNC(=O)OC(C)(C)C 2282417974 FUHCNHAVAYXTPA-UHFFFAOYSA-N 402.278 -0.817 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)NCc2ccc(B(O)O)s2)C1 2283985856 BAABPFQLGMWPNU-UHFFFAOYSA-N 406.216 -0.339 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cnc(B(O)O)s1)[C@@H](O)C(C)(C)C 2284061932 HOSFUEAIHUTFHZ-WDEREUQCSA-N 401.294 -0.261 50 10 HBGE COc1cc([N+](=O)[O-])c(/C=N/NC(=O)[C@@H](C)Sc2n[nH]c(=O)[nH]c2=O)cc1O 169890926 FGILBYOWGBQLJW-SVSQBPIJSA-N 410.368 -0.289 50 10 HBGE CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)CCOc2ccccc2)CC1 730825428 ARPJJMZAMZFKSI-UHFFFAOYSA-N 405.455 -0.133 50 10 HBGE Cc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 752236862 JHUDRSIDXCGYTJ-UHFFFAOYSA-N 417.447 -0.415 50 10 HBGE Cc1nc(C(C)C)ccc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 815826815 BSSPJHSNTUAIRS-UHFFFAOYSA-N 413.438 -0.278 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCn2ncc(I)c2C1 1178733168 BUKVULREDFKYKT-UHFFFAOYSA-N 414.971 -0.037 50 10 HBGE O=C(Cn1nc2n(c1=O)CCCC2)N1CCN(S(=O)(=O)CBr)CC1 1546252004 NYYJMZNAFWUUJI-UHFFFAOYSA-N 422.305 -0.793 50 10 HBGE C[C@]1(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCS(=O)(=O)N1 1623873111 XRGIOAQLMNRHPZ-CQSZACIVSA-N 403.486 -0.787 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267627288 WMUZGGIOWJHVKF-UHFFFAOYSA-N 403.291 -0.795 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272655977 SHIRCZDPWNNHQY-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282380931 PRFZTWIPCPMOHI-MNOVXSKESA-N 402.282 -0.882 50 10 HBGE COC1(CNS(=O)(=O)c2ccc(B(O)O)cc2)CN(C(=O)OC(C)(C)C)C1 2282707165 VPDRUWHPNYWYBB-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 2282737221 BLTMUNJPKLQMJE-OLZOCXBDSA-N 400.262 -0.755 50 10 HBGE O=C(NN=Cc1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1)c1ccncc1 2297659769 JLTKHQOIUGCLNI-BCDMZGRMSA-N 403.391 -0.976 50 10 HBGE C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)[C@@H]1COCCO1 801756881 YICMJKZTTBCFDG-OCCSQVGLSA-N 400.457 -0.511 50 10 HBGE CCN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccc(B(O)O)cc2)CC1 1305523226 CXZCIBCTDKOYHF-HXUWFJFHSA-N 409.295 -0.128 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)cn2ncnc12 1440707100 XBTIBSOUYOGGDL-SSDOTTSWSA-N 402.230 -0.313 50 10 HBGE CC1=C(C)C(=O)N(CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1=O 1463541651 TWOUVDNLOYCTIA-UHFFFAOYSA-N 407.452 -0.164 50 10 HBGE O=C(NCCN1C[C@H]2CCCCN2C1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 1470896464 LMMVYYSOFVQMAR-OAHLLOKOSA-N 413.442 -0.104 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c1 1565158500 VIGGJFLOOHEGPU-UHFFFAOYSA-N 401.445 -0.862 50 10 HBGE CC(C)(C)OC(=O)NOCCNS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2247947672 ZAIPKCQHVASXSX-UHFFFAOYSA-N 400.671 -0.184 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267210175 FSEPCWKYZHQJBA-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cncc(B(O)O)c2)[C@@H](F)C1 2282103631 TVEZTNRZZKSRDC-STQMWFEESA-N 403.241 -0.613 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1 2282706355 KSXMMCJAYGDUFN-NSHDSACASA-N 402.282 -0.832 50 10 HBGE COc1ccc(/C=C\C(=O)NCC(=O)NNC2=c3cc([N+](=O)[O-])ccc3=NC2=O)cc1 38166305 MORSMDQMPAWNIQ-WTKPLQERSA-N 423.385 -0.678 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CS(=O)(=O)N(C)C)CC2)cc1 752577143 FLRZFIPQWBLWFO-UHFFFAOYSA-N 411.528 -0.849 50 10 HBGE CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)[C@@H]3COCCO3)cc2)CC1 757582222 MFYMZDQMSDOAHN-KRWDZBQOSA-N 419.482 -0.039 50 10 HBGE Cc1ccc(C)c2c1NC(=O)C2=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 764812070 FWKHZHTVYRLKLJ-UHFFFAOYSA-N 409.406 -0.477 50 10 HBGE CC(C)C[C@@H](C)OCCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765723924 FYXGQRGMOHDMPU-GFCCVEGCSA-N 408.459 -0.578 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cnc(C3CC3)s2)n(C)c1=O 766635281 AWICRVOBTWLOHE-UHFFFAOYSA-N 403.424 -0.771 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cnc3ccccc3c2)n(C)c1=O 784444181 DQDXSEHBGKGJMN-UHFFFAOYSA-N 421.417 -0.628 50 10 HBGE O=C(c1ccc(I)cc1-n1cnnn1)N1CC[C@@H](B(O)O)C1 864231769 RYRSAHILLZWNHB-MRVPVSSYSA-N 412.984 -0.044 50 10 HBGE CC(C)(O)C(=O)NNC(=O)c1ccc(I)cc1-n1cnnn1 1138284584 TZJUDQXSAPZUPX-UHFFFAOYSA-N 416.179 -0.201 50 10 HBGE O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)[C@H]1CCN1C1CCOCC1 1156183615 DBSSPWKOMIRPGB-OAHLLOKOSA-N 402.517 -0.407 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCNC(=O)c1cc(F)ccc1Br 1301697189 JOBUZFXOHHPODL-UHFFFAOYSA-N 424.248 -0.100 50 10 HBGE O=C(CN1CCCC2(CC2)S1(=O)=O)NNC(=O)c1ccc(-n2cnnn2)cc1 1540515204 WUHKZYCPIKKRPQ-UHFFFAOYSA-N 405.440 -0.619 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn(CCO)c1 1545423804 AZPFDZUSZDGIBI-UHFFFAOYSA-N 400.439 -0.906 50 10 HBGE CNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1 1556921406 DXGCTRDRLURLHC-UHFFFAOYSA-N 413.525 -0.380 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NNC(=O)[C@H]1CCC(=O)N1 1630431618 LROJYOYXALUKNN-YYTHCXKUSA-N 416.356 -0.602 50 10 HBGE CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)CS(C)(=O)=O 1634355904 VMMSPQQWXPTVIP-UHFFFAOYSA-N 407.395 -0.563 50 10 HBGE COC1(CCNC(=O)c2cc(B(O)O)sn2)CN(C(=O)OCc2ccccc2)C1 2267423307 KXBYMJREVRXCMR-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267615165 YVBXKUXZCBSJHQ-UWVGGRQHSA-N 406.291 -0.612 50 10 HBGE CCn1cc(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)nc1B(O)O 2281642526 XVTOQGWWOAZBQH-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@](C)(CNC(=O)OC(C)(C)C)C1 2282082758 KWOKFFPTOQPGOM-OAHLLOKOSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2CN(S(=O)(=O)c3ccc(F)cc3B(O)O)C[C@H]12 2282360675 GFYZPIXKMRDGNA-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE O=C(NC[C@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1)C(F)(F)F 2282369980 OAVXZCWFWJIOLJ-MRVPVSSYSA-N 415.224 -0.957 50 10 HBGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282377557 SGFDDTMGMVPTKL-LLVKDONJSA-N 419.334 -0.111 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 2282706873 RONNUODYEANGKA-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](O)C[C@H](NC(=O)OC(C)(C)C)C1 2282729336 LRVCSPSTLVYSOG-QWRGUYRKSA-N 420.318 -0.615 50 10 HBGE C[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765729741 FQGXWQRSWDZCDZ-NSHDSACASA-N 416.413 -0.401 50 10 HBGE Cc1c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cnn1CC(C)C 767087592 GAJNGCOWPSPJKN-UHFFFAOYSA-N 416.442 -0.944 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cnc(Cl)c(F)c2)n(C)c1=O 803205246 WZNVHRIKHKHYPB-UHFFFAOYSA-N 409.765 -0.918 50 10 HBGE CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816878567 UQQKTWCFABNTLK-SNVBAGLBSA-N 410.431 -0.261 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(I)cn1 1135771342 JHWBRCKTHIDHPL-ZETCQYMHSA-N 409.205 -0.118 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)N[C@@H]1CCS(=O)(=O)C1 1292039073 RCRJHHVVUHIJMA-LLVKDONJSA-N 409.399 -0.497 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(c2cc(N3CCOCC3)ncn2)CC1 1444616726 DKIKLXIPJFWHEW-UHFFFAOYSA-N 415.234 -0.906 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2CCC(=O)N2)s1 1533745192 XKZJOQITHFDEGP-QWRGUYRKSA-N 400.482 -0.364 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CS(=O)(=O)C[C@@H]2C(F)(F)F)C[C@@H](C)O1 1638062696 CODVVRWULFEAPH-KKOKHZNYSA-N 415.434 -0.144 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc2c(cc1Br)OCO2 1638299968 BRXWBNRSIKPKGB-LURJTMIESA-N 408.230 -0.124 50 10 HBGE COc1ccnc(NNC(=O)NCC(=O)NCC(=O)N(C)Cc2ccccc2)n1 1638311602 SKCSNBTVPQLBOO-UHFFFAOYSA-N 401.427 -0.114 50 10 HBGE CO[C@]1(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)CCS(=O)(=O)C1 1684253202 ZWSHGKGECFJUNG-KRWDZBQOSA-N 409.468 -0.350 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2255885154 LKEOZBJXBPPEHV-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1 2282362366 FGZKQNITSGMKRY-NSHDSACASA-N 402.282 -0.975 50 10 HBGE COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NNC(=O)Cc2ccccn2)CC1 729232113 DFCPBSJYLGWMTJ-OAHLLOKOSA-N 406.487 -0.476 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(C(=O)N(C)C)CC3)cc2)CC1 806781259 AADXXKLSGNHZIR-UHFFFAOYSA-N 409.512 -0.066 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCN1 815826864 DDAGNGBKBOWTMY-HNNXBMFYSA-N 401.467 -0.492 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CC(=O)N(c2ccc(F)c(F)c2)C1 1463793924 WWPDMCWXDZCFAW-VHSXEESVSA-N 401.391 -0.100 50 10 HBGE Cc1ccc(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1Cl 1465790072 GJBLERMACDJUET-UHFFFAOYSA-N 418.841 -0.214 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2sccc2B(O)O)C1 2267607449 NKJULCWQXXVWAY-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N1CC(ONS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)C1 2267621151 DRXVBWFOFLPTGL-UHFFFAOYSA-N 406.653 -0.151 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2cscc2B(O)O)C1 2267622235 OCKVNFHODQDDNU-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC1(CO)CCN(S(=O)(=O)c2ccc(B(O)O)s2)CC1 2282080341 IQYOGFNLYMUMHA-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE CCCC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1c(B(O)O)cnn1C 2282084848 RKHOFGBNJUBECU-NSHDSACASA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1CO 2282086623 OHZIQMFWNLUDFE-WDEREUQCSA-N 420.318 -0.676 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCN(C(=O)OC(C)(C)C)CCC1 2282698889 FVZDYNVSEVIMSW-UHFFFAOYSA-N 402.282 -0.879 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N1CCOCCN1C(=O)OC(C)(C)C 2282728235 PZCWWEBNHLNLDZ-UHFFFAOYSA-N 400.262 -0.152 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2285207432 XYUOZOSBELBQQI-DLBZAZTESA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2csnc2B(O)O)C1 2288536580 SIQMMZLJQLUFAM-UHFFFAOYSA-N 407.204 -0.830 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1cc(B(O)O)cs1 2334264152 NLULUNNPKALXCX-WCQGTBRESA-N 402.303 -0.038 50 10 HBGE COc1c(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C)ccc([N+](=O)[O-])c1O 27519292 DIWGVGXVDCFJKY-FZSIALSZSA-N 403.315 -0.073 50 10 HBGE CCc1c(C(=O)NNC(=S)NCCSC)cnc2c1c(=O)n(C)c(=O)n2C 769770078 YQSKOLSVMKDGEU-UHFFFAOYSA-N 410.525 -0.334 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cccc(S(=O)(=O)NC2CC2)c1 816885252 UUIWBSBMBRXLTR-GFCCVEGCSA-N 404.452 -0.258 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1306514570 VUQHAFPCBPEQBV-YPMHNXCESA-N 414.459 -0.698 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)cn1 1328652880 GVONWPSRDHEGBH-HZSPNIEDSA-N 411.484 -0.709 50 10 HBGE CS(=O)(=O)SCCNC(=O)CCC(=O)N1CCN(c2ncccn2)CC1 1471451959 UPLPFYORDRROQC-UHFFFAOYSA-N 401.514 -0.286 50 10 HBGE O=C(C[C@H]1CS(=O)(=O)c2ccccc2O1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1539402441 YVJSZWHFGOTPKN-MNOVXSKESA-N 402.450 -0.807 50 10 HBGE O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCCCO1 1628548398 XLBLOWPNGWMZBN-BYNSBNAKSA-N 415.512 -0.187 50 10 HBGE O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2)C(=O)N1 1646045798 STJPXXXRHRIQRZ-RDJZCZTQSA-N 414.462 -0.094 50 10 HBGE CC(C)(C)OC(=O)N1CCN(Cc2cc(B(O)O)cc(N3CCNCC3)c2)CC1 1887522519 NUADGLDBEPYORK-UHFFFAOYSA-N 404.320 -0.171 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(CC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Cl)C1 2130056493 WJXQHCFIMCANJN-QWRGUYRKSA-N 411.908 -0.922 50 10 HBGE COC(=O)[C@@H]1C[C@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231658127 APIOVTYZFCDBCX-GJZGRUSLSA-N 401.184 -0.512 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2247940969 CCMDBXDVJBDLBQ-UHFFFAOYSA-N 410.282 -0.025 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282073285 DYSJNENOAOGXRC-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)cc1S(=O)(=O)N1CCOCC1 744642154 FTEUCVQBUVBWCX-AWEZNQCLSA-N 413.452 -0.808 50 10 HBGE COC(=O)Cn1cc(S(=O)(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1 788501040 SNIJQWKPJPJAIZ-HOCLYGCPSA-N 408.436 -0.062 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)nnn1-c1ccc2c(c1)OCCO2 816872676 NUXXWOCWTIQPTI-GFCCVEGCSA-N 424.421 -0.038 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@]1(F)CCS(=O)(=O)C1 1349691611 BQHDZRPRDRYEGS-SFHVURJKSA-N 412.487 -0.127 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1noc2c1COCC2 1622153381 DIOFYWORTBITAS-UHFFFAOYSA-N 413.434 -0.034 50 10 HBGE O=C(NNC(=O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F)c1ccc(-n2cnnn2)cc1 1624704132 WQDCGFOFDGIVDT-QWRGUYRKSA-N 418.357 -0.354 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnc2c(c1)c(C(F)(F)F)nn2C 1648534720 QLCNBEZTXQJKSS-LURJTMIESA-N 408.362 -0.314 50 10 HBGE Cn1nc(C(=O)N[C@H]2C[C@@](F)(CNC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281663901 RMWUWSCORZZEMX-APXWNHPRSA-N 404.635 -0.122 50 10 HBGE Cc1nc(S(=O)(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c(B(O)O)n1C 2282413832 KDUKUZPMSKHGID-UHFFFAOYSA-N 402.282 -0.960 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2CC(B(O)O)C2)[C@@H]2CS(=O)(=O)C[C@H]21 2282485013 IBVQGCNLECIJII-FIYWTHMPSA-N 402.278 -0.516 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282704049 FRHFFARNWSCUIQ-AWEZNQCLSA-N 402.253 -0.150 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](NS(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2282736283 NVBDJTWFXXYJPG-USWWRNFRSA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CNS(=O)(=O)c1cncc(B(O)O)c1)C(C)(C)C 2362084279 LKZWPKKRTUFUKL-ZDUSSCGKSA-N 401.294 -0.021 50 10 HBGE CC(C)(C)OC(=O)N1CC(C(=O)NCc2sccc2B(O)O)(S(C)(=O)=O)C1 2379890493 VQLNJZLXFBGPPQ-UHFFFAOYSA-N 418.302 -0.922 50 10 HBGE CC(CN1Cc2ccccc2C1=O)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 754963443 BMRUICCRCCIPCH-UHFFFAOYSA-N 423.433 -0.418 50 10 HBGE Cc1nc(Cl)ccc1CC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 764753321 VVNXOVGCWOVPRT-UHFFFAOYSA-N 419.829 -0.819 50 10 HBGE COc1cc(OC)c(NC(=O)NNC(=O)CNS(=O)(=O)N(C)C)cc1Cl 1467439484 USNXKCHHSRSIPL-UHFFFAOYSA-N 409.852 -0.094 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CS(=O)(=O)C[C@H]1C 1638537276 JZEYMUMHOXBQBX-KOLCDFICSA-N 417.513 -0.335 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@H]3CS(=O)(=O)C[C@@]3(C)C2)cc1OC 1655005911 XMNUROYKWFGJAY-SCLBCKFNSA-N 411.480 -0.169 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)C1 1884252068 FDEIKLXFXHYBNX-LNLATYFQSA-N 405.826 -0.350 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1sncc1B(O)O)OCc1ccccc1 2255687258 DQBFFWRUUMZMMN-KBPBESRZSA-N 405.241 -0.363 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267208879 OHYGUDIVMQPSER-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2cc(B(O)O)cs2)CCOC1 2267474268 ROSRAZMYWSZNOK-CQSZACIVSA-N 406.291 -0.610 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cscc1B(O)O 2267618161 BYSQCVCZDLFUQS-JTQLQIEISA-N 406.291 -0.011 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCC2(CNC(=O)OC(C)(C)C)CC2)n1 2282365539 ARUFLRONAJRPPV-UHFFFAOYSA-N 402.282 -0.927 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1B(O)O 2282372204 VKTQEHIGAVIFGS-WDEREUQCSA-N 420.318 -0.697 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 2282719133 HVRIOGQFFYPLFL-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2282726121 MYICDLJSQQNEMH-HNNXBMFYSA-N 422.696 -0.426 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)c2cc(B(O)O)c(F)cc2Cl)C1 2285967146 WCXWZODKGIUUJJ-UHFFFAOYSA-N 402.615 -0.130 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]1C2 2359274363 YCPMFZOANWUDCW-CKYFFXLPSA-N 417.318 -0.360 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@]3(C)CCN(C)C3=O)cc2)CC1 1137652005 WCZADBKBBICVNR-GOSISDBHSA-N 409.512 -0.066 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)ccc1=O 1179627914 BCFWERXKYTYRDB-INIZCTEOSA-N 414.340 -0.222 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1454060170 JHEGYUXEWVKFDH-CHWSQXEVSA-N 408.480 -0.027 50 10 HBGE C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)C2=O 1635371967 MEULYOPBBSRJFU-RCDCFZSISA-N 421.498 -0.112 50 10 HBGE CN1CCO[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1=O 1635520815 ZIEAYQAJKCISRZ-QGZVFWFLSA-N 423.901 -0.538 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1c(C(F)(F)F)nn(CCO)c1C(F)F 1642619376 JKFKSSNKGWHUIE-UHFFFAOYSA-N 408.305 -0.363 50 10 HBGE O=C(NNc1cc(Br)ncn1)[C@H]1CC(=O)N(CCN2CCOCC2)C1 1644899442 ARCKAZNGBSCSHM-NSHDSACASA-N 413.276 -0.137 50 10 HBGE O=C(N[C@H]1C[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1)OCc1ccccc1 2255681511 SVXIPBSLAYJQTJ-GASCZTMLSA-N 405.241 -0.503 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](CO)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267387364 HXLMSOSHWAVNIQ-SNVBAGLBSA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282065629 NTPOBSQBTRKWCR-MRXNPFEDSA-N 400.262 -0.983 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 2282079110 RPMVCERQAGNJMU-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE CCC1(CNS(=O)(=O)c2cc(B(O)O)nn2C)CN(C(=O)OC(C)(C)C)C1 2282082216 IFDPSBYDTIUSBH-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2nscc2B(O)O)CC1 2282314949 HKRASXVEWGFDPT-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE N#C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CCN1Cc1ccccc1 2282335048 KBMDJAUZEQDVAC-CQSZACIVSA-N 406.298 -0.637 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282368265 NIZJDOOAHMSYCT-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C 2282737069 APRGCSUJFZLHLV-AREMUKBSSA-N 420.318 -0.014 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC12CC2 2282738879 AQIPPSBMNMHQFR-NSHDSACASA-N 417.318 -0.358 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cc(-c3ccccc3)n[nH]2)n(C)c1=O 767791300 PEFBCEMXMNHIAQ-UHFFFAOYSA-N 406.406 -0.026 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)c1cc(B(O)O)ccc1F 1138741082 DXNGMZQCRJJRAM-UHFFFAOYSA-N 402.159 -0.508 50 10 HBGE COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CC(=O)NNC(=O)c1ccc(C#N)cc1 1192443007 GGSYKHLNIXGLHM-CABCVRRESA-N 402.407 -0.254 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)ccc1=O 1478422063 CGHOFSLPJNQQCX-UHFFFAOYSA-N 413.500 -0.078 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccc(C(F)F)c(F)c2)n(C)c1=O 1545423884 DWJPEJFLZJPISW-UHFFFAOYSA-N 424.339 -0.028 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1567306538 SKYZPSVQDQIMTI-UHFFFAOYSA-N 421.520 -0.096 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)n(C)c1=O 1587964903 XTMWALRUHQIURB-CABCVRRESA-N 424.461 -0.150 50 10 HBGE O=C(NNC(=O)[C@H]1CCCS1(=O)=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1641062352 SZTJIHWFJVPVMW-CQSZACIVSA-N 415.493 -0.191 50 10 HBGE C[C@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1cc(B(O)O)ccn1 2108234682 QRKJYCQNEKVTDK-KRWDZBQOSA-N 421.215 -0.473 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCCCCNC(=O)OCc1ccccc1 2267209005 PXGVBUBNUKJKDP-UHFFFAOYSA-N 424.288 -0.525 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cscc1B(O)O 2267625346 NYKSWMUWWGSMRM-JGVFFNPUSA-N 400.209 -0.352 50 10 HBGE Cc1c(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2281604476 ROWDXBGSUIBITO-GJZGRUSLSA-N 416.243 -0.778 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2282067304 YDSHIGKYCSGBDA-JTLRNRKASA-N 418.302 -0.613 50 10 HBGE Cn1cc(B(O)O)c(C(=O)NCC2(F)CCN(C(=O)OCc3ccccc3)CC2)n1 2282172616 ZCOPLTTWOHGBEX-UHFFFAOYSA-N 418.234 -0.029 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ccsc2B(O)O)[C@H](O)C1 2282335056 KDMLXNLXHPWVTJ-VXGBXAGGSA-N 420.318 -0.782 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@@H]2CCCN2C(=O)OC(C)(C)C)n1 2282376848 JHSGERFACLJDME-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](NC(=O)C(F)(F)F)C1 2282730012 WAKOVOZJEQHKAE-IONNQARKSA-N 414.236 -0.186 50 10 HBGE CN(C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1)C(=O)OC(C)(C)C 2282743794 UECXXBAHACFZRT-LLVKDONJSA-N 419.334 -0.159 50 10 HBGE COc1ccc(/C=N/NC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)cc1[N+](=O)[O-] 27527413 WJSNMLWKUYVDQG-FBCYGCLPSA-N 415.366 -0.499 50 10 HBGE O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)C(F)(F)Oc1ccccc1 742702568 UKJFRYXLFBPSMG-RFHZTLPTSA-N 409.345 -0.032 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)NCC1CC1 1442296728 SXIJLKUMIBJJQB-UHFFFAOYSA-N 403.482 -0.141 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C1CS(=O)(=O)C1 1445562468 NRKNDVOGPDWJGR-UHFFFAOYSA-N 414.915 -0.350 50 10 HBGE COC[C@]1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)CN(C(=O)OC(C)(C)C)CCO1 1454062686 MCWPQMNCEASWEW-DIFFPNOSSA-N 400.432 -0.935 50 10 HBGE CN1CCn2nc(C(=O)NNc3cc(Br)ncn3)cc2S1(=O)=O 1471714735 QLQRPVDXQFTWOY-UHFFFAOYSA-N 402.234 -0.173 50 10 HBGE O=C(CSc1n[nH]c(O)n1)N1CCN(S(=O)(=O)CBr)CC1 1546252060 PSRNGCNAZZTQRN-UHFFFAOYSA-N 400.280 -0.571 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1 1638300693 VSVCLIRBIIPWEJ-VIFPVBQESA-N 423.900 -0.269 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cn1C 1648450321 JXAQAGIUOYMIQG-ZDUSSCGKSA-N 416.500 -0.130 50 10 HBGE CN(C)S(=O)(=O)NCCNC(=O)NNC(=O)c1ccc(Br)cc1 1681318413 REDDTHBYXRMSKV-UHFFFAOYSA-N 408.278 -0.211 50 10 HBGE C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1CN(C)CCN1C 1687863517 KVXGESLDZTYXDM-ZBFHGGJFSA-N 404.519 -0.342 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267612698 NDNINOHIXATERJ-USOBGDSLSA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2cscc2B(O)O)C1 2267623590 KOYCPGOXSAIKHW-LLVKDONJSA-N 408.282 -0.089 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@H](NC(=O)OCc2ccccc2)C1 2278564512 MQOCZGYKWXGXHS-AWEZNQCLSA-N 422.272 -0.821 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=S1(=O)CCN(C(=O)OC(C)(C)C)CC1 2281848099 WSBNMRLDBCGPKH-UHFFFAOYSA-N 400.266 -0.733 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282373697 PZCBKWRDXRYCSQ-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)Cc1ccccc1B(O)O 2282863191 OJEWGGURVNFEIH-KBPBESRZSA-N 400.262 -0.922 50 10 HBGE COc1ccccc1C(=O)NCC(=O)NN/C=C1\C=C([N+](=O)[O-])C=C([N+](=O)[O-])C1=O 38160383 NVNBPPQCBMRIQD-CSKARUKUSA-N 417.334 -0.166 50 10 HBGE COc1cc(C(=O)N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)ccc1C 746004658 XEDNSNKKJVTAFN-MRXNPFEDSA-N 406.439 -0.082 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)[C@@H]1COCCO1 760819152 SAAKFHUITNJIJA-STQMWFEESA-N 414.459 -0.545 50 10 HBGE CNS(=O)(=O)NCC(=O)NNC(=O)c1ccc(OCCC(C)C)c(OC)c1 774327311 NLTFBRIFFKFHRZ-UHFFFAOYSA-N 402.473 -0.065 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(F)(F)Cc2ccccc2)n(C)c1=O 793677968 XUPCRFNBVTXLMQ-UHFFFAOYSA-N 420.376 -0.541 50 10 HBGE CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCF)c(=O)n2Cc1ccccc1 1141362883 IIGDHAMYFGQTHN-UHFFFAOYSA-N 416.413 -0.065 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3n2CCOC3)CC1 1182822654 KCUJGHDNXAKXAF-UHFFFAOYSA-N 421.483 -0.499 50 10 HBGE C[C@@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(F)n1 1454096891 CLKRTBNYYMGHIQ-PRHODGIISA-N 402.429 -0.229 50 10 HBGE COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2)c1 1534064244 DYVFQHYAQPGXCT-INIZCTEOSA-N 418.450 -0.018 50 10 HBGE C[C@@H](O)CN(C)NC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1629362856 VICKTGJLZIQFME-OCCSQVGLSA-N 407.514 -0.888 50 10 HBGE CS(=O)(=O)c1cccc(Cl)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1631030403 WEMRDHQYHZABMB-QMMMGPOBSA-N 409.873 -0.125 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O 1647996814 GIPDNAHXBVUSNJ-VIFPVBQESA-N 418.269 -0.006 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ncc(B(O)O)cn1 2102382320 VAWHCBIKHMVWFE-UHFFFAOYSA-N 418.240 -0.780 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282070195 AJBAUGBFWGWZGO-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(NS(=O)(=O)c3sccc3B(O)O)CO[C@H]1C2 2282084106 NDMFBGJOELNVRO-PGUXBMHVSA-N 418.302 -0.469 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)cc1B(O)O 2282368749 VKQUEVCQWIZJOX-LLVKDONJSA-N 402.278 -0.186 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)C(=O)c1nn(C)c(Cl)c1B(O)O 2285414410 YQBWAQFBWHWWDB-VIFPVBQESA-N 404.660 -0.899 50 10 HBGE CNC(=O)C1=c2s/c(=C/C(=O)OC)c(=O)n2C(N)=C(C#N)[C@H]1c1cccs1 33853436 ZFWGRHSEKUIMIB-JXPAYYINSA-N 402.457 -0.730 50 10 HBGE Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)C(F)(F)Oc2ccccc2)cn1 741709301 FKOUCSUGQNDZQE-UHFFFAOYSA-N 403.367 -0.482 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@H]2COCC[C@H]21)NNC(=O)c1ccccc1Cl 1195002514 FVZXVZCGOGVRDY-KGLIPLIRSA-N 401.872 -0.011 50 10 HBGE CS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1 1435098009 AWYOLCFIGCBYPK-UHFFFAOYSA-N 404.452 -0.047 50 10 HBGE CCn1ncc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1 1684126323 GBSVQJVGOQLWSO-UHFFFAOYSA-N 409.472 -0.242 50 10 HBGE O=C(NC[C@@H](NC(=O)c1nccnc1B(O)O)C(F)(F)F)OCc1ccccc1 2267857822 HJJLMFGXNAUMJL-LLVKDONJSA-N 412.133 -0.257 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2282071800 WLLWKDYDCONOPH-VHSKPIJISA-N 414.236 -0.106 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](O)C[C@@H]1CNC(=O)OC(C)(C)C 2282368971 YQOMWOVSVYTOGJ-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCc2cc(B(O)O)cs2)CCS(=O)(=O)C1 2284066822 ZLLHVGXGULLBON-HNNXBMFYSA-N 418.302 -0.874 50 10 HBGE COc1cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OC(C)C 169893110 DJYCUERUFCGFIW-NGYBGAFCSA-N 421.370 -0.276 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)[C@H]1COCCO1 810462828 YXBQGDOSHCAKQO-LLVKDONJSA-N 412.251 -0.166 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 814343090 YRSQXMOIWKZQOK-CQSZACIVSA-N 401.416 -0.213 50 10 HBGE CCN(CC)Cc1ccc(C(=O)NNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)o1 920248583 JUHRLUINAWJKBH-YFHOEESVSA-N 403.439 -0.007 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 1302575338 HQVMBESLNIZGRG-CYBMUJFWSA-N 402.407 -0.210 50 10 HBGE O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)[C@H]1CCC(=O)N1 1587114621 ODKFRVYDKRBXNW-NEPJUHHUSA-N 407.814 -0.029 50 10 HBGE C[C@H](NNC(=O)CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1)C(F)(F)F 1646071525 QJKZYXXKCTWWSK-QMMMGPOBSA-N 403.404 -0.060 50 10 HBGE O=C(NCC1(F)CCN(C(=O)OCc2ccccc2)CC1)c1c[nH]nc1B(O)O 2267024143 JSGBXTRNAQTTKH-UHFFFAOYSA-N 404.207 -0.040 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@H]2CN1S(=O)(=O)c1sccc1B(O)O 2267212507 WAKBTFYSIFUQEQ-JBLDHEPKSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@H]1CO 2282358898 GRSBMWOEJGOAGA-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE Cc1cc(S(=O)(=O)N2CCOC[C@@H](NC(=O)OC(C)(C)C)C2)sc1B(O)O 2282416775 AKJGSOWKUGAYFK-NSHDSACASA-N 420.318 -0.349 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCCC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282420237 WFGFETORJNEQOK-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 2282698691 DDNABGCPEUGYKY-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(CNS(=O)(=O)c2sccc2B(O)O)C1 2282708024 HFYAINDECZJBEV-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282712285 NRFKFMUXDDTGER-NSHDSACASA-N 420.318 -0.410 50 10 HBGE CN(CCC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282736528 RZPFIGSSFCTGFV-UHFFFAOYSA-N 419.334 -0.159 50 10 HBGE CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)CN2CCCC2=O)c2ccccc21 1152014605 ADUOJKWRDXTGNC-HXUWFJFHSA-N 402.451 -0.168 50 10 HBGE C=C(CN(C)C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1566278367 AEMPYZZRFVANTL-UHFFFAOYSA-N 423.539 -0.433 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C\CCc2ccccc2)n(C)c1=O 1587964947 ZNJCNQIWIAVZAY-XFFZJAGNSA-N 410.434 -0.230 50 10 HBGE C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1CN(C)CCN1C 1687863516 KVXGESLDZTYXDM-HOCLYGCPSA-N 404.519 -0.342 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1NC(=O)OC(C)(C)C 2267211858 RNZYJCBKNAWVJR-ZJUUUORDSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626767 NKDHZFDLSVLIDQ-VHSXEESVSA-N 405.307 -0.312 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282092404 PIKLJXRBFBVAMI-QWHCGFSZSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](F)CN1S(=O)(=O)c1cncc(B(O)O)c1 2282097357 DRPNHIXFWVDSCQ-VXGBXAGGSA-N 403.241 -0.613 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2282168276 ROCCECXIDUVXPD-MHZLTWQESA-N 400.266 -0.734 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282356198 RAXVSNJTCDGXQB-GHMZBOCLSA-N 402.253 -0.055 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282373721 QMHAMDYLENMETO-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282742943 JKAMZAMYBZQZSM-NSHDSACASA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 782226589 FQIQCRKGXUTPAP-LLVKDONJSA-N 405.473 -0.406 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C 792855696 SAFQNAFZZNYQMR-RYUDHWBXSA-N 407.489 -0.015 50 10 HBGE COC1(C(=O)NNC(=O)COc2ccccc2Br)CS(=O)(=O)C1 1132945644 ABKAGPWZCWNBTR-UHFFFAOYSA-N 407.242 -0.211 50 10 HBGE C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CS(C)(=O)=O 1149617758 RUYMVXXBYKIUFS-QGZVFWFLSA-N 408.436 -0.823 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cccn(CC(=O)OC(C)(C)C)c2=O)ccc1=O 1463157420 MEJOXGBZSPGLTL-UHFFFAOYSA-N 402.407 -0.037 50 10 HBGE O=C(CCn1cnnn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 1540328790 LRRVGKVXOBFNAT-UHFFFAOYSA-N 407.456 -0.301 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NNC(=O)[C@H]1CCC(=O)N1 1585691845 CZHONVQPARGAJZ-LLVKDONJSA-N 407.370 -0.009 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2282353716 XLMWOOCBZLTNOT-MGPLVRAMSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(B(O)O)cc1F 2282372621 ZGZNHUBCGCKSDQ-UHFFFAOYSA-N 406.241 -0.987 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]2C1 2282380353 HYBUCCAAKPNOAB-DCAQKATOSA-N 417.318 -0.502 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2S(=O)(=O)c2sccc2B(O)O)C1 2282717611 MCSWKYGYYVKYLH-SNVBAGLBSA-N 418.302 -0.827 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282736917 XIHYUDSMGVKVSZ-HTQZYQBOSA-N 415.224 -0.816 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCOC[C@H](NC(=O)OC(C)(C)C)C1 2282740322 XSRPAKSDWVGIEW-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282851698 FYSFHBPHPJSNPP-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)Nc1ccn(CC(=O)N2CCOCC2)n1 756654792 LUYLXTOSUBITNT-OAHLLOKOSA-N 414.422 -0.102 50 10 HBGE O=C(NNC(=O)c1ccn2nnnc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 1160365977 ZTBPQTKMMKWJDD-UHFFFAOYSA-N 415.435 -0.016 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)cc1Br 1528388016 MZQNHQLLCZRUJF-VIFPVBQESA-N 420.241 -0.868 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)OC2)NNC(=O)C1CCN(c2ncccn2)CC1 1565239338 DWVMNHVPJJWMHO-SFHVURJKSA-N 419.442 -0.755 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cn1 1618233956 ALPNZMNFMDDMLL-NSHDSACASA-N 409.406 -0.519 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc2ncc(Br)cn2n1 1628912052 KWPGIWKEJYNGFQ-SSDOTTSWSA-N 402.230 -0.313 50 10 HBGE C[C@@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282365148 UYQRNOKYPCAXQL-GFCCVEGCSA-N 414.598 -0.149 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)CC1(C)C 2282369184 CDBQTCVYVAFPCO-UHFFFAOYSA-N 419.334 -0.016 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CCCN(C(=O)C(F)(F)F)C1 2282373926 UDWBSCQJULSBJH-SECBINFHSA-N 414.236 -0.184 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282380628 LYSOHGMNIKWJAB-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)Nc2nc(CNC(=O)OC(C)(C)C)cs2)n1 2282741669 QUOMNTNYYJZDNM-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE CN(Cc1ccc(B(O)O)s1)C(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284054788 JDKNKWXQJGRAHN-GFCCVEGCSA-N 402.253 -0.294 50 10 HBGE COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)[C@H]2COCCO2)C1=O 746781561 RYKIRFLTHFZCGN-WDEREUQCSA-N 412.424 -0.614 50 10 HBGE CSCCNC(=S)NNC(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 793764052 GAWCRSGPERMENY-AWEZNQCLSA-N 403.530 -0.540 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1=O 1134417238 LTGAIBQYEXLESY-UHFFFAOYSA-N 421.431 -0.219 50 10 HBGE O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)Cc1ccccc1O 1149270220 ZMHNSHJINXZNGT-QGZVFWFLSA-N 404.467 -0.205 50 10 HBGE CON(C)C(=O)[C@H](C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1253773459 OOHJHUUDOJMPJA-HNNXBMFYSA-N 406.487 -0.063 50 10 HBGE CC(C)OC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1624586030 ZFLYIMNHEYWGLQ-RYUDHWBXSA-N 407.489 -0.113 50 10 HBGE O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c(F)c2)C1)N[C@@H]1CCS(=O)(=O)C1 1625564013 PNASLIKMZBYKAU-VHSXEESVSA-N 416.406 -0.165 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)[C@H]1CCC(=O)N1 1647297613 UUIRAQHJXCTFRB-OAHLLOKOSA-N 408.480 -0.340 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267390920 KYRMUWPIJZFIJX-XPTSAGLGSA-N 403.291 -0.748 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2267614572 PVMQRKDQBWYTAP-APPZFPTMSA-N 400.209 -0.495 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CCCCN1C(=O)OC(C)(C)C 2282079156 SIDITGUEPYIOTF-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccccc1B(O)O 2282105487 LRSXSTXENTVGPC-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCNC(=O)[C@H]2C[C@@H](B(O)O)C2)C1 2282482970 QSPMOXYYNRYOOL-XQQFMLRXSA-N 404.294 -0.220 50 10 HBGE Cc1ccc(S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C)c(B(O)O)c1 2282720575 CDBBGIJPPFNESX-INIZCTEOSA-N 402.278 -0.771 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1C 2362574467 UAHKNZJRHNKPNH-GJZGRUSLSA-N 416.243 -0.778 50 10 HBGE CC(=O)N[C@@H]1[C@H](OC(=O)CCl)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 256020605 WRIXCIGJYAONQN-DGVSKKNDSA-N 423.802 -0.576 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(C)(C)CO)CC2)cc1 1137299671 WTVOVFAAXIFYMG-UHFFFAOYSA-N 412.512 -0.533 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)c(=O)n2C)c1 1440328118 FTVNNGUEHONJAU-UHFFFAOYSA-N 409.468 -0.171 50 10 HBGE CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1456600587 SNNUAOAIPVRRON-UHFFFAOYSA-N 422.463 -0.086 50 10 HBGE Cn1ncc(I)c1CNC(=O)NNC(=O)c1cccnn1 1471161519 BTOJLKZJPVENLG-UHFFFAOYSA-N 401.168 -0.041 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(B(O)O)c1 1628159689 JTOUJGRJMIFNOG-UHFFFAOYSA-N 417.252 -0.774 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@H]2COCCN2C(=O)OC(C)(C)C)ccc1=O 1637557879 MDBYJNFDMGIAPR-ZDUSSCGKSA-N 409.443 -0.035 50 10 HBGE COC(=O)[C@H](Br)CN1C[C@@H](C(N)=O)C[C@@H](NC(=O)C(F)(F)F)C1 1999244673 WNFOHTPIKMDHFD-XLPZGREQSA-N 404.183 -0.223 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2cc(B(O)O)cs2)CC1 2267199255 JPMPEJLWIOMXNU-UHFFFAOYSA-N 424.331 -0.165 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)N[C@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2267336318 ZJWJVWKYWBJWMJ-HOTGVXAUSA-N 401.228 -0.481 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272653163 LICJYEPEAMBUEX-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281836929 WEKGSNADASEXTN-GFVXYOJSSA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]1C2 2282069234 NIKWJQZIIZBZRR-ZETOZRRWSA-N 418.302 -0.469 50 10 HBGE O=S(=O)(NCC1(O)CCN(Cc2ccccc2)CC1)c1ccc(B(O)O)s1 2282070725 IJEJVUYRUPERDC-UHFFFAOYSA-N 410.326 -0.267 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)n1 2282380379 IGOOHMFWVVQGRJ-MNOVXSKESA-N 402.282 -0.786 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)c(B(O)O)nn1C 2282439278 ZJVABEWYXKTRFT-IQSLBTHBSA-N 402.282 -0.440 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2282738484 VMEQJKGXEXXMNT-QWRGUYRKSA-N 420.318 -0.758 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1sc(B(O)O)cc1C 2283954784 AULXTJVERYBUHJ-GFCCVEGCSA-N 400.262 -0.191 50 10 HBGE CC(=O)c1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)s1 765726860 HBABBYLSASXBIV-UHFFFAOYSA-N 404.408 -0.841 50 10 HBGE Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1 807577588 CRLJUURXWVRYPV-CQSZACIVSA-N 413.500 -0.025 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1C 816875874 KAVNMKKNFANCQV-CQSZACIVSA-N 420.495 -0.075 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cn1 1303284055 MPQPAMWKINLYFZ-NDHOYJIESA-N 419.463 -0.041 50 10 HBGE COc1cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc(OC)c1OCC(N)=O 1351202700 XLFMXJGOVHPCSJ-GFCCVEGCSA-N 415.468 -0.326 50 10 HBGE C[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)CN(C)C(=O)OC(C)(C)C 2267391303 BXYYHZUJWFJCDI-SNVBAGLBSA-N 407.323 -0.255 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1cccc(B(O)O)c1 2282092119 LRTUUPGHRVJHKY-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC[C@@](C)(NC(=O)OC(C)(C)C)C2)n1 2282371336 IOFNIDGPAPYGRV-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE NCC1(NS(=O)(=O)c2cc(B(O)O)cs2)CCN(Cc2ccccc2)CC1 2282704670 NDAMPASLOCOUQK-UHFFFAOYSA-N 409.342 -0.300 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C[C@H]1NC(=O)OC(C)(C)C 2282706221 JGFQWNBZNAFHIO-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 2282707370 YAFUZZCSQJZQRM-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282861661 QVIYMLRCVBQYCS-UMNHJUIQSA-N 417.318 -0.502 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)[C@H]2CCN(C(=O)OCc3ccccc3)C2)n1C 2337401948 QOXRPMFWZGWARC-HNNXBMFYSA-N 400.244 -0.109 50 10 HBGE O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@H]1COCCO1 744640693 BJUZMRPMMPLCMQ-GFCCVEGCSA-N 411.212 -0.278 50 10 HBGE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)c1ccc(C#N)cc1 749561260 PUBBLNSQWTZUIN-SRABZTEZSA-N 414.418 -0.256 50 10 HBGE C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)[C@H]3COCCO3)cn2)C[C@@H](C)O1 756839385 QNOVZKZOOZLYLU-MBNYWOFBSA-N 410.431 -0.913 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCNC(=O)CC3)cc2)CC1 815854755 PFJUSJWSRIIYTO-CQSZACIVSA-N 409.512 -0.018 50 10 HBGE COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(=O)n(C)c2)c1 1157835896 LHLZXKRMLVENNF-UHFFFAOYSA-N 422.463 -0.307 50 10 HBGE CC(C)(CO)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1290233129 YDQYPRXMLJJSJR-UHFFFAOYSA-N 413.496 -0.194 50 10 HBGE Cc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1-c1nc[nH]n1 1295729316 FSZIXILDXCDZOE-UHFFFAOYSA-N 419.265 -0.866 50 10 HBGE COc1cc(N)c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1S(C)(=O)=O 1298901355 UOSYRAPOMTZEFR-SNVBAGLBSA-N 405.498 -0.213 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(Nc2ncc(Br)cc2B(O)O)C1 2217198284 ZDDZCWNLRDZOEP-UHFFFAOYSA-N 402.054 -0.082 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)NCc1ccc(B(O)O)cc1F 2257500396 RCXHAEMPJWJVIM-UHFFFAOYSA-N 406.200 -0.779 50 10 HBGE C[C@H]1CN(C(=O)c2c(B(O)O)nnn2C)C[C@@H](C)N1C(=O)OCc1ccccc1 2267336940 JFIPSPXXOVYNIQ-BETUJISGSA-N 401.232 -0.634 50 10 HBGE CON(CCCNS(=O)(=O)Cc1ccccc1B(O)O)C(=O)OC(C)(C)C 2282350659 PYEZXXNGVYXNBJ-UHFFFAOYSA-N 402.278 -0.026 50 10 HBGE COc1ccc(S(=O)(=O)N(CCNC(=O)OC(C)(C)C)OC)cc1B(O)O 2282355313 DDFBFEIBTPGVND-UHFFFAOYSA-N 404.250 -0.548 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282383105 UVBJBBINXXRNBG-BLBHWQHRSA-N 400.266 -0.273 50 10 HBGE CO[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2cscc2B(O)O)C1 2282736898 XCQMKLCDIXSTOB-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE CN(Cc1ccc(B(O)O)cc1)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 707723836 XPMULTLGXYCFQA-UHFFFAOYSA-N 416.264 -0.186 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNC(=O)c1ccccn1 739680079 IXCRRBLCYCOJRY-UHFFFAOYSA-N 404.452 -0.126 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1443728427 JTOLQHRLQUFTNZ-CQSZACIVSA-N 412.855 -0.236 50 10 HBGE O=C(NNC(=O)c1cnn(CCO)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 1628159878 RARNUQZPDFQBMD-UHFFFAOYSA-N 407.452 -0.265 50 10 HBGE COC(=O)C(=O)NNC(=O)NCC1(N2CCN(c3ccccc3)CC2)CCOCC1 1635286730 GCTOJAHKOCOCAJ-UHFFFAOYSA-N 419.482 -0.139 50 10 HBGE Cn1c(CC(=O)NNC(=O)NCCN2CCC3(C2)OCCO3)nc2ccccc21 1685332476 ZLSKOLPZYZPIGZ-UHFFFAOYSA-N 402.455 -0.105 50 10 HBGE Cn1nc(C(=O)N[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c(B(O)O)c1Cl 2255486492 BEYJPBCXGKCRDV-GFCCVEGCSA-N 406.635 -0.106 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNS(=O)(=O)c2cscc2B(O)O)C1 2267624230 VDSGXMRJMJLFIG-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2281841833 PFIKMVFEQWCGLV-YKBSNTEPSA-N 400.266 -0.369 50 10 HBGE Cc1cnc(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)c1 2281867236 UWFBTXVUYSHVDC-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@H]1CCCN1C(=O)OC(C)(C)C 2282079600 YPCHNFHYWWKHSO-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)Cc1ccccc1B(O)O 2282328833 DFYAORLSWRAPLE-SANMLTNESA-N 420.318 -0.181 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713085 ZTMMHYHVLRSREM-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC2CC(CCNC(=O)OC(C)(C)C)C2)n1 2282728125 OZHZRDDNAPEVQX-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282733511 XAHJGBFWBDLLPT-RYUDHWBXSA-N 406.216 -0.021 50 10 HBGE CS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)ccc1Br 1438037629 SPVKHGISZQRXSW-VIFPVBQESA-N 404.242 -0.108 50 10 HBGE CO[C@@H]1C[C@@H](C(=O)NNC(=O)[C@@H]2CCC(=O)N2)N(C(=O)OCc2ccccc2)C1 1534064740 PYBWKBICDZOKHM-ILXRZTDVSA-N 404.423 -0.162 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1 1687345174 MYWZUIZKCGUEMA-SFHVURJKSA-N 408.411 -0.968 50 10 HBGE O=S1(=O)CCC(S(=O)(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Br)CC1 2177849676 OVJUCBYACUXSNW-IUCAKERBSA-N 410.333 -0.957 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2nccc(B(O)O)c2F)[C@H](S(C)(=O)=O)C1 2240310608 RIANFCNUOMEMKM-WDEREUQCSA-N 403.241 -0.655 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CNS(=O)(=O)c1sccc1B(O)O 2267209374 WDZXRGMILVOLHH-UMNHJUIQSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CN(S(=O)(=O)c3cc(B(O)O)cs3)C[C@H]2C1 2267614946 VPLPNNAGAIJIOY-GHMZBOCLSA-N 402.303 -0.085 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282072804 JFSMRUPMLDTBDF-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282079683 ZJGICNPQKAOFAO-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE CN(CCOCCNS(=O)(=O)c1cccc(B(O)O)c1)C(=O)OC(C)(C)C 2282092813 UHYOJVYVLMNNKA-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2282437757 KAGULKFIITYTOO-FLESLCNUSA-N 400.266 -0.686 50 10 HBGE Cc1cc(S(=O)(=O)N(CCNC(=O)OC(C)(C)C)C[C@H](C)O)sc1B(O)O 2285301597 PEPRYCDKAXSAAG-NSHDSACASA-N 422.334 -0.367 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c(OC)c1 729969030 JGTFYOZZBBLJEQ-UHFFFAOYSA-N 415.406 -0.332 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ncccn1 1142464106 FTNWSOPAJCOUCY-UHFFFAOYSA-N 414.241 -0.021 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)c1c[nH]nc1I 1182942629 ZVZMAGNOHFXTRM-UHFFFAOYSA-N 414.163 -0.400 50 10 HBGE O=C1CN(CCNC(=O)NNC(=O)COc2ccccc2Br)CCN1 1226057313 NWHITNRENBELSH-UHFFFAOYSA-N 414.260 -0.410 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)c1cnn(C)c1 1248591726 XPIHUXPKFAVPNE-UHFFFAOYSA-N 401.427 -0.861 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 1586191230 POZKVNIKZMLGAS-CQSZACIVSA-N 417.509 -0.580 50 10 HBGE CCS(=O)(=O)N[C@@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1 1631772544 MIPOJKZAFOMEIC-VIFPVBQESA-N 406.324 -0.859 50 10 HBGE CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1642269781 BHECSMWNNOTKMT-STQMWFEESA-N 414.509 -0.487 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H]1CCN1C(=O)OC(C)(C)C 1652258387 PHYYNBJOMATKAK-CHWSQXEVSA-N 411.459 -0.730 50 10 HBGE C[C@H]1C[C@@H](CNS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282081819 GARBAHUYYXXRCC-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE COC1(CCNC(=O)c2cc(B(O)O)cn2C)CN(C(=O)OCc2ccccc2)C1 2282272985 GZFQSTWOQWTWSP-UHFFFAOYSA-N 415.255 -0.138 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NC[C@@H]1CN(Cc2ccccc2)CCO1 2282377356 POBKDUUQMLUYHG-CQSZACIVSA-N 411.314 -0.857 50 10 HBGE CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H]1COCCO1 744650038 XSFOBUKVOODCFC-LSDHHAIUSA-N 411.480 -0.134 50 10 HBGE O=C(COC(=O)C1(N2CCOCC2)CCC1)NNC(=O)[C@H]1COc2ccccc2O1 769815320 IGGPTCRASDYDAJ-MRXNPFEDSA-N 419.434 -0.228 50 10 HBGE CN(C)CCN1C[C@@H](C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1=O 794065872 QTFREMPXPXIDIL-HNNXBMFYSA-N 405.455 -0.530 50 10 HBGE O=C(NNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)N[C@H]1CCS(=O)(=O)C1 1136389884 MTBIHUZIJLQYLZ-NSHDSACASA-N 401.466 -0.246 50 10 HBGE O=C(NNC(=O)[C@H]1CCN1C1CCOCC1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 1558458429 GICFLVAOVRSWMV-RHSMWYFYSA-N 401.467 -0.169 50 10 HBGE CCON(C)C(=O)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1674147987 QEYFRWQCLQLSLQ-UHFFFAOYSA-N 406.487 -0.061 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2cscc2B(O)O)C1 2267625976 YZEQFQGYKBNDDU-IJRMKIOGSA-N 424.331 -0.118 50 10 HBGE CON(CCCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267626654 LVFOMNHRXGNSOH-UHFFFAOYSA-N 409.295 -0.569 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)NCc2cc(B(O)O)cs2)C1 2284041512 SGRROWRRCAAYAO-LBPRGKRZSA-N 418.302 -0.922 50 10 HBGE O=C(/C=C\c1cccs1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 12368454 CKXZRVZGZAZWSZ-ARJAWSKDSA-N 422.496 -0.694 50 10 HBGE COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CSCN2C(C)=O)cc1OC 730311556 MCMCBSDWHLEHIK-LBPRGKRZSA-N 411.436 -0.071 50 10 HBGE COc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(Cl)c1 765723597 CGGUDINVNSWTEW-UHFFFAOYSA-N 420.813 -0.443 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)C1 805031695 NSQWDNLPHABAIQ-UKRRQHHQSA-N 411.484 -0.409 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)nn1 1131111728 XBTSYBBYACBXHR-UHFFFAOYSA-N 410.431 -0.184 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CCOC(=O)CNC(=O)C(C)(C)C)C[C@@H](C)O1 1182158129 OXWIWZBIKGQMGV-OKILXGFUSA-N 414.503 -0.271 50 10 HBGE CCc1noc(COCC(=O)N2CCN(S(=O)(=O)CBr)CC2)n1 1295733637 KPFFAXYQBCACBP-UHFFFAOYSA-N 411.278 -0.025 50 10 HBGE COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1cccc(B(O)O)c1 1297549975 HEEZAULNTKMGFM-HNNXBMFYSA-N 406.244 -0.009 50 10 HBGE COC(=O)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)[nH]1 1306648204 HUNFNOKKUGTNRA-UHFFFAOYSA-N 422.467 -0.111 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NCC1CN(S(C)(=O)=O)C1 1343129037 LUYRKSTVRGSBES-UHFFFAOYSA-N 408.278 -0.377 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1 1351126606 QRJMHWYJDCWLLU-QMMMGPOBSA-N 412.204 -0.438 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)n1 2282378031 ZTDGAWHPNPQCOH-PWSUYJOCSA-N 402.282 -0.928 50 10 HBGE CCCC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282414690 WNRPXOAYNVRHGJ-LLVKDONJSA-N 404.298 -0.538 50 10 HBGE COCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cscc1B(O)O 2282732912 NEPVWCHLNMPCII-UHFFFAOYSA-N 420.318 -0.316 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)Cc1ccsc1B(O)O)C(=O)OC(C)(C)C 2282868749 RWPKLBPFQJODIK-GFCCVEGCSA-N 422.334 -0.583 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)NCc2sccc2B(O)O)C1 2284034730 GDWPOZJBDLKYRK-GFCCVEGCSA-N 418.302 -0.922 50 10 HBGE COCCN(C=C(C#N)C(=O)N[C@@H](CCSC)C(=O)O)[C@H]1CCS(=O)(=O)C1 2325031364 JOPZNKWOXVTYOH-KBPBESRZSA-N 419.525 -0.148 50 10 HBGE CN(C(=O)CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1)C1CCCCC1 745999818 MVUABAXIWVVFNC-INIZCTEOSA-N 411.503 -0.449 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@]2(C1)NC(=O)NC2=O 789379974 UKHKIVYWWGOQNU-QGZVFWFLSA-N 409.830 -0.216 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1 800055656 LTDLMGMNHLKQNF-YWPYICTPSA-N 412.468 -0.125 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CCC(=O)N1CCN(c2ncccn2)CC1 1440641423 XLGGMYGRRJMODB-UHFFFAOYSA-N 423.543 -0.221 50 10 HBGE CO[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCOC1 1445568625 XLZVRTIEEZPLAX-SJLPKXTDSA-N 404.467 -0.357 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NNC(=O)c1cn(C)nn1 1470083328 IXZKLHWBOGKPLI-IFFSRLJSSA-N 414.344 -0.438 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(=O)n(C)c1=O 1627321386 BDQCEZGJLRWALF-LLVKDONJSA-N 409.443 -0.508 50 10 HBGE Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1642271058 UMIPKUAITIYQOE-JTQLQIEISA-N 404.452 -0.131 50 10 HBGE CNS(=O)(=O)c1ccc(N2CCN(CC(=O)NNC(=O)C(C)(C)C)CC2)cc1 1655469222 RLZDPDAHYPGMMC-UHFFFAOYSA-N 411.528 -0.090 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@@H](CO)CNC(=O)OC(C)(C)C)c1B(O)O 2267388591 ALKZNTCBEMYKMX-SNVBAGLBSA-N 408.307 -0.791 50 10 HBGE C[C@@H](CCCNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267393395 YELUYAWYSOMTKN-JTQLQIEISA-N 407.323 -0.064 50 10 HBGE COCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)s1 2282707171 VQQKVZJYMVKXLP-UHFFFAOYSA-N 420.318 -0.316 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NC[C@H]1COCCN1Cc1ccccc1 2282742153 YOUYAZBYBJKOAF-AWEZNQCLSA-N 411.314 -0.857 50 10 HBGE N#CC(=Cc1ccc(Br)cc1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 2329656748 FJTFOJVKPWVKDQ-WZYWGQKZSA-N 413.224 -0.728 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccncc1 731595948 LSFKYVOQUQNPQW-RRFJBIMHSA-N 408.480 -0.048 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)ccc1F 816880888 UGFRVTZGYDASDJ-NSHDSACASA-N 410.431 -0.309 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(CC3CC3)C2)c1 1313205491 OGRMKAKZDARSBU-CQSZACIVSA-N 423.495 -0.108 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1ccccn1 1440525924 WARSAVZVWYWHCT-UHFFFAOYSA-N 411.461 -0.025 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)c1 1461147809 IPKMFUSWINDPJL-TZMCWYRMSA-N 414.484 -0.549 50 10 HBGE C[C@H](Sc1ncccc1C(=O)NNC(=O)CS(C)(=O)=O)C(=O)N1CCCC1 1630862335 GXWDJJFZMAZLHJ-NSHDSACASA-N 414.509 -0.010 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1c1ncc(Br)cc1B(O)O 2223675464 WTFBMVXRPTWQEZ-GHMZBOCLSA-N 416.081 -0.012 50 10 HBGE C[C@H]1CN(C(=O)c2nn(C)cc2B(O)O)C[C@H](C)N1C(=O)OCc1ccccc1 2266887914 LXMWVCAIOPCGOP-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE CN([C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)c1cc(B(O)O)cs1 2267606641 AREINIYSNGEVAM-PTEHBNRSSA-N 402.303 -0.086 50 10 HBGE C[C@H]1[C@H](C)N(S(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282380932 PRFZTWIPCPMOHI-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1CNS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282732761 LBVWFWCYAYEASJ-QPUJVOFHSA-N 406.216 -0.164 50 10 HBGE CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1 745776019 JQLZUZZFSBKVKO-HNNXBMFYSA-N 414.484 -0.240 50 10 HBGE CCN1CCN(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1 755775844 KUQRHMOPCMRVCB-UHFFFAOYSA-N 424.571 -0.297 50 10 HBGE C[C@H](NC(=O)Cn1cnnn1)C(=O)NNC(=O)c1cc(F)ccc1Br 1143776333 PRYHVHQYYFDYCZ-ZETCQYMHSA-N 414.195 -0.459 50 10 HBGE Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)CS(C)(=O)=O 1149617349 KFQCGJJMWLMAOJ-UHFFFAOYSA-N 406.486 -0.995 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(B(O)O)ccc1F 1440613390 RRJWVAYWONBOKO-UHFFFAOYSA-N 422.243 -0.544 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)ccc1=O 1463160443 YHQOCILAHPMZMK-IBGZPJMESA-N 415.381 -0.247 50 10 HBGE Cn1cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N=S(C)(C)=O)CC2)cn1 1468029127 LRFKGHKBJIWOPG-MDWZMJQESA-N 400.486 -0.556 50 10 HBGE CN(CCNC(=O)NNC(=O)[C@@H]1CCC(=O)N1)S(=O)(=O)c1ccc(F)cc1 1478531891 IQSILMGIAUZZRT-LBPRGKRZSA-N 401.420 -0.945 50 10 HBGE CON(C)C(=O)[C@H](C)NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 1479060794 UWUIGRMLBQXAFZ-JTQLQIEISA-N 400.461 -0.360 50 10 HBGE O=C(NNC(=O)C1=NN(c2ccc(F)cc2)C(=O)CC1)N[C@H]1CCS(=O)(=O)C1 1543752341 FHKNFXSYTRGSSQ-NSHDSACASA-N 411.415 -0.174 50 10 HBGE NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c(F)c1 1558458485 HMFNNKXYXCZRCP-AWEZNQCLSA-N 400.432 -0.513 50 10 HBGE Cn1cc(/C=C(\C#N)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1 1566278603 KBIPCHSDEMUJSV-WOJGMQOQSA-N 421.461 -0.068 50 10 HBGE C[S@@](=O)C1(C(=O)NNC(=O)[C@@H]2COCCO2)CCN(C(=O)OC(C)(C)C)CC1 1620975605 YVSGWPFEHKAZLE-PSBQPLHCSA-N 419.500 -0.303 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cccc(CCl)c2)n(C)c1=O 1629793495 UBNVQUHCYFNHES-UHFFFAOYSA-N 404.814 -0.366 50 10 HBGE CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2cn(C)nn2)CC1 1667977689 MCMMDVAGBFNGMN-UHFFFAOYSA-N 400.443 -0.372 50 10 HBGE CN([C@@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1cncc(B(O)O)c1 2267612250 GQOCZFZMUVWEOL-MRXNPFEDSA-N 419.268 -0.207 50 10 HBGE CN([C@@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2267613443 CAPNUMHIMXLSSI-CQSZACIVSA-N 422.272 -0.869 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282079522 XSTZTKFNVRBBFH-CQSZACIVSA-N 420.274 -0.830 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282085591 AHGYGZVFDJQFHE-KBPBESRZSA-N 416.330 -0.004 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282346951 ZLHMOTKFBXSLIT-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](C)C[C@@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282364056 LFTZVKHGFCBSTN-IONNQARKSA-N 414.236 -0.186 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Cl)C[C@@H]1NC(=O)C(F)(F)F 2357445350 QRBFEBPCSKSBRM-RCWTZXSCSA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)N1CC[C@](C)(B(O)O)C1 2368336053 LKELWBQOSWPYKT-WBMJQRKESA-N 404.294 -0.124 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)Cn2c(O)nc3ccccc3c2=O)C[C@@H](C)O1 732261179 LEFGKIWKQMVMEL-CHWSQXEVSA-N 403.439 -0.251 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)ccc1F 816880887 UGFRVTZGYDASDJ-LLVKDONJSA-N 410.431 -0.309 50 10 HBGE Cn1cc(C2=NO[C@@H](C(=O)N3CCN(S(=O)(=O)CBr)CC3)C2)cn1 1137882002 INIBSWINKHQHLQ-GFCCVEGCSA-N 420.289 -0.261 50 10 HBGE CC[C@@H](CO)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1440629969 XKWJWGBQMKTJSM-HNNXBMFYSA-N 413.496 -0.194 50 10 HBGE O=C(Cc1csc([C@@H]2CCS(=O)(=O)C2)n1)NNC(=O)[C@H]1CCS(=O)(=O)C1 1539401509 GOTMWRPXDLOSSC-VHSXEESVSA-N 421.522 -0.830 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1557185463 MSTWCHQQNABDNP-XDTLVQLUSA-N 405.860 -0.448 50 10 HBGE Cc1ccc(C(=O)NNC(=O)CN2CCN(C[C@H]3CCCS3(=O)=O)CC2)cc1 1655337273 AYVCLLQCJAIIRE-QGZVFWFLSA-N 408.524 -0.049 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(CC(F)(F)CO)CC2)cc1OC 1659228450 KGWFEPHDBBGAPC-UHFFFAOYSA-N 416.425 -0.290 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 2282075279 RHRJQBSGJUJEIR-GHMZBOCLSA-N 402.282 -0.786 50 10 HBGE Cc1cc(S(=O)(=O)N2[C@H]3CC[C@H]2CN(C(=O)C(F)(F)F)C3)sc1B(O)O 2282728504 FHUPYBMOMWVDKC-IUCAKERBSA-N 412.220 -0.337 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2284036377 DFLXBQGLJYHUKM-SECBINFHSA-N 400.628 -0.488 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1 2285201349 DMXMMOOVEVSZLX-KRWDZBQOSA-N 413.239 -0.163 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)Cc2ccc(F)cc2)C1 806037033 MKQARDSBQULUTJ-CQSZACIVSA-N 401.464 -0.031 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@]3(C)C[C@H](O)CN3C)cc2)CC1 1151459757 XMLSGBUKJHMPCM-YJBOKZPZSA-N 411.528 -0.479 50 10 HBGE CNC(=O)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1564770985 OITKMEFHQBKRKG-LBPRGKRZSA-N 411.484 -0.060 50 10 HBGE C[C@@]1(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)CCS(=O)(=O)N1 1597885583 IOZHTABYKYOHRD-NSHDSACASA-N 418.335 -0.715 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267202264 ABWVKHIWCXBFLL-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2sncc2B(O)O)C1 2267439868 XSLKROKHZKKHSF-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE C[C@H]1[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282077483 WMUADXADWLFNLY-JQWIXIFHSA-N 402.282 -0.834 50 10 HBGE Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NNC(=O)C(C)C)n[nH]1 59888264 WIYCXEHSGLNCRU-REZTVBANSA-N 423.503 -0.048 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 703992900 HATGNEOZKKJFGY-RYUDHWBXSA-N 406.869 -0.394 50 10 HBGE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)[C@H]3COCCO3)cc2)C1 745692744 YOZRLQVVXKJFKJ-GDBMZVCRSA-N 405.455 -0.366 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCN(Cc3ccccc3)C2)n(C)c1=O 764812237 HTWMMLKPKBHFHF-UHFFFAOYSA-N 409.450 -0.188 50 10 HBGE C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2nccn2S(=O)(=O)N(C)C)C[C@@H](C)O1 814766891 SQCKSQDMNWZWJV-MGPQQGTHSA-N 400.505 -0.267 50 10 HBGE O=C(NNC(=O)[C@H]1CC(=O)N(c2cc(F)cc(F)c2)C1)N[C@@H]1CCS(=O)(=O)C1 919887552 AHUXICJLWHAIFH-JOYOIKCWSA-N 416.406 -0.165 50 10 HBGE CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)CC1 1628970426 MNVCKEDTELICAK-UHFFFAOYSA-N 419.504 -0.392 50 10 HBGE CC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)C2=O 1635371676 HCHPGOHMRPCKGG-KLSXAPCHSA-N 421.498 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@@H](O)C1 2267206071 ZYQLAOMRDCQTGL-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N[C@H](CNC(=O)OCc1ccccc1)C(F)(F)F 2267322769 IFBBUVSRRZEPKE-GFCCVEGCSA-N 414.149 -0.313 50 10 HBGE CN([C@H]1CC[C@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1nn(C)cc1B(O)O 2267390579 GIDMFIWGBZRZQP-CABCVRRESA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267424349 YXBNYNGOSIYCTO-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE COCCN(CCNC(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2281647985 FOMJWCMWQLLCMX-UHFFFAOYSA-N 404.660 -0.633 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282080506 KMTSEXYNKPPHTK-OQCKYNKVSA-N 418.302 -0.613 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCOCCCNC(=O)OC(C)(C)C 2282357818 PDYFJVGRDXXGMV-UHFFFAOYSA-N 422.334 -0.054 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1COCCN1Cc1ccccc1 2282370129 QDPDFWOVDYNYQA-HNNXBMFYSA-N 410.326 -0.084 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1F 2282720881 HREKTXQEHGPVOT-RYUDHWBXSA-N 404.225 -0.924 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282729608 PKYLYUHTQRBJGE-WDEREUQCSA-N 420.318 -0.446 50 10 HBGE Cc1cn([C@@H]2C[C@@H](O)[C@H](CNC(=O)CI)O2)c(=O)[nH]c1=O 40368809 NWGXFMGORNLEMS-WEDXCCLWSA-N 409.180 -0.955 50 10 HBGE CN(C)Cc1ccsc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766641796 CHJSRSCHKWBNFD-UHFFFAOYSA-N 419.467 -0.982 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 790325111 ICGRHIVBJQHQIO-KCXAZCMYSA-N 421.479 -0.193 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 1135830095 QHSNIINPAYGHTF-LLVKDONJSA-N 420.561 -0.422 50 10 HBGE CN(C)N(C(=O)CNc1ccc(S(N)(=O)=O)cc1F)[C@@H]1CCS(=O)(=O)C1 1450813707 UJZJVPKPQGPWPV-SNVBAGLBSA-N 408.477 -0.623 50 10 HBGE O=C(CCC(=O)N1CCC(O)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 1565676712 UNNVSXKZOAUQGN-UHFFFAOYSA-N 404.471 -0.396 50 10 HBGE C[C@@H](O)CN(C)NC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1629362857 VICKTGJLZIQFME-TZMCWYRMSA-N 407.514 -0.888 50 10 HBGE C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1684632568 BTZSMHQYSDNKPN-XIKOKIGWSA-N 410.402 -0.449 50 10 HBGE CN(C)S(=O)(=O)C1(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1 1685300748 LLUVGKQEDMHARI-UHFFFAOYSA-N 408.484 -0.130 50 10 HBGE CC(C)(C)OC(=O)N(CCNS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2267626140 BTPJHFRRMMSUOJ-UHFFFAOYSA-N 405.307 -0.358 50 10 HBGE Cc1nn(C)c(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)c1B(O)O 2281853907 XABDCEANGIYKRF-UHFFFAOYSA-N 400.266 -0.733 50 10 HBGE COCC[C@H](CNS(=O)(=O)Cc1ccsc1B(O)O)NC(=O)OC(C)(C)C 2282328146 SZAWYADKAORVNU-GFCCVEGCSA-N 422.334 -0.223 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(B(O)O)cc1F 2282373620 PATOXTRHVYTDCP-NWDGAFQWSA-N 400.237 -0.112 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@H](CCO)COCc1ccccc1 2343589693 YSTWMTSNFXEWAS-CYBMUJFWSA-N 400.287 -0.790 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 744653804 KMKZDQPNNMDYGN-CZUORRHYSA-N 401.423 -0.022 50 10 HBGE C[C@H](Cc1ccccc1F)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765726411 AZUOXFCCLLMAAI-LLVKDONJSA-N 416.413 -0.401 50 10 HBGE COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)[C@@H]1COCCO1)CC2 765731610 ACPCJKPLRGGFRC-KRWDZBQOSA-N 421.450 -0.069 50 10 HBGE C[C@@](O)(Cn1ccccc1=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 790482692 AIUYSDKHVKUKSF-QGZVFWFLSA-N 407.452 -0.646 50 10 HBGE COCCNC(=O)C(=O)NN=Cc1ccc(OCC(=O)NC[C@H]2CCCO2)cc1 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400.457 -0.676 50 10 HBGE C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CO1 1682431071 KRVUJILGEBJNCI-JSGCOSHPSA-N 412.468 -0.171 50 10 HBGE C[C@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cscc1B(O)O 2013657051 VFZHGYUNCWPXNK-JTQLQIEISA-N 408.266 -0.296 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1C(=O)c1sccc1B(O)O 2267295538 NFCDZCRBKGSBEI-UHFFFAOYSA-N 404.275 -0.549 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2281718535 CMILITUHVCZINK-JTQLQIEISA-N 400.262 -0.077 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1ncsc1B(O)O 2282154543 JOEIPRNEYANBMG-UHFFFAOYSA-N 403.266 -0.889 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1ccccc1B(O)O 2282429370 QZKHHHDEJQZSGO-NEPJUHHUSA-N 400.262 -0.985 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@@]1(=O)CC[C@@H](NC(=O)OC(C)(C)C)C1 2282437758 KAGULKFIITYTOO-GFVXYOJSSA-N 400.266 -0.686 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@]2(C)CCCN2C(=O)OC(C)(C)C)n1 2282738286 SGAFOCXOGIEFPH-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE Cc1nnc(CN(C)CC(=O)NNC(=O)CNC(=O)OCc2ccccc2)n1C 794070348 TYYXHKJPOYEXFL-UHFFFAOYSA-N 403.443 -0.371 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)COB2O 1444712732 BNGXBNZFHDOIFZ-UHFFFAOYSA-N 417.252 -0.318 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)N1 1530230271 BFVDCMXHOOYNEP-WDEREUQCSA-N 400.482 -0.283 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c(OC)c1 1584990956 PPZRXACEJJUSSW-BZUAXINKSA-N 417.422 -0.611 50 10 HBGE O=C(NNC(=O)c1cc2nccc(C(F)(F)F)n2n1)N[C@H]1CCS(=O)(=O)C1 1625567188 DHFWBUUTMXAGBC-ZETCQYMHSA-N 406.346 -0.121 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2([S@@](C)=O)CCN(C(=O)OC(C)(C)C)CC2)nn1 1645367834 MJVYCMQVIQLPRK-MUUNZHRXSA-N 414.488 -0.276 50 10 HBGE CCn1ccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)n1 1654359976 ZKAFHMFRNHYPNE-UHFFFAOYSA-N 407.500 -0.080 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccncc1 731595950 LSFKYVOQUQNPQW-SOUVJXGZSA-N 408.480 -0.048 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 758043415 HJYXZKWBJFYCGM-BDAKNGLRSA-N 404.395 -0.597 50 10 HBGE O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)NNC(=O)[C@@H]1COCCO1 773345356 BRBKSTMULDWNNJ-AWEZNQCLSA-N 416.431 -0.389 50 10 HBGE O=C(NNC(=O)[C@H]1[C@H]2OCCC[C@@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 779713796 RTUCJRYMBAESGJ-OAGGEKHMSA-N 409.464 -0.107 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@@]2(F)CN(C(=O)OC(C)(C)C)CC23COC3)CC1 1155657226 XGLSWJYIAAGLPZ-SFHVURJKSA-N 415.466 -0.050 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1303882806 HCKWTAXELBTSHA-CQSZACIVSA-N 411.503 -0.803 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 1456015401 CZADFNVXBSDSCI-QIRZIZBZSA-N 418.450 -0.050 50 10 HBGE O=C(CCc1nn[nH]n1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 1587985578 IJAQKXIAPWBNLX-UHFFFAOYSA-N 406.878 -0.249 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NS(=O)(=O)N2CC(Cl)C2)C1 2254232286 RMBWVSNVIYJPFR-MNOVXSKESA-N 417.937 -0.224 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2267393328 XGGWTWZASGCTTC-NXEZZACHSA-N 406.291 -0.693 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@@](=O)(=NC(=O)c2sncc2B(O)O)C1 2267439865 XSLKROKHZKKHSF-BGGANLFTSA-N 403.291 -0.024 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1NC(=O)OC(C)(C)C 2267613302 AZUDNPMJAXJZEI-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE CN(CC(C)(C)CNS(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2282073295 MHUCNJRGJZBTBP-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CN(Cc1ccccc1)C[C@H](NS(=O)(=O)Cc1ccsc1B(O)O)C(=O)O 2284408660 AYOLXOUHBKMHIO-AWEZNQCLSA-N 412.298 -0.568 50 10 HBGE CCOC(=O)C(=NO)C(C)=NNC(=O)CC(=O)NN=C(C)C(=NO)C(=O)OCC 2297710758 QYHOUTJVYYDPFF-UHFFFAOYSA-N 414.375 -0.853 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2COCCO2)s1 744652667 LZQKTJJNJXTGAQ-RYUDHWBXSA-N 403.482 -0.228 50 10 HBGE CS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1 751278847 CKTYUMGQHWNYKO-UHFFFAOYSA-N 417.490 -0.109 50 10 HBGE 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Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 2282078985 PPVIDCAVKZLDQE-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1cccc(B(O)O)c1 2282102927 MRGCDQJPBQVYLY-UHFFFAOYSA-N 402.278 -0.424 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@H]2C[C@H]21 2282345003 FHSQTSVJWAHHRX-JFGNBEQYSA-N 417.318 -0.360 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](NC(=O)C(F)(F)F)[C@H](C)C1 2282383695 CJRJIFNDVQBQCS-VXNVDRBHSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2ccccc2B(O)O)C1 2282420807 FLHHJUZUVXYURZ-UHFFFAOYSA-N 400.262 -0.937 50 10 HBGE CCN([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2282700937 UBIKZSXMNSLPSL-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@H]2COC[C@@H]21 2282703602 YOOSZAUVXYJULX-RYUDHWBXSA-N 418.302 -0.563 50 10 HBGE C[C@H]1C[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2282732637 JIYDNASDFVJBQK-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282739836 QLNKWGBUCDAMBS-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282863565 TWRSTQXWUNWEEH-RYUDHWBXSA-N 420.318 -0.782 50 10 HBGE C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284054258 ZXJFKRCWRKKLHN-WPRPVWTQSA-N 400.266 -0.841 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)n1C 2337397814 HPOGEDBIAXOEPU-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ccc(B(O)O)cc1F 704305011 FZUJVEQYCJGSRM-UHFFFAOYSA-N 406.200 -0.067 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(Br)c(S(N)(=O)=O)c2)cn1 735524705 VKPZVXGHIIRGHP-UHFFFAOYSA-N 402.230 -0.095 50 10 HBGE O=C(NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@@H]1COCCO1 746000097 ZIWMCCQFDPWKNK-AAEUAGOBSA-N 401.803 -0.110 50 10 HBGE C/C(=C/C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765725987 XOHCKAQHOOBQRJ-XFFZJAGNSA-N 414.397 -0.176 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)n(C)c1=O 1137299419 QZTVSWBOCIAWQG-RNODOKPDSA-N 410.434 -0.441 50 10 HBGE CC(C)NC(=S)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1318636949 WPQOKDWYPOJREA-YNEHKIRRSA-N 404.558 0.000 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCC(=O)N(c3cnn(C)c3)C2)C[C@@H](C)O1 1457496828 JLRISBXLVTVIGS-RBSFLKMASA-N 406.487 -0.190 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)nn1 1528541736 OZAFMDSHCZNYFQ-NSHDSACASA-N 410.431 -0.184 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)c1 1618697074 IOTBLAVEYRZOMU-AWEZNQCLSA-N 406.370 -0.210 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(B(O)O)c2)c1 1628159643 HOBFZQQHEKJGEE-UHFFFAOYSA-N 419.268 -0.528 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NN(C)[C@H](C)CO 1643697265 ZKNRPZZESBJBNV-CQSZACIVSA-N 414.528 -0.021 50 10 HBGE O=C(NC[C@@H]1CCCS(=O)(=O)C1)NNC(=O)c1csc(N2CCOCC2)n1 1683029747 MUSNXGPZQGMVHJ-NSHDSACASA-N 417.513 -0.252 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCc2ncn(C)n2)cc1 1686888896 VYLZTJIBKKXZDR-UHFFFAOYSA-N 423.499 -0.293 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@@H]1NC(=O)C(F)(F)F 2267206922 NAIMLKRZVZABAB-SFYZADRCSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)c1sccc1B(O)O 2267209190 TVKGNVDTPQVJDB-MWLCHTKSSA-N 406.291 -0.754 50 10 HBGE Cn1ncc(C(=O)N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1B(O)O 2267257751 ANTKKISZVSSXHA-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE O=C(NC1CCN(S(=O)(=O)Cc2ccsc2B(O)O)CC1)C(F)(F)F 2270599063 MRLLYQHELIZCRQ-UHFFFAOYSA-N 400.209 -0.599 50 10 HBGE CN1CCN(C(=O)c2cc(B(O)O)c(Cl)s2)[C@@H](CNC(=O)C(F)(F)F)C1 2281905023 WVPOJGBTSCSPJZ-ZETCQYMHSA-N 413.614 -0.484 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2csc(B(O)O)c2)[C@H](S(C)(=O)=O)C1 2282220722 OLPXAMABHHKBQL-GHMZBOCLSA-N 418.302 -0.810 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2282369594 IUANYSGXRDQDKY-STQMWFEESA-N 400.262 -0.755 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@@H](CCNC(=O)OC(C)(C)C)C1 2282716427 ULSXGLLGBHZTAO-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)sc2C)C[C@@H]1NC(=O)OC(C)(C)C 2282726103 MTKWBDPRGVZIAV-WDEREUQCSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](C(F)(F)F)[C@@H](C(=O)N=c2nc(B(O)O)[nH]s2)C1 2283946224 KUOARQQPJMMTKY-NKWVEPMBSA-N 410.183 -0.376 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1csc(B(O)O)c1 2283954598 ACPUKEVIBYAXII-GFCCVEGCSA-N 400.262 -0.157 50 10 HBGE C[C@H](CC(=O)NNC(=O)[C@@H]1COCCO1)NS(=O)(=O)c1cccnc1Cl 760694707 CKTRXDTYYYXLOJ-ZJUUUORDSA-N 406.848 -0.645 50 10 HBGE C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 1160776486 OCAKLEKGLSPZBT-TZMCWYRMSA-N 419.525 -0.548 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)cn1 1328652881 GVONWPSRDHEGBH-MELADBBJSA-N 411.484 -0.709 50 10 HBGE O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NC1CCN([C@@H]2CCOC2)CC1 1479004675 JYUOEULCKXVFFG-MRXNPFEDSA-N 400.443 -0.140 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)C1=O 1638110356 XYRQLSXJWPJFOO-NSHDSACASA-N 413.452 -0.047 50 10 HBGE CCN1C[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 1686974684 ZONWKNCTKXVZSL-LBPRGKRZSA-N 411.484 -0.251 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2267621802 KEICURQRGWCYKA-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)n1 2282363114 DWXOBDAEPZLPPB-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2282414013 MVTBJBAQEKXDRW-JLLWLGSASA-N 417.318 -0.360 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2282725377 AHTCGUDZGQUKBK-NSHDSACASA-N 422.334 -0.056 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)N[C@@H]1CCN(CCN2CCOCC2)C1 734685485 FJENIQGUDIIBKA-SJLPKXTDSA-N 403.483 -0.273 50 10 HBGE CCN1CCN(c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)CC1 746164596 YEUKBTUJMGVWRC-OAHLLOKOSA-N 409.512 -0.040 50 10 HBGE NS(=O)(=O)c1ccccc1N1CCN(CC(=O)NNC(=O)c2cccs2)CC1 785507640 QICHJQXTJFRTGO-UHFFFAOYSA-N 423.520 -0.021 50 10 HBGE CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)[C@H]1COCCO1)C2 790755056 VOUWTYFDCTVWOA-CQSZACIVSA-N 412.468 -0.549 50 10 HBGE O=C(NNC(=O)c1c(Br)nc2n1CCOC2)N[C@H]1CCS(=O)(=O)C1 1626650412 RETDCMIADUATOW-ZETCQYMHSA-N 422.261 -0.693 50 10 HBGE CC(C)(C)OC(=O)N1CCN(c2ncc(Br)cc2B(O)O)[C@@H](CO)C1 2223666135 JYFWWQSEYMUNHJ-LLVKDONJSA-N 416.081 -0.058 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282339864 YILGRPMMMAUKMJ-NEPJUHHUSA-N 420.318 -0.471 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C 2282365320 XHUAWFPMENSMDP-IONNQARKSA-N 414.236 -0.044 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)sc1C 2282367725 GJQDSZQSMLGXJX-QWRGUYRKSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1cccc(B(O)O)c1 2282429823 XBHFWILVFXXOQF-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)CO1 2282703363 VMWUVHUFESVTRL-JQWIXIFHSA-N 420.318 -0.364 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CNC(=O)c1cc2c(s1)CCCC2 758051843 GMGCOKWDVIATEX-SECBINFHSA-N 402.498 -0.558 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CNc2cccc(Cl)c2)n(C)c1=O 766635088 GSIHXEZNDVJQKA-UHFFFAOYSA-N 419.829 -0.653 50 10 HBGE C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1nccn1S(=O)(=O)N(C)C 814766888 SQCKSQDMNWZWJV-BFHYXJOUSA-N 400.505 -0.267 50 10 HBGE O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)[C@H]1CCc2nncn2C1 816874663 HXCBIKCAYOSOJV-ZDUSSCGKSA-N 421.417 -0.375 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 817215052 ADPAQERPYOPZDJ-GXTWGEPZSA-N 423.447 -0.050 50 10 HBGE COC(=O)c1ccc(NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c(F)c1 1141814598 JCYCPDSKUIEBSY-RBSFLKMASA-N 405.386 -0.021 50 10 HBGE Cn1ccn2c(CCNC(=O)NNC(=O)COc3ccc(F)cc3)nnc2c1=O 1255505358 XVLCRQMPNHZKTM-UHFFFAOYSA-N 403.374 -0.481 50 10 HBGE CS(=O)(=O)N1CCC(CC(=O)NNC(=O)CNC(=O)c2cccs2)CC1 1357557187 MMDGLWJDJVEUMD-UHFFFAOYSA-N 402.498 -0.313 50 10 HBGE COc1c(F)cc(CC(=O)NCCSS(C)(=O)=O)cc1S(N)(=O)=O 1455115288 NBVSJKYQRQPAMH-UHFFFAOYSA-N 400.475 -0.167 50 10 HBGE O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)[C@H]1CCN1C1CCOCC1 1471976595 PEWUOLPLTDCJNM-CQSZACIVSA-N 414.459 -0.495 50 10 HBGE O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)c2cccc(B(O)O)c2)c1 1542139431 YKKUIBDJCCBUOS-UHFFFAOYSA-N 411.267 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC2=O)C1 1558693994 HCKPVAMBEZEDCG-AWEZNQCLSA-N 403.244 -0.684 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCCN(C)C2=O)CC1 1610948166 PJANMQYWGJUNBA-CQSZACIVSA-N 424.527 -0.281 50 10 HBGE O=C1CN(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCN1 1623864717 CPNWFDXUROMJGZ-UHFFFAOYSA-N 423.495 -0.946 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@@H](CNC(=O)NNC(=O)[C@@H]2COCCO2)C1 1635207540 ODOZYJRRKYBYBV-STQMWFEESA-N 402.448 -0.242 50 10 HBGE COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NNC(=O)CN2CCCC2=O)cc1OC 1643804516 QVNMSUBIHHVKAE-HXUWFJFHSA-N 420.466 -0.089 50 10 HBGE CN(Cc1ccc(B(O)O)s1)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 2039344277 XYZRTWADDGBUOP-UHFFFAOYSA-N 422.293 -0.124 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267388109 SSXFPMFIKSSCHN-MNOVXSKESA-N 406.291 -0.612 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3ccc(B(O)O)s3)[C@@H]2C1 2282075073 QKXFZILUMPQJMG-MNOVXSKESA-N 418.302 -0.563 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NC1(CNC(=O)OC(C)(C)C)COC1 2282375410 PABUNYZAFSQUSG-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282736919 XIHYUDSMGVKVSZ-SFYZADRCSA-N 415.224 -0.816 50 10 HBGE CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)[C@H]1COCCO1 778828756 LBAHATVGVPQCQV-CYBMUJFWSA-N 401.366 -0.192 50 10 HBGE CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1OC 795326629 PIIHJBBGKWLAKQ-SNVBAGLBSA-N 407.832 -0.567 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)N1 1131722427 DZEYETAQXFUQGU-LSDHHAIUSA-N 408.480 -0.346 50 10 HBGE O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@H]1CCC(=O)N1 1148922230 XNRHHLJJGMERRG-SECBINFHSA-N 409.251 -0.302 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)c(=O)n3C)cc2)CC1 1596692725 KKZQTKRUZOSZJB-UHFFFAOYSA-N 408.484 -0.583 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1OCC[C@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1624585806 RQMQWTDQXGUTQE-TUAOUCFPSA-N 405.473 -0.502 50 10 HBGE COC1CC(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1629793382 QCJKJMGEOJKEDV-UHFFFAOYSA-N 424.523 -0.126 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn2c1NCCC2 1635505241 ORNNBGSBVMTQDI-UHFFFAOYSA-N 411.466 -0.082 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 1640382933 RTOIHLXJSRKBTE-UHFFFAOYSA-N 417.484 -0.150 50 10 HBGE O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1652302237 WICHQWJQGZQYOL-ZDUSSCGKSA-N 416.525 -0.183 50 10 HBGE COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ncn1 1654138644 UELDJPQTGSUIQH-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE Cc1nc(C(=O)N[C@@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)s1 2266898572 ZTSREQSZMGLQCW-ZIAGYGMSSA-N 419.268 -0.055 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)cs1 2267199518 NREJUAAMWNHFOC-LLVKDONJSA-N 406.291 -0.011 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCCCCNC(=O)OCc2ccccc2)n1 2267627067 RXTSRXLDDAYUGP-UHFFFAOYSA-N 424.288 -0.525 50 10 HBGE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cc(C)c(B(O)O)s1 2283970948 WNHHYKPIERCYIR-NSHDSACASA-N 400.262 -0.191 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](O)Cc2cnn(C)c2)cc1 786685815 ANVJLZOYWDPQBC-HNNXBMFYSA-N 409.468 -0.900 50 10 HBGE C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCN(C)CC1 1256497156 TZBXVFCGZVDDAR-CYBMUJFWSA-N 411.532 -0.440 50 10 HBGE NC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1 1294588037 XBEQZKJLXKZHNN-CVEARBPZSA-N 401.467 -0.507 50 10 HBGE COC(=O)[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccccc1Cl 1308131697 IWASPZADAXZRHG-GFCCVEGCSA-N 403.844 -0.627 50 10 HBGE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(C(=O)c2cc(B(O)O)c(Cl)s2)C1 2281917821 KJXAOSJUHKMLSL-UHFFFAOYSA-N 417.680 -0.372 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1 2282506730 WQTRKSHXLCPNQQ-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE COCCOCCN(Cc1ccccc1)S(=O)(=O)Cc1ncsc1B(O)O 2282851018 WGBNFDRMARGSJN-UHFFFAOYSA-N 414.314 -0.182 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2288268220 ZQTFGYWVZYOYBO-BMIGLBTASA-N 417.318 -0.501 50 10 HBGE C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)[C@H]1COCCO1 745981774 ZNNNQPYWOANSMA-AUUYWEPGSA-N 402.407 -0.452 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1 772063899 LYFOGGMNKDTOEF-APPDUMDISA-N 416.434 -0.049 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc(Br)ccc1-n1cnnn1 1168877326 ILGAMMSNKKOXEP-UHFFFAOYSA-N 403.218 -0.770 50 10 HBGE O=C(C[C@@H]1CS(=O)(=O)c2ccccc2O1)NNC(=O)[C@H]1CCS(=O)(=O)C1 1539402449 YVJSZWHFGOTPKN-WDEREUQCSA-N 402.450 -0.807 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCS2(=O)=O)CC1 1558940526 YXVNENBTOFTMNE-CYBMUJFWSA-N 417.513 -0.962 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2S1(=O)=O 1627720851 DQJDONPYOPKSHY-UHFFFAOYSA-N 415.435 -0.222 50 10 HBGE CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1ccc(=O)n(C)c1 1653053464 HEMBINYYBSRZCW-UHFFFAOYSA-N 406.464 -0.205 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)NCc1cn(CC(F)(F)F)c(=O)nc1O 1684220595 OUAWTPURPVIIGR-UHFFFAOYSA-N 400.317 -0.021 50 10 HBGE CC(C)[C@H](CCNS(=O)(=O)c1cncc(B(O)O)c1)NC(=O)OC(C)(C)C 2282095464 CZZADAVAWHUKDC-AWEZNQCLSA-N 401.294 -0.021 50 10 HBGE CCN(C[C@H](C)NC(=O)OC(C)(C)C)S(=O)(=O)c1nc(C)n(C)c1B(O)O 2282338459 NMOGRGYBQBTHDN-JTQLQIEISA-N 404.298 -0.668 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1cc(B(O)O)sc1C)NC(=O)OC(C)(C)C 2282355451 GQKOBOUEGXEMGA-NSHDSACASA-N 422.334 -0.056 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C 2282376932 KLGIHVNNZKOHDN-AREMUKBSSA-N 420.318 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]2C1 2282707438 YTJXSAUWGUIARP-TUAOUCFPSA-N 418.302 -0.660 50 10 HBGE O=S(=O)(NC[C@]1(O)CCCN(Cc2ccccc2)C1)c1cscc1B(O)O 2282741620 PZVGCAAZCYJJIV-QGZVFWFLSA-N 410.326 -0.267 50 10 HBGE CN1CCN(Cc2c(C(=O)NN=Cc3ccccn3)nnn2-c2nonc2N)CC1 254760347 YUJKTKUWRDMISN-UHFFFAOYSA-N 411.430 -0.861 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1254316566 WNFHRMVGAQEGRD-GOSISDBHSA-N 424.479 -0.255 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccc(C(F)F)cc2F)n(C)c1=O 1465790564 QAZPHCBVGVIBHS-UHFFFAOYSA-N 424.339 -0.028 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)C1 1471976881 AORHDYYXHPDXSP-CQSZACIVSA-N 412.487 -0.241 50 10 HBGE Cc1c(C(=O)N(C)[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2267357533 ARDKDORBPOQBOI-CABCVRRESA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282339750 ZXGFTYHPZKIIGM-WDEREUQCSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](CNS(=O)(=O)c2cscc2B(O)O)CO1 2282364814 YNQBLZBIMNLPCV-GHMZBOCLSA-N 420.318 -0.364 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@H]1CCOC[C@H]1OCc1ccccc1 2282384444 MTEZZSDYKLNMPG-DZGCQCFKSA-N 412.298 -0.383 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282724833 RJTFXVDQKHKAOY-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728884 HXNWARBFAXGXOF-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)n1 2282733017 OXKBATPLZRBJLE-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE C[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284043701 ZXJFKRCWRKKLHN-PSASIEDQSA-N 400.266 -0.841 50 10 HBGE CC[C@H]1CCCC[C@H]1OCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 768273974 BQECROUNNDITAX-QWHCGFSZSA-N 420.470 -0.434 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)Cc2cnn(C)c2)c1 786688907 PSLYBFSQOSPNLP-INIZCTEOSA-N 423.495 -0.185 50 10 HBGE CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]cc2Cl)c1 1153934920 YPNAGOWCHZKZEZ-UHFFFAOYSA-N 418.884 -0.018 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)N1 1530230766 NQYJLIGPAUYJQT-SECBINFHSA-N 418.522 -0.475 50 10 HBGE COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NNC(=O)c2cn(C)nn2)cc1OC 1532346155 JFBNCZZVIHMGEM-GOSISDBHSA-N 404.427 -0.269 50 10 HBGE C[C@@H]1[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCN1C 1608469548 IIMZGKODEVVCJZ-CZUORRHYSA-N 410.496 -0.191 50 10 HBGE CN1CCO[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1=O 1635520814 ZIEAYQAJKCISRZ-KRWDZBQOSA-N 423.901 -0.538 50 10 HBGE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NNC(=O)[C@@H]1COCCO1 1682583130 VHVYVXLHKIGNTE-HNNXBMFYSA-N 412.468 -0.833 50 10 HBGE CCON(C)C(=O)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1683615541 CRMKNKOOHXGSQY-UHFFFAOYSA-N 401.445 -0.709 50 10 HBGE Cn1nnc(Br)c1C(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1Br 2057676304 XQMSSMHNNINMAR-CRCLSJGQSA-N 402.068 -0.132 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N(C)CC1CN(C(=O)OCc2ccccc2)C1 2267027638 ZZYAEIXZTGKUAO-UHFFFAOYSA-N 400.244 -0.251 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2nscc2B(O)O)C1 2267349295 RNXVHVAHQYGATE-SANMLTNESA-N 403.291 -0.072 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](CO)NS(=O)(=O)c1c(Cl)cccc1B(O)O 2267391923 HRDOHSAJONQNDZ-SECBINFHSA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@](=O)(=NC(=O)c2csnc2B(O)O)C1 2267435717 NHNPQDKZERHUCY-UAXLGHPASA-N 403.291 -0.024 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1cc(B(O)O)cs1 2267610888 LFJWIXWNMRIOHB-NSHDSACASA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282343257 CZZSBPVGSLLZIZ-UHFFFAOYSA-N 406.241 -0.987 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1sc(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282408046 FFMCTTMZDSRXPX-NSHDSACASA-N 400.262 -0.077 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNS(=O)(=O)c2cscc2B(O)O)CC1 2282742237 ZQZOACDXTZBMNL-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ncc(B(O)O)s1)[C@@H](O)C(C)(C)C 2284063377 QLEXHKCNHAWOJM-NWDGAFQWSA-N 401.294 -0.261 50 10 HBGE CC[S@@](=O)CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 741422257 VMYBRZFEUONDBF-AREMUKBSSA-N 418.545 -0.588 50 10 HBGE COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]3COCCO3)C2=O)cc1 744645046 OECFLQQINYCDBU-UGSOOPFHSA-N 406.395 -0.975 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)Nc1ccn(CCN2CCOCC2)n1 814644045 YFTXYIIQWUYJTO-CYBMUJFWSA-N 403.447 -0.778 50 10 HBGE C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)[C@H]2CCc3nncn3C2)C1=O 816882065 WMHVBJZBRCCJGM-BUXKBTBVSA-N 411.422 -0.545 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1457689921 TXXKRMLNXYHKLS-UWVGGRQHSA-N 408.358 -0.818 50 10 HBGE Cn1cc(C(=O)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCS2(=O)=O)cn1 1586569735 KTTQKYBQNHTAIC-LBPRGKRZSA-N 415.472 -0.395 50 10 HBGE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1646044613 KMCSIPWREJYBNY-IRXDYDNUSA-N 422.457 -0.754 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NOC1CN(C(=O)OC(C)(C)C)C1 2282363042 LITOTXCPTDXZPB-UHFFFAOYSA-N 402.234 -0.796 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccccc1B(O)O 2285302380 YJNCQPWMJYDRTM-LBPRGKRZSA-N 402.278 -0.737 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N[C@H]1CS(=O)(=O)C[C@H]1Cl 703992877 HATGNEOZKKJFGY-NEPJUHHUSA-N 406.869 -0.394 50 10 HBGE CCN1C(=O)C(=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c2ccccc21 730569309 TZBBZWLUHLZSSI-UHFFFAOYSA-N 402.436 -0.542 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1454060182 JHEGYUXEWVKFDH-STQMWFEESA-N 408.480 -0.027 50 10 HBGE CS(=O)(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1456177674 JMUXSPNSJHAULI-UHFFFAOYSA-N 410.500 -0.488 50 10 HBGE CO[C@@]1(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCS(=O)(=O)C1 1618241860 WKNFMXJLCNROBE-SFHVURJKSA-N 422.463 -0.058 50 10 HBGE O=C1CN(c2ccnc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)c2)CCN1 1645053999 NEAHLXWCIUMQNO-MRXNPFEDSA-N 402.455 -0.968 50 10 HBGE CCOC(=O)CS[C@H](CNC(=O)NNC(=O)[C@H]1COCCO1)C(F)(F)F 1684893565 OMBRIJFAJXHUMF-RKDXNWHRSA-N 403.379 -0.041 50 10 HBGE COC(=O)[C@H](CNC(=O)OC(C)(C)C)Oc1ncc(Br)cc1B(O)O 2223628401 TYLCVBBMVPPZEV-JTQLQIEISA-N 419.037 -0.031 50 10 HBGE CCON(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267392780 OBRSJSCLHAXHBM-UHFFFAOYSA-N 409.295 -0.569 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267714925 PGCLBQDQMOALLU-OTYXRUKQSA-N 403.291 -0.748 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCN1S(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282363723 JGUQFFNRMODLBZ-SNVBAGLBSA-N 406.216 -0.068 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1F 2282720879 HREKTXQEHGPVOT-NEPJUHHUSA-N 404.225 -0.924 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(F)CN(C(=O)OC(C)(C)C)C2)ccc1B(O)O 2282736278 NSLYENZBCRVJFG-UHFFFAOYSA-N 402.253 -0.088 50 10 HBGE COc1ccc(C(=O)N/N=C(\c2nc3ccccc3[nH]c2=O)[C@H](O)[C@H](O)CO)cc1 5285631 UTIQURRKVVUIES-NUGVPOSTSA-N 412.402 -0.220 50 10 HBGE COc1c(F)cc(CC(=O)NNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)cc1S(N)(=O)=O 1165461843 CDILRHYQXVKTAZ-JFGNBEQYSA-N 401.416 -0.261 50 10 HBGE CN(C)C1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 1290232108 BOAGHPZBFJDKMC-UHFFFAOYSA-N 424.523 -0.118 50 10 HBGE CNS(=O)(=O)NCC(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1472469571 DAIGHBUWYPUOPJ-UHFFFAOYSA-N 406.464 -0.143 50 10 HBGE O=C(NNC(=O)C1(O)COC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 1587153730 AYLPVBZDFHWWFX-UHFFFAOYSA-N 405.432 -0.313 50 10 HBGE COC[C@]1(C(=O)NNC(=O)N2CCN(C)CC2)CN(C(=O)OC(C)(C)C)CCO1 1626125959 POIKBRCXCDFWIM-SFHVURJKSA-N 415.491 -0.373 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 1639935626 ZWCJNFVDJHILSY-QWRGUYRKSA-N 403.482 -0.045 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nnn(-c2ccccc2)c1C(F)F 1654294779 JPBAGARLKGTTJR-QMMMGPOBSA-N 402.383 -0.096 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)NC1CCN(C(=O)OCc2ccccc2)CC1 2267431621 BOZJLJOMKUYYGS-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1ncc(B(O)O)s1 2268642389 SCHSNVBPCWBWGE-MRVPVSSYSA-N 407.279 -0.911 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NC(=O)c2cscc2B(O)O)C1 2281606968 LMBHSLIVQUDNOV-NEPJUHHUSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2ccc(B(O)O)s2)[C@H](S(C)(=O)=O)C1 2281618059 DPLJJSWIDGOZKS-MWLCHTKSSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(B(O)O)c(F)c2)CCO1 2282366833 ULOBSLOUAAHQCS-SNVBAGLBSA-N 404.225 -0.275 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1ccc(B(O)O)cc1O)OCc1ccccc1 2282874974 IWJTWMKWQSZWDK-DLBZAZTESA-N 414.223 -0.114 50 10 HBGE O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)[C@H]1COCCO1 745999478 YRCZLTFIGRJVDQ-OAHLLOKOSA-N 412.468 -0.710 50 10 HBGE Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816881112 ZHCAUAPGAYZSIX-DZGCQCFKSA-N 413.417 -0.094 50 10 HBGE COc1cccc([C@@]2(C)NC(=O)N(NC(=O)c3cc(B(O)O)ccc3F)C2=O)c1 1634476788 IZVAGNFULFOQDM-GOSISDBHSA-N 401.159 -0.374 50 10 HBGE Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1C 1635371306 AKJFWUPZOPPXOV-MRXNPFEDSA-N 410.496 -0.035 50 10 HBGE O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccnnc1 1643024664 NQJGRYNSHCVVOY-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 1643800368 RWZSESBBUYBWPN-UHFFFAOYSA-N 412.443 -0.006 50 10 HBGE O=C(CN1C[C@H]2C[C@H]1CN2C(=O)C(F)(F)F)N[C@H]1CS(=O)(=O)C[C@H]1Cl 1884253448 KZVFDWUDZQBLSE-JLIMGVALSA-N 403.810 -0.646 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cscc1B(O)O 2267410553 LDSJYJMHEPFNEV-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(CNS(=O)(=O)c3cscc3B(O)O)[C@@H]2C1 2267622639 USHYEMLRGJGYBC-QWRGUYRKSA-N 402.303 -0.181 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NC(=O)c2ncc(B(O)O)cc2F)CC1 2281659423 DGGOSNNEEMYAFK-UHFFFAOYSA-N 401.225 -0.241 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2csc(B(O)O)c2)[C@H](S(C)(=O)=O)C1 2282220725 OLPXAMABHHKBQL-WDEREUQCSA-N 418.302 -0.810 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@@H]1CNC(=O)OC(C)(C)C 2282361635 UGLIDEQJKSFIIF-WDEREUQCSA-N 420.318 -0.446 50 10 HBGE COCC1(CNS(=O)(=O)c2cscc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282738507 VUUBDRWAWUZQOW-UHFFFAOYSA-N 420.318 -0.410 50 10 HBGE COCCN(C=C(C#N)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H]1CCS(=O)(=O)C1 2325031365 JOPZNKWOXVTYOH-KGLIPLIRSA-N 419.525 -0.148 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)Nc1ccn(CC(=O)N2CCOCC2)n1 756654790 LUYLXTOSUBITNT-HNNXBMFYSA-N 414.422 -0.102 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccnn2C2CCCC2)n(C)c1=O 766641612 AXAOGLITJVXJFP-UHFFFAOYSA-N 414.426 -0.794 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)NNC(=O)[C@H]1COCCO1 801028731 NGUIUKWLJUQBFJ-LLVKDONJSA-N 424.838 -0.497 50 10 HBGE O=C(NCCN1CCOCC1)c1ccc(NC(=O)c2cc(B(O)O)ccc2F)cc1 1136584415 CMUIANCIWMVKNC-UHFFFAOYSA-N 415.230 -0.180 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@]3(C)C[C@H](O)CN3C)cc2)CC1 1151459749 XMLSGBUKJHMPCM-MAUKXSAKSA-N 411.528 -0.479 50 10 HBGE CO[C@@H]1CCOC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1251253729 CIOGFYCECJKLHH-ZIAGYGMSSA-N 400.457 -0.315 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c(OC)c1 1638558787 GQVHQBASXNFVRZ-MRXNPFEDSA-N 401.441 -0.149 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)[C@H]1CCCCO1)C1CCCC1 1674042475 VBUQBHINDBGINM-UONOGXRCSA-N 405.521 -0.159 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)CC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 2266365675 LCXWOCQQYDKWHW-NWDGAFQWSA-N 413.924 -0.674 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)[C@H]2C[C@H]21 2267365823 WENVUNLLKCKQMT-NEPJUHHUSA-N 402.303 -0.049 50 10 HBGE C=C(CS(=O)(=O)N=[S@@](C)(=O)N1CCN(C(=O)OC(C)(C)C)CC1)B(O)O 2267623029 COXIFZOXRYASGG-RUZDIDTESA-N 411.311 -0.550 50 10 HBGE CN(CC[S@@](C)(=O)=NC(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2281663349 KFSSNPFJTGWWNQ-HHHXNRCGSA-N 422.700 -0.142 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 2282707371 YAFUZZCSQJZQRM-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2334266893 ITMUPWYNCRQQBR-INTQDDNPSA-N 403.291 -0.750 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2cccc(B(O)O)c21 712242919 FHFYJBFTQWTRQT-UHFFFAOYSA-N 400.221 -0.645 50 10 HBGE CO[C@]1(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCS(=O)(=O)C1 1360608473 XSRHIZDNMMORIL-QGZVFWFLSA-N 419.500 -0.015 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1533743950 ARWKXGOVZSZGAO-FVCCEPFGSA-N 410.496 -0.291 50 10 HBGE O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)[C@H]1CCS(=O)(=O)C1 1628908235 HMZQSSFKMPAJTR-MRBYEJRBSA-N 404.514 -0.706 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COCCN2S(=O)(=O)c2ccc(B(O)O)s2)C1 2282083840 RMZPYXQNANLQET-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282336950 IARVRCACQKGXQA-VXGBXAGGSA-N 420.318 -0.782 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)c1c(B(O)O)cnn1C 2282705556 ZPDKCKDEZVQQGC-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282708732 QMCDXAPLBLBQNQ-IJLUTSLNSA-N 420.318 -0.223 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1 2282711467 CLOAMHXNFRFKOH-OAHLLOKOSA-N 402.282 -0.975 50 10 HBGE CNS(=O)(=O)N1CCC(C(=O)NNC(=O)CN2CCCc3ccccc32)CC1 794767596 QZDJDIMVZRQFIP-UHFFFAOYSA-N 409.512 -0.237 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)C[C@@H](C)O1 1160415995 HXWBPVFUFKXKMB-TXEJJXNPSA-N 413.500 -0.849 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)CN2CCCC3(CC3)S2(=O)=O)C[C@@H](C)O1 1306209834 OHXTWQVVTFETFF-ZIAGYGMSSA-N 402.517 -0.409 50 10 HBGE Cn1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 1336600300 JTYOMQHGISPYDZ-UHFFFAOYSA-N 422.467 -0.415 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 1539067566 RQDMCNUKHXBQES-OAHLLOKOSA-N 415.560 -0.426 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)O1 1566279148 FQJKIMDCTAAGET-MSOLQXFVSA-N 418.494 -0.019 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C 2281635346 YKKYFDDCNWBCHO-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282068234 AHWIJOFSWBFRKP-VXGBXAGGSA-N 420.318 -0.222 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CNCCN2Cc2ccccc2)sc1B(O)O 2282359903 UOCZKCVHOUBKMO-HNNXBMFYSA-N 409.342 -0.511 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@]2(CNS(=O)(=O)c3cscc3B(O)O)C[C@H]1CO2 2282372006 RYSONUMXFWAGOI-BONVTDFDSA-N 418.302 -0.515 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)[C@H]2COC[C@@H]12 2282507886 NMEHWBBHUVSCEF-WCQGTBRESA-N 418.302 -0.660 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@H](CCNC(=O)OC(C)(C)C)C1 2282719140 HWMMXYPIJOFAAA-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282733509 XAHJGBFWBDLLPT-NEPJUHHUSA-N 406.216 -0.021 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)n1C 2337404849 JDZGAQBTBIFKLL-LSDHHAIUSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1cc(Cl)ccc1B(O)O 2359390792 SPXLEWFEXTZICL-JHJVBQTASA-N 400.624 -0.701 50 10 HBGE NC(=O)CN1C(=O)C(=NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21 254819819 XZSREOXCOGEGBB-UHFFFAOYSA-N 423.385 -0.503 50 10 HBGE CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)[C@@H]1COCCO1 755531012 JQBHFZDHOLKLRR-AWEZNQCLSA-N 415.472 -0.429 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 776754572 WSCQNPJFBZEUCE-NSHDSACASA-N 405.473 -0.406 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)[C@H]1CCc2nncn2C1 816885550 CIFMRELVMJNTKZ-NWDGAFQWSA-N 424.508 -0.097 50 10 HBGE CC1=C(C)C(=O)N(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 1585617656 MIYOXDUHTAFOCZ-UHFFFAOYSA-N 400.439 -0.064 50 10 HBGE CN(CC1(NC(=O)OC(C)(C)C)CC1)S(=O)(=O)Cc1ncsc1B(O)O 2267627800 CZEIAYQXLVRRMZ-UHFFFAOYSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1O 2282079068 RCHDKACTMHKKBX-JLLWLGSASA-N 420.318 -0.630 50 10 HBGE O=C(O)[C@H](COCc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2284403853 UXYUGGCVYLMBKO-HNNXBMFYSA-N 413.644 -0.032 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)Cc2ccsc2B(O)O)CC1)C(F)(F)F 2286119204 CIPMOYUABXFMNK-JTQLQIEISA-N 414.236 -0.209 50 10 HBGE CCOc1c(OC)cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc1[N+](=O)[O-] 169893113 FCIJYEZWCQHKMF-UBKPWBPPSA-N 407.343 -0.664 50 10 HBGE O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 731620656 DWQDHEZHSZCCCN-BFHYXJOUSA-N 416.500 -0.831 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)[C@H]1COCCO1 755433298 CTVVYLBBZVYLCL-NWDGAFQWSA-N 400.432 -0.935 50 10 HBGE COc1cc(OC)c(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(OC)c1 777599049 GWFAUMDWUCVBGY-SECBINFHSA-N 408.454 -0.543 50 10 HBGE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 782226590 FQIQCRKGXUTPAP-NSHDSACASA-N 405.473 -0.406 50 10 HBGE O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@@H]1CCc2nncn2C1 816884114 RHRZJHDOCVDRRJ-ZHUYAKLQSA-N 418.479 -0.032 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cn1 1124467440 BVGBYDIOUTXOTA-KBPBESRZSA-N 413.500 -0.625 50 10 HBGE CCCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1135501970 AVSFZQKCOUANOV-UHFFFAOYSA-N 405.498 -0.087 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3C[C@@H](O)C3)CC2)cc1 1294587525 GLPXKYWVAPQAMY-GASCZTMLSA-N 410.496 -0.780 50 10 HBGE COCC(COC)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 1654720045 MDZQSLKAOHJGGQ-UHFFFAOYSA-N 409.443 -0.365 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3cc(B(O)O)cs3)C[C@H]2C1 2267612736 NVJKWYLTPWSWCU-WCQGTBRESA-N 402.303 -0.038 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cccc(B(O)O)c1 2282097959 MEFKVKHAFAXGRN-UHFFFAOYSA-N 400.262 -0.072 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1C(=O)c1ccsc1B(O)O 2282261359 WQSAJTKSHRHSJY-MRXNPFEDSA-N 400.262 -0.844 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H](O)C[C@H]1CNC(=O)OC(C)(C)C 2282368973 YQOMWOVSVYTOGJ-WDEREUQCSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)c2cccc(B(O)O)c2)C1 2282704334 IZAPIDRPPYCLIJ-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282725838 INYVNOWGXDZGNT-HNNXBMFYSA-N 406.241 -0.941 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@](C)(CO)C1 2282731796 WMMNRECYROJEKO-OAHLLOKOSA-N 420.318 -0.580 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1CN([C@H]2CCOC2)C1 1137299342 OKMAKQFUINGTFP-SFHVURJKSA-N 415.494 -0.688 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n(C)c1=O 1137304500 XKYYBDVZUDUSPB-UHFFFAOYSA-N 420.901 -0.044 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1cc(Br)ccc1-n1cnnn1 1302583737 YWSPEPLDKWFJDC-UHFFFAOYSA-N 408.216 -0.192 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@@H]1CCC(=O)N1 1587115638 XSJJFYNBLKFXTF-HNNXBMFYSA-N 408.480 -0.170 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn2c(=O)cc[nH]c12 1587969311 YVLRPPDTPXBTAS-UHFFFAOYSA-N 423.433 -0.758 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c3c(nn2C)CCC3)CC1 1610951609 CKCUGJAFDKANTL-UHFFFAOYSA-N 419.511 -0.003 50 10 HBGE Cn1nc(C(=O)NNC(=O)CC2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O 1618234440 JWWQQYGHUGHTPM-UHFFFAOYSA-N 421.479 -0.244 50 10 HBGE O=C(c1ccc(-c2nn[nH]n2)cn1)N1CCN(S(=O)(=O)CBr)CC1 1637455444 DADPOQDTLWIMBO-UHFFFAOYSA-N 416.261 -0.298 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3cc(B(O)O)cs3)C[C@@H]2C1 2267614947 VPLPNNAGAIJIOY-QWRGUYRKSA-N 402.303 -0.085 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1 2281905529 BSQIUMRQMXGZKQ-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@@H]1CO 2282699374 JQWVEOIQXYSGTH-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE CCNC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 761780232 MDCZXXHAFQATMT-LLVKDONJSA-N 401.427 -0.319 50 10 HBGE C[C@@H](Cc1ccccc1F)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765726414 AZUOXFCCLLMAAI-NSHDSACASA-N 416.413 -0.401 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)n(C)c1=O 802762877 OXTAYZMCFUKYHS-IUCAKERBSA-N 416.360 -0.440 50 10 HBGE CN1C(=O)CN(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 1350637574 GXBPBQKKRQLQCW-UHFFFAOYSA-N 402.455 -0.760 50 10 HBGE CS(=O)(=O)N1CCN(CC(=O)NNC(=S)NCCc2cccs2)CC1 1463855221 HIUQLECKYFWOTR-UHFFFAOYSA-N 405.571 -0.637 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1F 1634355389 JSTSAHZTCLNWLG-UHFFFAOYSA-N 409.461 -0.338 50 10 HBGE C[C@]1(C(=O)NNC(=O)CN2CCCC2=O)C[C@@H](O)CN1C(=O)OCc1ccccc1 1635877737 IYUQATGUJSQWQU-FOIQADDNSA-N 418.450 -0.082 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)n1 2266888544 QJGSAMZOACJFAT-GFCCVEGCSA-N 414.149 -0.313 50 10 HBGE Cn1cc(C(=O)N[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)nc1B(O)O 2267321482 IPUFGWMFIKQKLB-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1cc(B(O)O)cs1 2267607352 LOUOIUKAYGCKTM-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282337825 NPXXZXXBIKCZSM-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1CCO 2282708515 NPQZJCAFYWFNFW-NSHDSACASA-N 420.318 -0.580 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(CNS(=O)(=O)Cc3ncsc3B(O)O)[C@@H]2C1 2282737562 HUCXGHIWKRZAAR-QWRGUYRKSA-N 417.318 -0.645 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N[C@@H]1CS(=O)(=O)C[C@H]1Cl 703997055 ZQZJOPRLAKCGDE-CHWSQXEVSA-N 420.896 -0.004 50 10 HBGE CC[S@](=O)CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 741422258 VMYBRZFEUONDBF-SANMLTNESA-N 418.545 -0.588 50 10 HBGE CN(C)c1ncn(-c2cccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)n1 799418357 GCCPEIPJIXYLQV-NSHDSACASA-N 407.456 -0.079 50 10 HBGE COC/C=C\C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1135611074 LYIDQSPIXUGLLY-IHWYPQMZSA-N 411.480 -0.010 50 10 HBGE CC(C)(C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)NCc2ccccc2)CC1 1195874832 YMAKCEVRCZIONC-UHFFFAOYSA-N 411.528 -0.168 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1cc[nH]n1 1453303242 HSZGEBNCGGPYMJ-UHFFFAOYSA-N 402.230 -0.088 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)[C@H]2CCCN(S(N)(=O)=O)C2)cc1 1455405204 IAGMELUZOUIPMD-NSHDSACASA-N 400.530 -0.014 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2(C)CCC(F)(F)CC2)n(C)c1=O 1622153565 KKILIMGRLIMMNA-UHFFFAOYSA-N 412.397 -0.203 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)CN2CCCc3ccccc32)C1=O 1624318145 UPHWYEJSKUHEJH-HNNXBMFYSA-N 402.451 -0.002 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=S)NCCc3cccs3)c2S1(=O)=O 1629084194 XHQOQEDJWUDLSK-UHFFFAOYSA-N 414.538 -0.070 50 10 HBGE C[C@@H](Sc1ncccc1C(=O)NNC(=O)CS(C)(=O)=O)C(=O)N1CCCC1 1630862334 GXWDJJFZMAZLHJ-LLVKDONJSA-N 414.509 -0.010 50 10 HBGE C/C=C\[C@@H](O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1635501119 VHUJWKOJRIXUNH-MJSXRHKHSA-N 410.496 -0.614 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1645963017 ABACKWXYRTWNEE-UPJWGTAASA-N 406.443 -0.427 50 10 HBGE O=C(CNC(=O)c1ccccn1)NNc1ccccc1S(=O)(=O)N1CCOCC1 1654365953 IUEAKUFDMWLKJX-UHFFFAOYSA-N 419.463 -0.024 50 10 HBGE O=C(CN(Cc1ccccc1)CC1(O)CNC1)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 1915486380 QATKHEQYXSLYJT-LSDHHAIUSA-N 401.916 -0.657 50 10 HBGE CN1C[C@H](NS(=O)(=O)c2c(Br)nnn2C)[C@H](Br)C1 2029861595 BYFBKHDHLYNAJI-RITPCOANSA-N 403.100 -0.067 50 10 HBGE Cc1cc(B(O)O)c(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)s1 2215982679 PDZYWRCKCCZUND-UHFFFAOYSA-N 408.266 -0.548 50 10 HBGE C=C(CS(=O)(=O)N1CCO[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)B(O)O 2282362945 KJPMNBIGDFGIKV-INIZCTEOSA-N 404.294 -0.014 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C 2282699173 IIIZKQBEWXBQOB-CMPLNLGQSA-N 402.282 -0.928 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282740429 ZNPYOTGCQHORNA-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE C[C@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1nscc1B(O)O 2284061461 FDWAUEOIFDDTFA-GZMMTYOYSA-N 403.241 -0.680 50 10 HBGE O=C(NNC(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)[C@@H]1COCCO1 771219531 JBCRCTFFXMIXFI-WFASDCNBSA-N 418.406 -0.860 50 10 HBGE COc1ccc(-c2cc(C(=O)NNC(=O)CN3CCOCC3=O)n[nH]2)cc1OC 790891672 RNFDUKXNWGDQLW-UHFFFAOYSA-N 403.395 -0.286 50 10 HBGE COCC#CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1160425746 JZMSMKVGTJXOIT-UHFFFAOYSA-N 409.464 -0.563 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@]3(C)CCNC(=O)C3)cc2)CC1 1545921753 FSMXECGIRNTOHK-GOSISDBHSA-N 409.512 -0.018 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cn(C)nn2)ccc1OC 1617483764 BNJANZISERPBGI-UHFFFAOYSA-N 410.456 -0.071 50 10 HBGE O=C(NNC(=O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F)c1ccc(-n2cnnn2)cc1 1624704121 WQDCGFOFDGIVDT-GHMZBOCLSA-N 418.357 -0.354 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)COCC(=O)NCc1cccnc1 1632923140 ATYKKPNBUCOSJE-UHFFFAOYSA-N 407.471 -0.196 50 10 HBGE Cn1cc(C(=O)N[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)nc1B(O)O 2267321481 IPUFGWMFIKQKLB-GFCCVEGCSA-N 414.149 -0.313 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)c1cscc1B(O)O)C(F)(F)F 2267621465 HGACXYJURHXJPH-MRVPVSSYSA-N 400.209 -0.350 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 2282066014 PTUNGTCWWMUGIA-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 2282078312 GYVKZQZFJWWWEY-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CCCC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1c(B(O)O)cnn1C 2282084847 RKHOFGBNJUBECU-LLVKDONJSA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NS(=O)(=O)c2cccc(B(O)O)c2)s[nH]1 2282092002 KCWHQQZIJVFFCV-UHFFFAOYSA-N 414.274 -0.535 50 10 HBGE O=S(=O)(c1ccc(Cl)c(B(O)O)c1)N(Cc1ccccc1)CC1(O)CNC1 2282360979 KNLKNQKPQCNUIB-UHFFFAOYSA-N 410.688 -0.455 50 10 HBGE CCC(CC)(CNS(=O)(=O)c1c(B(O)O)cnn1C)NC(=O)OC(C)(C)C 2282703429 WDWPPMADXSAOQO-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2cccc(B(O)O)c2)C1 2282704333 IZAPIDRPPYCLIJ-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282736807 WDEYJEKQXSAJJU-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cscc2B(O)O)[C@@H](CO)C1 2282742170 YTAVRYRQHWZESL-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cnc(B(O)O)s1)[C@H](O)C(F)(F)F 2284130296 SFKZGPVDVCZVDK-YUMQZZPRSA-N 413.183 -0.744 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H](CN(C)Cc2ccccc2)C(=O)O)sc1B(O)O 2284411248 HYPHENLPRZSDSI-ZDUSSCGKSA-N 412.298 -0.400 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(Oc2ncccc2B(O)O)CCCS(=O)(=O)C1 2368395349 VUTUXSBAXSGNKZ-MRXNPFEDSA-N 400.262 -0.388 50 10 HBGE N#C/C(=C/NCCN1C(=O)CSC1=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1 217006789 QAKBZUSAXWDNND-NTMALXAHSA-N 409.449 -0.035 50 10 HBGE NC(=O)c1ncccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 787439197 IFIASFWTNYNBPE-UHFFFAOYSA-N 410.434 -0.601 50 10 HBGE NS(=O)(=O)c1ccccc1N1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1168494036 GSODAKYSYBXMIG-UHFFFAOYSA-N 407.232 -0.885 50 10 HBGE COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)[C@H]1CCC(=O)N1)CC2 1470498854 SGEKAHHJNWYDII-CQSZACIVSA-N 418.450 -0.205 50 10 HBGE CN1CCC(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)(N2CCOCC2)CC1 1470507460 RKVMOHHFGVDOOG-MRXNPFEDSA-N 403.549 -0.836 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2cncc(B(O)O)c2)C1 2255669532 PQEZCXIWROMPII-UHFFFAOYSA-N 405.241 -0.692 50 10 HBGE O=C(N1CCC[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1)C(F)(F)F 2267208225 WRQLQDMIYCJCNI-QMMMGPOBSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNS(=O)(=O)c2cscc2B(O)O)C1 2267624231 VDSGXMRJMJLFIG-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)n1 2281652050 ZBVRONLUZLYVJS-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE Cc1nc(S(=O)(=O)NCCC[C@@H](C)NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282417973 LENVOFNRNKSYQO-SNVBAGLBSA-N 404.298 -0.620 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 2282706609 NYGADDJKZZDBEO-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)NCCSSCCNC(=O)OC(C)(C)C 2337289817 NHQAGETYAYUJLV-UHFFFAOYSA-N 404.323 -0.264 50 10 HBGE COc1ccc(B(O)O)cc1NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 704309042 BUQHQXBQNVSJCX-UHFFFAOYSA-N 418.236 -0.197 50 10 HBGE Cc1c(F)cccc1NC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 756839773 HRLOOTSOTUINQM-UHFFFAOYSA-N 403.374 -0.266 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3(S(N)(=O)=O)CC3)CC2)cc1 1137300167 IDLJTKSOCHKZJR-UHFFFAOYSA-N 409.512 -0.919 50 10 HBGE CC[C@H](C)[C@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)NCCN1CCOCC1 1143965639 SQLQRGLWRHEATA-GUYCJALGSA-N 409.267 -0.902 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccc(B(O)O)cc1 1291595342 GXFRPZZUHOVLFC-KRWDZBQOSA-N 418.280 -0.246 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn4c(=O)cc[nH]c34)CC2)cc1 1545424136 NXBOEBFRUCWWFP-UHFFFAOYSA-N 423.477 -0.090 50 10 HBGE O=C(NNC(=O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F)c1ccc(-n2cnnn2)cc1 1624704130 WQDCGFOFDGIVDT-MNOVXSKESA-N 418.357 -0.354 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267203231 NRKLRZUUPLXVAT-YUMQZZPRSA-N 400.209 -0.495 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1 2267324363 ZPQXDFHQFGJTOP-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@@H]2CN1S(=O)(=O)c1cscc1B(O)O 2267625515 QYBOIANLAZLTSB-JFGNBEQYSA-N 402.303 -0.038 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282333998 VZQUZMXYYUJPSA-PSASIEDQSA-N 414.236 -0.211 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@@H]21 2282414012 MVTBJBAQEKXDRW-ADEWGFFLSA-N 417.318 -0.360 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1B(O)O 2282418154 MNWJEGXNFNUYOU-GHMZBOCLSA-N 420.318 -0.385 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2282435195 USHJHRMEJUVAME-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(F)C[C@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282719275 JOTISCCQVYDISV-FUKZOUPISA-N 403.241 -0.565 50 10 HBGE CN(CC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)cc1F 2282739180 FMDZRXHPLVRSBL-UHFFFAOYSA-N 402.253 -0.007 50 10 HBGE COC(=O)[C@H](CC(=O)N[C@@H](C)c1nscc1B(O)O)NC(=O)OC(C)(C)C 2284012212 UGFGFKOAZKMKPQ-WPRPVWTQSA-N 401.250 -0.544 50 10 HBGE CS(=O)(=O)N1CCN(C=C(C#N)C(=O)Nc2cccc(S(=O)(=O)O)c2)CC1 2324210064 UMFHDTDFBSYNDJ-UHFFFAOYSA-N 414.465 -0.144 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COCCO2)ccc1Cl 744640772 CYEIAHUFTUEENT-NSHDSACASA-N 407.832 -0.302 50 10 HBGE C[C@@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 745681066 OQLKPNQLPZPNOR-RISCZKNCSA-N 400.457 -0.256 50 10 HBGE C[C@H](CO)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1299926572 VVKDODZQFFPRSJ-OCCSQVGLSA-N 407.514 -0.888 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)c1cccc(Cl)c1 1538921595 CXZOOHFHUUXJKC-UHFFFAOYSA-N 404.876 -0.065 50 10 HBGE CN(CCCC(=O)NNC(=O)c1cn(C)nn1)C1=NS(=O)(=O)c2ccccc21 1587244548 ZBMCMBRHOWCIPD-UHFFFAOYSA-N 405.440 -0.563 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(c2cccc(F)c2)C1 1654295126 WMCLRHBUZCUMSB-GHMZBOCLSA-N 400.432 -0.346 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@H](O)C1 2267422543 BPUYTRWTXMEJAM-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2cscc2B(O)O)C1 2267625977 YZEQFQGYKBNDDU-OLUQVHSISA-N 424.331 -0.118 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282070196 AJBAUGBFWGWZGO-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282705566 ZROWKJKAUSTRHB-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE CN(Cc1ccccc1)[C@]1(CNS(=O)(=O)c2cc(B(O)O)cs2)CCOC1 2282706711 PLPVFVSKIQHKHV-KRWDZBQOSA-N 410.326 -0.003 50 10 HBGE COCC1(NS(=O)(=O)c2cc(B(O)O)sc2C)CN(C(=O)OC(C)(C)C)C1 2282722508 HUNDEFTYVBMDEK-UHFFFAOYSA-N 420.318 -0.349 50 10 HBGE COc1cc(/C=N/NC(=O)[C@H](C)Sc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1O 169890769 CUOJNQTUQZAYOE-XMQIJBHMSA-N 410.368 -0.289 50 10 HBGE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1 805044150 HRWHKUKCFYZRBF-LLVKDONJSA-N 417.513 -0.378 50 10 HBGE CN1CCN(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)CC1 1139084053 FLYBKAIRIMOZGZ-UHFFFAOYSA-N 410.496 -0.002 50 10 HBGE CCS(=O)(=O)N[C@@H](C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1147903080 RDOHEVPDEPEWIS-LBPRGKRZSA-N 420.513 -0.522 50 10 HBGE CO[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)[C@@H]1CCOC1 1182816474 SESJGONYTHVRIP-UKRRQHHQSA-N 413.500 -0.488 50 10 HBGE CS(=O)(=O)C[C@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1 1292038203 CNPDNFOADYQFJI-OLZOCXBDSA-N 403.482 -0.668 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@@H]2CCC(=O)NC2)CC1 1306648080 AHGPAZYHFXBZJK-ZDUSSCGKSA-N 410.500 -0.623 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@H]2COCCO2)C[C@@H](O)CN1C(=O)OCc1ccccc1 1545111645 YWZPPIPIUYPEAR-SPYBWZPUSA-N 407.423 -0.289 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)NNC(=O)CN3CCCC3=O)=NO2)C1 1557979463 ROYUSYOZSWMITK-SFHVURJKSA-N 409.443 -0.088 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C#CC1CCN(C(=O)OC(C)(C)C)CC1 1641246361 AMBDGZIBEQXOPN-LBPRGKRZSA-N 416.500 -0.278 50 10 HBGE Cn1cc(S(=O)(=O)NC[C@@H]2[C@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(CCl)n1 2233980386 XRXDVAMDPJNGTI-MDZLAQPJSA-N 424.907 -0.222 50 10 HBGE CCC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ncsc1B(O)O 2267626957 QRYBHYICCGZWHM-JTQLQIEISA-N 407.323 -0.064 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CC[C@@H]1NC(=O)OC(C)(C)C 2282077821 AGTUEBYYPUUPAW-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282361648 UKGOMLWTFSNAFY-UHFFFAOYSA-N 422.696 -0.161 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1COCCN1Cc1ccccc1 2282370130 QDPDFWOVDYNYQA-OAHLLOKOSA-N 410.326 -0.084 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)n1 2282378032 ZTDGAWHPNPQCOH-ZYHUDNBSSA-N 402.282 -0.928 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)cn1C 21436027 UJXGXHBOFSKRCQ-UHFFFAOYSA-N 404.246 -0.152 50 10 HBGE O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)c1cnn[nH]1 729457601 RMRFSHUOCRGSJI-UHFFFAOYSA-N 402.483 -0.322 50 10 HBGE COC/C=C/C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1135611075 LYIDQSPIXUGLLY-NSCUHMNNSA-N 411.480 -0.010 50 10 HBGE COCCn1cc(N2C[C@H](C(=O)NNC(=O)COc3ccccc3O)CC2=O)cn1 1144657268 RLXPTPHXFVANSM-CYBMUJFWSA-N 417.422 -0.186 50 10 HBGE CN1CCC(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)(N2CCOCC2)CC1 1230072543 FUXMXBISOAVOLH-UHFFFAOYSA-N 406.487 -0.874 50 10 HBGE C[C@@](O)(Cn1ccccc1=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1321006850 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HBGE Cc1nnc(CN(C)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1C 747337412 QTAZJFBPDBVMCW-UHFFFAOYSA-N 423.499 -0.733 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 758043419 HJYXZKWBJFYCGM-IUCAKERBSA-N 404.395 -0.597 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 758046268 GRCPWWQVYVTDEJ-ZETCQYMHSA-N 417.387 -0.321 50 10 HBGE CCOC(=O)C1CCC(=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 764812057 FLZQGLOOTLGSME-UHFFFAOYSA-N 404.427 -0.341 50 10 HBGE CS(=O)(=O)C1(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CCOCC1 816545451 RICFQRONDVGUQW-UHFFFAOYSA-N 413.452 -0.346 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)NC[C@H](C)O)cc1 1624409583 BHNQEUUMKQZWRW-LBPRGKRZSA-N 418.541 -0.167 50 10 HBGE CN(C)N(C(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1)[C@@H]1CCS(=O)(=O)C1 1629230952 VMHSFOWBWAIDQX-GFCCVEGCSA-N 403.482 -0.949 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NC1CN(C(=O)OCc2ccccc2)C1 2255756789 LHZRMIHYBPIVRV-UHFFFAOYSA-N 404.253 -0.026 50 10 HBGE Cc1ccnc(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2281886241 JCPGVIUALQIICW-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N(CCO)CCNC(=O)OC(C)(C)C 2282378155 BGJBVGZMOUJIIL-UHFFFAOYSA-N 402.278 -0.817 50 10 HBGE COCC1(CNS(=O)(=O)c2sccc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282703067 REBZTLVXMYLTHP-UHFFFAOYSA-N 420.318 -0.410 50 10 HBGE C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282736809 WDEYJEKQXSAJJU-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)n1 2282738918 BBJUEQUKFDCDAX-XYPYZODXSA-N 402.282 -0.928 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)n1 2282739406 IYSMHUWQGAMHCW-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282740641 CLTROQMHGQFVMX-NEPJUHHUSA-N 420.318 -0.782 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@](C)(=O)CC1CN(C(=O)OC(C)(C)C)C1 2362450507 FDTGTWRHVDFKLJ-HHHXNRCGSA-N 400.266 -0.795 50 10 HBGE C[C@H](CN1CCN(C)CC1)NC(=O)NNC(=O)CNC(=O)OCc1ccccc1 792986729 CIUNHBIYQSFNAX-OAHLLOKOSA-N 406.487 -0.121 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1c2c(cc3c1CCC3)CCC2 810386500 CUHRGTAZRIRKSL-JTQLQIEISA-N 408.480 -0.312 50 10 HBGE O=C(NCc1ccc(CN2CCS(=O)(=O)CC2)cc1)c1ccc(B(O)O)cc1 1162634157 FJEICCRQDCCIKA-UHFFFAOYSA-N 402.281 -0.473 50 10 HBGE O=C(CN1CCCC2(CC2)S1(=O)=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1645054038 OGIDHTDDNCOGGQ-CQSZACIVSA-N 400.501 -0.655 50 10 HBGE CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)[C@H]2CCC(=O)N2)CC1 1668881484 VPANTHURAWRABP-MRXNPFEDSA-N 402.455 -0.218 50 10 HBGE NC(=O)C1CCN(c2ccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)cc2)CC1 1684169036 ILUCYCQTCCVQIR-INIZCTEOSA-N 405.455 -0.366 50 10 HBGE CCn1cc(C(=O)N(C)CC2CN(C(=O)OCc3ccccc3)C2)nc1B(O)O 2266882887 XTCRZNDHGBPURO-UHFFFAOYSA-N 400.244 -0.077 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2267392792 OJDGSROSEYFTRT-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)NCC1(CNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2267628661 NRYDXQCRTQOQQU-UHFFFAOYSA-N 405.307 -0.453 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281868993 ORYFGQCLUUBDLZ-JGFSIVIASA-N 400.266 -0.273 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282336649 AOHSPBIGVYPFHX-NSHDSACASA-N 402.282 -0.914 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282339865 YILGRPMMMAUKMJ-NWDGAFQWSA-N 420.318 -0.471 50 10 HBGE CC(C)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1nn(C)cc1B(O)O 2282373316 KUDWFEKHPQWVBU-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 746333608 WCHZCQOGUXAMTR-LSDHHAIUSA-N 417.422 -0.901 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCCN(CCN2CCOCC2)C1 1684835838 AZRVDOGQWZIWHS-OAHLLOKOSA-N 422.486 -0.864 50 10 HBGE C[C@@H](O)CN(CCNS(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267202527 DISCCJDQGLLDFF-SNVBAGLBSA-N 408.307 -0.676 50 10 HBGE COC1(CCNC(=O)c2nscc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2267365926 XOMPUACROJTEHX-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE C=C(CS(=O)(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F)B(O)O 2282362126 BDJAKCQLLSBATM-YUMQZZPRSA-N 412.117 -0.042 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](CNC(=O)OC(C)(C)C)C1 2282698778 FDUMCDYJXSLBGK-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)c(F)c2)[C@H]2C[C@H]21 2282742111 XWYXQXKJIPHJAS-KGLIPLIRSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cc(B(O)O)cs1)[C@H](O)C(F)(F)F 2284130787 VWQMYVWEDQQPPR-ZJUUUORDSA-N 412.195 -0.139 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)Cn1cnc2c(cnn2C)c1=O 10465464 DLZCVBDJCMWNQM-UHFFFAOYSA-N 408.216 -0.308 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc3[nH]ccc3s2)n(C)c1=O 793673230 FLDBYIXUZUUFCP-UHFFFAOYSA-N 401.408 -0.562 50 10 HBGE COCCn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1 1149622653 QMGBMCJQJIBLOB-UHFFFAOYSA-N 415.454 -0.857 50 10 HBGE Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)CS(C)(=O)=O)cc12 1168877679 VPKYFAHUORKOBO-QMMMGPOBSA-N 401.470 -0.746 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)c2ccc(Br)cc2C1=O 1530231280 YSNWVASNWZJIQX-CPCISQLKSA-N 423.223 -0.140 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1cc(C)c2c(=O)n(C)c(=O)n(C)c2n1 1539067216 MLRGPLSJYFBGNZ-UHFFFAOYSA-N 408.484 -0.572 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCCO2)cc1 1544528800 HJWQVRGUFUFOOH-OAHLLOKOSA-N 412.468 -0.018 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc2c(cc1Br)NC(=O)CO2 1557734567 NHXFMLHSFQEPCA-UHFFFAOYSA-N 406.214 -0.414 50 10 HBGE CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3cc(B(O)O)ccc3F)cn2)CC1 1616668095 JNYUWAUVTFLFJT-UHFFFAOYSA-N 422.247 -0.766 50 10 HBGE CN(C)S(=O)(=O)CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1618614499 AZHHUFVYPFUERF-UHFFFAOYSA-N 420.513 -0.568 50 10 HBGE CN(C[C@H](O)CN(C)S(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267201713 RXBQPHOYKSNWBC-NSHDSACASA-N 408.307 -0.724 50 10 HBGE Cn1cc(C(=O)NCCSSCCNC(=O)OC(C)(C)C)c(B(O)O)n1 2267401199 IBQMVUWTSOVGSH-UHFFFAOYSA-N 404.323 -0.264 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 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412.472 -0.652 50 10 HBGE Cc1oc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1S(=O)(=O)N(C)C 1645054015 NPGCANFANNPLEY-ZDUSSCGKSA-N 414.484 -0.147 50 10 HBGE COc1ccc(NCC(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1 1654167426 HAJYITMRCZEHIB-UHFFFAOYSA-N 408.440 -0.601 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1S(=O)(=O)c1sccc1B(O)O 2267607151 IWYYITYXLUZSOE-UWVGGRQHSA-N 406.291 -0.924 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)c1B(O)O 2281833790 HTLMDHCYFBZJAA-GFVXYOJSSA-N 400.266 -0.686 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282707483 ZHZNNXWUGKELEB-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1CCO 2282708514 NPQZJCAFYWFNFW-LLVKDONJSA-N 420.318 -0.580 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)C[C@H]1NC(=O)OC(C)(C)C 2282722733 KYMIKLKHXABUGO-KGLIPLIRSA-N 400.262 -0.721 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C 2282734991 TVNOUWNZAWWFEN-NSHDSACASA-N 402.278 -0.186 50 10 HBGE Cn1nc(Br)c(Br)c1CNC(=O)c1cc(B(O)O)n[nH]1 2364434387 DVMMFIWUJWKBIF-UHFFFAOYSA-N 406.831 -0.722 50 10 HBGE COc1ccc(B(O)O)cc1NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O 704373427 NUSWYGFXXXBMMF-UHFFFAOYSA-N 404.209 -0.587 50 10 HBGE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)c1ccc(C#N)cc1 749561253 PUBBLNSQWTZUIN-JHNDHUHGSA-N 414.418 -0.256 50 10 HBGE O=C(NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1)C1CCOCC1 1153080094 TWCYQNYBRIKKFR-CYBMUJFWSA-N 405.860 -0.447 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N(C)C)cc1 1331471892 IHOJATGDVWOLCB-WCQYABFASA-N 417.509 -0.378 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O 1352938893 SFFZYOCDVYGLJT-GFCCVEGCSA-N 423.422 -0.115 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@H]1CCS(=O)(=O)C1 1617989468 AQYOICYIDRRDTI-NSHDSACASA-N 402.498 -0.126 50 10 HBGE C#CCCCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(CNC(C)=O)s1 1635718874 TYCFZHADTCHVMY-UHFFFAOYSA-N 400.482 -0.387 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CS(=O)(=O)C[C@@H]2C(F)(F)F)C[C@@H](C)O1 1638062697 CODVVRWULFEAPH-KXNHARMFSA-N 415.434 -0.144 50 10 HBGE COC(=O)[C@H]1CN(C(=O)c2ccc(B(O)O)cc2)CC12CN(C(=O)OC(C)(C)C)C2 1639348090 PBPFAARKPZTGIM-OAHLLOKOSA-N 418.255 -0.152 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267714924 PGCLBQDQMOALLU-LKFCYVNXSA-N 403.291 -0.748 50 10 HBGE Cn1nc(C(=O)NC[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281647816 FAIHARYXKJDREC-VIFPVBQESA-N 404.635 -0.312 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2282064462 AGNPJAHFQGXGAC-MNOVXSKESA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ccsc2B(O)O)[C@H](O)C1 2282345919 KDMLXNLXHPWVTJ-NWDGAFQWSA-N 420.318 -0.782 50 10 HBGE COc1ccc(S(=O)(=O)NCC=CCNC(=O)OC(C)(C)C)cc1B(O)O 2282366080 IVNJKNMSGUSYON-UHFFFAOYSA-N 400.262 -0.266 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@@H](B(O)O)C2)[C@@H]2CS(=O)(=O)C[C@@H]21 2282484267 IBVQGCNLECIJII-XQHKEYJVSA-N 402.278 -0.516 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 2282699175 IIIZKQBEWXBQOB-PWSUYJOCSA-N 402.282 -0.928 50 10 HBGE C[C@H](NC(=O)CN(CCN(C)C)C(=O)OC(C)(C)C)c1nscc1B(O)O 2283948731 QFVXQZQRHHTGLN-NSHDSACASA-N 400.310 -0.201 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)Nc1ncc(B(O)O)s1 2283965000 QOTGYDRMHKOUIB-SECBINFHSA-N 419.290 -0.814 50 10 HBGE O=C(NC1CCN(S(=O)(=O)c2c(Cl)cccc2B(O)O)CC1)C(F)(F)F 2286102572 NCCPKBMDQQMELN-UHFFFAOYSA-N 414.598 -0.149 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)n1 2362079469 DNAUZACQDPAMLJ-NSHDSACASA-N 404.298 -0.682 50 10 HBGE O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)[C@@H]1Cc2ccccc2O1 732066178 JRPLIIDHKAERMO-ROUUACIJSA-N 416.478 -0.149 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)(c2ccccc2)CC1 1131507593 AKUFWJYRZZPIFJ-HNNXBMFYSA-N 422.507 -0.204 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2S1(=O)=O 1135495098 QIAYUNGKWGDWGD-ZDUSSCGKSA-N 407.408 -0.882 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](C)CC#N)CC2)cc1 1149622576 OUIJXORMGIXDDV-OAHLLOKOSA-N 407.496 -0.002 50 10 HBGE CN1CC[C@@](Cc2ccccc2)(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)C1=O 1292038881 OGJRUARMYORLSV-KBXCAEBGSA-N 408.480 -0.405 50 10 HBGE Cc1ccc(C(=O)NNC(=O)c2cnsn2)cc1S(=O)(=O)N1CCOCC1 1611553711 SWSNQONQPOJMML-UHFFFAOYSA-N 411.465 -0.058 50 10 HBGE O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)NNC(=O)c1csc(N2CCOCC2)n1 1680738106 FBWLWEMPYLILSB-NSHDSACASA-N 408.484 -0.065 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282084547 WDUFNKSXLJQIMK-MNOVXSKESA-N 420.318 -0.676 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1ncc(B(O)O)cc1F 2282290865 BJYGHARACIJXLM-HNNXBMFYSA-N 417.202 -0.332 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1CCO 2282703231 TZIYPSDQUYGEFB-GFCCVEGCSA-N 420.318 -0.580 50 10 HBGE COCCN(C=C(C#N)C(=O)N[C@H](CCSC)C(=O)O)[C@@H]1CCS(=O)(=O)C1 2325031367 JOPZNKWOXVTYOH-ZIAGYGMSSA-N 419.525 -0.148 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN(C)C(=S)NC)c1 1160936729 YXJNWPHFTOVUNG-UHFFFAOYSA-N 415.541 -0.086 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)COB2O 1294587791 LRQAULMUTPMBFF-UHFFFAOYSA-N 422.250 -0.877 50 10 HBGE COc1nccnc1NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 1451571179 PSHHUOZSBXAPHW-YPMHNXCESA-N 411.415 -0.109 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CS1(=O)=O 1478930943 AWNNNPIKXZJKGA-GHMZBOCLSA-N 417.513 -0.111 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2cc(Br)c[nH]2)C1=O 1540475167 SBVMGQKKGVAKMP-VIFPVBQESA-N 401.217 -0.050 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CS1(=O)=O 1674203353 BLESCDSRKRTIRY-ZYHUDNBSSA-N 403.482 0.000 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@H]2CCCN2C(=O)OC(C)(C)C)n1 2282376847 JHSGERFACLJDME-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282707117 VCAWLGKURDMPOF-SCZZXKLOSA-N 414.236 -0.104 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(Cl)cc1B(O)O 2359390698 OWRPLJVVUGBRJS-FRRDWIJNSA-N 400.624 -0.701 50 10 HBGE O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 762475586 RUVZJYABTKEGSO-JTQLQIEISA-N 409.214 -0.128 50 10 HBGE CN(C)CCn1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cn1 763732727 DPFCXCWPCBETAS-UHFFFAOYSA-N 413.482 -0.017 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1306513848 GGUWONGEXBAURI-YFKTTZPYSA-N 404.489 -0.426 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)c2cncn2-c2ccccc2)C1 1565158610 ZHYJAMDRDYLGCG-UHFFFAOYSA-N 407.456 -0.693 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1nc2ncccn2n1 1587968786 NZELLIUORFFJTE-UHFFFAOYSA-N 408.422 -0.657 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)c2cccc(B(O)O)c2)CC1 1628967939 PAXDOXHBOMACDN-UHFFFAOYSA-N 407.257 -0.492 50 10 HBGE CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NNC(=O)c1cc(Br)cn1C 1636814947 PBMBXRSNQGOUBD-WCBMZHEXSA-N 409.262 -0.456 50 10 HBGE O=S(=O)(Nc1ncc(B(O)O)cn1)c1ccc(I)cc1 2235613020 UFVRTBVQDWVJDT-UHFFFAOYSA-N 404.982 -0.438 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2cscc2B(O)O)C1 2247942639 XUZIOJMNQVMQGA-UHFFFAOYSA-N 410.282 -0.025 50 10 HBGE C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2267626192 CWDBZYJKSVNTAK-UWVGGRQHSA-N 405.307 -0.360 50 10 HBGE O=C(N[C@@H]1CC[C@@H]1NC(=O)c1cc(B(O)O)c(O)cc1O)OCc1ccccc1 2267811288 XWLDAPHLFBHHAC-LSDHHAIUSA-N 400.196 -0.035 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282706118 HYYJKUULQWWCDE-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 745322510 WJDWALFIRDUJTR-OAHLLOKOSA-N 414.484 -0.037 50 10 HBGE Cn1c(=O)c2cc(NC(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cnc2n(C)c1=O 755847172 RGQDQDSACWRQIL-CQSZACIVSA-N 410.390 -0.211 50 10 HBGE Cn1cc(C[C@H](O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1 786682784 KWJQFKFWMODGJK-SFHVURJKSA-N 400.483 -0.317 50 10 HBGE O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 919889940 XGLAUXBEODPYQI-OLZOCXBDSA-N 412.493 -0.281 50 10 HBGE CC(C)[C@H](C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)N1CCCS1(=O)=O 1558459168 PXWCBBVWBZILNV-HUUCEWRRSA-N 402.517 -0.553 50 10 HBGE CCS(=O)(=O)c1ccccc1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1583280575 CILDJNYXQGJUCS-GFCCVEGCSA-N 403.482 -0.460 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 1635877713 HZUDCOTUDBKLKV-HIFRSBDPSA-N 406.414 -0.900 50 10 HBGE CON(C)C(=O)[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1687203741 KMNQXFNNWLVSQI-JTQLQIEISA-N 401.445 -0.711 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(c2ncc(Br)cc2B(O)O)C1 2223677484 OMGBRXRUYMHCBG-GHMZBOCLSA-N 416.081 -0.012 50 10 HBGE O=S(=O)(c1cc(B(O)O)cs1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2282707103 VAPWAZMFTOAUAR-CVEARBPZSA-N 408.310 -0.298 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1B(O)O 2282733852 CJRLXBTYHSZWMH-NSHDSACASA-N 406.241 -0.988 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC(CNC(=O)C(F)(F)F)CC2)sc1B(O)O 2282735630 DOYXKDGYTLBIBJ-UHFFFAOYSA-N 414.236 -0.184 50 10 HBGE O=C(NCCNC(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1COCCO1 745713277 CQTAEOKLOMUAOH-LBPRGKRZSA-N 415.244 -0.075 50 10 HBGE Cc1ccc(C[C@@H](C)C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 778687381 DMRKBDBIKOGIBW-CYBMUJFWSA-N 412.450 -0.232 50 10 HBGE COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)n(C)n2)c1 784002345 CQCZNIMLQOIHTG-UHFFFAOYSA-N 414.422 -0.196 50 10 HBGE O=C(NCc1ccc(CN2CCS(=O)CC2)cc1)c1cc(B(O)O)ccc1F 1142737117 BCWIWFPKUAEJOJ-UHFFFAOYSA-N 404.272 0.000 50 10 HBGE CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 1631029593 MAGFMBZDOBPPHA-DGCLKSJQSA-N 420.557 -0.258 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)Cc1cccnc1)C1CCCC1 1686923140 XSSANWWPLFDTSE-HNNXBMFYSA-N 412.516 -0.091 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)Cc1ccsc1B(O)O 2267373472 DJILXOIMHKQGHW-ZSBIGDGJSA-N 402.303 -0.287 50 10 HBGE C[C@@H](O)CN(CCNC(=O)c1ncc(B(O)O)cc1Cl)C(=O)OC(C)(C)C 2281896729 MDKWDMHPQYOFOW-SNVBAGLBSA-N 401.656 -0.238 50 10 HBGE Cn1nc(C(=O)N[C@@H]2COCCN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282152996 NCHIZTSFHQVZDO-VIFPVBQESA-N 402.644 -0.881 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@H]2COC[C@H]21 2282418182 GVMMVCPPUYOXLW-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282709069 VBRXHZOQYZGPKR-STQMWFEESA-N 400.262 -0.985 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2282711666 FXAZKEQSYDQQCS-ZJUUUORDSA-N 402.282 -0.930 50 10 HBGE O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccccn3)cc2)CCN1 729395384 WJFWRGJKSKXXEF-UHFFFAOYSA-N 417.447 -0.794 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 744643456 VKAGPFRIQVXKAA-ZDUSSCGKSA-N 401.416 -0.213 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(C2CCOCC2)C1=O 747595029 YGHXPRWOBSCFMQ-HNNXBMFYSA-N 400.439 -0.013 50 10 HBGE CCOc1cc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1OC 764812098 GRTHWGJRRDKLKK-UHFFFAOYSA-N 414.422 -0.009 50 10 HBGE O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 788867825 NBJQFCKXLGDOCX-NRNHGZALSA-N 413.430 -0.131 50 10 HBGE COc1cccc2c1OCCC2=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 920370877 NOTOSUHFFMZJHY-UHFFFAOYSA-N 405.436 -0.117 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cn([C@@H]2CC[C@H]2O)nn1 1135291620 DEQYOAGNGZSSSJ-QZTJIDSGSA-N 413.482 -0.053 50 10 HBGE CC(C)(C)NC(=S)NNC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1 1135975573 XHJWNBOALCIUIU-SNVBAGLBSA-N 413.525 -0.019 50 10 HBGE COc1cc(N2CCS(=O)(=O)CC2)ccc1NC(=O)c1cccc(B(O)O)c1 1138400079 MRQVJTOYOWJYNV-UHFFFAOYSA-N 404.253 -0.138 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN(CC(F)(F)F)C1=O)N[C@@H]1CCS(=O)(=O)C1 1542285180 HDXWFVLLHWWWGA-RKDXNWHRSA-N 400.379 -0.695 50 10 HBGE O=C(NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1)OCC(F)(F)F 1634094629 OUFHJLMZFSXREU-SSDOTTSWSA-N 400.335 -0.528 50 10 HBGE CN(C)S(=O)(=O)NCCNC(=O)NNC(=O)c1ccc(Br)s1 1672944208 ZABICKXEGOORQH-UHFFFAOYSA-N 414.307 -0.149 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N[C@@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2281909619 RZYDNTXQBABSBP-HZPDHXFCSA-N 416.243 -0.604 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N(CCNC(=O)OC(C)(C)C)CC1CC1 2282075950 ATDANSUXHVJIBN-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE Cn1nc(C(=O)NCC2(F)CCN(C(=O)OCc3ccccc3)CC2)cc1B(O)O 2282427815 WEFQITXFLJDAKG-UHFFFAOYSA-N 418.234 -0.029 50 10 HBGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282857501 JCNJTRDCUCDLFH-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE O=C(O)[C@]1(NS(=O)(=O)c2ccc(B(O)O)s2)CCN(Cc2ccccc2)C1 2284404715 YXIYMCCHIVENAW-INIZCTEOSA-N 410.282 -0.565 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(F)cc1B(O)O 2359281553 CGTZAKWWGDEPHE-DUFXMDAXSA-N 400.237 -0.208 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)cc1S(=O)(=O)NC(C)C 744646981 INDBLETWONGXBT-ZDUSSCGKSA-N 401.441 -0.442 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 746385543 GHBUIJIEMCGCRJ-CQSZACIVSA-N 405.411 -0.464 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cc2ccccn2)[C@@H](C)O)cc1 779513645 WIFWSJUCGMOZLE-DYVFJYSZSA-N 406.464 -0.192 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)NNC(=O)Cc1cn2ccccc2n1 800054783 IXIDQISZVWOOCE-GXTWGEPZSA-N 408.484 -0.075 50 10 HBGE CCOCc1nc(Cl)cc(NNC(=O)NC[C@]23COCCN2C(=O)COC3)n1 1235027250 GXFXDYGRMLKSDZ-MRXNPFEDSA-N 414.850 -0.080 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)NCc1nnc2n1CCNC2=O 1246797626 BKKDZGULVDLXCA-UHFFFAOYSA-N 405.440 -0.347 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 1290349719 WLNRJRNRPVCUDX-ZBEGNZNMSA-N 405.473 -0.406 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCC(=O)N(C)C1=O 1312901934 NXFKETJEHYTNGB-JTQLQIEISA-N 410.456 -0.620 50 10 HBGE Cc1cc(O)cc(=O)n1CC(=O)N1CCN(S(=O)(=O)CBr)CC1 1446952257 CBNRBVNSLHKOMO-UHFFFAOYSA-N 408.274 -0.311 50 10 HBGE O=C(Cc1cc[nH]n1)NNC(=O)Cn1nc(Br)c(Br)n1 1565681735 FUASMNJVQDSYTC-UHFFFAOYSA-N 407.026 -0.084 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 1565851065 KNUFYFYVXDIYKW-UHFFFAOYSA-N 421.520 -0.481 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)N1 1623368564 QSUURBOGCXYKKZ-SECBINFHSA-N 409.449 -0.662 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282339749 ZXGFTYHPZKIIGM-QWRGUYRKSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282422482 BNZJACSWKDDUBH-QWRGUYRKSA-N 400.237 -0.112 50 10 HBGE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1c(B(O)O)cnn1C 2282701375 WYSJMZZCWHCIFI-NSHDSACASA-N 404.298 -0.682 50 10 HBGE Cc1sc(B(O)O)c(C(=O)NCC(CO)(CO)NC(=O)OC(C)(C)C)c1C 2286170680 KYVRLTLMTUSQJW-UHFFFAOYSA-N 402.278 -0.977 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCSc2ccccn2)n(C)c1=O 765730699 FIXUGUNSHONMJG-UHFFFAOYSA-N 417.451 -0.842 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@H]2COCC[C@H]21)NNC(=O)c1cccc(Cl)c1 1460221551 KMJWBLDIRMZUNK-KGLIPLIRSA-N 401.872 -0.011 50 10 HBGE O=C([C@H]1CC(=O)N(c2cn[nH]c2)C1)N1CCN(S(=O)(=O)CBr)CC1 1466476290 WDXQZHMMQRCHQO-JTQLQIEISA-N 420.289 -0.411 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1 1642897132 LRINJAZNGXESDO-LLVKDONJSA-N 400.482 -0.329 50 10 HBGE COC(=O)[C@@H]1CC[C@@H](C(=O)OC)CN1CC(=O)NNC(=O)c1ccc(C#N)cc1 1654261618 NLWIUUUJBCXBJM-CABCVRRESA-N 402.407 -0.254 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1 1687345173 MYWZUIZKCGUEMA-GOSISDBHSA-N 408.411 -0.968 50 10 HBGE COC(=O)[C@H]1C[C@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231654203 APIOVTYZFCDBCX-LSDHHAIUSA-N 401.184 -0.512 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1cc(B(O)O)c(C)s1)NC(=O)OC(C)(C)C 2281861762 XVFBKLFRBUAVBW-NSHDSACASA-N 400.262 -0.077 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)cc3F)C[C@@H]21 2282355808 LFIDZFSUWDYUNT-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)cc2)C[C@@H]1NC(=O)OC(C)(C)C 2282711049 WTJSMLNABCYSKI-UONOGXRCSA-N 400.262 -0.721 50 10 HBGE N#CC(=CNCc1ccc(S(N)(=O)=O)cc1)C(=O)NCCCN1CCCC1=O 2324077301 JNFJORREIPVAML-UHFFFAOYSA-N 405.480 -0.040 50 10 HBGE Cc1nc(B(O)O)c(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)n1C 2362566697 NCNXGWRBCQXKCU-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE Cn1c(=O)ccn(CC(=O)NN=c2cc(C(F)(F)F)[nH]c(-c3ccncc3)n2)c1=O 736708151 KYOQGCMTMRWSIM-UHFFFAOYSA-N 421.339 -0.017 50 10 HBGE O=C(Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccc(B(O)O)cc1 1135537767 AOTAYIMMAPXJFQ-UHFFFAOYSA-N 408.216 -0.221 50 10 HBGE COC(=O)[C@@H]1CN(C(=O)c2cccc(B(O)O)c2)CC12CN(C(=O)OC(C)(C)C)C2 1304079498 MJCRTWXBAILGTH-HNNXBMFYSA-N 418.255 -0.152 50 10 HBGE Cc1ccc(OCC(=O)NNC(=O)NCCc2nnc3c(=O)n(C)ccn23)cc1C 1313302981 UQCRSULAYCOISM-UHFFFAOYSA-N 413.438 -0.003 50 10 HBGE CN(C)S(=O)(=O)n1ccnc1C=NNC(=O)C1CCN(c2ncccn2)CC1 1324925050 NYNRYXNWJPIHBM-UHFFFAOYSA-N 406.472 -0.306 50 10 HBGE CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cccc(B(O)O)c1 1445041045 ZYFFXOZEBTZQMC-OAHLLOKOSA-N 406.244 -0.009 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@H]1CCC(=O)N1)N1C(=O)c2ccccc2C1=O 1534064301 GHVQTEDKCFGBSQ-CHWSQXEVSA-N 404.448 -0.170 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCCC1=O)N1CCN(C(=O)OC(C)(C)C)CC1=O 1557977202 AHVVAMIDJOYTMK-LBPRGKRZSA-N 411.459 -0.776 50 10 HBGE CCCN1C[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1=O 1566278662 MPCPDRCBMVXFNU-QGZVFWFLSA-N 415.494 -0.150 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@H](C(=O)NNC(=O)[C@H]2COCCO2)C1=O 1634837862 KLCUJCDHXMKWRY-CHWSQXEVSA-N 414.459 -0.688 50 10 HBGE COc1ccc(/C=C(\C#N)C(=O)N(CC(=O)O)[C@H]2CS(=O)(=O)C[C@H]2O)cc1OC 1866366013 FUILCWGUOLEYLP-ODYZYYDOSA-N 424.431 -0.318 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2Cl)C1 2195883702 PZARGZJTTCPYNQ-VPOLOUISSA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)CC1 2281840060 PLMKVHXOJHZHKS-MHZLTWQESA-N 400.266 -0.273 50 10 HBGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282082106 YBUWRDIAQOLDAG-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)NCC1CCS(=O)(=NC(=O)c2c[nH]nc2B(O)O)CC1 2282471425 JJKNQWSOFJKAPW-UHFFFAOYSA-N 400.266 -0.368 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)NCc1cc(B(O)O)cs1 2283954212 CAVANKBRCLYDBM-GFCCVEGCSA-N 420.318 -0.628 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)CC1 764334677 IMNZVJVEBVKAEY-UHFFFAOYSA-N 423.495 -0.491 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc(C(F)F)ccc2F)n(C)c1=O 1294587852 OYISSDRDBUBGKM-UHFFFAOYSA-N 424.339 -0.028 50 10 HBGE CN(C)CCn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cn1 1295730692 NZOGTDVSKJNBKT-UHFFFAOYSA-N 408.322 -0.115 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CCO[C@@H]2C)C1 1469404242 ZTMKJMYCENMLLN-RDBSUJKOSA-N 413.500 0.000 50 10 HBGE CN(C)C(=O)Cn1nc2n(c1=O)CCN(C(=O)NC[C@@]1(C)C[C@H]1Br)C2 1565124591 BMZHNWFIDGUOCQ-MEBBXXQBSA-N 415.292 -0.168 50 10 HBGE Cn1c(=O)n(CC(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)c2ccccc21 1569618271 XWOMKVQWQVJMOH-MRXNPFEDSA-N 407.386 -0.061 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCS(C)(=O)=O 1585951949 KOJXAFRMOYMNLO-RYUDHWBXSA-N 418.493 -0.309 50 10 HBGE COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cn(C)nn3)CC2)cc1 1587244241 OSVHNOFBNUATOJ-UHFFFAOYSA-N 422.467 -0.314 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1cc(B(O)O)ccc1O)OCc1ccccc1 2282976644 WATJNKLRRBFNQU-SJORKVTESA-N 414.223 -0.114 50 10 HBGE CC(=O)NNC(=O)C[S@@](=O)CC(=O)Nc1nc(C)c(C(=O)OC(C)C)s1 586313592 GFGHCNCQPXNENY-SANMLTNESA-N 404.470 -0.129 50 10 HBGE CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn[nH]2)cc1Br 729458319 SWSULDSYXJYOKA-UHFFFAOYSA-N 417.245 -0.108 50 10 HBGE Cn1nc(SCC(=O)NN=Cc2cc(-c3cccnc3)n[nH]2)c(=O)n(C)c1=O 743433692 LUGJYSVAJWQWIF-UHFFFAOYSA-N 400.424 -0.494 50 10 HBGE COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)[C@H]1COCCO1 756258351 SNARRSMJJPLXOH-OAHLLOKOSA-N 408.411 -0.264 50 10 HBGE COCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(Br)cn1C 770134594 KBJPKNXCCATJMN-UHFFFAOYSA-N 411.278 -0.496 50 10 HBGE Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794064387 CQKBMGRDJGMTQL-HXUWFJFHSA-N 416.434 -0.018 50 10 HBGE CN1CCC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1294587814 MUUBLNQRWDDCIL-MRXNPFEDSA-N 401.467 -0.540 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)N1 1438034880 ICVKSARLLAMWEW-LBPRGKRZSA-N 400.844 -0.226 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)CC2CC2)cc1 1472505529 YMDPZTDQLBTFAV-SNVBAGLBSA-N 403.482 -0.431 50 10 HBGE O=C1CC(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 1624362441 DNIDONCLTMCNDW-UHFFFAOYSA-N 409.464 -0.233 50 10 HBGE CC[C@@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCNC1=O 1630996542 LNJXUGKUZGIFIT-HXUWFJFHSA-N 401.467 -0.492 50 10 HBGE Cn1nc(Br)c(C(=O)N[C@H]2CS(=O)(=O)C[C@H]2Br)n1 2219802865 AGAXRBCTAXRPKS-UHNVWZDZSA-N 402.068 -0.132 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@H](O)C1 2267613376 WOPMKABBZMOZEY-SNVBAGLBSA-N 406.291 -0.970 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC2CCN(C(=O)OCc3ccccc3)CC2)n1 2267626775 NODSDSYZWBMLHZ-UHFFFAOYSA-N 422.272 -0.821 50 10 HBGE CCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2282081481 CSDZKCMIPJBXCZ-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE Cc1nc(S(=O)(=O)N2[C@H]3CC[C@@H](C3)N2C(=O)OC(C)(C)C)c(B(O)O)n1C 2282346299 VENZLCMSVXFCQZ-QWRGUYRKSA-N 400.266 -0.514 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)n1 2282425529 QTHOTJLBKYTMNX-XYPYZODXSA-N 402.282 -0.786 50 10 HBGE Cc1cnc(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)c1 2282481788 AKLKTFONQUGWJM-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)Cc1ncsc1B(O)O 2282738968 BOAUUXZQAHXQQG-UHFFFAOYSA-N 419.334 -0.016 50 10 HBGE COC1(CCNC(=O)c2cnsc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2337334471 MWAOZBUKQMXDAA-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE Cn1cc(/C=C\C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(=O)n(C)c1=O 726862571 UNICPIZUOSTMDV-KMKOMSMNSA-N 419.463 -0.319 50 10 HBGE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)Cc1nc(C)cs1 749550434 JGSVSPVRSXEBPU-XYPYXGAPSA-N 424.479 -0.434 50 10 HBGE C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1 816873238 BJNXJLMKBJWNLV-CYBMUJFWSA-N 404.452 -0.234 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)CCO)cc1 1140368131 KAUZAJANJXMTPT-UHFFFAOYSA-N 402.469 -0.068 50 10 HBGE CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1156184269 OUQZWKYUWPNEKF-MRXNPFEDSA-N 410.496 -0.001 50 10 HBGE CS(=O)(=O)NC[C@H]1COCCN1CC(=O)NNC(=O)c1cccc(Cl)c1 1460567123 PJMDKYHVXPEYTH-ZDUSSCGKSA-N 404.876 -0.649 50 10 HBGE O=C(NNC(=O)[C@H]1CCCCO1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1468454568 WTOFXSQFXCIESA-QWHCGFSZSA-N 405.860 -0.304 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)NNC(=O)Cc3ccccc3O)CC2=O)cn1 1557705838 LCGYMFMWWLXRDE-AWEZNQCLSA-N 401.423 -0.022 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CSCC(=O)N1CCOCC1 1558447496 ORAXZBBDTXHSCX-GFCCVEGCSA-N 416.500 -0.265 50 10 HBGE CCN1CCN(C(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccc(B(O)O)c2)CC1 1607436666 KNHGBDIKKBZWAL-HXUWFJFHSA-N 409.295 -0.128 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2)C1CCCC1 1683688862 JFRJSMWOWMCFKO-LXTVHRRPSA-N 417.532 -0.161 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1sccc1B(O)O 2255886806 OALAJVMQRUBLJI-UHFFFAOYSA-N 400.234 -0.134 50 10 HBGE CC(C)(C)OC(=O)N=S1(=O)CC2(CN(C(=O)c3ncsc3B(O)O)C2)C1 2266888123 OXJGSHYHYJYRAH-UHFFFAOYSA-N 401.275 -0.318 50 10 HBGE Cc1c(C(=O)N(C)[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2267357540 ARDKDORBPOQBOI-HUUCEWRRSA-N 400.244 -0.062 50 10 HBGE CCN(CCN(C)S(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267372761 SYFKFHUNXCWGGZ-UHFFFAOYSA-N 407.323 -0.159 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267607496 NYDCTNLESPRAHP-WDEREUQCSA-N 406.291 -0.612 50 10 HBGE CC[C@H](CNS(=O)(=O)c1cc(B(O)O)ccc1OC)NC(=O)OC(C)(C)C 2282721600 UESSDDDMIHRRET-GFCCVEGCSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@H](O)C1 2282740353 YOYALQIJGIPUTH-GFCCVEGCSA-N 420.318 -0.829 50 10 HBGE CC(=O)N1CCN(C(=O)C(C#N)=CNCCc2ccc(S(N)(=O)=O)cc2)CC1 2324851728 HJJYFSSAQAQRLW-UHFFFAOYSA-N 405.480 -0.436 50 10 HBGE O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)NNC(=O)[C@@H]1CCc2nncn2C1 816884617 DJJRCZMLOLDBMD-SNVBAGLBSA-N 413.369 -0.511 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(S(C)(=O)=O)c(Br)c1 1301697011 INLUSQAKOYPENJ-UHFFFAOYSA-N 413.271 -0.342 50 10 HBGE C/C(=C\C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1C 1545423943 GXMDWQTYPNXZTP-UKTHLTGXSA-N 410.434 -0.007 50 10 HBGE CN1C[C@@H](O)C[C@]1(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1587968607 KIRIOUXQFJFYCZ-OXJNMPFZSA-N 403.483 -0.953 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3n2CCOC3)cc1 1648386279 FHCQLWBRBZXFND-UHFFFAOYSA-N 407.452 -0.197 50 10 HBGE O=C(NCC[C@H]1CCCS1(=O)=O)NNC(=O)C1CCN(c2ncccn2)CC1 1675617721 LKNKXYJURIQYKU-CQSZACIVSA-N 410.500 -0.009 50 10 HBGE O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1nscc1B(O)O 2255458109 MYSGTZPILUPPJR-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2cc(Cl)c(B(O)O)s2)CO1 2255758945 RCCXOAXKGNOFPB-SSDOTTSWSA-N 412.682 -0.090 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2267210056 DWRYNQXLOIIRBU-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE O=C(N[C@H]1[C@H]2C[C@H]1N(S(=O)(=O)c1cncc(B(O)O)c1)C2)OCc1ccccc1 2267214587 SGHXWQFMRPWNJT-XKQJLSEDSA-N 417.252 -0.551 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N1CC[C@](C)(B(O)O)C1 2368336048 LKELWBQOSWPYKT-LRDDRELGSA-N 404.294 -0.124 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)C(F)(F)Oc1ccccc1 755405271 WQZZXOPZOGGDEG-SNVBAGLBSA-N 417.394 -0.094 50 10 HBGE C[C@@H](C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765728976 APKUDUXEZWOOBP-SNVBAGLBSA-N 402.386 -0.476 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cccc(Cl)c2F)n(C)c1=O 810591104 AESCPNQWYAMXOC-UHFFFAOYSA-N 422.804 -0.384 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCC(=O)N2)(c2ccccc2)CC1 1131507594 AKUFWJYRZZPIFJ-OAHLLOKOSA-N 422.507 -0.204 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)Nc1ccc2c(c1)OCO2 1254322880 FZHUPGGVIHOMKK-QGZVFWFLSA-N 407.383 -0.621 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3C[C@H]4CC[C@H]3O4)c2)CCN1 1452934231 LDKTUKZMSPEMHQ-VHDGCEQUSA-N 422.463 -0.864 50 10 HBGE Cc1nn(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n1C 1617193311 IWFXPUNZYCCMEK-UHFFFAOYSA-N 411.463 -0.380 50 10 HBGE Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c1 1624269291 FPKBSORNHMDSSR-KZNAEPCWSA-N 415.450 -0.246 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnn2c(-c3cccnc3)ccnc12 1624585996 XXUCUTBTYMMXRT-LBPRGKRZSA-N 400.420 -0.013 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NN(C)[C@@H](C)CO 1643697204 ZKNRPZZESBJBNV-AWEZNQCLSA-N 414.528 -0.021 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H]1CN(Cc2ccncc2)CCO1 1683164421 DLMRNILQPPJRDH-OAHLLOKOSA-N 416.438 -0.364 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c1B(O)O 2282418160 MNWJEGXNFNUYOU-WDEREUQCSA-N 420.318 -0.385 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)cc3F)C[C@@H]21 2282729281 LFIDZFSUWDYUNT-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1nscc1B(O)O 2283956441 KIROANUCHMMRSY-KWQFWETISA-N 401.250 -0.544 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2283989838 TYPBGZXMWPNUKX-LLVKDONJSA-N 400.262 -0.191 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)C(=O)c1ncc(B(O)O)cc1Cl 2285350264 MNWPONOORRMZEF-JTQLQIEISA-N 401.656 -0.238 50 10 HBGE COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)Cc2ccccn2)C1 755251230 VMUJDUMUWSKHKR-HNNXBMFYSA-N 413.500 -0.263 50 10 HBGE Cc1ccc2[nH]c(C(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2c1C 766638680 IAAQMKPNRVPNHA-UHFFFAOYSA-N 423.433 -0.007 50 10 HBGE Cc1cnc(N)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1 767850284 JAAQXSXDAUMNDJ-UHFFFAOYSA-N 413.319 -0.039 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)Nc1cnn(CCN2CCOCC2)c1 814655447 XOXSQFPLNVJUFF-CYBMUJFWSA-N 403.447 -0.778 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)N[C@H]1CCN(S(C)(=O)=O)C1 1312954694 RSSOHNJQOBNXFF-VIFPVBQESA-N 408.278 -0.235 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NCCn1cc(Br)ccc1=O 1470351454 UXRXNKBCZNJIMT-JTQLQIEISA-N 405.249 -0.007 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 1539401382 BZYHNSLIQQAWGS-BWACUDIHSA-N 419.500 -0.017 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)C[C@@H]2NC(=O)c3ccccc3NC2=O)C[C@H](C)O1 1608487812 ZXHFAHCKOJQQLS-XEZPLFJOSA-N 417.466 -0.226 50 10 HBGE COC(=O)[C@H]1CC[C@H](C(=O)OC)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1 1654261634 NLWIUUUJBCXBJM-LSDHHAIUSA-N 402.407 -0.254 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)NCCc2nnc3c(=O)n(C)ccn23)cc1 1684164904 UXQSAQSOPNMIGV-UHFFFAOYSA-N 413.438 -0.058 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1ncccc1B(O)O 1913618771 FNUPEGTYHLMNNI-UHFFFAOYSA-N 403.225 -0.421 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267201712 RXBQPHOYKSNWBC-LLVKDONJSA-N 408.307 -0.724 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@@H](O)C1 2267206072 ZYQLAOMRDCQTGL-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE C[C@@H](CCNC(=O)OC(C)(C)C)N(C)S(=O)(=O)Cc1ncsc1B(O)O 2267393407 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O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1csnc1B(O)O 2255579930 WQIACONXZDVPDG-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2282067299 YDSHIGKYCSGBDA-GMNPVEAJSA-N 418.302 -0.613 50 10 HBGE CO[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282073230 DFDKQTGVDFMADB-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1 2282376513 FJQNKUMPLVICEV-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CCC1(NC(=O)OC(C)(C)C)CC(NS(=O)(=O)c2c(B(O)O)cnn2C)C1 2282703488 WZKRSOJDRNLUMR-UHFFFAOYSA-N 402.282 -0.786 50 10 HBGE O=S(=O)(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(B(O)O)s1 2282716475 VBHXATUYGRENGT-OAHLLOKOSA-N 410.326 -0.003 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@@H](C)CCNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282865100 PLUGNMKBTAWSQR-JTQLQIEISA-N 404.298 -0.668 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284060016 KAKSKQXDLAYAJB-VHSXEESVSA-N 412.195 -0.139 50 10 HBGE CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)[C@H]2COCCO2)CC1 808279294 ZWRUANGPJKPPEV-GXTWGEPZSA-N 406.505 -0.475 50 10 HBGE O=C(Cn1nc(C(F)(F)F)c2c1CCC2)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1464443144 JYDMHSPEQOOIDJ-QMMMGPOBSA-N 409.390 -0.092 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C[C@@H]3CCOC3)nn2)c1 1586905628 YUXUYBJINCEDGC-LBPRGKRZSA-N 422.467 -0.360 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2267372544 PVLJOZZRFQKXAA-UHFFFAOYSA-N 407.279 -0.865 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNS(=O)(=O)c1cscc1B(O)O 2267385488 UBZRYWMRLJGOMQ-JBLDHEPKSA-N 402.303 -0.038 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282862985 LFXQKHCEBKKVOW-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCCc2cccc(B(O)O)c21 712224728 BSRMQZIKMSRLLL-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](NS(C)(=O)=O)C1 735078936 XKSWKKKLUOCAGK-NSHDSACASA-N 404.876 -0.267 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(C(=O)NC3CC3)cc2)n(C)c1=O 764811915 DFZVXBVXUBLJEI-UHFFFAOYSA-N 423.433 -0.524 50 10 HBGE CCS(=O)(=O)c1ccc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 1115982249 PEZKSCPDNMWSHV-GFCCVEGCSA-N 403.482 -0.460 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1233945536 VEYLYGQHBRZAAW-JTQLQIEISA-N 403.436 -0.586 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@]1(C)CCS(=O)(=O)N1 1289976241 WFGXHRWSBGCGLY-OAHLLOKOSA-N 417.513 -0.479 50 10 HBGE COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3cn(C)nn3)CC2=O)cc1OC 1528541944 SPKBBAFBWSBVJC-CYBMUJFWSA-N 416.438 -0.316 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1 1540390295 YBSVDNPIVVMCQS-UHFFFAOYSA-N 409.424 -0.391 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](O)c3cnn(C)c3)cc2)CC1 1545922188 XBTJICVCACKNOC-INIZCTEOSA-N 408.484 -0.467 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 1611087349 OXXROXXTRLUNNA-SFYZADRCSA-N 413.232 -0.535 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2OCCO)c1 1618168684 MGSMIVMZVSKDGQ-UHFFFAOYSA-N 408.436 -0.222 50 10 HBGE C[S@@](=O)C1(C(=O)NNC(=O)[C@H]2COCCO2)CCN(C(=O)OC(C)(C)C)CC1 1620975603 YVSGWPFEHKAZLE-BODITIBLSA-N 419.500 -0.303 50 10 HBGE COc1ccc([C@@]2(C)NC(=O)N(NC(=O)c3cc(B(O)O)ccc3F)C2=O)cc1 1623484093 SVXDKAOPDMYXMO-GOSISDBHSA-N 401.159 -0.374 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1675294421 KJLATRHYPVYJJA-LJQANCHMSA-N 422.438 -0.578 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1ncsc1B(O)O 2255478012 APHIUENLVHUCHD-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)c2cscc2B(O)O)CC1)C(F)(F)F 2267384535 MNCPCOWUMLBCRF-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE CCn1cc(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)nc1B(O)O 2281649929 UATSDHDLAWKDBA-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE CO[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2sccc2B(O)O)C1 2282071600 TZCULTURZJPLIU-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(N(C)C(=O)OC(C)(C)C)C2)cc1B(O)O 2282359927 UXFMWJFOGVJYKO-UHFFFAOYSA-N 400.262 -0.385 50 10 HBGE CN(C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1)C(=O)OC(C)(C)C 2282743795 UECXXBAHACFZRT-NSHDSACASA-N 419.334 -0.159 50 10 HBGE Cn1cc(S(=O)(=O)NC[C@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(CCl)n1 2358558107 XRXDVAMDPJNGTI-GMXVVIOVSA-N 424.907 -0.222 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cc2ccccn2)[C@H](C)O)cc1 779513646 WIFWSJUCGMOZLE-GUYCJALGSA-N 406.464 -0.192 50 10 HBGE COCCN1C(=O)/C(=C\NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)C(=O)NC1=S 788340026 FJOFWQAJSADTJT-LANAQNJFSA-N 418.475 -0.047 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)nn1 1557478751 DJICGRGRUYCVQN-UHFFFAOYSA-N 401.427 -0.470 50 10 HBGE CC#CCS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 1626650522 SRVXMSDZJOTFHH-CYBMUJFWSA-N 413.477 -0.385 50 10 HBGE O=S(=O)(N1CCc2sc(B(O)O)cc2C1)N1CC(OCc2ccccc2)C1 2206355407 YMSQORGLZUKJNI-UHFFFAOYSA-N 408.310 -0.068 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c(B(O)O)n1C 2267712711 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CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282335614 RSUVAPYUNLXDDJ-VXGBXAGGSA-N 420.318 -0.518 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1sccc1B(O)O 2282711898 IUYSLSNKMZEIHS-WEDXCCLWSA-N 414.236 -0.106 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282743812 UJUGDIISESLDMR-NSHDSACASA-N 402.282 -0.914 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)c1cncc(B(O)O)c1 2369652503 NRJFFRPQPMVIBG-CHWSQXEVSA-N 403.241 -0.661 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCCC2CCOCC2)n(C)c1=O 798980049 BXXMYRJPQWRIOY-UHFFFAOYSA-N 406.443 -0.822 50 10 HBGE C[C@@H](C(=O)NNC(=O)c1ccc(=O)n(C)c1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1134416808 ATBNBVGKCYXQHA-LBPRGKRZSA-N 421.454 -0.386 50 10 HBGE O=C(NCc1cn(CC(F)(F)F)c(=O)nc1O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 1251128140 WJYHFXZMTUZAOV-KXUCPTDWSA-N 405.333 -0.091 50 10 HBGE CCN(CC)c1nc(NNC(=O)CN2CCC(=O)NC2=O)nc(N(CC)CC)n1 1451481217 DDAMTCUIHJRACL-UHFFFAOYSA-N 407.479 -0.051 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1OC 1471101231 XLRLHYWTTXGCCQ-GOSISDBHSA-N 408.411 -0.724 50 10 HBGE COC[C@]1(C(=O)NNC(=O)[C@H]2COCCO2)CN(C(=O)OC(C)(C)C)CCO1 1587237797 BJIQILWXUHPGHW-PXAZEXFGSA-N 403.432 -0.798 50 10 HBGE COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CN3CCCC3=O)CC2=O)c1 1632321261 UBVMVAMZJGRTQB-LBPRGKRZSA-N 404.423 -0.174 50 10 HBGE O=C(CCn1nnc2ccccc2c1=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1635372799 YZAATWAOEICSDV-MRXNPFEDSA-N 400.439 -0.418 50 10 HBGE O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2)C(=O)N1 1646045799 STJPXXXRHRIQRZ-WBVHZDCISA-N 414.462 -0.094 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)Cc1ccsc1B(O)O 2267375590 JJZLIZYLUMNGOP-UHFFFAOYSA-N 408.307 -0.611 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282073460 FTCLZMVRGKGSQS-AWEZNQCLSA-N 420.274 -0.830 50 10 HBGE C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1cc(B(O)O)nn1C 2282076031 BWZISYKZZPCFBN-JTQLQIEISA-N 402.282 -0.976 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c(B(O)O)n1C 2282413672 IIBUEOXBMDQPPI-LLVKDONJSA-N 404.298 -0.764 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCCO1 2282704183 HGSABXHQJQFMJB-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2cocc2B(O)O)CC1 2286017126 YREZUMCGNKDRSN-MHZLTWQESA-N 401.250 -0.335 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)[C@H]1COCCO1 744642857 HPLDIDZUFBDNLV-MRXNPFEDSA-N 411.480 -0.034 50 10 HBGE CN1C(=O)C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(F)cc1 758676397 MYNDLUYBAOSEMJ-VNHYZAJKSA-N 412.443 -0.137 50 10 HBGE CN(C)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1 806034110 VNQCKLQFYYFPOS-CQSZACIVSA-N 412.516 -0.033 50 10 HBGE CS(=O)(=O)SCCNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 1175500948 IVTYFQZSXTYPQC-UHFFFAOYSA-N 421.522 -0.770 50 10 HBGE CC(C)NS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1 1194290508 HKVOEVONTLEEFG-UHFFFAOYSA-N 401.464 -0.553 50 10 HBGE CS(=O)(=O)CCCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 1470584617 SCDBLXHBGCPARF-UHFFFAOYSA-N 405.502 -0.252 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CN(C)CCN1C 1479597497 PUUHJHGPQGZYFM-WFASDCNBSA-N 401.471 -0.488 50 10 HBGE COc1c(O)nc(O)nc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1623945441 FWYRSONONWWGCK-UHFFFAOYSA-N 416.438 -0.130 50 10 HBGE CC(=O)NCCN1C[C@H](C(=O)N2CCC[C@@H](C(=O)NNc3ccccn3)C2)CC1=O 1872962437 SZDRDBSKSLWGNE-HZPDHXFCSA-N 416.482 -0.252 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@H]1NC(=O)C(F)(F)F 2267206909 MSSXRNDVCGLSCB-IONNQARKSA-N 400.209 -0.495 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 2267619136 NRHTYEFLGYPYKZ-IWIIMEHWSA-N 402.303 -0.120 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1cc(B(O)O)nn1C 2282083512 PMMFGGKKUXOXBU-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1 2282706670 OUWWGQZDHNYPNC-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282857326 GSNPCQXRNBKIHF-ZYHUDNBSSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC(C)(C)OC[C@H]1CC(=O)N=c1nc(B(O)O)[nH]s1 2284055406 SMIGMPFFYBPDAU-SECBINFHSA-N 400.266 -0.617 50 10 HBGE C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)[C@@H]1COCCO1 745999725 JOADUWQXYANLGU-WFASDCNBSA-N 419.438 -0.162 50 10 HBGE CC(=O)N1CSC[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 766635736 DXSZSTYFYBHQPK-INIZCTEOSA-N 419.507 -0.487 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@@H]2CCCO[C@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 779713672 RTUCJRYMBAESGJ-ARFHVFGLSA-N 409.464 -0.107 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ncccn3)CC2)cn1C 1130013659 NLIAPLUZOFGCMZ-UHFFFAOYSA-N 407.456 -0.620 50 10 HBGE O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCS(=O)(=O)C1 1478319994 WJADLVILNDNJSG-JTQLQIEISA-N 403.486 -0.499 50 10 HBGE CC1=C(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)S(=O)(=O)CCO1 1540291115 KPVWITLCXDIHHH-UHFFFAOYSA-N 417.465 -0.626 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1 1586191133 LCYPTDYJLSSUSC-UHFFFAOYSA-N 413.477 -0.300 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](Nc2ncc(Br)cc2B(O)O)C1 2217204229 GYEKZPFISAPWOK-QWRGUYRKSA-N 402.054 -0.084 50 10 HBGE CCn1cc(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)nc1B(O)O 2282228862 DVTAOBIYUYFGRZ-GOEBONIOSA-N 416.243 -0.604 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC(CNC(=O)C(F)(F)F)CC1 2282367018 WOQNTXXLGARPDK-UHFFFAOYSA-N 414.236 -0.184 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCNC(=O)C2CC(B(O)O)C2)C1 2282489292 QSPMOXYYNRYOOL-BPCQOVAHSA-N 404.294 -0.220 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1cc(B(O)O)cs1 2334273004 QFKZBCLFMYOOBT-JLLWLGSASA-N 402.303 -0.038 50 10 HBGE CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)n1 764168782 WQAXRFGQLJPIDQ-UHFFFAOYSA-N 402.411 -0.474 50 10 HBGE COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cnn(C)c2)C1=O 771268883 PQGOOTBYMAHBAV-LJQANCHMSA-N 414.422 -0.035 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCN1 1326426296 LRDWGZBXEVLQIZ-CYBMUJFWSA-N 424.479 -0.615 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=S)N[C@H](C)C1CC1 1557285494 BEZMPVPJURBAQE-PSASIEDQSA-N 402.546 -0.002 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(Br)cc1-n1cnnn1 1557735310 WCVLCALIYOQXQA-UHFFFAOYSA-N 403.218 -0.770 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1cccnn1 1644567666 PWVXROCJDNHZRU-UHFFFAOYSA-N 414.241 -0.021 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C 1648450320 JXAQAGIUOYMIQG-CYBMUJFWSA-N 416.500 -0.130 50 10 HBGE CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(=O)n(C)c2)CC1 1685893229 XDEPOVCSHBOYGI-UHFFFAOYSA-N 413.500 -0.221 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)nc2)CC1 1686951011 ZYHFMYPUXSDQOH-YUELXQCFSA-N 410.500 -0.036 50 10 HBGE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)CCOCCCl)C1 1877123059 GWGMTYNFXDDKEK-IUCAKERBSA-N 409.814 -0.574 50 10 HBGE 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CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@@H](B(O)O)C2)[C@@H]2CS(=O)(=O)C[C@H]21 2282484269 IBVQGCNLECIJII-YVECIDJPSA-N 402.278 -0.516 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2B(O)O)[C@@H]2C[C@@H]21 2282729941 VDOTXNJZWHFLLZ-QWHCGFSZSA-N 400.237 -0.112 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1ccc(B(O)O)cc1O 2282793323 ZNYMJXSVAZCCRL-INIZCTEOSA-N 414.223 -0.161 50 10 HBGE C[C@@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286914211 ZHDUTLSPOGMMNJ-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2 758030947 UHGABNLQOMFUFZ-CBAPKCEASA-N 423.417 -0.006 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nnn(C(C)(C)C)n2)c1 1135327574 JZIDZFIKSLQMJR-UHFFFAOYSA-N 409.472 -0.318 50 10 HBGE COc1cc(C(=O)NNC(=O)NC[C@@]23COCCN2C(=O)OC3)cc(OC)c1OC 1471129862 QBVRYJHMVNTLQJ-SFHVURJKSA-N 424.410 -0.122 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)cc1OC 1473774539 GYMSTTFXOTUNRM-KGLIPLIRSA-N 411.480 -0.169 50 10 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CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1 745777842 NTCIZHDNUVNNCA-HNNXBMFYSA-N 414.484 -0.039 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@]2(F)CN(C(=O)OC(C)(C)C)CC23COC3)CC1 1155657225 XGLSWJYIAAGLPZ-GOSISDBHSA-N 415.466 -0.050 50 10 HBGE O=C(COc1ccc(Br)cc1)NNC(=O)C1=NN(CCO)C(=O)CC1 1440755403 MJWIMRSGWQIYIZ-UHFFFAOYSA-N 413.228 -0.054 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NN(C)[C@@H](C)CO 1452346358 DQHKRWXXLYNKSA-GXTWGEPZSA-N 401.485 -0.428 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)N1 1530230767 NQYJLIGPAUYJQT-VIFPVBQESA-N 418.522 -0.475 50 10 HBGE O=C(COCCNC(=O)c1ccccc1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1596923777 UEAJQYDTJOXBRS-KRWDZBQOSA-N 404.467 -0.166 50 10 HBGE C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1684632566 BTZSMHQYSDNKPN-KZULUSFZSA-N 410.402 -0.449 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)C1CCOCC1 1687563958 RYZLIKAUQBPFTP-UHFFFAOYSA-N 405.455 -0.482 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NS(=O)(=O)c1sccc1B(O)O 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CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]2O)N(C)C1 256004195 UHQYIIRIOVIPLI-RRGIJBDPSA-N 410.964 -0.001 50 10 HBGE O=C(NCCNS(=O)(=O)c1cccnc1)NNC(=O)[C@H]1Cc2ccccc2O1 772996734 HBDGVFXAPSXGFK-OAHLLOKOSA-N 405.436 -0.306 50 10 HBGE CS(=O)(=O)N1CCC(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1 794070655 WYGKJRCOXBWVQQ-UHFFFAOYSA-N 412.468 -0.268 50 10 HBGE O=C(NNC(=O)[C@H]1CCCS1(=O)=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1124434390 DTZHGUANMUHBQS-CQSZACIVSA-N 415.493 -0.191 50 10 HBGE COCCCN(CC(=O)NNC(=O)c1ccc(C#N)cc1)[C@@H]1CCS(=O)(=O)C1 1307567549 RMLLMGYJNIFGSZ-MRXNPFEDSA-N 408.480 -0.155 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3n[nH]cc3F)CC2)cc1 1587963926 NBUWOYIYOAAHKK-UHFFFAOYSA-N 424.458 -0.375 50 10 HBGE Cc1cnn(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1641081175 NPBDSXYHSFJVQK-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282084549 WDUFNKSXLJQIMK-WDEREUQCSA-N 420.318 -0.676 50 10 HBGE 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417.318 -0.360 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)sc1B(O)O 2282741418 NJXPKLUFRCTZSA-MNOVXSKESA-N 420.318 -0.758 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(F)c(B(O)O)c2)CCO1 2282868645 QJOLFMQSTAGWFR-JTQLQIEISA-N 404.225 -0.275 50 10 HBGE CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2COCCO2)cc1 744644270 HXISPDGZHNSFJI-AWEZNQCLSA-N 401.441 -0.684 50 10 HBGE CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)C1 1456041408 ZCUODNQCCNZLIS-ZFWWWQNUSA-N 402.517 -0.551 50 10 HBGE COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC(=O)NNC(C)=O)CC1 1858633457 IWTUFWMDYOJNEK-UHFFFAOYSA-N 404.876 -0.178 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@](C)(NC(=O)C(F)(F)F)C1 2267384008 IBPBFUGPWRRIEH-LLVKDONJSA-N 400.209 -0.432 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2267439655 VBEZFQDOPQXGRU-CQSZACIVSA-N 419.268 -0.101 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)nn(C)c1B(O)O 2281609486 SPPKSIUJLGKSAC-RWXBIINUSA-N 402.282 -0.440 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083608 JZNDMQFQUDZQOC-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@H](C)CNC(=O)OC(C)(C)C 2282365067 TVNOUWNZAWWFEN-LLVKDONJSA-N 402.278 -0.186 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)c1nc(NS(=O)(=O)c2cscc2B(O)O)n[nH]1 2282378027 ZSVVEVITMHGFFU-SSDOTTSWSA-N 417.278 -0.068 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)n1 2282728669 GRPUVGLUGFAMOK-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)CC1)C(F)(F)F 2286110672 BDQCUNCTUXEWQF-QMMMGPOBSA-N 415.224 -0.814 50 10 HBGE Cc1cccnc1C(F)(F)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 787438858 GBJYGGCIMYGARR-UHFFFAOYSA-N 421.364 -0.923 50 10 HBGE CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 793448622 VNHMHZZGNJSHIY-CYBMUJFWSA-N 407.452 -0.044 50 10 HBGE O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1COCCOC1 813817935 HQFPXWJVCAURGK-UHFFFAOYSA-N 412.468 -0.170 50 10 HBGE O=C(NNC(=O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F)[C@@H]1CCN1C1CCOCC1 1178420136 DPJRASYFXYCQCL-UTUOFQBUSA-N 413.418 -0.390 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N(C)C)cc1 1331471893 IHOJATGDVWOLCB-YPMHNXCESA-N 417.509 -0.378 50 10 HBGE O=C(NNC(=O)[C@H](C[C@H]1COCCO1)C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 1442180924 GZLPRSXCBUOMNA-GUBZILKMSA-N 403.379 -0.512 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@H](C(=O)NNC(=O)N2CCOCC2)C1=O 1542427328 QMHQVHCPXBLRGP-CYBMUJFWSA-N 413.475 -0.177 50 10 HBGE CN(C)N(C(=O)CSc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCS(=O)(=O)C1 1570070767 BLKKQRMFMCJQEP-LLVKDONJSA-N 407.539 -0.082 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@H]1CCC(=O)N1 1587115639 XSJJFYNBLKFXTF-OAHLLOKOSA-N 408.480 -0.170 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)Cc3cn4ccccc4n3)c2S1(=O)=O 1635269419 MJJYNCFMBSTIHX-UHFFFAOYSA-N 403.424 -0.831 50 10 HBGE COC(=O)Cc1ccc(NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 1644566782 VDYMPPAXYDFQBK-DZGCQCFKSA-N 409.464 -0.119 50 10 HBGE C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1nnc2n1CCNC2=O 1687452686 BEHFBENGMGSOMA-VIFPVBQESA-N 407.818 -0.027 50 10 HBGE CN(C)S(=O)(=O)N1CCC(NS(=O)(=O)CI)CC1 2258198651 FFSXQOPQGMOLJY-UHFFFAOYSA-N 411.287 -0.431 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(NS(=O)(=O)c2ccc(B(O)O)s2)n[nH]1 2267208509 YQNQXBLBLBDMSP-UHFFFAOYSA-N 403.251 -0.629 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2ccc(B(O)O)o2)CC1 2281613632 AHCDWRUZSFBBNZ-MHZLTWQESA-N 401.250 -0.335 50 10 HBGE CCn1cc(B(O)O)cc1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2282280111 AVRCLGYTEOUXHI-QGZVFWFLSA-N 415.255 -0.045 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)NCc1ccc(B(O)O)s1 2283974299 LMZHENBHFXQCDR-LLVKDONJSA-N 420.318 -0.628 50 10 HBGE C[C@H](OCc1ccccc1)[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(=O)O 2284411975 QRRVDVRTNIYVMW-GXFFZTMASA-N 414.270 -0.699 50 10 HBGE COc1ccc(OC)c(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 254555867 OQSCPSDROYUMDL-UHFFFAOYSA-N 400.395 -0.399 50 10 HBGE COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)[C@@H]2COCCO2)C1=O 746781559 RYKIRFLTHFZCGN-QWRGUYRKSA-N 412.424 -0.614 50 10 HBGE CC[C@@H](C)[C@@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)NCCN1CCOCC1 1143965637 SQLQRGLWRHEATA-CXAGYDPISA-N 409.267 -0.902 50 10 HBGE O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@@H]1CCC(=O)N1 1148922231 XNRHHLJJGMERRG-VIFPVBQESA-N 409.251 -0.302 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C[C@@H]3CCCS3(=O)=O)CC2)cc1 1175390011 MVELSGPLDYBQHA-KRWDZBQOSA-N 419.507 -0.486 50 10 HBGE COCCNS(=O)(=O)c1ccc(CNC(=O)c2cc(B(O)O)ccc2F)cc1 1441575542 ZNPAJDRDIDYLCJ-UHFFFAOYSA-N 410.232 -0.640 50 10 HBGE O=C(Cn1nnc2c1CCCC2)N1CCN(S(=O)(=O)CBr)CC1 1466475940 QBVMONVWJTYJGP-UHFFFAOYSA-N 406.306 -0.017 50 10 HBGE COC(=O)[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1cccc(Cl)c1 1620643176 YALLIJCFEKPNQD-GFCCVEGCSA-N 403.844 -0.627 50 10 HBGE O=C(Cc1csc(N2CCCC2=O)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1626649829 HEIVAGWYMUWZSY-SECBINFHSA-N 401.470 -0.670 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272653577 SHIRCZDPWNNHQY-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCC(C)(C)NC(=O)OC(C)(C)C 2282066765 UOZXMJYCDWHWDN-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@H](CO)C1 2282081469 CNQQMUFVAOJJLR-QWRGUYRKSA-N 420.318 -0.676 50 10 HBGE CON(CCNS(=O)(=O)c1c(F)cc(F)cc1B(O)O)C(=O)OC(C)(C)C 2282365630 BWKFSMNRJZIINU-UHFFFAOYSA-N 410.204 -0.279 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 2282508153 RTVLTBJINKGASN-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2CC[C@@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282728627 UEFFPLYOZCLRPO-QWHCGFSZSA-N 400.262 -0.291 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)n1 2282739785 PNIVIXMTFJTEFV-RYUDHWBXSA-N 402.282 -0.786 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](NC(=O)C(F)(F)F)CC1 2286120806 NUONPFCJDWWLAS-VIFPVBQESA-N 414.236 -0.042 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1cc(B(O)O)cs1 704310629 PNXWZSXNZFPLNG-UHFFFAOYSA-N 408.266 -0.466 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734772352 YHPJXLMLPQYNTJ-JGGQBBKZSA-N 409.464 -0.203 50 10 HBGE CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)[C@H]1COCCO1 745408880 VDPJYRLZUAJUMC-OAHLLOKOSA-N 414.484 -0.240 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)Cc3cnn(C)c3)CC2)cc1 787128467 ZKYGYXCVJYYDQE-LJQANCHMSA-N 414.510 -0.403 50 10 HBGE COCCN1CCN(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1=O 793223881 OZYBCTYSUZCTOX-UHFFFAOYSA-N 407.427 -0.556 50 10 HBGE CNC(=S)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1298980109 BIZWKPQOCDQDRM-GFCCVEGCSA-N 422.554 -0.765 50 10 HBGE COc1nn(C)cc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1313398841 OQJJPTLJFNCZMR-UHFFFAOYSA-N 424.483 -0.112 50 10 HBGE Cn1cc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1 1472472588 YDXCKIIVJNRLJR-UHFFFAOYSA-N 406.468 -0.007 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@@H](C)[C@H](CS(N)(=O)=O)C1 1560185601 VWLILXIIMLPHSQ-MNOVXSKESA-N 418.903 -0.034 50 10 HBGE O=C(CS(=O)(=O)C1CC1)NNc1ccccc1S(=O)(=O)N1CCOCC1 1586843955 UTIVWCNEDOMOLW-UHFFFAOYSA-N 403.482 -0.272 50 10 HBGE C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cn(C)nn3)n(C)c2)C1 1617484327 MKQWTZODNBZNQY-LLVKDONJSA-N 409.472 -0.351 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 1647997564 WGHQMFAJILSSLR-UHFFFAOYSA-N 412.493 -0.081 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1cc(B(O)O)sn1)OCc1ccccc1 2255576083 ZYXHJDXURWCLSO-GXTWGEPZSA-N 405.241 -0.363 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267390921 KYRMUWPIJZFIJX-YMTOWFKASA-N 403.291 -0.748 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](NC(=O)OCc2ccccc2)C1 2278539896 NWYCBYNBPPNUAL-CQSZACIVSA-N 422.272 -0.821 50 10 HBGE C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282073332 MQVODINIJQPCDF-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE C=C(CS(=O)(=O)Nc1n[nH]c([C@H]2CCN(C(=O)OC(C)(C)C)C2)n1)B(O)O 2282376779 IPBKHRKBDWTITJ-JTQLQIEISA-N 401.254 -0.161 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282415075 BNAVKQKPHSJQIM-ZUZCIYMTSA-N 417.318 -0.358 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282710283 MPCRGFCMNNWSCY-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2CC[C@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282728626 UEFFPLYOZCLRPO-OLZOCXBDSA-N 400.262 -0.291 50 10 HBGE O=C(NCc1cccc(OCCN2CCOCC2)c1)NNC(=O)[C@@H]1COCCO1 745781123 PHCAWSZQHKUFDK-KRWDZBQOSA-N 408.455 -0.357 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cn2cccnc2n1 766635841 GSTWRNNMUHCWIH-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 1294587868 PLMMZPLIGGZRMK-VQFNDLOPSA-N 422.507 -0.659 50 10 HBGE Cc1c(C(=O)NNC(=O)CS(C)(=O)=O)nnn1-c1ccc(OC(F)F)cc1 1642619090 BXPFDRBWDZYZEC-UHFFFAOYSA-N 403.367 -0.017 50 10 HBGE O=C(N1CCC[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1)C(F)(F)F 2267208222 WRQLQDMIYCJCNI-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2c(Cl)cccc2B(O)O)CO1 2267392954 QUKSPBXBWVAQLY-VIFPVBQESA-N 406.653 -0.151 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282704180 HGDSBZNMAPPRFL-JQWIXIFHSA-N 420.318 -0.269 50 10 HBGE O=C(NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1)[C@@H]1COCCO1 746004367 WAQQUUKWEXQABC-KRWDZBQOSA-N 406.439 -0.268 50 10 HBGE C[C@@H](CO)NS(=O)(=O)c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1 1141786350 DPFZRJKRJSBNAW-JSGCOSHPSA-N 419.525 -0.548 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNC(=O)NNC(=O)[C@@H]2COCCO2)C1 1248485627 RAJXXFRGNNDWND-YVEFUNNKSA-N 402.448 -0.242 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)c2nccn2c1 1610347260 JRNUTAWMFNPMFH-ZETCQYMHSA-N 404.246 -0.205 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=O)c2n[nH]c3c2CCCC3)[C@H]1c1nccn1C 1623716691 IUENPDPUUTWVPH-HOTGVXAUSA-N 415.454 -0.228 50 10 HBGE O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccnnc1 1630210749 ZPARUHLFIMCOCO-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)n(C)c1 1645054448 UEBCRQBYSXWHFQ-AWEZNQCLSA-N 413.500 -0.710 50 10 HBGE Cn1cc([C@H]2[C@@H](C(=O)NNC(=O)CN3CCCC3=O)CC(=O)N2C(C)(C)C)cn1 1648934544 ALUYUKCSPIOQQV-GUYCJALGSA-N 404.471 -0.122 50 10 HBGE CN(C[C@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1sccc1B(O)O 2282069880 WJEFHBBTDRHJSH-QGZVFWFLSA-N 410.326 -0.315 50 10 HBGE C[C@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1c(B(O)O)cnn1C 2282074782 XDYIUZYXUOTHAL-LLVKDONJSA-N 404.298 -0.634 50 10 HBGE COC1(CCNC(=O)c2c(B(O)O)cnn2C)CN(C(=O)OCc2ccccc2)C1 2282251315 KCELPLBSSQOEQG-UHFFFAOYSA-N 416.243 -0.743 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NC(=O)c2n[nH]cc2B(O)O)C(C)(C)C1 2282396321 XXWHTRNWSLDIGN-MHZLTWQESA-N 400.266 -0.273 50 10 HBGE C[C@H](NC(=O)[C@H](CCN(C)C)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284055329 RCGWRPDYFAVWHI-JQWIXIFHSA-N 400.310 -0.155 50 10 HBGE O=C(CO)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1 753439275 LKUZRLRCIKJVFR-NSHDSACASA-N 406.258 -0.258 50 10 HBGE C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CS(C)(=O)=O 1149617757 RUYMVXXBYKIUFS-KRWDZBQOSA-N 408.436 -0.823 50 10 HBGE CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CN2CCCC2=O)c1 1171828998 WZPGTHRTPAIASH-UHFFFAOYSA-N 400.432 -0.104 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)C1(CC(=O)N2CCOCC2)CCCC1 1292564484 QQOHOMFWUWJACV-UHFFFAOYSA-N 406.439 -0.034 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)[C@H](CO)NC(=O)c1ccc(F)cc1 1292575013 XOGCWBMAORMMGF-LBPRGKRZSA-N 408.411 -0.445 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CCc3ccccc3C2)n(C)c1=O 1294587998 VPEVDBWWSMQXSJ-CQSZACIVSA-N 410.434 -0.614 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)C(F)F)c1)N[C@@H]1CCS(=O)(=O)C1 1542285354 LSTJLOWOWUOVMB-SECBINFHSA-N 411.408 -0.186 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1 1557733942 BATJGBYKIDZERG-UHFFFAOYSA-N 416.399 -0.243 50 10 HBGE CN(C)S(=O)(=O)CCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 1585921353 XGYKRALDRFDVMP-UHFFFAOYSA-N 421.520 -0.002 50 10 HBGE CCOC(=O)[C@@H]1C[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1622153489 HUZJJRGKPNLDMH-HZPDHXFCSA-N 402.451 -0.209 50 10 HBGE CC[C@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCNC1=O 1630996541 LNJXUGKUZGIFIT-FQEVSTJZSA-N 401.467 -0.492 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1 1638300424 PMDPNJOLIGXIPW-GFCCVEGCSA-N 405.498 -0.615 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)cc1 1641946108 IUCLWHBYUAIZFY-UHFFFAOYSA-N 407.452 -0.080 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1cnc(B(O)O)s1 2029308247 OTLHOVZFIXLCDC-UHFFFAOYSA-N 423.281 -0.681 50 10 HBGE Cc1c(C(=O)NC2CCN(C(=O)OCc3ccccc3)CC2)c(B(O)O)nn1C 2267430342 KBNFSKXCNQESKM-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cscc2B(O)O)[C@H](S(C)(=O)=O)C1 2281606969 LMBHSLIVQUDNOV-NWDGAFQWSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282080672 MCAZFXHDDFHEQC-MZHQLVBMSA-N 418.302 -0.180 50 10 HBGE CC(C)(C)OC(=O)NCC12CC(NS(=O)(=O)c3cscc3B(O)O)(CO1)C2 2282359884 UIGIGFXDHQCOCN-UHFFFAOYSA-N 418.302 -0.468 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(OC)c1 729950100 IURSLCVOURKHDP-UHFFFAOYSA-N 413.390 -0.276 50 10 HBGE CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)n1 746004421 WMNAYOGUOIAPSM-QWHCGFSZSA-N 412.447 -0.559 50 10 HBGE CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc(F)c(N)c(F)c1 814876949 GGQWTUOUQGAJGX-UHFFFAOYSA-N 405.365 -0.166 50 10 HBGE COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)cc1OC 1299885116 LRNNQZHCEXLJIG-DGCLKSJQSA-N 415.468 -0.055 50 10 HBGE C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)C1 1463774913 ZBMLPHNUFPMOEO-HUUCEWRRSA-N 405.279 -0.232 50 10 HBGE C[C@@H]1[C@@H](C)N(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2282339751 ZXQRNGCTAFWHDQ-GHMZBOCLSA-N 419.334 -0.018 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cc(C)c(B(O)O)s2)C[C@@H]1NC(=O)OC(C)(C)C 2282371506 KKDDHXCREVUMKC-WDEREUQCSA-N 420.318 -0.351 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282378020 ZOOUVKPHDNHTGI-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE C[C@@H](NC(=O)[C@@H](CCN(C)C)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284055331 RCGWRPDYFAVWHI-ZYHUDNBSSA-N 400.310 -0.155 50 10 HBGE O=C(O)[C@H](COCc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1B(O)O 2284396727 YFCISBPSQVSNLI-AWEZNQCLSA-N 413.644 -0.032 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 744644161 GFLOFDCYMPKWQJ-SWLSCSKDSA-N 403.391 -0.362 50 10 HBGE CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 793448623 VNHMHZZGNJSHIY-ZDUSSCGKSA-N 407.452 -0.044 50 10 HBGE O=C(NNC(=O)[C@H]1CCc2nncn2C1)Nc1ccn(CCN2CCOCC2)n1 814644046 YFTXYIIQWUYJTO-ZDUSSCGKSA-N 403.447 -0.778 50 10 HBGE CO[C@]1(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CCS(=O)(=O)C1 1297752536 FWAGZUKRJFIGKP-YVEFUNNKSA-N 419.500 -0.015 50 10 HBGE Cn1[nH]c(Br)c2c(=NCCNC(=O)c3ccc(B(O)O)cc3)ncnc1-2 1565641766 HOYOMZNWZTTWFP-UHFFFAOYSA-N 419.048 -0.979 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(B(O)O)cc3)cc2)CC1 1636677422 PIISZGFZGTXCDA-UHFFFAOYSA-N 418.284 -0.941 50 10 HBGE COc1cccc(NCC(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)c1 1654173762 QADJZGHBCOYYLU-UHFFFAOYSA-N 407.452 -0.227 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)c(OC)c1 1687345565 YNGLGIXMSYYTFG-GOSISDBHSA-N 408.411 -0.724 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCCS(=O)(=O)Nc1cccc(B(O)O)n1 2089786391 JSEKXHOFGFIPSQ-UHFFFAOYSA-N 417.252 -0.030 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2267389436 OJDGSROSEYFTRT-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267614066 ITGSJDZSEJJDLY-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2267626344 GRIYNVJGZQQENE-JTQLQIEISA-N 405.307 -0.406 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@H](NC(=O)C(F)(F)F)[C@@H]2C)sc1B(O)O 2282361314 PATZPVNTZPGEPD-IUCAKERBSA-N 414.236 -0.044 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)n1 2282377093 MMBKSLVRURLLTJ-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282380627 LYSOHGMNIKWJAB-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2OCCN(S(=O)(=O)c3sccc3B(O)O)[C@@H]2C1 2282715291 DYWYLEJWFCOGOE-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE CCc1nc(C(=O)N(CCNC(=O)OC(C)(C)C)C[C@H](C)O)c(B(O)O)s1 2285351671 YJUIRXPHSHCMQV-JTQLQIEISA-N 401.294 -0.267 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)CC2CN(C(=O)OCc3ccccc3)C2)n1C 2337404041 XRNPWWSDDZJHFS-UHFFFAOYSA-N 400.244 -0.251 50 10 HBGE CCOc1cc(OCC)c([N+](=O)[O-])cc1/C=N/NC(=O)CNc1n[nH]c(=O)[nH]c1=O 169893210 ZGOUYGOGWPFEGQ-CNHKJKLMSA-N 421.370 -0.274 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)N[C@H]1CCN(CCN2CCOCC2)C1 734685486 FJENIQGUDIIBKA-WMZOPIPTSA-N 403.483 -0.273 50 10 HBGE Cc1nn(C)c(C)c1[C@@H](NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)C(F)(F)F 757893271 PCTRPWMEYOQPBT-OIBJUYFYSA-N 414.410 -0.092 50 10 HBGE COc1cccc2c1OCCC2=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 764817186 OAKUWJWGTRFQQK-UHFFFAOYSA-N 412.406 -0.255 50 10 HBGE CCn1nccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 769862179 JDJYKODKPZRDFA-UHFFFAOYSA-N 401.470 -0.223 50 10 HBGE C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816881901 RWAMQKPGMFOODA-UPJWGTAASA-N 417.470 -0.265 50 10 HBGE C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1313097739 FMNYUSWLKBEPER-JTQLQIEISA-N 403.436 -0.586 50 10 HBGE COC(OC)[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1471149508 STRZSNPHRATRAN-LBPRGKRZSA-N 416.504 -0.349 50 10 HBGE O=C(NNC(=O)c1ccccc1S(=O)(=O)C(F)F)N[C@H]1CCS(=O)(=O)C1 1597425580 DZGUETMLLXRVSQ-QMMMGPOBSA-N 411.408 -0.186 50 10 HBGE CO[C@]1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCS(=O)(=O)C1 1597886619 SXDIJWCEFXJPAL-LLVKDONJSA-N 419.319 -0.984 50 10 HBGE CN(NC(=O)c1cccc(B(O)O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1624656376 ZWSAFMCSUAIXIW-UHFFFAOYSA-N 406.248 -0.384 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(F)c2)C1)N[C@H]1CCS(=O)(=O)C1 1625564014 PNASLIKMZBYKAU-ZJUUUORDSA-N 416.406 -0.165 50 10 HBGE Cn1nc(Br)c(C(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Br)n1 2219802866 AGAXRBCTAXRPKS-WHFBIAKZSA-N 402.068 -0.132 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1scc(B(O)O)c1C)NC(=O)OC(C)(C)C 2281850962 KQPZNEAQEXFRPS-NSHDSACASA-N 400.262 -0.077 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@@H]2COC[C@H]21 2282070932 LGDTYFINKXBSJQ-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2sccc2B(O)O)[C@H](S(C)(=O)=O)C1 2282206756 JHOJNEGHZLVOBT-GHMZBOCLSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282378545 HXZQQKDLWOKIEY-KBPBESRZSA-N 400.262 -0.922 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)N2CCC[C@@H]2C)cc1 769861430 BSXSNIINWHSWOQ-ZDUSSCGKSA-N 404.514 -0.035 50 10 HBGE O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)[C@@H]1CCc2nncn2C1 816884113 RHRZJHDOCVDRRJ-SLZMIMFISA-N 418.479 -0.032 50 10 HBGE Cn1cc(I)c(CNC(=O)NNC(=O)[C@@H]2CCC(=O)N2)n1 1248674731 KFVXAAAFXOYERF-ZETCQYMHSA-N 406.184 -0.866 50 10 HBGE Cc1cn(C)c(CC(=O)NNC(=O)[C@H]2CCCO2)c1C(=O)NNC(=O)[C@H]1CCCO1 1326367198 OIGJXKJHKDPIAG-ZIAGYGMSSA-N 421.454 -0.858 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)c2ccccc2C1=O 1534064303 GHVQTEDKCFGBSQ-QWHCGFSZSA-N 404.448 -0.170 50 10 HBGE Cc1cc(CC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)n[nH]1 1570717237 WBFWTVPIDYILGG-UHFFFAOYSA-N 406.468 -0.096 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cc(B(O)O)sn1 2255773978 FWQHADYHTOIAIS-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CN(S(=O)(=O)N3CC(Cl)C3)CCN2C1=O 2265388060 VUPMDVMIWQWKIS-NWDGAFQWSA-N 408.908 -0.036 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1 2267081895 GUCKNBPCTRBWLV-AWEZNQCLSA-N 419.268 -0.101 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613905 GSTHGVQRDQGXLQ-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE COC(=O)[C@@H](CC(=O)N[C@@H](C)c1nscc1B(O)O)NC(=O)OC(C)(C)C 2283989858 UGFGFKOAZKMKPQ-WCBMZHEXSA-N 401.250 -0.544 50 10 HBGE CSc1ccc(N2C[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2=O)cc1 758047525 XXPDRCMFNHDIEE-WDEREUQCSA-N 414.509 -0.154 50 10 HBGE Cc1cccc(Cl)c1CC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 792605592 JHRHQZJDEUMKAQ-UHFFFAOYSA-N 418.841 -0.214 50 10 HBGE CC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 921056775 XEXRXAKDEFBQIE-ZDUSSCGKSA-N 400.482 -0.381 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/CN3CCOCC3)cc2)CC1 1446388637 RQBUXSSFZQEESF-NSCUHMNNSA-N 423.539 -0.046 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)N1 1461838094 PAWFEFNUGOPKPO-SNVBAGLBSA-N 400.482 -0.038 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)NC[C@H](NS(=O)(=O)N(C)C)C1CCCC1 1478899152 BDIIXZPKTAJKLA-YUTCNCBUSA-N 405.521 -0.303 50 10 HBGE CN(C)CC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1 1610332435 NZSDRPTVHHUGGN-AWEZNQCLSA-N 414.484 -0.575 50 10 HBGE Cn1cc(C(=O)NC[C@@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)cn1 1647977796 LQGIALGXUDJIIK-KRWDZBQOSA-N 409.450 -0.053 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201423 OMWOMKGYTYYMMW-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@@H]1CO 2282358900 GRSBMWOEJGOAGA-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282377108 MQZVMNGKCUURLT-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE Cn1cc(/C=C/C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(=O)n(C)c1=O 726862572 UNICPIZUOSTMDV-XCVCLJGOSA-N 419.463 -0.319 50 10 HBGE CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)CCCc2cccs2)CC1 732573467 QNFIVPQQNKLWMG-UHFFFAOYSA-N 417.557 -0.022 50 10 HBGE Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1C 917518749 CUDIEICROBQHPI-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2[C@@H]3CCCCCC[C@@H]23)n(C)c1=O 1630996559 MGPIWLBBSQQWBB-VXGBXAGGSA-N 402.455 -0.203 50 10 HBGE Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)c1C 1682730217 FUHBUFMPURBORC-ZDUSSCGKSA-N 401.489 -0.203 50 10 HBGE Cc1c(C(=O)N(C)[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2267022753 LBVOISWRUAWAFC-LSDHHAIUSA-N 400.244 -0.062 50 10 HBGE O=C(OCc1ccccc1)N1CCC[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2267612640 MDVCHXHQAUBTHX-MRXNPFEDSA-N 419.268 -0.159 50 10 HBGE Cn1nc(C(=O)Nc2nnc(CNC(=O)OC(C)(C)C)o2)c(B(O)O)c1Cl 2282288440 OAHHVRVABHHUEE-UHFFFAOYSA-N 400.588 -0.587 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)CO1 2282425410 PHDTUFCCULAIPT-VIFPVBQESA-N 408.188 -0.526 50 10 HBGE CN(C[C@@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)cs1 2282510104 UPCOEIXMPUREFN-GFCCVEGCSA-N 420.318 -0.316 50 10 HBGE O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)[C@H]1COCCO1 744642113 PACUPYQPIVBYNS-GFCCVEGCSA-N 421.269 -0.073 50 10 HBGE COc1cc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)ncn1 763939203 MACDISYERMFNAU-UHFFFAOYSA-N 405.484 -0.238 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnn2c(=O)cc[nH]c12 1135292055 WESWOOSJJWFJAC-UHFFFAOYSA-N 409.450 -0.004 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)C1=O 1178358798 OGHNMZDUYDDXLO-RYUDHWBXSA-N 412.443 -0.445 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 1299883945 BKQIILONRKHDKI-ZYHUDNBSSA-N 402.498 -0.062 50 10 HBGE CCCn1nc(C(=O)NNC(=O)[C@@]2(OC)CCS(=O)(=O)C2)c2ccccc2c1=O 1352972470 TZBKAMYSIGQIRH-GOSISDBHSA-N 422.463 -0.229 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1 1478945529 UDDIULOBZUZAHW-UHFFFAOYSA-N 407.456 -0.806 50 10 HBGE CNC(=O)[C@H](CNC(=O)c1cc(B(O)O)ccc1F)Cc1ccc(OC)c(F)c1 1630951985 WBJKULJBADYWPH-LBPRGKRZSA-N 406.194 -0.012 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3COCO3)nc2)CC1 1684765802 QSTXRUFIZFMTGW-GFCCVEGCSA-N 400.461 -0.983 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2nccc(B(O)O)c2F)[C@@H](S(C)(=O)=O)C1 2240310606 RIANFCNUOMEMKM-QWRGUYRKSA-N 403.241 -0.655 50 10 HBGE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)c1scc(B(O)O)c1Cl 2267446242 QGTIXEDDJBCQGN-UHFFFAOYSA-N 408.669 -0.941 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)cc1 2282089219 XTFYTMGQHOJGAA-CYBMUJFWSA-N 400.262 -0.072 50 10 HBGE C=C(CS(=O)(=O)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1)B(O)O 2282367126 YBNOYMARPHTVCL-AWEZNQCLSA-N 403.310 -0.489 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(S(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282370049 PBOURSXQKRYQOE-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE Cc1sc(C(=O)NCC(CO)(CO)NC(=O)OC(C)(C)C)c(B(O)O)c1C 2286185227 VSODSPLGPDSIDE-UHFFFAOYSA-N 402.278 -0.977 50 10 HBGE O=C(COC(=O)[C@]12[C@H]3C(=O)[C@H]4[C@H]5C[C@@H]([C@@H]41)[C@@H]2[C@H]53)NNC(=O)[C@H]1COc2ccccc2O1 800250238 FAHYMFFFBSBBKE-BCYYPFRGSA-N 424.409 -0.156 50 10 HBGE CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)[C@@H]2COCCO2)CC1 808279305 ZWRUANGPJKPPEV-OCCSQVGLSA-N 406.505 -0.475 50 10 HBGE CS(=O)(=O)c1nc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c2ccccn12 1156184707 YVRAXUVCIBWQIY-AWEZNQCLSA-N 421.479 -0.248 50 10 HBGE C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3cnn(C)c3)CC2)C[C@@H](C)O1 1290837076 KGDMMBBZGYXHSI-IQYKXVSTSA-N 422.511 -0.175 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 1299883943 BKQIILONRKHDKI-JQWIXIFHSA-N 402.498 -0.062 50 10 HBGE CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1 1631029595 MAGFMBZDOBPPHA-YPMHNXCESA-N 420.557 -0.258 50 10 HBGE O=C1C[C@@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1 1636162685 FYKNXPNWGBJGFE-GFCCVEGCSA-N 409.468 -0.449 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@H]1CNS(=O)(=O)c1cscc1B(O)O 2267385486 UBZRYWMRLJGOMQ-HOSYDEDBSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@](F)(CNC(=O)c2sncc2B(O)O)C1 2281919382 DPCZRSYRQRBNEA-HNNXBMFYSA-N 403.241 -0.472 50 10 HBGE CC(C)(C)OC(=O)N1CC(CNC(=O)c2cc(B(O)O)c(Cl)s2)(C(N)=O)C1 2281920768 BFYMVNMPEVVBEP-UHFFFAOYSA-N 417.680 -0.467 50 10 HBGE Cc1cc(S(=O)(=O)NCCOCCCNC(=O)OC(C)(C)C)sc1B(O)O 2282359686 RJTBFFKAAVKUKP-UHFFFAOYSA-N 422.334 -0.054 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2282430331 CXCQDGQXXJOLNL-GJZGRUSLSA-N 416.243 -0.778 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1c(C)nsc1B(O)O)NC(=O)OC(C)(C)C 2282456084 BZKQBSSLRFECSN-SECBINFHSA-N 401.250 -0.682 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)C[C@@H](C)N1C(=O)OC(C)(C)C 2282700064 NZSAECJFKMYDIZ-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1c(B(O)O)cnn1C 2282706198 IXWFIENBOSDRHX-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(CO)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282724153 KLXIGMFPBBHSOE-UHFFFAOYSA-N 420.318 -0.756 50 10 HBGE COC(=O)[C@H](CC(=O)N(C)Cc1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2284010026 AFVQULDYXVHBBG-NSHDSACASA-N 400.262 -0.157 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)CN(C)CCNC(=O)OC(C)(C)C 2284046409 AMLYYJJQZJYHLD-LLVKDONJSA-N 400.310 -0.201 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2285201350 DMXMMOOVEVSZLX-QGZVFWFLSA-N 413.239 -0.163 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1cc(B(O)O)sn1)C(=O)O 2289799337 WRMNUWSZDRNHDL-VIFPVBQESA-N 401.250 -0.299 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H]2C(=O)NCCN2S(=O)(=O)N2CC(Cl)C2)C1 2351723068 AZJVWLWQVSORCN-GFCCVEGCSA-N 408.908 -0.179 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)cc1OC 1684435104 USCKCCYOJJAMLX-UHFFFAOYSA-N 415.472 -0.472 50 10 HBGE C[C@H]1CN(C(=O)c2nn(C)nc2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267040708 YWPUBURSUOYZRC-BETUJISGSA-N 401.232 -0.634 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2267390141 ZPJZDYFATNSGPU-JTQLQIEISA-N 405.307 -0.406 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267608257 UTVJSOMESUZGFM-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C1 2282079222 TXWMUDBPAMUKBY-JTQLQIEISA-N 402.282 -0.976 50 10 HBGE C[C@H]1[C@@H](C)N(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2282339754 ZXQRNGCTAFWHDQ-WDEREUQCSA-N 419.334 -0.018 50 10 HBGE COc1cc(C=NNC(=O)c2nnn(-c3nonc3N)c2CN(C)C)ccc1O 254739909 CSFJKGBTHLATRM-UHFFFAOYSA-N 401.387 -0.228 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1ccccc1OCC(=O)N1CCOCC1 756872142 BNVWOHAKNPDNGT-OAHLLOKOSA-N 408.411 -0.508 50 10 HBGE NS(=O)(=O)c1ccccc1N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1 785508892 NQJOJHQHNILCGU-UHFFFAOYSA-N 417.491 -0.083 50 10 HBGE CO[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)[C@H]1CCOC1 1182816472 SESJGONYTHVRIP-DZGCQCFKSA-N 413.500 -0.488 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cn(-c2ccccc2Br)nn1 1454279047 VOKVOZXWCQXBTR-UHFFFAOYSA-N 402.230 -0.165 50 10 HBGE COCCCNC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)OC(C)(C)C)CC1=O 1464489979 ZBQJCYNGSFRGRK-LBPRGKRZSA-N 401.464 -0.179 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 1471221890 FKUUHIZZSSLSLR-MRXNPFEDSA-N 422.507 -0.002 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CN3CCN2C[C@@H]3C)c1 1540250308 CIVAAXLWIVLPEZ-YOEHRIQHSA-N 423.539 -0.134 50 10 HBGE NC(=O)N[C@H](CO)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 1542453173 ZUABJZWVKJIDPT-MSOLQXFVSA-N 411.462 -0.210 50 10 HBGE CC(C)(C)OC(=O)N1CC2CC1(C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C2 1543753722 XQSKEHVGFOXYES-NOEPWBJOSA-N 402.473 -0.097 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1cc(B(O)O)ccc1F 1585942074 AEYLYVMXWBUXKP-UHFFFAOYSA-N 412.170 -0.203 50 10 HBGE CN(C)CC(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 1641243215 MGBSYQAPOBMGBU-UPJWGTAASA-N 418.516 -0.634 50 10 HBGE C[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(C)(C)NC(=O)OC(C)(C)C 2267371434 AJVKSWAHGBRVLK-VIFPVBQESA-N 407.323 -0.066 50 10 HBGE CC[C@@H](CN(C)S(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267380004 ASXQPUTWRGPHAN-JTQLQIEISA-N 407.323 -0.112 50 10 HBGE O=C(N[C@@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1sccc1B(O)O)C2)C(F)(F)F 2282069417 PPYUAPWJMPDOKN-SZEHBUNVSA-N 412.220 -0.352 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1CC[C@H]1NC(=O)OC(C)(C)C 2282361698 VJCZLHDVWIVAPC-NEPJUHHUSA-N 400.262 -0.291 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282376218 AJXATPDKUCNAMS-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCO[C@@H](CNC(=O)OC(C)(C)C)C1 2282729995 VVWXHHZWIXKTIK-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CCN(NS(=O)(=O)c2ccc(B(O)O)cc2Cl)CC1 2282731760 VZCUIYFBJHCWJA-UHFFFAOYSA-N 419.696 -0.234 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)c2cc(F)c(B(O)O)cc2Cl)C1 2282969548 DRLUMLDTMAKAPT-UHFFFAOYSA-N 402.615 -0.130 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Nc2ccc(F)cc2F)n(C)c1=O 765312258 BJZVRVHYUZBBMV-UHFFFAOYSA-N 407.337 -0.435 50 10 HBGE Cc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 765729611 DPGNCAJXBSGBHV-LBPRGKRZSA-N 414.422 -0.643 50 10 HBGE O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1cccc(S(=O)(=O)NC2CC2)c1 816885253 UUIWBSBMBRXLTR-LBPRGKRZSA-N 404.452 -0.258 50 10 HBGE O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)[C@@H]1CCN1C1CCOCC1 1178420386 JDQNHHPCCNOFRY-ARFHVFGLSA-N 403.439 -0.642 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCS(=O)(=O)C[C@@H]2CCO)cc1C 1197991021 RCWOOCZEWFXABF-LBPRGKRZSA-N 403.526 -0.139 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)NCCS(=O)(=O)CC(F)(F)F 1252760875 POJMEVXTTPLCSA-UHFFFAOYSA-N 416.403 -0.215 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n(C)c1=O 1463534040 BIYFHHMDSMOVRJ-UHFFFAOYSA-N 407.452 -0.417 50 10 HBGE CN1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1472474939 FWLIKEAXTFRWHE-INIZCTEOSA-N 410.496 -0.047 50 10 HBGE O=C(CCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@H]1CCC(=O)N1 1543093971 RUVRQIFFNYESIM-LLVKDONJSA-N 423.223 -0.139 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccnn3)CC2)cc1 1587964100 QECRBBNYHXFHTK-UHFFFAOYSA-N 418.479 -0.447 50 10 HBGE CNC(=O)[C@@H](CNC(=O)c1cc(B(O)O)ccc1F)Cc1ccc(OC)c(F)c1 1630951984 WBJKULJBADYWPH-GFCCVEGCSA-N 406.194 -0.012 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)N1CCCC1 1685500485 FJVOBBYRXQVLAY-UHFFFAOYSA-N 400.457 -0.170 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNS(=O)(=O)c2sccc2B(O)O)C1 2267201258 LUEWPEJIXURQJN-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE CC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1ccc(OC)c(B(O)O)c1 2282366856 UTOQBIXHHXBMKZ-LLVKDONJSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@H]1CO 2282374917 HYPONOIKLQACFG-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CN(C)CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cscc1B(O)O 2282414783 XJZDDDMACHXNKG-UHFFFAOYSA-N 421.350 -0.495 50 10 HBGE COC(=O)[C@H](CC(=O)N(C)Cc1csc(B(O)O)c1)NC(=O)OC(C)(C)C 2283998433 XIQSLXDZGOBSHL-NSHDSACASA-N 400.262 -0.157 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2CCC(NC(=O)C(F)(F)F)CC2)c1B(O)O 2286121805 UJHAUVLLLDSQDP-UHFFFAOYSA-N 414.236 -0.124 50 10 HBGE COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@@H]2COCCO2)c1 744642606 KMTKNNKTNFYLNG-AWEZNQCLSA-N 401.441 -0.904 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)ccc1=O 1134417443 POXPPWVMWSGWEN-AWEZNQCLSA-N 400.370 -0.594 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1539175369 XENRISDOMGEDDL-YXAMBPQSSA-N 404.467 -0.117 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 1540475299 WKKLAAMCZQMEJL-AWEZNQCLSA-N 402.494 -0.118 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2282339531 YHDXABJQUAWIKQ-JGVFFNPUSA-N 415.224 -0.816 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)n1 2282378030 ZTDGAWHPNPQCOH-JQWIXIFHSA-N 402.282 -0.928 50 10 HBGE CN(Cc1nc(NS(=O)(=O)c2cscc2B(O)O)n[nH]1)C(=O)OC(C)(C)C 2282410016 UPECYIXVLZOHIV-UHFFFAOYSA-N 417.278 -0.286 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cnc(B(O)O)s1)[C@H](O)C(C)(C)C 2284061931 HOSFUEAIHUTFHZ-QWRGUYRKSA-N 401.294 -0.261 50 10 HBGE CN([C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1ccc(B(O)O)cc1 2369652909 SLRVEURGLYRZGW-KBPBESRZSA-N 402.253 -0.056 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)N(C)C1 575232484 UHQYIIRIOVIPLI-KJZNXJRVSA-N 410.964 -0.001 50 10 HBGE in-vitro Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)CS(C)(=O)=O)cc12 1168877677 VPKYFAHUORKOBO-MRVPVSSYSA-N 401.470 -0.746 50 10 HBGE O=C(NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O)[C@@H]1COCCN1CC(F)(F)F 1298495347 YLOBKJQEYKMKAD-NWDGAFQWSA-N 414.340 -0.152 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1558926938 BVCRSGLEBCXKIA-DCAQKATOSA-N 410.468 -0.333 50 10 HBGE Cn1nc(I)cc1C(=O)NNC(=O)c1nc[nH]c2ncnc1-2 1645050924 XBJOWHUUSLXHSR-UHFFFAOYSA-N 412.151 -0.283 50 10 HBGE O=C(O)[C@H](CB(O)O)NS(=O)(=O)CCCCCN1C(=O)c2ccccc2C1=O 2042873954 YZMLHHZJDURIIM-ZDUSSCGKSA-N 412.229 -0.702 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(O)CCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282069920 WRNFTZRBCBWXJA-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC[C@H](CNS(=O)(=O)c1ccc(OC)c(B(O)O)c1)NC(=O)OC(C)(C)C 2282365138 UVWSZCLCJBUVSW-LLVKDONJSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)S(=O)(=O)Cc1ccsc1B(O)O 2282737122 YUKUCKJJNNZOGP-UHFFFAOYSA-N 422.334 -0.533 50 10 HBGE COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)c(OC)c1 746002761 LVZZGWZMBVFJGJ-MRXNPFEDSA-N 422.438 -0.382 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(CCC(=O)N(C)C)CC2)cc1OC 760985129 RCWREIYZNFDWPJ-UHFFFAOYSA-N 421.498 -0.439 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCCN(S(=O)(=O)N(C)C)CC1 811851805 SXMNEKYXUVIZCJ-UHFFFAOYSA-N 423.499 -0.189 50 10 HBGE O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNC(=O)[C@H]1CCc2nncn2C1 816880622 ORWPVWYGTIAVCZ-NSHDSACASA-N 401.818 -0.005 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2OCCN(C)C2=O)c1 1135229549 XWRHIMPWLRTTKW-AWEZNQCLSA-N 412.468 -0.665 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@H]1COCCO1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1533477188 SWIQOLVUWXQJOP-VXGBXAGGSA-N 400.432 -0.983 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)OC)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1 1654261632 NLWIUUUJBCXBJM-HUUCEWRRSA-N 402.407 -0.254 50 10 HBGE O=C(CN1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2)N[C@H]1CS(=O)(=O)C[C@H]1Cl 2195882823 FAAGHTCAWGJDKQ-MMWGEVLESA-N 417.837 -0.256 50 10 HBGE O=C(OCc1ccccc1)N1CC[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2255669495 PBIYDMZDQYVJAF-OAHLLOKOSA-N 405.241 -0.549 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282083314 OAAYJNNSMXFZAL-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)c3ccc(F)c(B(O)O)c3)[C@H]2C1 2282348585 NCBOCOFZDAGLHW-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)Cc1cccc(B(O)O)c1 2282348632 NLFOPFGLWGWRPS-UHFFFAOYSA-N 402.278 -0.985 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282719316 KESPKPMEYIDLKI-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282863563 TWRSTQXWUNWEEH-NEPJUHHUSA-N 420.318 -0.782 50 10 HBGE C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)C1 746000880 BHIHWZMGEHQFIU-BZUAXINKSA-N 411.503 -0.735 50 10 HBGE COc1cc(C(=O)N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)ccc1C 746004657 XEDNSNKKJVTAFN-INIZCTEOSA-N 406.439 -0.082 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(OC)c1 753067375 AJWXJYAAYVUFKS-NSHDSACASA-N 400.457 -0.071 50 10 HBGE O=C(NCc1ccccc1)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 787367089 XBSHIDHIFDKVAT-ZDUSSCGKSA-N 407.452 -0.318 50 10 HBGE CN(C)CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1 1463588895 JNMASVHXTSIHIG-UHFFFAOYSA-N 408.484 -0.230 50 10 HBGE O=C1CC[C@]2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)SCCN12 1566973689 LGSJICGTFLTARI-GFCCVEGCSA-N 412.331 -0.122 50 10 HBGE O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 1683057240 PBPUBGKEYYOHMQ-ZIAGYGMSSA-N 402.455 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](C#N)C1 2267387163 FJYZGDGAUJQRBF-SNVBAGLBSA-N 401.275 -0.439 50 10 HBGE O=C(N1CCC(CNS(=O)(=O)c2cscc2B(O)O)CC1)C(F)(F)F 2267622906 XFQKWFBPLMWBHX-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267712622 GQJYMXUFCVKCRB-UWVGGRQHSA-N 405.307 -0.312 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267719912 HBFCRFPGKUBYFD-JTQLQIEISA-N 403.291 -0.582 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2282364969 ZMOMLIVVUWACKW-LJWDBELGSA-N 400.237 -0.208 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCCC1CN(C(=O)OC(C)(C)C)C1 2282710744 SADPTMHQLQPHCX-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1cccc(B(O)O)c1 2282720351 ZDHBHPXNRKPGJM-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)cn1 2283973721 JDVHHAIKTQRYTL-NSHDSACASA-N 401.250 -0.972 50 10 HBGE O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)[C@H]1Cc2ccccc2O1 730580992 QWRKKBKHAZTCCB-CQSZACIVSA-N 414.509 -0.301 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)[C@H]2COCCO2)CCO1 760780294 LPHAOYBJHHVVLJ-YNEHKIRRSA-N 402.448 -0.243 50 10 HBGE COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(B(O)O)cc1 1556513377 CXKYLYXPEYPAEA-OAHLLOKOSA-N 406.244 -0.009 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nscc1I 1628908123 CZJKBHUWYUKVPQ-YFKPBYRVSA-N 415.234 -0.057 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)ccc1=O 1653053385 DTSGRCWHQKFUNB-CYBMUJFWSA-N 421.454 -0.338 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@H](O)CNC(=O)OC(C)(C)C)c1B(O)O 2267625272 MQJWBVNAKDUZHM-SNVBAGLBSA-N 408.307 -0.791 50 10 HBGE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cscc1B(O)O 2267625348 NYKSWMUWWGSMRM-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)Cc2cccc(B(O)O)c2)COC1 2282347002 RPOGINSDXWSISH-UHFFFAOYSA-N 400.262 -0.921 50 10 HBGE Cc1nc(S(=O)(=O)N(C)C[C@H]2CCN2C(=O)OC(C)(C)C)c(B(O)O)n1C 2282741677 QYNKMGBXQNONDF-LLVKDONJSA-N 402.282 -0.962 50 10 HBGE CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@@H]1COCCO1 744649022 RCYHJEHSIXFEBB-KBPBESRZSA-N 417.509 -0.351 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)[C@@H]1COCCO1 767467087 OSRLSUFTAPYFFM-ABAIWWIYSA-N 404.416 -0.034 50 10 HBGE NC(=O)[C@@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(Br)c1 792970150 HPRDNIIXXCEFJY-QWRGUYRKSA-N 401.217 -0.279 50 10 HBGE C=CCNC(=S)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 798304766 KMWVLEWWQCIECY-RWMBFGLXSA-N 402.542 -0.223 50 10 HBGE CN(C)N(C(=O)c1nc2ncc(Br)cn2n1)[C@@H]1CCS(=O)(=O)C1 1124467842 GXZHOHZNPRAOLO-SECBINFHSA-N 403.262 -0.007 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1COCCN1C(=O)OCc1ccccc1 1471222792 ZJADMJGCJCGJBN-OAHLLOKOSA-N 404.423 -0.206 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)Cn1cnc(-c2ccccc2)cc1=O 1611014913 AIIQLTRJLNTWGG-UHFFFAOYSA-N 406.402 -0.117 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)C2CCOCC2)c1 1643424700 NULYXZULERSBSI-UHFFFAOYSA-N 412.468 -0.759 50 10 HBGE C#CCNS(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1 1644281565 GKFGISLDQDUZLP-MHWRWJLKSA-N 400.464 -0.276 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 1682008385 IQJNASJNVCNGRR-GXSJLCMTSA-N 406.411 -0.002 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)C[C@@H](C)N1C(=O)OC(C)(C)C 2282078852 NZSAECJFKMYDIZ-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE C[C@@H](CCCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282082229 INDPWVUKFNALLC-NSHDSACASA-N 404.298 -0.586 50 10 HBGE CCC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nc(C)n(C)c1B(O)O 2282335548 QWAFOIUTSZFDDG-NSHDSACASA-N 404.298 -0.620 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282357444 JYMWJFIDWLQZPL-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282383106 UVBJBBINXXRNBG-FLESLCNUSA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C2(CC2)C1 2282731462 QWLNORKSGKFYQL-LLVKDONJSA-N 417.318 -0.358 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](C(=O)N=c1nc(B(O)O)[nH]s1)C1CCOCC1 2284036643 BYHIZMRVVBQSDO-SNVBAGLBSA-N 400.266 -0.854 50 10 HBGE Cc1scc(C(=O)N2CCS(=O)(=O)CCN2C(=O)OC(C)(C)C)c1B(O)O 2369518815 VYGVVTYZZDLYKS-UHFFFAOYSA-N 418.302 -0.241 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N1CCc2cc(B(O)O)ccc21 712225563 COFYSMFPSPLSKD-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@@H]1COCCO1)S(=O)(=O)c1ccc(F)cc1 744641574 DGEWFTBMGSQRJR-AWEZNQCLSA-N 403.432 -0.211 50 10 HBGE O=C(NNC(=O)N1CCN2C(=O)OCC[C@H]2C1)c1csc(N2CCOCC2)n1 763460020 DDDLADIPBLKPSE-NSHDSACASA-N 410.456 -0.139 50 10 HBGE CO[C@@H]1C[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1124366664 QUHKOLDVXFCDFW-HZPDHXFCSA-N 411.480 -0.178 50 10 HBGE O=C(NNC(=O)c1cnsn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 1133630655 NPCRCDMMPKGABV-UHFFFAOYSA-N 415.428 -0.227 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H](C)S(C)(=O)=O 1137299190 MSZFONRYHQOYKV-CABCVRRESA-N 424.523 -0.339 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)[C@H]2CCCCO2)c1 1141463052 CXBJJZFSRCECBB-CQSZACIVSA-N 412.468 -0.617 50 10 HBGE CC(C)NC(=S)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318636944 WPQOKDWYPOJREA-JHJVBQTASA-N 404.558 0.000 50 10 HBGE CCOC(=O)[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(C)=O 1446966589 YUFJKXIVDPDBNN-NSHDSACASA-N 413.290 -0.029 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NN(C)C[C@@H](C)O)o1 1450939043 CTOFRRJJNGHRAY-NEPJUHHUSA-N 403.457 -0.047 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCC(=O)N1 1465791346 CXXYDACEJYZPMK-GDBMZVCRSA-N 401.467 -0.494 50 10 HBGE COC(=O)[C@]1(N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)CCOC1 1643888083 ABQGVRNNFBHMRA-FQEVSTJZSA-N 404.467 -0.294 50 10 HBGE C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1684632565 BTZSMHQYSDNKPN-KPZWWZAWSA-N 410.402 -0.449 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)Cc3ccsc3B(O)O)[C@H]2C1 2267369926 DJILXOIMHKQGHW-GDNZZTSVSA-N 402.303 -0.287 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267609053 KSHNQGLCCAQNQZ-WCQGTBRESA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C[C@H]2NS(=O)(=O)c2sccc2B(O)O)C1 2267611885 WQQXCIDJFZNJKE-HOSYDEDBSA-N 402.303 -0.038 50 10 HBGE CN(C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)S(=O)(=O)Cc1ncsc1B(O)O 2282380936 PRHNHYSZVDHUDR-UWVGGRQHSA-N 417.318 -0.550 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(S(=O)(=O)c2cscc2B(O)O)C1 2282732622 JHASIHWJFQEZNH-CQSZACIVSA-N 420.274 -0.830 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2369893257 WARTXVYXPYOBRV-VIFPVBQESA-N 419.696 -0.144 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1)Nc1ccccc1F 756074410 LBRHLZSTKKGATK-OAHLLOKOSA-N 409.418 -0.462 50 10 HBGE C=CCNC(=S)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 798304765 KMWVLEWWQCIECY-JHJVBQTASA-N 402.542 -0.223 50 10 HBGE CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)ccc1F 1178420735 PPQWMLVDDQJRKV-AWEZNQCLSA-N 414.459 -0.252 50 10 HBGE CN1C[C@H](O)C[C@]1(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1587968608 KIRIOUXQFJFYCZ-OXQOHEQNSA-N 403.483 -0.953 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](NC(=O)C(F)(F)F)C[C@H]1C 2282361236 OADMEVGXDDMQIM-VXNVDRBHSA-N 414.236 -0.044 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(O)CC(NC(=O)OC(C)(C)C)C2)sc1B(O)O 2282725263 YTGZOWKULYXSNT-UHFFFAOYSA-N 420.318 -0.567 50 10 HBGE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)Cc1nc(C)cs1 749550433 JGSVSPVRSXEBPU-WVATUKLVSA-N 424.479 -0.434 50 10 HBGE Cn1cc(C[C@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cn1 787096993 XOXOUGHUNLRMGT-HNNXBMFYSA-N 409.468 -0.512 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1CN(C)CCN1C 1256464732 JRCRCQGCPFHXGS-TZMCWYRMSA-N 411.532 -0.442 50 10 HBGE CC(C)N1CC[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@H](c2cnn(C)c2)C1 1327092262 ZGXMBHOORNONHJ-QEJZJMRPSA-N 414.532 -0.681 50 10 HBGE C/C=C/[C@@H](O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1463715056 AIJJBHJUROPDOD-WOMSROEHSA-N 411.480 -0.276 50 10 HBGE O=C1CC[C@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CN1 1587968382 DOCKSOOYPREJPJ-OAHLLOKOSA-N 401.467 -0.492 50 10 HBGE CN(C)S(=O)(=O)C1(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CC1 1684133147 FIDDDQMNMJQOSV-UHFFFAOYSA-N 403.486 -0.768 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2ccc(B(O)O)s2)CCOC1 2267203282 OFNQIHRZZNLTOQ-CQSZACIVSA-N 406.291 -0.610 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)n1 2267625958 YSSYSVTZODUUGS-KRWDZBQOSA-N 422.272 -0.821 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 2282064464 AGNPJAHFQGXGAC-WDEREUQCSA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282342359 GKUSBWMTDWDTCZ-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N=[S@@](C)(=O)CCNC(=O)OC(C)(C)C 2282376933 KLGIHVNNZKOHDN-SANMLTNESA-N 420.318 -0.014 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@H]1CO 2282699371 JQWVEOIQXYSGTH-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282736522 RZDXCWAKDRLNEX-GHMZBOCLSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC[C@H](B(O)O)C2)S(=O)(=O)C(C)(C)C1 2368347306 BKRWNBSMFHLWQU-RYUDHWBXSA-N 404.294 -0.126 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 748276569 MSKDRTBBVQPUFH-YDHLFZDLSA-N 407.448 -0.827 50 10 HBGE CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)CCc1ccco1 812880596 CQAYZBNFDRQJAR-LBPRGKRZSA-N 400.457 -0.422 50 10 HBGE O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)[C@@H]1COCCO1 814211689 MKURVIBLSZKEKD-AWEZNQCLSA-N 411.436 -0.571 50 10 HBGE Cc1[nH]nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1I 1135990035 GQLGCOVXNHTWKU-LURJTMIESA-N 412.209 -0.482 50 10 HBGE CC(C)(O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 1296519285 IBAVIDTVDFCCRB-UHFFFAOYSA-N 405.860 -0.107 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN(C)C[C@@H](C)O)c1 1556926237 LDAYLPXPBPBKGT-CYBMUJFWSA-N 400.501 -0.209 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(B(O)O)cc1 1586843728 PVJCNKDFHODZHR-UHFFFAOYSA-N 405.241 -0.856 50 10 HBGE O=C(NCCN1CCNC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1685320767 YRNRXICEMQRPSL-UHFFFAOYSA-N 424.483 -0.560 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1cscc1B(O)O 2267380020 BBGUBOIPKHQXNP-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE Cc1nn(C)c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2281849194 MMONRDRZXYZWNZ-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE O=S(=O)(NCCN1CCN(Cc2ccccc2)CC1)c1ccc(B(O)O)s1 2282076575 KBHYAMWCDFSXJG-UHFFFAOYSA-N 409.342 -0.476 50 10 HBGE C=C(CS(=O)(=O)N1CCO[C@@]2(CCCN(C(=O)C(F)(F)F)C2)C1)B(O)O 2282362834 KAMVKWJHWBVTMW-GFCCVEGCSA-N 400.184 -0.860 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282364973 ZNPYOTGCQHORNA-NSHDSACASA-N 402.282 -0.880 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1cc(B(O)O)ccc1O)OCc1ccccc1 2282976641 WATJNKLRRBFNQU-IAGOWNOFSA-N 414.223 -0.114 50 10 HBGE N#CC=C(COC(=O)C=Cc1ccc(O)cc1)CO[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O 2333278717 JDEJUHBDYJVLND-XZEJUNMKSA-N 421.402 -0.785 50 10 HBGE COCCNC(=O)CC(=O)NN=Cc1ccc(OCC(=O)NC[C@H]2CCCO2)cc1 725384038 DCBUUJPHYLBUCF-QGZVFWFLSA-N 420.466 -0.037 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cnc(-c3ccccc3)[nH]2)n(C)c1=O 764813071 UTIUAZVEYFTJQR-UHFFFAOYSA-N 406.406 -0.026 50 10 HBGE C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)n1cnc(C#N)n1 798980378 NOICPMMSDFBBNR-CQSZACIVSA-N 410.438 -0.684 50 10 HBGE CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN(S(N)(=O)=O)C1 1135736143 XNUDUXTYGNIGMW-LBPRGKRZSA-N 408.484 -0.338 50 10 HBGE CCCN1C[C@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1=O 1182816097 OPUIACUTZHLQEJ-CQSZACIVSA-N 424.527 -0.281 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)N1 1469609565 FWYKGNAMBZKXDY-ARFHVFGLSA-N 414.466 -0.806 50 10 HBGE CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2C[C@@H](O)CN2c2ccncn2)cc1 1569520518 VCHUUAZLPWIJSC-HIFRSBDPSA-N 406.468 -0.190 50 10 HBGE Cc1cc(CC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)Cc2ccccc2F)n[nH]1 1570719264 QZAAULWDCSQNKS-ZBFHGGJFSA-N 403.414 -0.248 50 10 HBGE COCCNS(=O)(=O)c1cc(NC(=O)c2ccc(B(O)O)cc2)ccc1OC 1626631600 IWZWNCFTSXPCNG-UHFFFAOYSA-N 408.241 -0.448 50 10 HBGE CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(C(=O)c2cccc(B(O)O)c2)C1 1631479442 GPYNMFINUYMWOA-HNNXBMFYSA-N 419.287 -0.141 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](CO)NS(=O)(=O)c1c(Cl)cccc1B(O)O 2267391924 HRDOHSAJONQNDZ-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](CNS(=O)(=O)c3sccc3B(O)O)[C@@H]2C1 2267607597 AFKUUDKYVUWLND-JGPRNRPPSA-N 402.303 -0.181 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1CC[C@@H]1NC(=O)OC(C)(C)C 2282361699 VJCZLHDVWIVAPC-NWDGAFQWSA-N 400.262 -0.291 50 10 HBGE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282704219 HUKSYWTWDUWYKM-DMDPSCGWSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](C(=O)NCCC#CB(O)O)S(=O)(=O)C(C)(C)C1 2287046473 QVSIWPGEMICJPE-GFCCVEGCSA-N 402.278 -0.679 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl 748722514 VRGFBYVCCNCDTO-CYBMUJFWSA-N 403.844 -0.089 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 810728858 ZKEYHCNOGBHRIG-PLNGDYQASA-N 410.228 -0.341 50 10 HBGE CO[C@@H]1COCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1251272842 MZSNHXXEVYJTDD-DZGCQCFKSA-N 414.484 -0.068 50 10 HBGE CC(=O)N[C@](C)(C(=O)NNC(=O)[C@@H]1COCCO1)c1ccc(S(C)(=O)=O)cc1 1294209192 SEDSUTGYOCWFAO-YOEHRIQHSA-N 413.452 -0.996 50 10 HBGE C[C@H](CC(=O)NNC(=O)CN1CCCC1=O)/N=C1/NS(=O)(=O)c2ccccc21 1302582845 MTMAMJOSNLUSDP-LLVKDONJSA-N 407.452 -0.727 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H](O)C1 2267207345 BSFYEXAXFBDOGA-SNVBAGLBSA-N 406.291 -0.970 50 10 HBGE CC(C)(C)OC(=O)NCCSSCCNC(=O)c1nccnc1B(O)O 2267873395 PGNXNZRDIJDAIR-UHFFFAOYSA-N 402.307 -0.208 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1cccc(B(O)O)c1)C(=O)OC(C)(C)C 2282088894 SZZVJYVEHWDQNT-CYBMUJFWSA-N 402.278 -0.785 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1S(=O)(=O)Cc1ncsc1B(O)O 2282380499 KCECOJWEKXZOQB-QWRGUYRKSA-N 419.334 -0.018 50 10 HBGE CN(Cc1cc(B(O)O)cs1)C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284058555 NTFNDKXWQNTGEQ-LBPRGKRZSA-N 402.253 -0.294 50 10 HBGE N#C/C(=C/NCCc1ccc(S(N)(=O)=O)cc1)C(=O)NCCN1CCOCC1 217260857 DBBGAZWMINPVJO-PEZBUJJGSA-N 407.496 -0.678 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1cccc(B(O)O)c1 704309370 HCWALKVUVMPSRC-UHFFFAOYSA-N 402.237 -0.528 50 10 HBGE C[C@H](Sc1ccccn1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766635399 CHINZGHGKOQVRL-JTQLQIEISA-N 417.451 -0.843 50 10 HBGE COCCN1C(=O)/C(=C/NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)C(=O)NC1=S 788340030 FJOFWQAJSADTJT-LTJDPMBBSA-N 418.475 -0.047 50 10 HBGE O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)[C@@H]1CCc2nncn2C1 816879665 SVYSBSDURRBYOA-ZUOKHONESA-N 423.433 -0.619 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)c1cnn(-c2ccccc2)c1 1479131992 LVSZJJNRPISVJK-LJQANCHMSA-N 414.422 -0.556 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccccc1S(=O)(=O)C(F)F 1610347671 NVFSPCLMUQQHLS-MRVPVSSYSA-N 413.424 -0.690 50 10 HBGE N#Cc1ccc(NCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nc1 1622153564 KJLKQWZEXNUSRB-UHFFFAOYSA-N 421.461 -0.029 50 10 HBGE COCCOCC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1 1631539892 ZBOOLLLEGNXFTE-UHFFFAOYSA-N 410.246 -0.480 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]2CS(=O)(=O)C[C@@H]21 1646087963 QGTJMCRUEGSXTD-CABCVRRESA-N 424.284 -0.775 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1 2267201873 UTPVNFIIDZADIS-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE Cc1ccnc(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2281889961 YTCWXKBJDNFILE-HOTGVXAUSA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)N1CCN(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)CC1 2282344271 KEQKQUYHYKOOHX-UHFFFAOYSA-N 403.241 -0.749 50 10 HBGE CC(C)(C)OC(=O)NC[C@](C)(NS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2282419089 MTAABOWOADKOAV-HNNXBMFYSA-N 419.334 -0.064 50 10 HBGE O=C(N[C@@H]1C(F)(F)C12CC(NC(=O)c1c[nH]nc1B(O)O)C2)OCc1ccccc1 2282482468 KHFJKKQIBVGYSJ-XNYLIXPXSA-N 420.181 -0.088 50 10 HBGE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2282708734 QMCDXAPLBLBQNQ-TUAOUCFPSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC12CC2 2282738878 AQIPPSBMNMHQFR-LLVKDONJSA-N 417.318 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2284046878 FJSDVTWASYLCTQ-AVGNSLFASA-N 400.624 -0.701 50 10 HBGE Cc1oc2ccccc2c1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 768278896 WXBVYSBPTQVGAF-UHFFFAOYSA-N 410.390 -0.050 50 10 HBGE CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816879424 OHGDXIBANIGNTR-CWTRNNRKSA-N 417.470 -0.121 50 10 HBGE CNC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1C 1115989293 XDDNKHLNUPZGTR-UHFFFAOYSA-N 421.483 -0.599 50 10 HBGE O=C(NNC(=O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F)[C@@H]1CCN1C1CCOCC1 1178420137 DPJRASYFXYCQCL-WOPDTQHZSA-N 413.418 -0.390 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 1611085726 FYIPYMXHKUSHDR-YPMHNXCESA-N 400.457 -0.768 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@H]2O)N(C)C1 1775962701 UHQYIIRIOVIPLI-XRNSUHBESA-N 410.964 -0.001 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272655826 SHIRCZDPWNNHQY-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE CC(C)C[C@@H](CNS(=O)(=O)c1nn(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282368036 KMVMZJMRDQIQQL-NSHDSACASA-N 404.298 -0.682 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C 2282373376 LSAXLTPAXGPYJO-ZDUSSCGKSA-N 402.278 -0.819 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282383973 GVIGNKMCUPSJLP-MNOVXSKESA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@](O)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282714654 VFFPWGBBHDZNCO-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)Cc1ccsc1B(O)O 2282865095 PKDCSOUBIAZRLC-LBPRGKRZSA-N 420.318 -0.517 50 10 HBGE COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)Cc2ccccn2)C1 755251231 VMUJDUMUWSKHKR-OAHLLOKOSA-N 413.500 -0.263 50 10 HBGE C[C@H](CO)NS(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 1141786352 DPFZRJKRJSBNAW-TZMCWYRMSA-N 419.525 -0.548 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@@]3(C)C(=O)NC(=O)[C@@]3(C)C2)cc1OC 1307994806 XDXOWAVPSXWYGS-KDURUIRLSA-N 404.423 -0.551 50 10 HBGE Cc1nn(-c2ccccn2)c(C)c1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1442182550 MFOLTCWEZRLSQY-CYBMUJFWSA-N 406.468 -0.056 50 10 HBGE O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1456039908 VDODENNZUMBAJD-HNNXBMFYSA-N 411.484 -0.849 50 10 HBGE Cc1nn(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(=O)n1C 1530003386 KMMWPVGNPMMXBI-UHFFFAOYSA-N 401.471 -0.750 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1 1542683725 AKARIOHCLVLGJI-GFCCVEGCSA-N 409.443 -0.292 50 10 HBGE O=C(CNC(=O)c1ccccc1I)NNC(=O)c1ncon1 1653025348 XPBJUCLCFOUKEL-UHFFFAOYSA-N 415.147 -0.135 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282077828 AJBAUGBFWGWZGO-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CON(CCCNS(=O)(=O)Cc1cccc(B(O)O)c1)C(=O)OC(C)(C)C 2282342511 IJOJAAKIRBGLMQ-UHFFFAOYSA-N 402.278 -0.026 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCCCN1C(=O)C(F)(F)F 2282366800 UAZHWDMIIVQZNM-VIFPVBQESA-N 414.236 -0.042 50 10 HBGE CN([C@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)Cc1ncsc1B(O)O 2282381219 SFXBPIRKWQEPEX-GFCCVEGCSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NS(=O)(=O)c2sccc2B(O)O)C1 2282708058 HPLRSXYNSDMVGC-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE N#CC(=Cc1cccc(Br)c1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 2329690430 XLHZEAYLLWABSI-WZYWGQKZSA-N 413.224 -0.728 50 10 HBGE Cn1cc(C[C@@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cn1 787096996 XOXOUGHUNLRMGT-OAHLLOKOSA-N 409.468 -0.512 50 10 HBGE CS(=O)(=O)Nc1ccc(N2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1 1556095982 NVVGGLFFBUGBAP-UHFFFAOYSA-N 403.269 -0.300 50 10 HBGE CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(B(O)O)cc1 1620921645 DTYYUQDPGZQDPI-HNNXBMFYSA-N 406.244 -0.009 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)NCCS(=O)(=O)N1CCCC1 1638675401 RBMMKDSLSUNPGS-UHFFFAOYSA-N 403.486 -0.766 50 10 HBGE CCCOc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)cc1OC 1686545353 UFDVDUBGKSYJFA-UHFFFAOYSA-N 417.488 -0.176 50 10 HBGE Cc1cc(B(O)O)sc1CNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 2039318907 JOVAXXJZLVEMNY-UHFFFAOYSA-N 422.293 -0.158 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267388644 BILWQDRPBNKIRM-SNVBAGLBSA-N 405.307 -0.501 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2267617227 HWUXKSVQWPBVFO-SECBINFHSA-N 408.669 -0.816 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)c1cccc(B(O)O)c1)C(=O)OC(C)(C)C 2282098865 ZCFRXCZQFVLOIJ-LBPRGKRZSA-N 402.278 -0.737 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNS(=O)(=O)c2cscc2B(O)O)C1 2282371022 DNTYLKFBDKKDAQ-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2ccc(F)cc2B(O)O)COC1 2282729706 QMTMOVWIUFZZHV-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2C[C@@H]21 2359273531 FHSQTSVJWAHHRX-UMNHJUIQSA-N 417.318 -0.360 50 10 HBGE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCc2scc(B(O)O)c2C1 2361640484 SGTGLQJCQARPHA-LBPRGKRZSA-N 400.262 -0.216 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@H]1COCCO1)S(=O)(=O)c1ccc(F)cc1 744641575 DGEWFTBMGSQRJR-CQSZACIVSA-N 403.432 -0.211 50 10 HBGE O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)[C@H]2COCCO2)cc1 755597887 CDZVJDLORRWPHK-OAHLLOKOSA-N 407.427 -0.475 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCCc3cccnc32)n(C)c1=O 768052936 DDTPGQNIOVQOAO-LBPRGKRZSA-N 411.422 -0.904 50 10 HBGE CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816885533 CAADYZKZZWSVAI-FWHMADFJSA-N 417.470 -0.121 50 10 HBGE O=C(COc1ccccc1Br)NNC(=O)c1cnn(C[C@H](O)CO)c1 1153524338 QYQDPVGRDYUCGF-NSHDSACASA-N 413.228 -0.161 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)C1=O 1178358799 OGHNMZDUYDDXLO-VXGBXAGGSA-N 412.443 -0.445 50 10 HBGE CN(NC(=O)c1ccc(B(O)O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1447343450 CIJATUXXJMPLLM-UHFFFAOYSA-N 406.248 -0.384 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc2n1CCOC2 1587968361 CUOPWHKQMGMVBK-UHFFFAOYSA-N 412.450 -0.368 50 10 HBGE CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1 1629346039 MGPNBKICOWWLOD-UHFFFAOYSA-N 416.264 -0.284 50 10 HBGE CO[C@@]1(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)CCS(=O)(=O)C1 1684253203 ZWSHGKGECFJUNG-QGZVFWFLSA-N 409.468 -0.350 50 10 HBGE CCN(C[C@@H](C)NC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267629093 SYQUPYRJPYAALT-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)C(=O)c1ncsc1B(O)O 2282231299 IZTMKSFFXCEBKH-UHFFFAOYSA-N 400.310 -0.259 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282364316 NXLSFCYBYAQWPX-QWHCGFSZSA-N 404.225 -0.924 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)C(F)(F)F)C2)sc1B(O)O 2282375398 OWDCKNUKIMPMDJ-VIFPVBQESA-N 414.236 -0.184 50 10 HBGE COC1(CCNC(=O)c2nccnc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2283053259 SKKSMODKDLOSHG-UHFFFAOYSA-N 414.227 -0.686 50 10 HBGE CN(C)C(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1C 774611249 LJBXUNSGGIYUTD-OAHLLOKOSA-N 408.436 -0.124 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN(CC(=O)OC(C)(C)C)C2=O)ccc1=O 1134637698 XPQMOUQQWXNRND-CYBMUJFWSA-N 406.439 -0.273 50 10 HBGE O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)[C@H]1CCC(=O)N1 1148922358 YUQZNFOJCIQDFX-LLVKDONJSA-N 418.269 -0.210 50 10 HBGE C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1558458049 ALZDQZNXTTZYOK-QGZVFWFLSA-N 420.491 -0.388 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(C)CCCS2(=O)=O)c1 1628315131 BEBLHBGSEMKRMW-HNNXBMFYSA-N 403.482 -0.335 50 10 HBGE CNC(=O)[C@@H](CNC(=O)NNC(=O)[C@@H]1COCCO1)Cc1ccc(OC)c(F)c1 1673913095 LKKQYJANMXMFRM-DOMZBBRYSA-N 412.418 -0.515 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(F)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2267393076 SJATUSDHGWPURX-UHFFFAOYSA-N 408.282 -0.026 50 10 HBGE CN(CCOCCNS(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267607588 PGTVUIPYMUTNCN-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1S(=O)(=O)c1c(B(O)O)cnn1C 2282706199 IXWFIENBOSDRHX-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2S[C@H](OC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1 263619651 ZTWOFLJTHFTWDO-XEANDCMQSA-N 410.964 -0.001 50 10 HBGE O=C(NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@H]1COCCO1 746000099 ZIWMCCQFDPWKNK-WCQYABFASA-N 401.803 -0.110 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NNC(=O)[C@H]1COCCO1 1445052249 QSXACELBSPKPRQ-LVEVGFFFSA-N 419.356 -0.465 50 10 HBGE O=C([C@@H]1CCc2nnnn2CC1)N1CCN(S(=O)(=O)CBr)CC1 1546251634 FZEDAVNIQCLRTN-SNVBAGLBSA-N 407.294 -0.548 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2ccnnc2)cc1S(=O)(=O)N1CCOCC1 1557068699 KZXGAIDXEFLRND-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE O=C(Cc1nc(C2CC2)n[nH]1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278475 FLVLKQVNMBVEDD-UHFFFAOYSA-N 411.466 -0.170 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1nc(B(O)O)ccc1Cl 2224184918 IIRKCWOTVWNIQE-UHFFFAOYSA-N 423.643 -0.157 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267209595 ZCGNGXYBKZOGTG-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1nc(C(=O)N[C@H]2COC[C@@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281655915 CWKCYVGBQVXJDK-IUCAKERBSA-N 402.644 -0.977 50 10 HBGE CCN([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2282364774 YBDBRRVVZJQBLR-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE C[C@H]1CC[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CN1C(=O)OC(C)(C)C 2282712309 OANIPRMKZGIWML-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282722358 FSAKZIZCLJITNK-RPHGYIDUSA-N 419.290 -0.785 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2359265620 DAVHHEXYLUWNSK-KKZNHRDASA-N 420.680 -0.848 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)n1C 2362570726 CPENVSWWSPXDRQ-JNVGHINZSA-N 402.282 -0.440 50 10 HBGE CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)CC1 731682354 WVPXTXIFIJZJJI-INIZCTEOSA-N 410.496 -0.171 50 10 HBGE O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1CCc2nncn2C1 816882535 HOKIEIXROBWVCB-GFCCVEGCSA-N 424.458 -0.114 50 10 HBGE Cc1ccc(SCC(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)cc1 1253793254 SAODJYYLRSYXCG-UHFFFAOYSA-N 401.514 -0.092 50 10 HBGE CNS(=O)(=O)c1ccccc1N1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1292670811 KUHSNRHIGYQYAJ-UHFFFAOYSA-N 403.269 -0.763 50 10 HBGE Cn1ncc(Br)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 1320892793 DUJLGAVQIZMLNE-UHFFFAOYSA-N 416.261 -0.783 50 10 HBGE CC1=NO[C@H](C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1445552547 QKNONCVWYHXNJB-INIZCTEOSA-N 423.495 -0.386 50 10 HBGE COc1cc(C(=O)CCC(=O)NNC(=O)CS(C)(=O)=O)cc(OC)c1OC 1454278767 SKRBEGCQGUWAOV-UHFFFAOYSA-N 402.425 -0.133 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)n(C)c1 1586340262 YFSDWSPVDPERST-UHFFFAOYSA-N 415.516 -0.021 50 10 HBGE CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CC(N)=O)C(=O)C2)N(C)c2ccccc21 1638842551 PMBSWZWEJSUZEM-UHFFFAOYSA-N 424.461 -0.187 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 1642598717 CDBQQUGDZSYXIC-SJORKVTESA-N 420.491 -0.013 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCCN(C(=O)OCc2ccccc2)C1 2267472607 SPJSRPZCMNTUHK-AWEZNQCLSA-N 422.272 -0.821 50 10 HBGE C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282078408 INDLYYITWCBNGX-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2CC[C@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282728625 UEFFPLYOZCLRPO-CHWSQXEVSA-N 400.262 -0.291 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccccn2)c1 739679361 VSPGSJOEHNMZPT-UHFFFAOYSA-N 405.436 -0.477 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)n(C)c1=O 802762878 OXTAYZMCFUKYHS-RKDXNWHRSA-N 416.360 -0.440 50 10 HBGE O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCc2nncn2C1 814284336 URUATYHYEPQSDE-INIZCTEOSA-N 412.498 -0.007 50 10 HBGE C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816873709 MZOALMALQIYTAR-CYBMUJFWSA-N 404.452 -0.234 50 10 HBGE CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NCCSS(C)(=O)=O)cc1 1152961023 WANJACBLFJUBAE-UHFFFAOYSA-N 408.523 -0.029 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1CN(C)CCN1C 1256464713 JRCRCQGCPFHXGS-GXTWGEPZSA-N 411.532 -0.442 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCO[C@@H]3C)CC2)cn1C 1526606294 VDAZROMLZVKLBX-BXUZGUMPSA-N 413.500 -0.298 50 10 HBGE Cc1ccccc1C[C@@H](C)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1545424163 OTCSZSDGMJLBCA-CYBMUJFWSA-N 412.450 -0.232 50 10 HBGE Cn1c(C#N)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1558898889 KKCBOGNYUXCLCC-UHFFFAOYSA-N 417.447 -0.008 50 10 HBGE O=C(NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1)c1cnn(-c2ccccc2)c1 1628884536 YILJAXNPMCLWHF-HNNXBMFYSA-N 412.381 -0.042 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)c2ccccc21 1687345067 JPOPAHYZJFSDGV-LJQANCHMSA-N 401.423 -0.250 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2CCON(C(=O)OC(C)(C)C)C2)sc1B(O)O 2267393127 TXXLUMOZMKFPDJ-JTQLQIEISA-N 406.291 -0.044 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282067293 YBYWUEHWAKKRKN-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE Cn1nc(C(=O)N[C@@H]2CSCCN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282287223 WJLDIHHROSBQDE-VIFPVBQESA-N 418.712 -0.164 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@H]2COC[C@@H]21 2282418177 GVMMVCPPUYOXLW-NWDGAFQWSA-N 418.302 -0.563 50 10 HBGE CN(C[C@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2282709603 YKTAHENEPCVLEK-NSHDSACASA-N 420.318 -0.316 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCC1CN(C(=O)OC(C)(C)C)C1 2282735083 VHVXGUUGPPSVLK-UHFFFAOYSA-N 400.262 -0.480 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)[C@@H]1COCCO1 744642855 HPLDIDZUFBDNLV-INIZCTEOSA-N 411.480 -0.034 50 10 HBGE O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)CN1CC(=O)NC1=O 766664592 RZGLQACAKAUQJJ-UHFFFAOYSA-N 422.873 -0.843 50 10 HBGE C[C@@H]1C(=O)CC[C@@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1(C)C 780925371 DEQRCRLULBNXHW-MNOVXSKESA-N 418.454 -0.778 50 10 HBGE O=C(CSCC(=O)N1CCOCC1)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1141421914 CENZGEVOEXORRO-HNNXBMFYSA-N 420.447 -0.823 50 10 HBGE Cn1ccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)n1 1161284666 LNGKVYYOPSDJPF-CYBMUJFWSA-N 415.497 -0.355 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)[C@H]1CCC(=O)N1 1454058514 FAYLOHSYJKHZBH-ZUOKHONESA-N 413.434 -0.199 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(N4CCOCC4)CC3)cc2)CC1 1545921789 HBHNWOMRUYFJJB-UHFFFAOYSA-N 423.539 -0.069 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cnn1-c1ccc(O)nn1 1558458543 JDCDNRWNGKWAES-CQSZACIVSA-N 401.427 -0.309 50 10 HBGE O=C(NNC(=O)c1ccc(I)cn1)N[C@@H]1CCS(=O)(=O)C1 1583280577 CJZXAUMQFCCPTL-MRVPVSSYSA-N 424.220 -0.183 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1 1647997224 PSLPSQIHBXEICJ-UHFFFAOYSA-N 409.511 -0.733 50 10 HBGE CC(=O)NS(=O)(=O)c1ccc(NC(=O)Nc2ncccc2OCC(=O)NN)cc1 1858836354 SFUFEHDHRNWSPY-UHFFFAOYSA-N 422.423 -0.081 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3cscc3B(O)O)C[C@H]2C1 2267387107 DMPAICDSWDNXKQ-UMNHJUIQSA-N 402.303 -0.038 50 10 HBGE CO[C@@H]1C[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)N(C(=O)OC(C)(C)C)C1 2282084164 TYENXYPPDMRSHI-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE Cc1nc(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)CCC2)c(B(O)O)n1C 2282338865 QHJPIHDXZHPMCU-UHFFFAOYSA-N 402.282 -0.866 50 10 HBGE COCCN(CCNS(=O)(=O)c1cc(C)c(B(O)O)s1)C(=O)OC(C)(C)C 2282354262 OCVHWOYTYFLUIE-UHFFFAOYSA-N 422.334 -0.102 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C)ccc1B(O)O 2282356958 CNLNXIDVJBOXAV-MRXNPFEDSA-N 402.278 -0.771 50 10 HBGE Cc1cc(S(=O)(=O)NCCOCCNC(=O)OC(C)(C)C)ccc1B(O)O 2282729795 RXOBIWUUKJIEED-UHFFFAOYSA-N 402.278 -0.506 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N2CC3(CC(NC(=O)OCc4ccccc4)C3)C2)n1C 2362574179 ITJGRXHKGDXZFH-UHFFFAOYSA-N 412.255 -0.061 50 10 HBGE CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)n1 746004422 WMNAYOGUOIAPSM-STQMWFEESA-N 412.447 -0.559 50 10 HBGE CCNC(=O)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 760864330 KAWFYGCUQHBMTD-CQSZACIVSA-N 404.475 -0.173 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](S(=O)(=O)N(C)C)C2)n1 796130180 VFQINHIYAYZSEV-LBPRGKRZSA-N 403.530 -0.503 50 10 HBGE O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@H]1CCc2nncn2C1 816884112 RHRZJHDOCVDRRJ-KLQCNHIUSA-N 418.479 -0.032 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cn2nc(Br)c(Br)n2)nn1 1470083673 MRPHKQNXVWTWKN-UHFFFAOYSA-N 408.014 -0.607 50 10 HBGE O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@@H]1CCC(=O)N1 1623367679 AJGCFOYRGPYCCF-LBPRGKRZSA-N 422.239 -0.025 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC(C)(C)CC(F)F)n(C)c1=O 1629792821 HPGDOHCCHCUIPM-UHFFFAOYSA-N 400.386 -0.347 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cccc3c2CCCC3)n(C)c1=O 1630996417 GOMMINABIFHNMG-UHFFFAOYSA-N 410.434 -0.226 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2CN(S(=O)(=O)c3cc(B(O)O)cs3)C2)C1 2267204497 FQSLDQSEOJUOEQ-UHFFFAOYSA-N 402.303 -0.085 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2282064685 DEOHGUUMNPPQRU-NSHDSACASA-N 402.282 -0.975 50 10 HBGE O=C(O)[C@H](COCc1ccccc1)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2284394804 CLIREPXPSHKWNT-AWEZNQCLSA-N 413.644 -0.032 50 10 HBGE Cc1nc(B(O)O)c(C(=O)NC2CC3(C2)C[C@H]3NC(=O)OCc2ccccc2)n1C 2362562652 SAPYUGSZGXNSBF-RDYUPDBUSA-N 412.255 -0.014 50 10 HBGE O=C(CCc1ccco1)NNC(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1 748333027 GOKIPSJKRODOTH-UHFFFAOYSA-N 415.472 -0.852 50 10 HBGE CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)O1 793037942 MWAJRVVKJDKFNE-GJZGRUSLSA-N 421.454 -0.121 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc[nH]n3)CC2)cc1OC 1460328560 JPYYNJOHIKFRPG-UHFFFAOYSA-N 403.443 -0.599 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)N1 1469609567 FWYKGNAMBZKXDY-JYJNAYRXSA-N 414.466 -0.806 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2nc[nH]c3ncnc2-3)c(I)n1 1634216631 PUJPSZMWSYNCMU-UHFFFAOYSA-N 412.151 -0.283 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 1635877714 HZUDCOTUDBKLKV-UKRRQHHQSA-N 406.414 -0.900 50 10 HBGE COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)CN2CCCC2=O)cc1OC 1642897107 KSZHUESDUILGRK-UHFFFAOYSA-N 413.452 -0.363 50 10 HBGE C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1676186117 CGSFOUZPCOVILC-WBVHZDCISA-N 423.539 -0.038 50 10 HBGE Cn1cc(S(=O)(=O)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(CCl)n1 2123408382 KYNFNLQKWLYAQC-UHFFFAOYSA-N 407.880 -0.088 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1cc(B(O)O)cs1 2267205191 OYPMIGSGGAFBBL-CBAPKCEASA-N 400.209 -0.352 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267427550 UIUWJVWDJFLGKS-LJQANCHMSA-N 400.244 -0.061 50 10 HBGE Cc1c(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)nn1C 2281841162 FVUKGPKFRFFGHV-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282083168 NBFSINPZXRIYID-MNOVXSKESA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1c(Cl)cccc1B(O)O 2282359725 RYMZLLLLKKJOEF-UHFFFAOYSA-N 422.696 -0.473 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2ccccc2B(O)O)C1 2282719219 IVRMPOQJQVWRTA-QYOLQKOISA-N 418.302 -0.180 50 10 HBGE CC(C)(C)OC(=O)NOCCCNS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282735269 YIQZNSPMJXMJDH-UHFFFAOYSA-N 410.204 -0.231 50 10 HBGE CS(=O)(=O)N1CCN(CC(=O)NNC(=O)CN2CCCc3ccccc32)CC1 759689410 MSPVRBOLEQIQOS-UHFFFAOYSA-N 409.512 -0.836 50 10 HBGE O=C(CNC(=O)N1CCCC1)NNc1ccccc1S(=O)(=O)N1CCOCC1 1444718547 QDJDRGFDHYENPY-UHFFFAOYSA-N 411.484 -0.044 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCC(=O)N(c3cnn(C)c3)C2)C[C@@H](C)O1 1457496806 JLRISBXLVTVIGS-KFWWJZLASA-N 406.487 -0.190 50 10 HBGE COCCOCCN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 1460335796 RSCZGCNEHWBFKJ-UHFFFAOYSA-N 409.443 -0.364 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2c(I)cnn2C)nn1 1471164311 VMFAQJVSGGTOIU-UHFFFAOYSA-N 404.172 -0.703 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)NC[C@@H](NS(=O)(=O)N(C)C)C1CCCC1 1478899147 BDIIXZPKTAJKLA-FPMFFAJLSA-N 405.521 -0.303 50 10 HBGE Cc1cc(N2CCC[C@H](N3CCN(CC(=O)NNC(=O)C(C)C)CC3)C2=O)n(C)n1 1642688906 DSPIRTKOBXRQOD-INIZCTEOSA-N 419.530 -0.355 50 10 HBGE Cn1nnc(Br)c1C(=O)N[C@H]1CS(=O)(=O)C[C@@H]1Br 2057676307 XQMSSMHNNINMAR-WHFBIAKZSA-N 402.068 -0.132 50 10 HBGE O=C(OCc1ccccc1)N1CCN(S(=O)(=O)c2cncc(B(O)O)c2)CC1 2255672043 AEMQEZTWDRLYIU-UHFFFAOYSA-N 405.241 -0.596 50 10 HBGE CC(C)(C)OC(=O)NCC1(CNS(=O)(=O)c2sccc2B(O)O)COC1 2267609059 KVNXMVJOZFYTAP-UHFFFAOYSA-N 406.291 -0.753 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282342357 GKUSBWMTDWDTCZ-MGPLVRAMSA-N 400.237 -0.207 50 10 HBGE CCc1nc(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c(B(O)O)s1 2282446916 PTULNITYLJYMQF-UHFFFAOYSA-N 401.294 -0.001 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2cc(B(O)O)cs2)CCOCC1 2282512202 RKMCPHOABAFWPF-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2ccccc2B(O)O)C1 2282717074 CUQDKKAQCFDVFW-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2sccc2B(O)O)CCOCC1 2282724054 UYURUDSTCQLJPD-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE CC[C@@H]1[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282737883 MPXGYKNQCJQBOH-NWDGAFQWSA-N 402.282 -0.834 50 10 HBGE C[C@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286860826 LRHISOZKNANIQF-JQWIXIFHSA-N 402.282 -0.834 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 744644159 GFLOFDCYMPKWQJ-IUODEOHRSA-N 403.391 -0.362 50 10 HBGE O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)[C@@H]1COCCO1 746001924 IOPOKJGXMTUEAI-KRWDZBQOSA-N 417.466 -0.651 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1OC 789378131 DVXYFFKOYWPLNG-GOSISDBHSA-N 405.411 -0.861 50 10 HBGE O=C(CNC(=O)OCc1ccccc1)NNC(=O)CSCC(=O)N1CCOCC1 794060844 PORDFPGJAZDCAG-UHFFFAOYSA-N 424.479 -0.348 50 10 HBGE CS(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 1334937595 UCGDNLONHGRGGV-YPMHNXCESA-N 415.493 -0.431 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCO[C@H]2C)cc1 1437079423 UZWZJGCDSJGFAC-XHDPSFHLSA-N 412.468 -0.162 50 10 HBGE O=C(Cn1nc(C(F)(F)F)c2c1CCC2)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1464443137 JYDMHSPEQOOIDJ-MRVPVSSYSA-N 409.390 -0.092 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2cnnn2C2CN(C(=O)OC(C)(C)C)C2)CC1 1556361810 IVTNTDXSNAAWPY-UHFFFAOYSA-N 408.463 -0.328 50 10 HBGE CCN1C(=O)C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]1c1cccnc1 1597426056 MNBNPYWXZDXTNK-VNHYZAJKSA-N 409.468 -0.491 50 10 HBGE C[C@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1nscc1B(O)O 2013656318 RCFTYULMWMNTMI-VIFPVBQESA-N 409.254 -0.901 50 10 HBGE CN1C[C@@H](Br)[C@H](NS(=O)(=O)c2c(Br)nnn2C)C1 2029861594 BYFBKHDHLYNAJI-PHDIDXHHSA-N 403.100 -0.067 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@H](O)C1 2267206073 ZYQLAOMRDCQTGL-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282069083 LJOGARABXFIVGQ-GFCCVEGCSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282074208 KBWSGKOQKJSNAU-SQNXGDPESA-N 418.302 -0.613 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(NS(=O)(=O)c3ccc(F)c(B(O)O)c3)[C@@H]2C1 2282341059 NCBOCOFZDAGLHW-GHMZBOCLSA-N 400.237 -0.351 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282722355 FSAKZIZCLJITNK-KPHLJTLVSA-N 419.290 -0.785 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1CNS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282732759 LBVWFWCYAYEASJ-PELKAZGASA-N 406.216 -0.164 50 10 HBGE CCON(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282741115 JULYXXIAGJJRJN-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)nc1I 761166045 KMCFLTMTTJEZSJ-VIFPVBQESA-N 407.164 -0.129 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCc2ccccc2F)n(C)c1=O 765726494 CBFPNTIVWAIXOS-UHFFFAOYSA-N 402.386 -0.647 50 10 HBGE Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1528896895 BWHKZNWYTQPSOR-UHFFFAOYSA-N 410.438 -0.272 50 10 HBGE CC1=CC(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)=S=C1 1642312205 HBUGAMHDYNJHRV-UHFFFAOYSA-N 422.488 -0.764 50 10 HBGE CN(CCCC(=O)NNC(=O)CN1CCCC1=O)C1=NS(=O)(=O)c2ccccc21 1648934729 HPFAGXRYRPJJEN-UHFFFAOYSA-N 421.479 -0.383 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)CC1=O 1652302521 ZHHPTBOOEKQKLP-CGTJXYLNSA-N 421.542 -0.280 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1 1683138226 OKSCSTQXEMDHMI-UHFFFAOYSA-N 404.880 -0.156 50 10 HBGE C[C@H]1CN(C(=O)c2cn(C)c(B(O)O)n2)C[C@@H](C)N1C(=O)OCc1ccccc1 2266891349 GNHGXOKLPBOBKU-OKILXGFUSA-N 400.244 -0.029 50 10 HBGE O=C(NC[C@@H](NC(=O)c1ncncc1B(O)O)C(F)(F)F)OCc1ccccc1 2267297664 VXXFCTPKSDXOID-GFCCVEGCSA-N 412.133 -0.257 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282081106 AHFWFPLRSNDDEP-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282709026 UUIQTDCAYQTGOY-STQMWFEESA-N 416.330 -0.004 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](NC(=O)C(F)(F)F)[C@H]1C 2282723259 PGBSAONMJJIOHJ-APPZFPTMSA-N 414.236 -0.044 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1B(O)O 2282730332 ADRKHXDMBZHKFJ-XYPYZODXSA-N 400.262 -0.291 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N[C@@H]1CCON(C(=O)OC(C)(C)C)C1 2282731426 QIRNLBZZUFTPQY-CYBMUJFWSA-N 400.262 -0.106 50 10 HBGE Cc1ccc(B(O)O)cc1NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360548246 AWKOMDOTZJUICX-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE Cc1cc(S(=O)(=O)NCCOC2CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2362310112 YHAVWQHLJSOLDY-UHFFFAOYSA-N 420.318 -0.349 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1cccc(B(O)O)c1 2369652142 JCMXHCJLPRXMPX-UONOGXRCSA-N 402.253 -0.056 50 10 HBGE O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@@H]1COCCO1 810461920 INXRAYUNFRCGMG-JTQLQIEISA-N 412.251 -0.166 50 10 HBGE O=C(CN1CCN(Cc2ccccc2)CC1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885366 LEQFQLVVDMMYBI-INIZCTEOSA-N 409.512 -0.678 50 10 HBGE CC1=NO[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 1538972341 NLWVIEJLQIODSQ-INIZCTEOSA-N 424.479 -0.048 50 10 HBGE Cn1nnc(Br)c1C(=O)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1569618143 VGMKSZVMRAPWAS-QMMMGPOBSA-N 407.184 -0.210 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](Oc1ncc(Br)cc1B(O)O)C(N)=O 2217174710 XRPRAACQSDBASV-SECBINFHSA-N 404.026 -0.719 50 10 HBGE COC(=O)[C@@H]1C[C@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231654091 APIOVTYZFCDBCX-GJZGRUSLSA-N 401.184 -0.512 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)Cc1ncsc1B(O)O 2267627467 ZIKPRQOCPDDGSX-VHSXEESVSA-N 403.291 -0.654 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 2282066013 PTUNGTCWWMUGIA-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)COC1 2282365277 WWMCIZBHBSWPKT-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE O=C(N1CCC[C@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1)C(F)(F)F 2282380967 QBZFOBHLKHSFCA-MRVPVSSYSA-N 415.224 -0.957 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282508577 YCPRYRQKILROEL-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)N[C@H]1CCN(CCN2CCOCC2)C1 734685484 FJENIQGUDIIBKA-FUHWJXTLSA-N 403.483 -0.273 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H](c2ccccc2)C2CC2)n(C)c1=O 765865859 CPCHKNGIJHCSAH-OAHLLOKOSA-N 410.434 -0.225 50 10 HBGE O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)NNC(=O)[C@@H]1COCCO1 776056985 RGRNQTLYTKXEEW-ULQDDVLXSA-N 417.466 -0.669 50 10 HBGE CCn1nc(C(=O)NNC(=O)CS(=O)(=O)NC(C)(C)C)c2ccccc2c1=O 919692630 VAUUCWIHSZUCOG-UHFFFAOYSA-N 409.468 -0.105 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2CCCC2=O)c(CN2C(=O)c3ccccc3C2=O)n1 1171828548 MWAUPIHQXNWZET-UHFFFAOYSA-N 424.417 -0.400 50 10 HBGE CN(C)S(=O)(=O)n1ccnc1C=NNC(=O)c1nn(C)c(=O)c2ccccc12 1327803025 WDDPGKIZPLJPHV-UHFFFAOYSA-N 403.424 -0.452 50 10 HBGE NC(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)nn1-c1ccccc1 1558458451 GTNRDKHJPBQEPD-INIZCTEOSA-N 412.450 -0.015 50 10 HBGE COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cn(C)nn3)C2=O)c(OC)c1 1686407843 MEKQUYZPLHTWHW-ZDUSSCGKSA-N 417.426 -0.423 50 10 HBGE NNC(=O)CCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 1857792098 ZMYVXDGSDGZSGP-XEZPLFJOSA-N 417.532 -0.758 50 10 HBGE CN(Cc1sccc1B(O)O)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 2039340911 FDYLXSKVLPMHFH-UHFFFAOYSA-N 422.293 -0.124 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267368197 FOSAPGXUKVCRMX-ZJUUUORDSA-N 405.307 -0.502 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3sccc3B(O)O)C[C@H]2C1 2267611888 WQQXCIDJFZNJKE-UMNHJUIQSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267625784 VXNPLCMDBMCUCH-AOOOYVTPSA-N 403.291 -0.654 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1ccc(B(O)O)cc1)C(=O)OC(C)(C)C 2282084702 QXVHHFRGLUSROW-CYBMUJFWSA-N 402.278 -0.785 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1 2282256136 ZLJPHTDDJQKGMP-IRXDYDNUSA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)Cc1cccc(B(O)O)c1 2282347490 YTYHXGJKNSPFHX-SANMLTNESA-N 420.318 -0.181 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](NC(=O)C(F)(F)F)[C@@H](C)C1 2282383694 CJRJIFNDVQBQCS-IONNQARKSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NC(=O)c2cc(B(O)O)n[nH]2)C(C)(C)C1 2282390617 NOGJGUKWPJSXEY-HHHXNRCGSA-N 400.266 -0.273 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714773 WQZVPVCJECVESW-KBPBESRZSA-N 416.330 -0.004 50 10 HBGE O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=O)[C@H]1COCCO1 744650506 LQVBPXCIZOOJNT-GFCCVEGCSA-N 414.212 -0.263 50 10 HBGE Cc1nnc(CN(C)CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1C 747336747 JMCSUJGLWSHHFM-UHFFFAOYSA-N 408.488 -0.690 50 10 HBGE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 750661646 GJEWTDFZBWAEHT-KYOSRNDESA-N 423.495 -0.110 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CN3CCCC3)CC2)cc1 1465789843 AIRHXWRYSXWIIL-UHFFFAOYSA-N 423.539 -0.455 50 10 HBGE Cc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnn1-c1ccc(F)c(F)c1 1631028624 ARYXGJPULLKACZ-SECBINFHSA-N 414.394 -0.015 50 10 HBGE C[C@@H]1[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CCN1C 1676207197 RLUJDGBULOTNDO-HIFRSBDPSA-N 411.532 -0.264 50 10 HBGE CCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@H](C)OCCOC)c1 1683042640 VLSXKHSYSYMHNU-LBPRGKRZSA-N 402.473 -0.133 50 10 HBGE CN(CC(C)(C)CNC(=O)OC(C)(C)C)S(=O)(=O)c1c(B(O)O)cnn1C 2282079693 ZKNBSLXCBBBGES-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CCn1cc(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)nc1B(O)O 2282228867 DVTAOBIYUYFGRZ-ZBFHGGJFSA-N 416.243 -0.604 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2ccccc2B(O)O)CCOC1 2282420694 CXEPEIVPLPFLNY-MRXNPFEDSA-N 400.262 -0.672 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2282699707 LTDSEGNPZWJSOO-FYBVGQRMSA-N 414.236 -0.106 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714775 WQZVPVCJECVESW-UONOGXRCSA-N 416.330 -0.004 50 10 HBGE COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1C 65208674 SPGBMFFFFIMRLL-UHFFFAOYSA-N 414.484 -0.004 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 746022352 BIUZATIFJJWHLQ-HIFRSBDPSA-N 413.452 -0.680 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(O)nc3)CC2)c1 766245871 HCNQNZVENLISCH-UHFFFAOYSA-N 408.418 -0.122 50 10 HBGE Cc1ccc(OCC(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1C 1463680308 GRJCHQXHDSUMBD-UHFFFAOYSA-N 407.452 -0.026 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)ccc1=O 1472185906 DDJFOXHOECETNT-UHFFFAOYSA-N 412.450 -0.330 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCO[C@H]3C)CC2)cn1C 1526606321 VDAZROMLZVKLBX-SMDDNHRTSA-N 413.500 -0.298 50 10 HBGE C[C@@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1565676300 DAKQFOAHBJNUQW-CZUORRHYSA-N 418.498 -0.104 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1sncc1B(O)O 2255784399 DOYIBVOFEBGGPG-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201896 VEAYZOXBJZGUMM-IONNQARKSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2267366647 IXYHAGZAFHEWML-ABAIWWIYSA-N 402.303 -0.143 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2Cl)CO1 2267386757 YTFXQDNKTOUNPC-JTQLQIEISA-N 406.653 -0.151 50 10 HBGE CCN(C[C@H](C)NC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267393117 SYQUPYRJPYAALT-JTQLQIEISA-N 407.323 -0.112 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C 2282366841 UOEPZPVIYPYYNH-NSHDSACASA-N 422.334 -0.415 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282422340 ZWHMXWCOEUHJAD-SFYZADRCSA-N 415.224 -0.816 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCC1(NC(=O)OC(C)(C)C)CC1 2282707395 YHNKLYIZLHRZSN-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE CC(C)(C)OC(=O)NCC1(CCNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2282735030 UMZWXHRCCVGSIB-UHFFFAOYSA-N 419.334 -0.063 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2COCCO2)cc1S(=O)(=O)NC(C)C 744646980 INDBLETWONGXBT-CYBMUJFWSA-N 401.441 -0.442 50 10 HBGE COCCn1cc(N2C[C@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cn1 1124467495 BVGBYDIOUTXOTA-ZIAGYGMSSA-N 413.500 -0.625 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)n(C)c2)C1 1530230945 QIWGTSVIUOSXSC-WCQYABFASA-N 411.484 -0.515 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)O1 1629942680 UBTDTGAUEOVQBB-KGLIPLIRSA-N 413.452 -0.129 50 10 HBGE O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)CN1CCCC1=O 1632321224 RXSFJXCZPRBMRL-UHFFFAOYSA-N 401.467 -0.115 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)Cc1cccnc1)C1CCCC1 1686923141 XSSANWWPLFDTSE-OAHLLOKOSA-N 412.516 -0.091 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)OCCN2S(=O)(=O)c1ccc(B(O)O)s1 2282075075 QKXFZILUMPQJMG-WDEREUQCSA-N 418.302 -0.563 50 10 HBGE COC1(CNS(=O)(=O)c2cc(B(O)O)sc2C)CN(C(=O)OC(C)(C)C)C1 2282726090 MMKBXQBEDJYJAZ-UHFFFAOYSA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN2S(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282729484 NRKBOKZYCWPSAL-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2282741878 UIFYYFMGUNHNBP-VWYCJHECSA-N 417.318 -0.360 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)Nc1cc(B(O)O)ccc1Cl 2284050518 ZXZPCKSZZVWNAH-XQQFMLRXSA-N 400.624 -0.701 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)[C@H]1COCCO1 775283276 SGIRRAGMFSIAMS-GFCCVEGCSA-N 419.481 -0.804 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cn1 1303284058 MPQPAMWKINLYFZ-YSXVBLCFSA-N 419.463 -0.041 50 10 HBGE O=C(NNC(=O)[C@H]1CCN1C1CCOCC1)c1cccc(CN2C(=O)CNC2=O)c1 1596923957 YVYIMMZJKNFSOO-MRXNPFEDSA-N 415.450 -0.247 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)s1 2267212861 YSNSQQKMKPAEEY-UHFFFAOYSA-N 406.291 -0.011 50 10 HBGE O=C(N[C@H]1CC[C@H]1NC(=O)c1cc(B(O)O)c(O)cc1O)OCc1ccccc1 2267811283 XWLDAPHLFBHHAC-CABCVRRESA-N 400.196 -0.035 50 10 HBGE O=S(=O)(NCC[C@H]1CN(Cc2ccccc2)CCO1)c1sccc1B(O)O 2282082002 XKIQEBDJQPHYNW-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2282471870 PXNWKXKMPOGRLG-RPIAUOFESA-N 400.266 -0.369 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CCC1 2282714003 LYSKQQKKWPDSPW-LBPRGKRZSA-N 402.282 -0.928 50 10 HBGE CN([C@@]1(CNC(=O)OC(C)(C)C)CCOC1)S(=O)(=O)c1cscc1B(O)O 2282736061 KHZUYPAYGUMENJ-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE COc1ccccc1/C=C\C(=O)NCC(=O)NNC1=c2cc([N+](=O)[O-])ccc2=NC1=O 38162046 GSOGMBDNJNEHEQ-TWGQIWQCSA-N 423.385 -0.678 50 10 HBGE O=c1ccn([C@H]2C[C@H](O)[C@@H](CO[P@@](=O)(O)I)O2)c(=O)[nH]1 199457482 SNIAXZMEPYJJJJ-SHYZEUOFSA-N 418.080 -0.263 50 10 HBGE O=C(NCCCNS(=O)(=O)c1ccccc1Cl)NNC(=O)[C@@H]1COCCO1 798493223 OGDHAQQMUKWWEJ-LBPRGKRZSA-N 420.875 -0.246 50 10 HBGE Cn1c(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc2c(=O)n3ccccc3nc21 816874383 BIKJGVDHECQBIK-LLVKDONJSA-N 406.406 -0.199 50 10 HBGE Cn1cc([C@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1307739890 FKPZVVGBHFBGES-WVDZOPJMSA-N 400.464 -0.142 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CCOCC3)CC2)cn1C 1438826595 VIRCIIFEJCGRLK-UHFFFAOYSA-N 413.500 -0.297 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2 1639948275 UQVCFTULABLAPV-UXIGCNINSA-N 412.468 -0.626 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267206875 MIINWLLISAISNX-VWLOTQADSA-N 424.331 -0.166 50 10 HBGE Cn1nc(C(=O)N[C@@H]2COCC[C@H]2NC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281654796 MFYUSIOHWQHUPX-RKDXNWHRSA-N 402.644 -0.835 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC1(C)CC(NC(=O)OC(C)(C)C)C1 2282079694 ZKRCSFIANYYVER-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(F)C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282376430 DNJFNEDLLZHJFS-KMHCFJFGSA-N 423.297 -0.362 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)C[C@H](C)N1C(=O)OC(C)(C)C 2282700065 NZSAECJFKMYDIZ-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1csnc1B(O)O)C(=O)O 2289799952 FXGCKBSPQWFKFI-JTQLQIEISA-N 401.250 -0.299 50 10 HBGE C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1 816874557 FRESFLJPDBTYOS-ZDUSSCGKSA-N 402.436 -0.787 50 10 HBGE COC(=O)c1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)no1 1294588091 YXJVFMDAXFPNSH-UHFFFAOYSA-N 415.406 -0.320 50 10 HBGE Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)CN1CCCC1=O 1471222425 QKTCEGYENCKMPR-UHFFFAOYSA-N 405.455 -0.627 50 10 HBGE Cn1c(CC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)nc2ccccc21 1565222435 AFYXYIFKTARMBN-IBGZPJMESA-N 416.438 -0.926 50 10 HBGE O=C1CC[C@@]2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)SCCN12 1566973690 LGSJICGTFLTARI-LBPRGKRZSA-N 412.331 -0.122 50 10 HBGE CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)ccc21 1638870642 DWAWUYPMNILWHR-INIZCTEOSA-N 415.450 -0.276 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267207726 TZIOTRBVJBIJSM-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CS(=O)(=O)CCN2C(=O)[C@H]1C[C@@H](B(O)O)C1 2281851919 VEZOWWUKPFEIBQ-TXEJJXNPSA-N 402.278 -0.514 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2281912076 FXVWPAOSUMGBJK-HNNXBMFYSA-N 416.243 -0.650 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@](CO)(NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282077545 XDWJWIZIXSYLSH-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282327975 QJKDXHAKOMLMBU-HNNXBMFYSA-N 420.318 -0.781 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CCN(S(=O)(=O)c2cscc2B(O)O)CC1 2282366940 VRVAIPAALVHNCN-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NS(=O)(=O)c2ccc(B(O)O)cc2F)C1 2282366957 VUJOYRSZWZUGJL-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cscc1B(O)O 2282421800 SSFYLPMIMIXFEP-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)COC2)ccc1B(O)O 2282725016 UYQYRNYMNYBSLK-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N[C@@H]1CCC=C1B(O)O 2283961454 DNQDAOCNKKMXBB-WCQYABFASA-N 402.278 -0.372 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c(Br)c1 745978583 NDEOLOPPDNVJCK-JTQLQIEISA-N 423.241 -0.039 50 10 HBGE COc1cccc(F)c1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766641946 DMKBVORDNQPHTB-UHFFFAOYSA-N 404.358 -0.957 50 10 HBGE CN(CC(=O)NNC(=O)c1cc(Br)cn1C)[C@@H]1CCS(=O)(=O)C1 914531818 GENMSKRIAOGXGW-SNVBAGLBSA-N 407.290 -0.333 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)COB2O 1290021121 HQTNEYZCDHKIKT-UHFFFAOYSA-N 408.267 -0.122 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1nc2ncc(CCO)cn2n1 1539437386 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Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)n1 2362079468 DNAUZACQDPAMLJ-LLVKDONJSA-N 404.298 -0.682 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@@H]1COCCO1 744640849 DUELRGNWWJNHAT-INIZCTEOSA-N 411.480 -0.034 50 10 HBGE CCNC(=O)N1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 761780234 MDCZXXHAFQATMT-NSHDSACASA-N 401.427 -0.319 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(F)c1 1182609350 LFINHWKAYDWQRO-DUFXMDAXSA-N 400.432 -0.570 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)c1cnn(C)c1)C1CCCC1 1312942267 KIEXRQKVADUQOI-ZDUSSCGKSA-N 401.493 -0.681 50 10 HBGE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1 1595527280 SGRPWPIPJHGHSX-CQSZACIVSA-N 417.509 -0.043 50 10 HBGE O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCCCO3)cc2)CCN1 1637663370 RASIIHQITQTJHS-CQSZACIVSA-N 410.452 -0.863 50 10 HBGE CC(=O)NCC(=O)N1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1 1644102257 MAZKUERIAGGJIK-UHFFFAOYSA-N 409.874 -0.229 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)C1(S(C)(=O)=O)CCOCC1 1645021913 RJRJRMSHWXMDCN-NSHDSACASA-N 405.473 -0.263 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)NNC(=O)c3cnn(C)c3)C2)cc1 1682173563 GUSVZECXTYYKMI-UHFFFAOYSA-N 408.440 -0.554 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2267210030 DSDTXZGHLGYYOO-JTQLQIEISA-N 408.307 -0.364 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)c2cscc2B(O)O)C1 2267619352 QNIFVSVIBXXUHU-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE Cn1ncc(C(=O)N=S2(=O)CCC(NC(=O)OC(C)(C)C)CC2)c1B(O)O 2281599603 VJINQXCDMJJHEO-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE Cn1nc(C(=O)N2C[C@@H](F)C[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281660311 ODDXPYMEAKNWHE-IUCAKERBSA-N 404.635 -0.169 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C[C@@H](F)C1 2282102370 JDLPQDRAQJIOIR-NEPJUHHUSA-N 402.253 -0.008 50 10 HBGE CCn1cc(C(=O)N=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C)nc1B(O)O 2282228300 AQJAJYZKKWYYBT-HHHXNRCGSA-N 402.282 -0.312 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@@H]1COCCN1Cc1ccccc1 2282341671 WDQLRNHBSYDOPF-MRXNPFEDSA-N 410.326 -0.252 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282356199 RAXVSNJTCDGXQB-MNOVXSKESA-N 402.253 -0.055 50 10 HBGE O=S(=O)(NCC[C@H]1CN(Cc2ccccc2)CCO1)c1cscc1B(O)O 2282358258 WQIUYWFTHQJPIF-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282505345 BYPINEPZCYSQCQ-MNOVXSKESA-N 402.282 -0.882 50 10 HBGE COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@H]2COCCO2)C1=O 771265189 NPQPUEPCCCDRMI-ACJLOTCBSA-N 406.395 -0.975 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 1301698079 VMDHYDKMHAOBDF-LBPRGKRZSA-N 403.482 -0.721 50 10 HBGE COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@H]3CCC(=O)N3)C2=O)c(OC)c1 1312666635 VLYVQKPUVZXEER-ZIAGYGMSSA-N 419.438 -0.586 50 10 HBGE COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)c1 1472185499 GTLYHFVYTUUYGE-UHFFFAOYSA-N 408.436 -0.615 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1546175456 QHMABZYADQQYSD-SFYZADRCSA-N 403.379 -0.118 50 10 HBGE Cn1nc(C(=O)NNC(=O)CN2CCCC3(CC3)S2(=O)=O)c2ccccc2c1=O 1624039377 ZXFDTFYWLFZOST-UHFFFAOYSA-N 419.463 -0.347 50 10 HBGE COC(=O)[C@H]1CC[C@@H](C(=O)OC)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1 1659462709 UUSFHPNKHHTEON-GJZGRUSLSA-N 402.407 -0.254 50 10 HBGE O=C(NCC1CN(S(=O)(=O)c2cc(Cl)c(B(O)O)s2)C1)C(F)(F)F 2255756328 CZNKUZAWNQSPBT-UHFFFAOYSA-N 406.600 -0.620 50 10 HBGE Cc1c(C(=O)N[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2267016849 JADKXNNUZUBKJT-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267209908 CHPVYVNQGNBJTR-ZJUUUORDSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267390919 KYRMUWPIJZFIJX-OTYXRUKQSA-N 403.291 -0.748 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1NC(=O)C(F)(F)F 2267608871 YYFWDBKGGJPPLU-IONNQARKSA-N 400.209 -0.495 50 10 HBGE O=C(N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1cc(Cl)c(B(O)O)s1)C(F)(F)F 2267624395 YARRCQVJOQZRNA-NTSWFWBYSA-N 418.611 -0.383 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282076433 IBTMOZQATVRJPQ-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)C[C@@H]1NC(=O)OC(C)(C)C 2282083784 RFLBCDRJNIXGJX-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1 2282256137 ZLJPHTDDJQKGMP-SJORKVTESA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)NC1CC(CCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282379597 WXKISQFKXUDZPL-UHFFFAOYSA-N 419.334 -0.064 50 10 HBGE O=C(N1CCC(CNS(=O)(=O)Cc2ccsc2B(O)O)CC1)C(F)(F)F 2282860529 BTBBCOXDLBBSRE-UHFFFAOYSA-N 414.236 -0.352 50 10 HBGE Cc1cc(B(O)O)ccc1NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360548944 JUUCOYRLUHXPLO-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCOc3ccccc32)n(C)c1=O 766635363 BROWTLIUTOPEDO-LBPRGKRZSA-N 412.406 -0.853 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 780604955 XAGVQZZXENUKTN-ZBFHGGJFSA-N 422.438 -0.265 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)N2CCC(O)CC2)cc1 1148561992 YGHRJYXZBPGCOR-HNNXBMFYSA-N 413.452 -0.992 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(B(O)O)cc1 1623865044 PYSWROKYMIDSEB-UHFFFAOYSA-N 417.252 -0.774 50 10 HBGE Cc1c(C(=O)NNC(=O)CS(C)(=O)=O)nnn1-c1cccc2c1CCN(C)C2 1641668018 XUBSMKJRMWQLQC-UHFFFAOYSA-N 406.468 -0.631 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)c1ccc2c(c1)OCCO2 1683459768 IVCGTGVPMWKZHC-GOSISDBHSA-N 406.395 -0.970 50 10 HBGE Cc1cc(S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)sc1B(O)O 2267419855 RZJNFQMVWPQOGN-SNVBAGLBSA-N 408.307 -0.758 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1ccc(B(O)O)s1 2267613155 UJKKEEIKFJHAMB-VWYCJHECSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1ccc(B(O)O)s1 2267614387 NECIFGHJMZQNNL-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282068231 AHWIJOFSWBFRKP-NEPJUHHUSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@H](F)C1 2282091784 ISJKDBVIEANUMS-ZIAGYGMSSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282724441 MQRRUEANULZQAC-STQMWFEESA-N 420.680 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCCC#CB(O)O)S(=O)(=O)C(C)(C)C1 2287046474 QVSIWPGEMICJPE-LBPRGKRZSA-N 402.278 -0.679 50 10 HBGE Cn1cccc1C(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 731598749 XIBGRLAQAJYJGA-HZSPNIEDSA-N 410.496 -0.104 50 10 HBGE O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)[C@H]1CCc2nncn2C1 816872073 ATLKRFNWQDHTPJ-NSHDSACASA-N 410.431 -0.504 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccccc2C2(C)CC2)n(C)c1=O 1630996855 XAGVGQHSRZOSQA-UHFFFAOYSA-N 410.434 -0.054 50 10 HBGE O=C(O)[C@@H](CB(O)O)NS(=O)(=O)CCCCCN1C(=O)c2ccccc2C1=O 2042873953 YZMLHHZJDURIIM-CYBMUJFWSA-N 412.229 -0.702 50 10 HBGE Cn1cc(S(=O)(=O)NC[C@@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(CCl)n1 2233980388 XRXDVAMDPJNGTI-NTZNESFSSA-N 424.907 -0.222 50 10 HBGE O=C(NC1CCN(S(=O)(=O)c2cncc(B(O)O)c2)CC1)OCc1ccccc1 2267225369 VJKKIUOHGFGODZ-UHFFFAOYSA-N 419.268 -0.159 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NC(=O)c2c[nH]nc2B(O)O)C(C)(C)C1 2281871897 OOLVXWDOTPZEDR-MHZLTWQESA-N 400.266 -0.273 50 10 HBGE O=C(N[C@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1sccc1B(O)O)C2)C(F)(F)F 2282069416 PPYUAPWJMPDOKN-FKTZTGRPSA-N 412.220 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)Cc1cccc(B(O)O)c1 2282342021 BAMCYYPUAPMBLQ-UHFFFAOYSA-N 402.278 -0.673 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc1B(O)O 2282359921 UWAHGOYZPZAYEP-NSHDSACASA-N 402.278 -0.091 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@H](C)[C@@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282360846 INVPORHIBUVRID-CBAPKCEASA-N 414.236 -0.186 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282368054 KSKDDLNWYVFQNE-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1sccc1B(O)O)[C@@H](O)C(F)(F)F 2284060828 RXXPPNZBZRSOGA-VHSXEESVSA-N 412.195 -0.139 50 10 HBGE C[C@H](OCc1ccccc1)[C@@H](NS(=O)(=O)Cc1ccsc1B(O)O)C(=O)O 2284416481 YNBWDXZZZHNFPT-SMDDNHRTSA-N 413.282 -0.094 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1ccnc1 746100392 HZGUSQIRKPYLMC-UHFFFAOYSA-N 421.479 -0.316 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1CCN(CC(=O)N2CCOCC2)CC1 766836423 DZRZYEHGMORXMH-UHFFFAOYSA-N 417.510 -0.839 50 10 HBGE CCO/C=C/C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1137298821 CNKKXFQBPZUDNK-MDWZMJQESA-N 410.496 -0.001 50 10 HBGE C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1cn(C)nn1 1161640997 PEUWJMVRBAHTAI-QMMMGPOBSA-N 420.373 -0.038 50 10 HBGE COC(=O)[C@@H](F)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1471334272 IZMCBKCYYMEIEI-ZDUSSCGKSA-N 416.431 -0.074 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CN1CCCC1 1587280376 MANMKCYUALMEFS-UHFFFAOYSA-N 424.523 -0.117 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@@]2(C)CC2(Cl)Cl)n(C)c1=O 1587963913 MULVBLHMHDKYOR-AWEZNQCLSA-N 417.253 -0.445 50 10 HBGE Cn1nc(C(=O)NNC(=O)CCN2C(=O)CCNC2=S)c2ccccc2c1=O 1624038829 KSJDVHJDEASJMD-UHFFFAOYSA-N 402.436 -0.809 50 10 HBGE O=C(CN1CCN(C[C@H]2CCCS2(=O)=O)CC1)NNC(=O)c1ccc(F)cc1 1659796402 DBXHMSRBZZLWPR-MRXNPFEDSA-N 412.487 -0.219 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2267340675 HPRBCJOENLCHQD-INIZCTEOSA-N 401.228 -0.528 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1[C@@H](OC)[C@H](OC)CN1C(=O)OC(C)(C)C)B(O)O 2282376435 DONMTRMNQRZKQQ-JHJVBQTASA-N 408.282 -0.877 50 10 HBGE N#CC(=Cc1cccc(Br)c1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 2329690427 XLHZEAYLLWABSI-SGPHBRAGSA-N 413.224 -0.728 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2CNS(=O)(=O)Cc1ncsc1B(O)O 2359283180 PLSILWQIGXDQLJ-NHCYSSNCSA-N 417.318 -0.502 50 10 HBGE Cn1c(=O)[nH]c(=O)c2c1nc(CSCC(=O)NN)n2CC(=O)c1ccccc1 36075924 JUOKYPNXPZSKEJ-UHFFFAOYSA-N 402.436 -0.471 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)Cc3ccccn3)cc2S1(=O)=O 729397174 OEJAILKGMAQCDY-UHFFFAOYSA-N 418.431 -0.124 50 10 HBGE CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1 816874632 HKXWHPGPQZZHMK-ZDUSSCGKSA-N 406.468 -0.012 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1=O 1439794799 IUMYPBBPYMPPIF-UHFFFAOYSA-N 419.463 -0.358 50 10 HBGE COCn1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1 1445563313 DPDJYTXTEUMHRA-UHFFFAOYSA-N 400.439 -0.294 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCO[C@H]3C)cc2S1(=O)=O 1530203498 DJLMOXJLXNEMHN-CMPLNLGQSA-N 411.436 -0.337 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)OC2)NNC(=O)C1CCN(c2ncccn2)CC1 1565239334 DWVMNHVPJJWMHO-GOSISDBHSA-N 419.442 -0.755 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc2c1CCC2 1646044230 HBHHTKHVYPUEFX-MRXNPFEDSA-N 422.507 -0.163 50 10 HBGE Cn1cc([C@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 1654356137 GAMHUMMJCLYWLP-MHTXLSKPSA-N 420.451 -0.105 50 10 HBGE O=C(NNC(=O)C1CCC1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1 1681825514 YIYYNLPDAAKQJX-UHFFFAOYSA-N 410.452 -0.039 50 10 HBGE COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)cc(OC)c1OC 1682415772 FVVLAKBNUVMIHU-LLVKDONJSA-N 416.456 -0.310 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201894 VEAYZOXBJZGUMM-APPZFPTMSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCC12CC(NS(=O)(=O)c3cc(B(O)O)cs3)(CO1)C2 2282065441 MJUHQKARWLSZSK-UHFFFAOYSA-N 418.302 -0.468 50 10 HBGE CO[C@H]1C[C@@H](CNS(=O)(=O)c2sccc2B(O)O)N(C(=O)OC(C)(C)C)C1 2282069288 OBHTZHPZGJDNET-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1 2282086416 LSWQZORKDFXYEW-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE COCC1(NC(=O)c2nn(C)c(Cl)c2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282287383 YJPCFFWKFXMADC-UHFFFAOYSA-N 402.644 -0.881 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1B(O)O 2282362348 FCGYQHLEFSDGFB-NEPJUHHUSA-N 420.680 -0.410 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C 2282381906 XWPPBNOYZGNZPL-INIZCTEOSA-N 402.278 -0.771 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282858238 UDOPEFFVKRNYLM-OLZOCXBDSA-N 404.225 -0.924 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1sncc1B(O)O)C(=O)O 2289804676 YSJIGUWCENNRDN-JTQLQIEISA-N 401.250 -0.299 50 10 HBGE CC(C)(C)OC(=O)N1CC(C(=O)NCc2ccc(B(O)O)s2)(S(C)(=O)=O)C1 2379890863 ZYLHANOGUNVDQS-UHFFFAOYSA-N 418.302 -0.922 50 10 HBGE Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCOCC3)CC2)c1 744384534 FGNWEXYJWCFGRA-UHFFFAOYSA-N 403.483 -0.768 50 10 HBGE COc1cc(OC)c(S(=O)(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(OC)c1 793448408 RZRFYSBWSFRGCX-SNVBAGLBSA-N 411.440 -0.124 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)NNC(=O)[C@@H]3COCCO3)O2)C1 1313031970 DYSHZCLOCPVYFY-STQMWFEESA-N 414.459 -0.099 50 10 HBGE CC(C)N1CC[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@H](c2cnn(C)c2)C1 1327092260 ZGXMBHOORNONHJ-CFVMTHIKSA-N 414.532 -0.681 50 10 HBGE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCN(S(=O)(=O)CBr)CC1 1466474049 ICFBYNPSLZAGKD-UHFFFAOYSA-N 423.245 -0.417 50 10 HBGE C[C@H]1CN(C(=O)Cn2cc(NC(=O)c3cc(B(O)O)ccc3F)cn2)C[C@H](C)O1 1587246425 FGDGCURWWAOVPZ-RYUDHWBXSA-N 404.207 -0.410 50 10 HBGE CN1C[C@H](O)C[C@@]1(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1587968609 KIRIOUXQFJFYCZ-UZLBHIALSA-N 403.483 -0.953 50 10 HBGE COc1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)ccc1OCC(N)=O 1635371429 COTACHQIEMBZEG-CQSZACIVSA-N 406.439 -0.426 50 10 HBGE CCN(CC)c1nc(NNC(=O)CN2CC(=O)N(C)C2=O)nc(N(CC)CC)n1 1642828155 CCECTYNXRKXSRL-UHFFFAOYSA-N 407.479 -0.099 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)C2CCN(S(N)(=O)=O)CC2)cc1 1644013979 ZHRZQYJCOMYQLX-UHFFFAOYSA-N 400.530 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3ccc(B(O)O)s3)C[C@@H]2C1 2267202355 BGLUGDXNKXMLIK-QWRGUYRKSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2nscc2B(O)O)C1 2267361927 KEFPTTVWDULGKC-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE C[C@@H]1[C@@H](C)N(S(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282719472 MRNREYBQZNHMHS-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE COCC[C@]1(C(=O)N=c2nc(B(O)O)[nH]s2)CCCN1C(=O)OC(C)(C)C 2284124200 DSHNVHGCDWJFCI-HNNXBMFYSA-N 400.266 -0.616 50 10 HBGE CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H]1COCCO1 744650026 XSFOBUKVOODCFC-CABCVRRESA-N 411.480 -0.134 50 10 HBGE CS(=O)(=O)SCCNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 1302913902 NJYSCTRDDKHMIP-UHFFFAOYSA-N 424.522 -0.065 50 10 HBGE CO[C@@H]1C[C@H](C(=O)NNC(=O)[C@@H]2CCC(=O)N2)N(C(=O)OCc2ccccc2)C1 1438037214 PYBWKBICDZOKHM-QLFBSQMISA-N 404.423 -0.162 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C[C@H]2CCCS2(=O)=O)CC1 1460641105 OSROXABHPLMXEO-GOSISDBHSA-N 422.551 -0.120 50 10 HBGE O=C(c1cccc(B(O)O)c1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1 1557383410 UREJPGHZSFOUML-UHFFFAOYSA-N 403.269 -0.841 50 10 HBGE O=C(NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 1625003947 QLQPLUSOUGGZNX-UFBFGSQYSA-N 412.324 -0.004 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CN(C3CCOCC3)C2)cc1 1641071964 UQLJMFZHNIHWQI-UHFFFAOYSA-N 424.523 -0.126 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](Nc2ncc(Br)cc2B(O)O)C1 2217204228 GYEKZPFISAPWOK-MNOVXSKESA-N 402.054 -0.084 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@H]1NC(=O)C(F)(F)F 2267624608 BIPIEZPSDWSKJG-IONNQARKSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272653575 SHIRCZDPWNNHQY-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CCn1cc(B(O)O)c(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)n1 2281886875 MJMHBOVBKHLUOL-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@H](O)C1 2282097398 FGTVAYCGNVNETF-UONOGXRCSA-N 400.262 -0.985 50 10 HBGE Cn1nc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(B(O)O)c1Cl 2282248655 XDBKJANPTCFDPV-ZCFIWIBFSA-N 414.577 -0.061 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@@H]2CCN2C(=O)OC(C)(C)C)cc1B(O)O 2282361325 PDNLNBOSZKVLOG-NSHDSACASA-N 400.262 -0.337 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N(CCNC(=O)OC(C)(C)C)CCN(C)C 2282458214 JUIOAXFHRRPWTP-UHFFFAOYSA-N 400.310 -0.340 50 10 HBGE O=C(N[C@H]1C(F)(F)C12CC(NC(=O)c1c[nH]nc1B(O)O)C2)OCc1ccccc1 2282482467 KHFJKKQIBVGYSJ-GMQFJONSSA-N 420.181 -0.088 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CO)CCCN(S(=O)(=O)c2cscc2B(O)O)C1 2282734513 MGNZRCDZZBTQJD-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2csc(C(C)(C)C)n2)n(C)c1=O 765729654 FBJDGINHMAQEPN-UHFFFAOYSA-N 419.467 -0.351 50 10 HBGE CCN(CC)c1nc(NNC(=O)C2CN(S(C)(=O)=O)C2)nc(N(CC)CC)n1 1626526706 MTGFZTWPYURURQ-UHFFFAOYSA-N 414.536 -0.102 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1cc(B(O)O)sn1 2281871228 DIWWSLRGOGIFGU-UHFFFAOYSA-N 403.266 -0.889 50 10 HBGE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2282070616 HEGMFJRMDKLHPU-LBPRGKRZSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2282075074 QKXFZILUMPQJMG-QWRGUYRKSA-N 418.302 -0.563 50 10 HBGE CC(C)C[C@@H](CNS(=O)(=O)c1c(B(O)O)cnn1C)NC(=O)OC(C)(C)C 2282088957 UWRYPAJFMPLYCT-NSHDSACASA-N 404.298 -0.682 50 10 HBGE COCC[C@@H](CNC(=O)c1nn(C)c(Cl)c1B(O)O)NC(=O)OC(C)(C)C 2282295557 NJWGZLODBSVQER-VIFPVBQESA-N 404.660 -0.587 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2cccc(B(O)O)c2)CCO1 2282338693 PDDMIHGCBFFDJX-AWEZNQCLSA-N 400.262 -0.273 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2282380605 LJZCDYFTGKYOSM-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC(=O)c1ncc(B(O)O)cn1 2282435844 DUMPWQYVDVAQSG-MHZLTWQESA-N 400.266 -0.301 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1)[C@@H]1Cc2ccccc2O1 748357746 GHHDAVRQTVOVOQ-WBVHZDCISA-N 402.451 -0.682 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H](F)Cc2ccccc2)n(C)c1=O 777993272 FONGFOJLSPFARL-GFCCVEGCSA-N 402.386 -0.838 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2ccccc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282105376 KAKONWCFIVBLGH-OLZOCXBDSA-N 400.262 -0.721 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC(CCCNC(=O)OC(C)(C)C)C2)n1 2282413623 HHRHNGSDOKINCX-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CN(C(=O)c1nn(C)c(Cl)c1B(O)O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F 2369667879 VDQJWWPFWHJUNT-RKDXNWHRSA-N 404.635 -0.217 50 10 HBGE CCOc1cc(C=NNC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)ccc1O 10038260 GLFWXWBZBMRTDP-UHFFFAOYSA-N 400.395 -0.312 50 10 HBGE CCOC(=O)[C@@H]1CCC(=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@H]1C 758115992 BGZXDGRXBJLOMT-DGCLKSJQSA-N 418.454 -0.095 50 10 HBGE CC(C)(C)NS(=O)(=O)CC(=O)NNC(=O)c1csc(N2CCOCC2)n1 919690981 XMNUTWVQEXZBNH-UHFFFAOYSA-N 405.502 -0.541 50 10 HBGE COc1cc(C(=O)NNC(=O)C[C@]2(C)CCS(=O)(=O)N2)cc(OC)c1OC 1264306314 CKAAYFAYVJFKIQ-INIZCTEOSA-N 401.441 -0.055 50 10 HBGE CCCn1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)CC)c2ccccc2c1=O 1355323971 YBVUWZSGVABKRQ-UHFFFAOYSA-N 409.468 -0.151 50 10 HBGE C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCC(=O)N1 1465791347 CXXYDACEJYZPMK-GOEBONIOSA-N 401.467 -0.494 50 10 HBGE CC(C)(C)OC(=O)NCCC1CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267374888 YLVWJZNWXSKCTE-UHFFFAOYSA-N 405.307 -0.501 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267720087 IAVXQUXGNSCUSW-UHFFFAOYSA-N 402.303 -0.190 50 10 HBGE Cc1c(C(=O)N2CCC[C@@H](NC(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2278564032 KOSMVLNDPQPJAT-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE COC(=O)C1(NC(=O)c2scc(B(O)O)c2Cl)CN(C(=O)OC(C)(C)C)C1 2281790731 LKIPSASJUMTCNG-UHFFFAOYSA-N 418.664 -0.026 50 10 HBGE CO[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2sccc2B(O)O)C1 2282071599 TZCULTURZJPLIU-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC1(C)C 2282377276 OTWWFDHSWQCVHI-LLVKDONJSA-N 419.334 -0.112 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282428991 MIQCOJAVRBYGSO-JGFSIVIASA-N 400.266 -0.512 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1CNC(=O)OC(C)(C)C 2282739514 KNDAMJIBXDEDRW-WDEREUQCSA-N 419.334 -0.255 50 10 HBGE CCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 730316516 IEPIOAJXKTVKQH-RISCZKNCSA-N 423.447 -0.172 50 10 HBGE COc1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)[C@@H]2COCCO2)cc1 744644039 SADDBMKJPGPBHU-HNNXBMFYSA-N 415.468 -0.341 50 10 HBGE COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1 746186279 SBCIIOIEVHWFGT-OAHLLOKOSA-N 408.436 -0.296 50 10 HBGE CCc1ccc(CCC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 765721706 GAEPCFPJTDCCAC-UHFFFAOYSA-N 412.450 -0.224 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cccc(S(=O)(=O)NCC2CC2)c1 816877401 SQCIJHYKNMHKOS-CQSZACIVSA-N 418.479 -0.010 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CS(=O)(=O)C[C@H]1OC 1252878342 QQJRNYRIZDTPEM-CMPLNLGQSA-N 403.482 -0.070 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)cn1 1328652882 GVONWPSRDHEGBH-MGPQQGTHSA-N 411.484 -0.709 50 10 HBGE O=C(c1nc(-c2cnccn2)no1)N1CCN(S(=O)(=O)CBr)CC1 1466475882 OZHUHDZOLFSMDD-UHFFFAOYSA-N 417.245 -0.033 50 10 HBGE CO[C@@H]1COC[C@@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1470443343 YJEPUGRCNZLWRE-LSDHHAIUSA-N 412.468 -0.171 50 10 HBGE O=C1CSC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)N1 1531049666 YMUBOVUIJNLTTH-ZDUSSCGKSA-N 412.493 -0.536 50 10 HBGE CC(C)[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 1586790681 MGMDYNFEQMRZCI-LLVKDONJSA-N 405.502 -0.686 50 10 HBGE O=C(COCCNC(=O)c1ccccc1)NNC(=O)[C@H]1CCN1C1CCOCC1 1596923778 UEAJQYDTJOXBRS-QGZVFWFLSA-N 404.467 -0.166 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(CN2C(=O)CNC2=O)cc1 1637851043 RHQNWWFSLFBADB-GFCCVEGCSA-N 407.427 -0.380 50 10 HBGE CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1652302224 VXLACXPESFEHSC-UONOGXRCSA-N 422.573 -0.552 50 10 HBGE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)CCOCCCl)C1 1877123058 GWGMTYNFXDDKEK-DTWKUNHWSA-N 409.814 -0.574 50 10 HBGE CN([C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1cncc(B(O)O)c1 2267616241 PZJNYNNUFKHOMB-DLBZAZTESA-N 419.268 -0.161 50 10 HBGE CC(C)(CCNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267625788 WAJAYAPAMMFQFF-UHFFFAOYSA-N 407.323 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2ccsc2B(O)O)[C@H](S(C)(=O)=O)C1 2282226235 NZWGQJJXEJXOSO-GHMZBOCLSA-N 418.302 -0.810 50 10 HBGE Cn1nc(C(=O)N[C@H]2C[C@@H](F)CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282286928 RVMMNCNJYDUSAO-BDAKNGLRSA-N 404.635 -0.169 50 10 HBGE CC(C)(C)OC(=O)N1CCC(O)(CNS(=O)(=O)c2cscc2B(O)O)CC1 2282360802 HXQCFOSDFLMUQD-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE C=C(CCNC(=O)OC(C)(C)C)CNS(=O)(=O)c1nc(C)n(C)c1B(O)O 2282856579 VGUYPSWDOUWMSF-UHFFFAOYSA-N 402.282 -0.842 50 10 HBGE COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 745978591 NQFPLAMMYNDDMU-JTQLQIEISA-N 423.241 -0.039 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc3ccsc3[nH]2)n(C)c1=O 765729629 DUEGDHLCFKCJDK-UHFFFAOYSA-N 401.408 -0.562 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)[C@H]1CCCO1 814216500 ONVNIRLPNUMLPX-GFCCVEGCSA-N 403.482 -0.040 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2cc(Br)cn2C)C1=O 1352560310 LTQMQEQISOFYLD-JTQLQIEISA-N 415.244 -0.040 50 10 HBGE CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc21 1454879395 PITHJQLWAOMPBQ-UHFFFAOYSA-N 401.423 -0.905 50 10 HBGE CC(C)(C)C(=O)N1CCO[C@@H](C(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)C1 1641457129 VKCSJNOGZFRRPZ-ZIAGYGMSSA-N 416.434 -0.142 50 10 HBGE Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)[C@H]1CCC(=O)N1 1642271059 UMIPKUAITIYQOE-SNVBAGLBSA-N 404.452 -0.131 50 10 HBGE O=C(CN1CCN(C[C@H]2CCCS2(=O)=O)CC1)NNC(=O)c1cccs1 1655337549 HDPKDKGRKZIHBG-CYBMUJFWSA-N 400.526 -0.296 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2267412388 MHJZOQOXVMPKNE-UHFFFAOYSA-N 409.270 -0.799 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267607495 NYDCTNLESPRAHP-QWRGUYRKSA-N 406.291 -0.612 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@@H]1CN(C(=O)OCc2ccccc2)CC12CCC2 2281717679 QQPQQSUVOXCIFN-CQSZACIVSA-N 413.243 -0.584 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cncc(B(O)O)c1 2282104019 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XVVBQGBGMXXIMB-UHFFFAOYSA-N 413.438 -0.058 50 10 HBGE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1ccc(B(O)O)s1 2267207733 UAWGVDIEPPNQDC-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NC1(CCNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2267629537 YZWFYISXNGHPMW-UHFFFAOYSA-N 405.307 -0.310 50 10 HBGE COCC1(NS(=O)(=O)c2cc(C)c(B(O)O)s2)CN(C(=O)OC(C)(C)C)C1 2282377028 LUTQFAMVMUVLQG-UHFFFAOYSA-N 420.318 -0.349 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C 2282735962 ITLYFODAWJVTAS-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O)C(F)(F)F 2282739379 ILCOAZKJDAVTSJ-MRVPVSSYSA-N 415.224 -0.814 50 10 HBGE O=C(OCc1ccccc1)N1CC2(CC=CCN2C(=O)c2nccnc2B(O)O)C1 2283069003 MKONOTDPHYORHB-UHFFFAOYSA-N 408.223 -0.050 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1sccc1B(O)O 2334272859 CBNOBXLQBMSQKG-UMNHJUIQSA-N 402.303 -0.038 50 10 HBGE O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@H]1COCCO1 745978283 JFSVYUJZINCFCD-CQSZACIVSA-N 419.481 -0.804 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H](C)S(C)(=O)=O 1137299192 MSZFONRYHQOYKV-HUUCEWRRSA-N 424.523 -0.339 50 10 HBGE COC(=O)C1CC2(C1)C[C@H](NC(=O)NNC(=O)[C@H]1CCO[C@H]1C)CCS2(=O)=O 1251485372 VKCYMEUMCQGZEW-HRAFGBQJSA-N 417.484 -0.359 50 10 HBGE O=C(NNC(=O)c1ccccc1S(=O)(=O)C(F)F)N[C@@H]1CCS(=O)(=O)C1 1597425579 DZGUETMLLXRVSQ-MRVPVSSYSA-N 411.408 -0.186 50 10 HBGE COc1ccc([C@]2(C)NC(=O)N(NC(=O)c3cc(B(O)O)ccc3F)C2=O)cc1 1623484094 SVXDKAOPDMYXMO-SFHVURJKSA-N 401.159 -0.374 50 10 HBGE Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2nnc3n2CCNC3=O)c1C 1638034298 VSBGLNKJLLPPOF-LBPRGKRZSA-N 401.427 -0.064 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NCCSS(C)(=O)=O)cc1 1644275689 XNMJGHZLWCPGOC-UHFFFAOYSA-N 409.511 -0.268 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267616568 VTQZHIKSAIUBKQ-NXEZZACHSA-N 406.291 -0.754 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1cscc1B(O)O 2267622549 SSBRXKLKJKEXNT-FOGDFJRCSA-N 402.303 -0.038 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CC[C@H]1NC(=O)OC(C)(C)C 2282077820 AGTUEBYYPUUPAW-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE O=C(NC[C@@H]1CCCN(S(=O)(=O)Cc2ccsc2B(O)O)C1)C(F)(F)F 2282333558 QCXPPBRVAJFORF-VIFPVBQESA-N 414.236 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN2S(=O)(=O)c2ccc(B(O)O)cc2F)C1 2282370877 BUBTWZUQNGXOJC-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@@H]21 2282414015 MVTBJBAQEKXDRW-YUSALJHKSA-N 417.318 -0.360 50 10 HBGE CC(C)(C)OC(=O)NCCc1nnc(NS(=O)(=O)c2sccc2B(O)O)o1 2282704466 KIMFIIRJXHVKGX-UHFFFAOYSA-N 418.262 -0.321 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(F)cc1B(O)O 2282721829 XSEWYTFVRRJKPG-UHFFFAOYSA-N 404.225 -0.323 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)C3CCOCC3)cc2)CC1 748619514 JBTKQILABRMFLX-QGZVFWFLSA-N 412.512 -0.147 50 10 HBGE COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)[C@@H]1COCCO1 756249518 WGBLVXXKVQYESF-INIZCTEOSA-N 421.454 -0.349 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc3c2CC(=O)N3)c1 1440436655 JLMSWVNBDBRYCQ-UHFFFAOYSA-N 403.420 -0.099 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NNC(=O)[C@H]1COCCO1 1445052255 QSXACELBSPKPRQ-ROHXPCBUSA-N 419.356 -0.465 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1 1608486720 IYVBGRZHAAOFFI-STQMWFEESA-N 413.519 -0.557 50 10 HBGE CN(C)N(C(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1F)[C@H]1CCS(=O)(=O)C1 1629231107 WVYDHVKDBDHJEJ-SMDDNHRTSA-N 414.459 -0.708 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C#CC3CC3)CC2)cc1 1629792824 HXSDKEVLIFKONW-UHFFFAOYSA-N 404.492 -0.138 50 10 HBGE O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 1631590546 MXRNRPKRGJORBV-ZIVKBKJYSA-N 407.810 -0.176 50 10 HBGE Cn1nc(C(=O)N[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)c1Cl 2255725298 LXKWSWPULOLICZ-RYUDHWBXSA-N 406.635 -0.060 50 10 HBGE O=C(N[C@@H]1C(F)(F)C12CC(NC(=O)c1n[nH]cc1B(O)O)C2)OCc1ccccc1 2281835020 RFEXANJLVXFYPS-XNYLIXPXSA-N 420.181 -0.088 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282427737 UYXHEDLUMBQDOF-MHZLTWQESA-N 400.266 -0.734 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282733217 SEZVOXFACUCFTK-AREMUKBSSA-N 420.318 -0.181 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)Cc1ncsc1B(O)O 2282869155 YHYMZXUTUDREMA-CKYFFXLPSA-N 417.318 -0.502 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)Nc2ncc(B(O)O)s2)[C@H]1OC 2284141524 DOZCNBJDZYEEPN-MIMYLULJSA-N 401.250 -0.589 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(F)c(B(O)O)c1 2360550980 JDUDJRAZWCGHDI-LBPRGKRZSA-N 404.225 -0.618 50 10 HBGE C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2cc(Br)cn2C)C1=O 748531827 RHWXDTAIZUVELS-UHFFFAOYSA-N 412.200 -0.475 50 10 HBGE O=C(CN1CCCCS1(=O)=O)NNC(=O)c1csc(N2CCOCC2)n1 1538401309 HEOMCTRTCIQWGH-UHFFFAOYSA-N 403.486 -0.834 50 10 HBGE O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)[C@H]1CCC(=O)N1 1587114626 ODKFRVYDKRBXNW-VXGBXAGGSA-N 407.814 -0.029 50 10 HBGE CC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)C2=O 1635371677 HCHPGOHMRPCKGG-LXDLAPCHSA-N 421.498 -0.112 50 10 HBGE CON(C)C(=O)[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1684434842 KMNQXFNNWLVSQI-SNVBAGLBSA-N 401.445 -0.711 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2occc2B(O)O)CC1 2281658985 AMFRKVYMPLFPFQ-MHZLTWQESA-N 401.250 -0.335 50 10 HBGE CN(CC[S@](C)(=O)=NS(=O)(=O)c1cncc(B(O)O)c1)C(=O)OC(C)(C)C 2282093691 GPGOUPFFXMPXGX-SANMLTNESA-N 421.306 -0.585 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282327961 QEHWIPXYFAKAIM-RYUDHWBXSA-N 420.318 -0.613 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282736523 RZDXCWAKDRLNEX-MNOVXSKESA-N 419.334 -0.064 50 10 HBGE O=C(O)[C@@]1(NS(=O)(=O)c2ccc(B(O)O)s2)CCN(Cc2ccccc2)C1 2284404716 YXIYMCCHIVENAW-MRXNPFEDSA-N 410.282 -0.565 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2369902773 WARTXVYXPYOBRV-VIFPVBQESA-N 419.696 -0.144 50 10 HBGE CCO[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CN(C)C 1255186570 MPSSZOSZLQFQMB-GFCCVEGCSA-N 400.505 -0.110 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1454058491 FAYLOHSYJKHZBH-RBZFPXEDSA-N 413.434 -0.199 50 10 HBGE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNS(=O)(=O)c1cc(B(O)O)cs1 2267608748 XXGXONVXVKYMBB-UHFFFAOYSA-N 402.263 -0.602 50 10 HBGE Cn1cc(C(=O)N=[S@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)c(B(O)O)n1 2282166234 CHNBRWWOJOSCCB-BLBHWQHRSA-N 400.266 -0.747 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(F)cc1B(O)O 2282374345 ZZJNCLVJKRGQMY-NEPJUHHUSA-N 404.225 -0.924 50 10 HBGE C=C(CS(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)Cc2nccn2C1)B(O)O 2282730078 WVLSUHRTAZFCFJ-GFCCVEGCSA-N 400.266 -0.510 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)NCc2cc(B(O)O)cs2)C1 2284041510 SGRROWRRCAAYAO-GFCCVEGCSA-N 418.302 -0.922 50 10 HBGE O=C(CCC(=O)N1CCOc2ccccc21)NNC(=O)N[C@H]1CCS(=O)(=O)C1 731616624 HEHAEUFUIODCJF-LBPRGKRZSA-N 410.452 -0.290 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 744643708 DUAZULWPKILTRT-AWEZNQCLSA-N 422.463 -0.590 50 10 HBGE O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@@H]1COCCO1 744647207 UGSJOVVLTUXPSZ-NSHDSACASA-N 412.196 -0.392 50 10 HBGE CCCn1nc(C)c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 766638403 GHNZUULWUIXTEU-UHFFFAOYSA-N 416.442 -0.882 50 10 HBGE Cc1ccc(C(=O)NNC(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)cc1F 773673706 PEUYSFONJRPFQF-LBPRGKRZSA-N 400.432 -0.228 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Cc2ccccn2)[C@@H](C)O)cc1 779513644 WIFWSJUCGMOZLE-CXAGYDPISA-N 406.464 -0.192 50 10 HBGE C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)[C@H]2CCc3nncn3C2)C1=O 816882067 WMHVBJZBRCCJGM-HXPMCKFVSA-N 411.422 -0.545 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]3OCCNC(=O)[C@@H]32)cc1OC 1308023754 NOLKZFNFPJCDBW-WMLDXEAASA-N 406.439 -0.556 50 10 HBGE Cc1nn(-c2ccccn2)c(C)c1CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1442182553 MFOLTCWEZRLSQY-ZDUSSCGKSA-N 406.468 -0.056 50 10 HBGE CC[C@](C)(O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1630996674 PPOVADQOMJMLRY-SFHVURJKSA-N 412.512 -0.390 50 10 HBGE COC[C@]1(C(=O)NNC(=O)c2ccc(=O)n(C)c2)CN(C(=O)OC(C)(C)C)CCO1 1645960966 GOQWVBYFHWYGPS-IBGZPJMESA-N 424.454 -0.201 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1cccc(B(O)O)c1 2180983637 QMLQWHOPZYZREH-ZDUSSCGKSA-N 400.262 -0.367 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267202526 DISCCJDQGLLDFF-JTQLQIEISA-N 408.307 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@@H](O)C1 2267382526 MNDYROFRYKANMW-JTQLQIEISA-N 406.291 -0.970 50 10 HBGE CN([C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1nn(C)cc1B(O)O 2267390582 GIDMFIWGBZRZQP-LSDHHAIUSA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1ccc(B(O)O)s1 2281625143 XEJYUHGEVVMGQF-UHFFFAOYSA-N 402.278 -0.284 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N1CC2(C1)CS(=O)(=NC(=O)OC(C)(C)C)C2 2281894348 NBSQMZTZRSVKDH-UHFFFAOYSA-N 415.302 -0.010 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C 2282073088 CKNFGJMXOGPJSA-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282081382 BWGKKNUSOCERKR-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282082203 YPTHNTBYXJKFRJ-STQMWFEESA-N 402.253 -0.008 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 2282712670 UIBFULOAVAMHGF-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 2282728082 OMEHUPSLKZOFHA-OAHLLOKOSA-N 420.318 -0.613 50 10 HBGE C[C@@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286908556 WTPDBLICDNAYRW-PWSUYJOCSA-N 402.282 -0.834 50 10 HBGE CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)[C@@H]2COCCO2)CC1 745794540 DYDIVVPQLBOEIM-KRWDZBQOSA-N 405.455 -0.399 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC(C)(C)CC(F)(F)F)n(C)c1=O 1137298755 ASERNFSQZLLJOO-UHFFFAOYSA-N 418.376 -0.050 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)N1 1252844851 RTTINLSCFBUHIP-CQSZACIVSA-N 409.468 -0.970 50 10 HBGE Cn1cc(I)c(C(=O)NNC(=O)CNC(=O)c2ccco2)n1 1434976167 IJGYRUDULIHEKR-UHFFFAOYSA-N 417.163 -0.191 50 10 HBGE O=C(NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O)[C@H]1CC12CCS(=O)(=O)CC2 1468416919 JGXOSAYSKBFXHN-DGCLKSJQSA-N 405.432 -0.200 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 1639935627 ZWCJNFVDJHILSY-WDEREUQCSA-N 403.482 -0.045 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)cc1OC 1685317615 PJOIANQXFLWIIW-MRXNPFEDSA-N 401.441 -0.149 50 10 HBGE CN([C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1c(B(O)O)cnn1C 2267199318 KQXXUYHRPYJGBI-LSDHHAIUSA-N 422.272 -0.822 50 10 HBGE CN(CCOCCNS(=O)(=O)c1ccc(B(O)O)s1)C(=O)OC(C)(C)C 2267608149 DNYGBKXSCWIKQY-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COCC[C@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2282375421 PCRGJTCEABRMFN-GHMZBOCLSA-N 420.318 -0.303 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2285207434 XYUOZOSBELBQQI-IRXDYDNUSA-N 413.239 -0.116 50 10 HBGE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](NC(=O)CCl)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 27987894 FRQAGJSNWYVMNG-DPZJBDQQSA-N 423.802 -0.576 50 10 HBGE O=C(c1cccc(B(O)O)c1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1 1135250212 JPDZEZLGIUCKFV-UHFFFAOYSA-N 410.207 -0.209 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@]3(C)C[C@H](O)CN3C)CC2)cc1 1137300268 LHOMRJHCHXCITR-RXVVDRJESA-N 403.527 -0.285 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCOC3(CCS(=O)(=O)CC3)C2)n1 1198732105 PRUPWFNHLUGMBS-UHFFFAOYSA-N 416.525 -0.579 50 10 HBGE O=C(NNC(=O)[C@H](C[C@H]1COCCO1)C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 1442180928 GZLPRSXCBUOMNA-UTLUCORTSA-N 403.379 -0.512 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)[C@H]1CCC(=O)N1 1533745209 XZJWCDQEHPBABM-LLVKDONJSA-N 400.482 -0.499 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@@H]1NC(=O)C(F)(F)F 2267206907 MSSXRNDVCGLSCB-APPZFPTMSA-N 400.209 -0.495 50 10 HBGE Cc1c(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)nn(C)c1B(O)O 2281609513 SUXLLPFLCPMUMB-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2C[C@@H]2CNC(=O)OC(C)(C)C)cc1B(O)O 2282367651 FFOCINDIILWDHG-ZWNOBZJWSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNS(=O)(=O)c2sccc2B(O)O)C1 2282708025 HFYAINDECZJBEV-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 2282721614 UGUJVJDEPFUINS-TXEJJXNPSA-N 400.262 -0.291 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)C[C@@H]1NC(=O)OC(C)(C)C 2282722732 KYMIKLKHXABUGO-KBPBESRZSA-N 400.262 -0.721 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NS(=O)(=O)c2cscc2B(O)O)CCO1 2282728845 VXGHRWDNNFCVQV-MNOVXSKESA-N 420.318 -0.222 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H](C)CCN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282857497 JAGGIVDKBJEUPW-SNVBAGLBSA-N 404.298 -0.668 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)n(C)c1=O 765723880 FHYKJAPDHIJYIX-OLZOCXBDSA-N 414.397 -0.476 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CN(C)CCN(C)C3)cc2)CC1 1151459497 QFHLFVCQASSZFS-UHFFFAOYSA-N 424.571 -0.441 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCCO2)cc1 1544528798 HJWQVRGUFUFOOH-HNNXBMFYSA-N 412.468 -0.018 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)c1cc(Br)c[nH]1)c1cccc(F)n1 1623505278 ZSZBCTFWSXRXGM-JTQLQIEISA-N 414.191 -0.137 50 10 HBGE COCCOCC(=O)NNC(=O)[C@@H]1CCCN(CCNC(=O)OC(C)(C)C)C1=O 1642243180 RMESQNAMARHALH-ZDUSSCGKSA-N 416.475 -0.440 50 10 HBGE Cn1cc(-n2cc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)ccc2=O)cn1 1646045874 VTFIIJVBEZLXQE-MRXNPFEDSA-N 400.439 -0.415 50 10 HBGE CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2268721855 RCUHFXITHMVCPY-PXAZEXFGSA-N 420.256 -0.606 50 10 HBGE CC(C)(C)OC(=O)NC[C@@](C)(NS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2282419090 MTAABOWOADKOAV-OAHLLOKOSA-N 419.334 -0.064 50 10 HBGE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282704220 HUKSYWTWDUWYKM-LOWVWBTDSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282705886 DMCLTBSTSVBZDA-RISCZKNCSA-N 400.262 -0.816 50 10 HBGE CN(CC(C)(C)CNS(=O)(=O)c1cncc(B(O)O)c1)C(=O)OC(C)(C)C 2282717398 ITWDLUGHVYGNNW-UHFFFAOYSA-N 401.294 -0.067 50 10 HBGE CC(C)(C)OC(=O)NC1CC2(C1)[C@H](C(=O)N=c1nc(B(O)O)[nH]s1)C2(F)F 2284047345 HUWXMXGTPATKAX-NYSXHVPRSA-N 404.204 -0.483 50 10 HBGE C[C@H]1CN(C(=O)c2c(B(O)O)ncn2C)C[C@H](C)N1C(=O)OCc1ccccc1 2337292361 PQHBESPRHLBAGA-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@@H]1COCCO1 744649054 KBZVIWOWCMEMRS-AWEZNQCLSA-N 400.409 -0.816 50 10 HBGE COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)[C@H]1COCCO1 745978307 KGIYWJPYLXYJQE-SNVBAGLBSA-N 423.241 -0.039 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 790324009 NQZAPJVENUTSMN-BQFCYCMXSA-N 402.451 -0.166 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)cc1F 793352087 FMQLFUVGADRIHE-VIFPVBQESA-N 408.429 -0.335 50 10 HBGE O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1cccc(Cl)n1 1300836471 MXXQIIRDEXRMNV-VHSXEESVSA-N 400.844 -0.468 50 10 HBGE COC(=O)[C@@H]1CO[C@H](CCC(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)C1 1450225250 NSFPWRRMASADQW-RWSFTLGLSA-N 403.391 -0.057 50 10 HBGE O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)c1cc(B(O)O)ccc1F 1544772195 HULIMUFKIXRZNT-UHFFFAOYSA-N 400.624 -0.133 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2267625024 ITMUPWYNCRQQBR-DVVUODLYSA-N 403.291 -0.750 50 10 HBGE O=C(N[C@H]1C[C@@H](NC(=O)c2cc(B(O)O)c(O)cc2O)C1)OCc1ccccc1 2267806046 RKXWQTOYMJMEME-BETUJISGSA-N 400.196 -0.035 50 10 HBGE Cc1c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2281609054 MYIWQRKBGWDMQD-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@H](CO)C1 2282074486 MOHJPUNKVYMOEP-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE Cn1cc(C(=O)N=S2(=O)CCC(NC(=O)OC(C)(C)C)CC2)nc1B(O)O 2282295653 OTEYDXMOYWUBHB-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)OCCN2S(=O)(=O)c1sccc1B(O)O 2282715289 DYWYLEJWFCOGOE-NWDGAFQWSA-N 418.302 -0.563 50 10 HBGE Cc1cc(B(O)O)sc1CNC(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284055424 STZFIBSXUARYRK-LBPRGKRZSA-N 402.253 -0.328 50 10 HBGE COC(=O)/C=c1/sc2n(c1=O)C(N)=C(C#N)[C@@H](c1cccs1)C=2C(=O)N(C)C 199505857 QBFBFXWCRMJTGZ-HJTPGIPUSA-N 416.484 -0.388 50 10 HBGE O=C(COC(=O)C1C[C@H]2COC[C@@H](C1)C2=O)NNC(=O)[C@H]1COc2ccccc2O1 740398425 IJNXDIGJIKYFLZ-XQERAMJGSA-N 418.402 -0.241 50 10 HBGE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)cc2)C1 745692746 YOZRLQVVXKJFKJ-HOCLYGCPSA-N 405.455 -0.366 50 10 HBGE CNS(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1 774325836 CULBHOOTULZLGE-QMMMGPOBSA-N 409.262 -0.582 50 10 HBGE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC(=O)NNC(=O)Cc1cn2ccccc2n1 800054786 IXIDQISZVWOOCE-OCCSQVGLSA-N 408.484 -0.075 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1 800055654 LTDLMGMNHLKQNF-SLEUVZQESA-N 412.468 -0.125 50 10 HBGE O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNC(=O)[C@@H]1CCc2nncn2C1 816880621 ORWPVWYGTIAVCZ-LLVKDONJSA-N 401.818 -0.005 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](C(=O)N3CCOCC3)C2)n1 841415986 ILWSCDAWYHNYLS-CQSZACIVSA-N 409.512 -0.288 50 10 HBGE O=C(NNC(=O)c1c[nH]c2c(F)cc(F)cc2c1=O)N[C@@H]1CCS(=O)(=O)C1 1543753841 ZCHZERCHHARNAI-MRVPVSSYSA-N 400.363 -0.063 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C 1545972037 VVLJAYHMKCMDFN-UHFFFAOYSA-N 421.545 -0.055 50 10 HBGE COC(=O)c1cccn(CC(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)c1=O 1596833220 LKBRMCMKNXARHX-GFCCVEGCSA-N 408.411 -0.208 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)N1 1623368565 QSUURBOGCXYKKZ-VIFPVBQESA-N 409.449 -0.662 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1c(O)ncnc1O 1628252411 FSNNYBDHTSUIOH-UHFFFAOYSA-N 400.439 -0.210 50 10 HBGE O=C(CN(Cc1ccccc1)CC1(O)CNC1)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 1915486378 QATKHEQYXSLYJT-GJZGRUSLSA-N 401.916 -0.657 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267203311 OMWOMKGYTYYMMW-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE O=C(N1CCC(CNS(=O)(=O)c2sccc2B(O)O)CC1)C(F)(F)F 2267621428 UIDUJMMNRSBKGT-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NC1(CNC(=O)OC(C)(C)C)COC1 2282377031 LUWYMSFMWHSMCA-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714824 XKKVWSHVPPKCED-UONOGXRCSA-N 400.262 -0.721 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)c1nn(C)cc1B(O)O 2282736273 NRTKFAHJPMCVRH-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282736918 XIHYUDSMGVKVSZ-JGVFFNPUSA-N 415.224 -0.816 50 10 HBGE CCc1cc(B(O)O)ccc1NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O 704368400 HNYNRZBESZNNLS-UHFFFAOYSA-N 402.237 -0.033 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)[C@@H]1COCCO1 810462830 YXBQGDOSHCAKQO-NSHDSACASA-N 412.251 -0.166 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ncon3)CC2)c1 1134396978 LGCDPQRGRLVQKH-UHFFFAOYSA-N 408.440 -0.709 50 10 HBGE CO[C@@]1(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CCS(=O)(=O)C1 1297752531 FWAGZUKRJFIGKP-PXAZEXFGSA-N 419.500 -0.015 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C 1558448073 NQTXRBPVCUWCIL-NSHDSACASA-N 401.445 -0.322 50 10 HBGE CC(=O)c1cn(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)nn1 1566278948 WYZZYGJAAITVKA-UHFFFAOYSA-N 413.482 -0.246 50 10 HBGE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)CNC(=O)c1cccs1 1584300348 DHZQKWCJKFIHQT-CYBMUJFWSA-N 402.498 -0.268 50 10 HBGE COc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)cc1 1618210110 UAXRDNTYYHIHMS-UHFFFAOYSA-N 422.243 -0.339 50 10 HBGE NC(=O)C[C@@H](NC(=O)Cc1cccc(F)c1)C(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 1640905696 MOSUGBQCPIIYNR-LXTVHRRPSA-N 406.414 -0.557 50 10 HBGE CC(C)NS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1 1643073327 MCWQNLXYNPJREQ-UHFFFAOYSA-N 417.919 -0.039 50 10 HBGE Cc1cc(CC(=O)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)n[nH]1 1643655158 JIKNYZHMLKBDDE-UHFFFAOYSA-N 400.443 -0.673 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267209395 WIZDGHCXGZPJNZ-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE O=C(OCc1ccccc1)N1CCC[C@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2267612639 MDVCHXHQAUBTHX-INIZCTEOSA-N 419.268 -0.159 50 10 HBGE CN(C[C@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(B(O)O)s1 2282081934 XDHDAUDAVOGAFY-QGZVFWFLSA-N 410.326 -0.315 50 10 HBGE O=C(NC[C@H]1CCCN(S(=O)(=O)Cc2ccsc2B(O)O)C1)C(F)(F)F 2282333557 QCXPPBRVAJFORF-SECBINFHSA-N 414.236 -0.352 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1F 2282363308 GETPQOKMRJRMEU-NSHDSACASA-N 406.241 -0.988 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)COC2)c1B(O)O 2282740428 ZNFBWLYGUJMDTK-UHFFFAOYSA-N 420.318 -0.383 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC12CC(NS(=O)(=O)Cc1ncsc1B(O)O)C2 2282741561 PKUPERFLFSGYEA-QMJNDHNRSA-N 417.318 -0.312 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@H](CCO)COCc1ccccc1 2343586367 YSTWMTSNFXEWAS-CYBMUJFWSA-N 400.287 -0.790 50 10 HBGE CCN1CCN(c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2F)CC1 758045604 DHAGPUSFOYTVEA-LBPRGKRZSA-N 415.491 -0.334 50 10 HBGE CCc1nc2ccccc2n1CC(=O)NNC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 810468225 FVXCPRWIVYAQDO-MDZDMXLPSA-N 410.434 -0.143 50 10 HBGE O=C(NNc1cc(O)nc2ncccc12)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 1176516954 WWOIOFSDCUMLOQ-CYBMUJFWSA-N 400.439 -0.041 50 10 HBGE Cn1ncc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1I 1290349723 WMTROLQFCMPYTC-ZCFIWIBFSA-N 412.209 -0.780 50 10 HBGE CCN1CC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1440628729 UTCSSFFVTRBZIT-QGZVFWFLSA-N 424.523 -0.118 50 10 HBGE Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2=O)n1 1456039182 STEWEDVDZAZODC-HNNXBMFYSA-N 415.454 -0.413 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)CCOc2ccccc2)[C@H]1c1cnn(C)c1 1464584525 MJOPZNNFGOEDKB-BRWVUGGUSA-N 401.423 -0.473 50 10 HBGE O=C(Cn1ccc2ccccc21)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1565223864 XJTLYYRRPZOIDR-IBGZPJMESA-N 401.423 -0.401 50 10 HBGE CN(C)CCSc1nc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cs1 1597432773 RBRJHNHAUOVBTL-JTQLQIEISA-N 421.570 -0.143 50 10 HBGE O=C(CN1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 2195882826 FAAGHTCAWGJDKQ-XWLWVQCSSA-N 417.837 -0.256 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2sccc2B(O)O)C1 2267613783 ZRPNIIVBKKLQHF-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)CC1 2282085242 WBENGASMVBOTEV-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE Cc1c(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282431841 ZAYWQCGFMDAQKO-GJZGRUSLSA-N 416.243 -0.778 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 2282700050 NYGADDJKZZDBEO-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1 2282707094 UXTCMIFLEVWAMA-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1 2282714335 QNVYMSJYWRQTSV-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE COc1ccc(S(=O)(=O)NC/C=C/CNC(=O)OC(C)(C)C)cc1B(O)O 2282727492 IVNJKNMSGUSYON-AATRIKPKSA-N 400.262 -0.266 50 10 HBGE O=C(NN=Cc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1)c1ccncc1 2297659770 JLTKHQOIUGCLNI-OYNZLANYSA-N 403.391 -0.976 50 10 HBGE COC(=O)c1cn(CCNC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nn1 790848218 RBCNAKIMTIQABB-ZFWWWQNUSA-N 402.411 -0.032 50 10 HBGE Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816887203 TWCXZDLNGNWABU-ZFWWWQNUSA-N 413.417 -0.094 50 10 HBGE NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)[C@H]2CCCO2)cc1 817216041 HWFFWXVUCZDANS-CYBMUJFWSA-N 403.482 -0.228 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@H](NC(=O)NNC(=O)[C@H]3CCCO3)CC2=O)C1 1251437646 RUFSHBAYNWYIQO-DGCLKSJQSA-N 411.459 -0.284 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ncccn2n1 1294587889 QUMLXXJHQVGXHB-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE O=C(CCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@@H]1CCC(=O)N1 1543093972 RUVRQIFFNYESIM-NSHDSACASA-N 423.223 -0.139 50 10 HBGE CC(=O)Nc1ccc(N2C[C@H](C(=O)NNC(=O)CN3CCCC3=O)CC2=O)cc1 1587515854 ACODWITYMHKHDL-CYBMUJFWSA-N 401.423 -0.232 50 10 HBGE CN(Cc1ccc(B(O)O)s1)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 1950893497 VPHIILZHJXOXCN-UHFFFAOYSA-N 408.266 -0.514 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2Cl)C[C@@H]1NC(=O)C(F)(F)F 2195883748 QRBFEBPCSKSBRM-VPOLOUISSA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267200562 FYXZSYUNHZFYDM-RUZDIDTESA-N 424.331 -0.166 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1sccc1B(O)O)NC(=O)OC(C)(C)C 2267607098 IGHYGJLGBWJUEG-JTQLQIEISA-N 408.307 -0.364 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2267607778 QQWBYZRBZCQFEU-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282065628 NTPOBSQBTRKWCR-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2ccccc2B(O)O)C1 2282095857 IQOMBSURHFASEY-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H](NS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2282329510 NLSRLQVEWDWMGW-NSHDSACASA-N 400.237 -0.041 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCN(S(=O)(=O)c2cscc2B(O)O)CC1 2282725155 XEBWWMFKFMJAMC-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282734780 QCVIYZBFIDFZLJ-MGCOHNPYSA-N 406.216 -0.021 50 10 HBGE COC(=O)[C@H](CC(=O)N(C)Cc1cc(B(O)O)cs1)NC(=O)OC(C)(C)C 2283943509 AJRGIOZDSYHAAB-LBPRGKRZSA-N 400.262 -0.157 50 10 HBGE Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cn1C 725896064 XEAHOGXAVGIRHK-AWEZNQCLSA-N 407.452 -0.452 50 10 HBGE Cc1cc(F)c2c(c1)C(=NNC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C(=O)N2 764815604 ACJVAECOXWCGGT-UHFFFAOYSA-N 413.369 -0.646 50 10 HBGE Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(=O)c1 794069005 DNEOKYZOCCSUIB-FQEVSTJZSA-N 416.434 -0.018 50 10 HBGE O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@H]1CCCO1 814217210 WWCANMSRXDUZPG-CQSZACIVSA-N 403.482 -0.040 50 10 HBGE C[C@H](C(=O)NNC(=O)c1ccc(=O)n(C)c1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1134416807 ATBNBVGKCYXQHA-GFCCVEGCSA-N 421.454 -0.386 50 10 HBGE Cn1cc([C@@H]2[C@@H](CNC(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC(=O)N2C(C)(C)C)cn1 1253006102 QYHWBEUAOMLWRS-FFSVYQOJSA-N 419.486 -0.283 50 10 HBGE CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NNC(=O)CN1CCCc2ccccc21 1538914922 OMMSSGAPKZNHHT-HNNXBMFYSA-N 403.483 -0.007 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O 1634355047 ANAXVGOOWWKXLC-NSHDSACASA-N 418.269 -0.006 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1ccc(B(O)O)s1 2255661173 FFRDFFSUXADLOD-UHFFFAOYSA-N 400.234 -0.134 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2267062260 QOEOLRRRMRYWME-KGLIPLIRSA-N 419.268 -0.055 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1NC(=O)OC(C)(C)C 2267613301 AZUDNPMJAXJZEI-QWRGUYRKSA-N 406.291 -0.660 50 10 HBGE CCN([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2282364775 YBDBRRVVZJQBLR-NSHDSACASA-N 402.282 -0.880 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282741751 SAAUUQTWVBZBJN-MNOVXSKESA-N 402.278 -0.045 50 10 HBGE C[C@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1cncc(B(O)O)c1 2284041853 QSBFZKLQEIXMID-GFCCVEGCSA-N 401.294 -0.019 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNS(=O)(=O)Cc1ncsc1B(O)O 2359273672 PLSILWQIGXDQLJ-UMNHJUIQSA-N 417.318 -0.502 50 10 HBGE Cc1cc(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)cc(B(O)O)c1 2360638249 WAYUPOJBBKDWIB-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2 758030949 UHGABNLQOMFUFZ-VXNVDRBHSA-N 423.417 -0.006 50 10 HBGE CCOC(=O)[C@@H]1CCC(=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@@H]1C 758115997 BGZXDGRXBJLOMT-WCQYABFASA-N 418.454 -0.095 50 10 HBGE COC(=O)[C@H](CS(=O)(=O)NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1 793449831 FWOJWFRRXDNJQM-ZIAGYGMSSA-N 407.452 -0.252 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NN(C)[C@H](C)CO 1452346363 DQHKRWXXLYNKSA-TZMCWYRMSA-N 401.485 -0.428 50 10 HBGE O=C(NNC(=O)c1c(Br)nc2n1CCOC2)c1nc[nH]c2ncnc1-2 1637751123 SYVQXSKBRLQGPI-UHFFFAOYSA-N 407.188 -0.132 50 10 HBGE O=C1C[C@@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1 1683908125 VYHUCIVLWCULJW-CYBMUJFWSA-N 423.495 -0.059 50 10 HBGE O=C1CC[C@@H](N2Cc3c(NC(=O)c4ccc(B(O)O)cc4)cccc3C2=O)C(=O)N1 1866097151 GZFSVSPNSSYJEQ-MRXNPFEDSA-N 407.191 -0.620 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267202262 ABWVKHIWCXBFLL-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2272655242 NWIYQKGCEZGTNI-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H]2COC[C@@H]12 2282708870 SKONBZUGISLYGI-AXFHLTTASA-N 418.302 -0.660 50 10 HBGE Cc1sc(CCNC(=O)OC(C)(C)C)nc1C(=O)N=c1nc(B(O)O)[nH]s1 2284063047 KUHLUQABAYENLL-UHFFFAOYSA-N 413.290 -0.276 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccsc1B(O)O 2285413848 SSFKCCPCBGQORF-LLVKDONJSA-N 422.334 -0.535 50 10 HBGE C[C@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286914213 ZHDUTLSPOGMMNJ-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CC(C)[C@@H](NC(=O)C(C#N)=CN(CCN(C)C)[C@@H]1CCS(=O)(=O)C1)C(=O)O 2324993985 SIPDKYIVQOSXKA-HUUCEWRRSA-N 400.501 -0.330 50 10 HBGE Cc1ccccc1OCC(=O)NCC(=O)NN=C1C(=O)N(CC(N)=O)c2ccccc21 254865461 CIODNNWRFXFIAW-UHFFFAOYSA-N 423.429 -0.158 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)[C@H]1COCCO1 763429934 DFHPTFOLWRAKLJ-CQSZACIVSA-N 401.416 -0.213 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCN=C3C2=NNN3C)c2ccccc2c1=O 816806109 RXDJCNQJFPGRJD-CYBMUJFWSA-N 410.438 -0.037 50 10 HBGE O=C(c1cn([C@@H]2CC[C@H]2O)nn1)N1CCN(S(=O)(=O)CBr)CC1 1295728792 CBTVDWAMSFVCKU-GHMZBOCLSA-N 408.278 -0.586 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@H](NC(=O)c3cccc(B(O)O)c3)CC2=O)C1 1456831236 VADUYFLIZRNSKW-CQSZACIVSA-N 403.244 -0.684 50 10 HBGE COc1cc2nc(C(=O)NNC(=O)CN3CCCC3=O)c(=O)n(C)c2cc1OC 1632321438 ZXEFIDAXHBMFDJ-UHFFFAOYSA-N 403.395 -0.666 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(CS(=O)(=O)N(C)C)cc1 1684015347 VWIJFVRILHSOIH-ZDUSSCGKSA-N 416.500 -0.040 50 10 HBGE Cn1nc(C(=O)N2CCC(CNC(=O)OCc3ccccc3)CC2)cc1B(O)O 2267084246 LXFVUYKUCHEGLT-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)c2cncc(B(O)O)c2)C1)OCc1ccccc1 2278541142 ZKHMMNZUQZKDFW-INIZCTEOSA-N 419.268 -0.159 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282365149 UYQRNOKYPCAXQL-LBPRGKRZSA-N 414.598 -0.149 50 10 HBGE CC[C@]1(NS(=O)(=O)c2c(B(O)O)cnn2C)CCN(C(=O)OC(C)(C)C)C1 2282710061 IXUIJAFMVXWWBH-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282858239 UDOPEFFVKRNYLM-QWHCGFSZSA-N 404.225 -0.924 50 10 HBGE CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)Nc1ncc(B(O)O)s1 2283945503 BQSHDXLFQXHMJT-NSHDSACASA-N 400.266 -0.573 50 10 HBGE O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 103829938 RXEWJUWIMXSYJI-UHFFFAOYSA-N 416.306 -0.275 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 732308216 UXHUMOSAZRZHTE-VHSXEESVSA-N 407.445 -0.925 50 10 HBGE O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)[C@@H]1COCCO1 744649542 SVYFACBKKPJUQB-HOCLYGCPSA-N 402.407 -0.975 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCc2cc(Cl)cs2)n(C)c1=O 765726808 GKOGGKFUAXHCPQ-UHFFFAOYSA-N 424.870 -0.071 50 10 HBGE C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)n1cnc(C#N)n1 798982353 ILMZRGZHAVZWQB-ZDUSSCGKSA-N 418.483 -0.210 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H]1CCCO1 814216208 BUYFRVASFYFPSC-CQSZACIVSA-N 419.481 -0.804 50 10 HBGE C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 1160776483 OCAKLEKGLSPZBT-GXTWGEPZSA-N 419.525 -0.548 50 10 HBGE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1178421028 UEWPKOHLSQILBR-KBPBESRZSA-N 400.476 -0.073 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2cnn(C)c2)cc1 1303283326 ORRMXCFAHLUNDX-UHFFFAOYSA-N 411.513 -0.218 50 10 HBGE O=C(NNC(=O)[C@H]1COCCN1CC(F)F)c1csc(N2CCOCC2)n1 1540330996 FEOUEUKFYQRNLS-LLVKDONJSA-N 405.427 -0.293 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1584300976 WSQSVKWXWDSQCZ-HTQZYQBOSA-N 413.399 -0.152 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C1CC1 2282078786 NHHYTUOJZVOUQU-HNNXBMFYSA-N 402.282 -0.928 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@H](NC(=O)C(F)(F)F)[C@H]2C)sc1B(O)O 2282361312 PATZPVNTZPGEPD-BDAKNGLRSA-N 414.236 -0.044 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282704419 JVAIHKCZSVYSRK-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282715396 GHGKUYGIWRKXNA-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1 730319376 XYGYPULFXDOZMK-SNVBAGLBSA-N 400.482 -0.004 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nccn(C)c2=O)C1 747938059 OUUXJHFLNWDLEI-GFCCVEGCSA-N 410.456 -0.071 50 10 HBGE CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 759660895 CZPSYILOKLAGGQ-OAHLLOKOSA-N 414.484 -0.133 50 10 HBGE CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1 812881177 MMJZUCJSEIWPOB-DZGCQCFKSA-N 424.479 -0.644 50 10 HBGE O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1135771214 HMZQSSFKMPAJTR-BLFANLJRSA-N 404.514 -0.706 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccc(OCCN(C)C)cc1 1182609040 FACBKAKBUIOVSE-CYBMUJFWSA-N 400.501 -0.355 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1)N[C@H]1CCS(=O)(=O)C1 1442184591 QFZORKNXHBJMOS-JTQLQIEISA-N 409.399 -0.497 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)[C@@H]1C(=O)Nc2ccccc2C1=O 1625003875 QLQPLUSOUGGZNX-PELKAZGASA-N 412.324 -0.004 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nnc(C)n3C)cc2)CC1 1633579750 RNDRCPITVACBJR-UHFFFAOYSA-N 421.483 -0.267 50 10 HBGE O=C(CCN1CCN(c2ccccn2)CC1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1645054040 OGISSVIGKHIKOE-SFHVURJKSA-N 416.526 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@@H](CO)C1 2282081467 CNQQMUFVAOJJLR-GHMZBOCLSA-N 420.318 -0.676 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@H](C)CN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282336386 CJOYPVWMTRJMST-SNVBAGLBSA-N 404.298 -0.716 50 10 HBGE CC(C)(C)OC(=O)NC1CC2(C1)CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282380838 ORLBCGWYVJZXHN-UHFFFAOYSA-N 417.318 -0.358 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1cccc(B(O)O)c1)NC(=O)OC(C)(C)C 2282716097 PLGKALBUHKZHMG-ZDUSSCGKSA-N 402.278 -0.426 50 10 HBGE O=C(N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1c(Cl)cccc1B(O)O)C(F)(F)F 2282729675 QIFLPBKJLDHOEZ-JGVFFNPUSA-N 412.582 -0.444 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2cc(B(O)O)cs2)C1 2288539938 OXEVUZGCQJNCKA-UHFFFAOYSA-N 406.216 -0.225 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)[C@H]2CCc3nncn3C2)C(=O)C1 816878445 RXITXPMYRFNPGE-LBPRGKRZSA-N 421.458 -0.933 50 10 HBGE CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CN2CCCC2=O)C1 1171828603 PFUUPYWAFQFIPX-OAHLLOKOSA-N 401.423 -0.046 50 10 HBGE COCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1 1355621422 KMUPPTFXAYCIGS-UHFFFAOYSA-N 422.467 -0.216 50 10 HBGE CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCN2C(=O)CCNC2=S)cc1 1633826523 RSYOAQLROWUSMP-UHFFFAOYSA-N 413.481 -0.260 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)cc1 1639948237 SRRAOVKUHSFUAH-VNQPRFMTSA-N 424.479 -0.020 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201424 OMWOMKGYTYYMMW-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE Cc1cc(S(=O)(=O)N2CC3(CN(C(=O)OC(C)(C)C)C3)C2)sc1B(O)O 2267386443 UIZIPPKQGCJANB-UHFFFAOYSA-N 402.303 -0.022 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282248162 PEHVSRPBMJNRJS-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE CN(C[C@@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2282709601 YKTAHENEPCVLEK-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(Oc2ncccc2B(O)O)CCCS(=O)(=O)C1 2368395348 VUTUXSBAXSGNKZ-INIZCTEOSA-N 400.262 -0.388 50 10 HBGE Cn1cc(C2=NO[C@H](C(=O)N3CCN(S(=O)(=O)CBr)CC3)C2)cn1 1137882003 INIBSWINKHQHLQ-LBPRGKRZSA-N 420.289 -0.261 50 10 HBGE O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1141422373 ODWDJVNETMCJSK-GOSISDBHSA-N 422.445 -0.198 50 10 HBGE COc1cc(N)c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1S(C)(=O)=O 1298901354 UOSYRAPOMTZEFR-JTQLQIEISA-N 405.498 -0.213 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)N1 1530230270 BFVDCMXHOOYNEP-QWRGUYRKSA-N 400.482 -0.283 50 10 HBGE Cn1nc(C(=O)NNC(=O)[C@@H]2COCCN2CC(F)(F)F)c2ccccc2c1=O 1618234439 JWPJNSNOGFWOQA-LBPRGKRZSA-N 413.356 -0.042 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCCCNC(=O)OCc1ccccc1 2267211221 NMSQWJAABONHRM-UHFFFAOYSA-N 424.288 -0.525 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2cc(B(O)O)sn2)C1 2267425818 VWVLPYKDLUMUJL-SANMLTNESA-N 403.291 -0.072 50 10 HBGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282711061 WXPVJMQKDQUWNR-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282739797 PUTLJFJTCFTHAM-SANMLTNESA-N 424.281 -0.183 50 10 HBGE CN1C(=O)CS/C1=C/C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1445563464 FFSFFPAGXBBKQZ-WOJGMQOQSA-N 417.491 -0.362 50 10 HBGE CC(C)(O)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1 1466945178 SJYVNFOPCGFKRA-UHFFFAOYSA-N 405.498 -0.327 50 10 HBGE CN(CC(=O)NNC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)[C@@H]1CCS(=O)(=O)C1 1596825835 XNOXYUIWSAFINJ-NEPJUHHUSA-N 404.489 -0.738 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3CN([C@@H]4CCOC4)C3)CC2)cc1 1622155062 AYFPPTHYLUITBY-HXUWFJFHSA-N 415.538 -0.019 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)Cc1ccncc1)C1CCCC1 1674042740 ZCDXRUKOOWOAJI-OAHLLOKOSA-N 412.516 -0.091 50 10 HBGE CCn1nncc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1684223499 VOHNIGOGQWIQAV-UHFFFAOYSA-N 409.472 -0.242 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1NC(=O)OC(C)(C)C 2267211857 RNZYJCBKNAWVJR-VHSXEESVSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2occc2B(O)O)CC1 2281658984 AMFRKVYMPLFPFQ-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE CC1(C[S@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2281834915 HTBIULUOMWMLTP-MHZLTWQESA-N 400.266 -0.416 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)C[C@H]1NC(=O)OC(C)(C)C 2282083780 RFLBCDRJNIXGJX-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)c1ccc(B(O)O)cc1F 2282357095 FGFVOEIUKOJWRM-UHFFFAOYSA-N 406.241 -0.675 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(NS(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282361545 SGXKWDKRMJMIQO-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE CC(C)(C)OC(=O)N1CC(N(C2COC2)S(=O)(=O)c2sccc2B(O)O)C1 2282703998 FGNJBXUDGQTDGF-UHFFFAOYSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@@H]1CO 2282709577 YBNKVEOLROTUAL-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CSCC(=O)N2)c1 1135409678 FRYGVWAVLXFJFB-ZDUSSCGKSA-N 414.509 -0.290 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn2c1S(=O)(=O)N(C)CC2 1135533454 MXTXXPIKQMVHQB-JTQLQIEISA-N 411.415 -0.115 50 10 HBGE O=C(NNC(=O)[C@H](O)c1cccc(Br)c1)N[C@H]1CCS(=O)(=O)C1 1136390127 UKKDUZMCSAYNIC-WDEREUQCSA-N 406.258 0.000 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NN(C)C[C@H](C)O)ccc2F)CC1 1160985207 FJPGCVGMEJTEIP-LBPRGKRZSA-N 416.475 -0.364 50 10 HBGE O=Cc1cn(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nc1-c1ccccc1 1542285235 IFDKUSFKUKFCQK-AWEZNQCLSA-N 405.436 -0.120 50 10 HBGE COc1nccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)n1 1638390027 IBDPYALIAOTZQS-UHFFFAOYSA-N 407.456 -0.427 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)cc1OC 1639948347 XXQDITRBJHHDIO-RAIGVLPGSA-N 413.452 -0.303 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1 1642598715 CDBQQUGDZSYXIC-IAGOWNOFSA-N 420.491 -0.013 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1ccc(=O)n(C)c1 1685504803 ZXCFJSFZTURUDG-CHWSQXEVSA-N 409.443 -0.036 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NCc1cccc(N(C)S(C)(=O)=O)c1 1687814942 CMGDJQPHMSWVKI-LBPRGKRZSA-N 402.473 -0.036 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282427736 UYXHEDLUMBQDOF-HHHXNRCGSA-N 400.266 -0.734 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2284052259 DFLXBQGLJYHUKM-SECBINFHSA-N 400.628 -0.488 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2359274385 ZYWKTCMUDZWCMN-QCZZGDTMSA-N 400.237 -0.208 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H]2COCCO2)nnn1-c1cccc2c1CCN(C)C2 744646107 XQEUOYUATMPGLE-MRXNPFEDSA-N 400.439 -0.260 50 10 HBGE CS(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)cc1 748148914 YYZDHHUOYRHXIX-AWEZNQCLSA-N 410.496 -0.286 50 10 HBGE CCN1C(=O)[C@H]2CN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CCN2C1=O 752337390 FYMXIVVBXDFGMY-CYBMUJFWSA-N 419.438 -0.567 50 10 HBGE CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)[C@H]1COCCO1 755432805 UAJIZPGMWCWJQI-HZSPNIEDSA-N 414.503 -0.225 50 10 HBGE COC(=O)CC1(NCC(=O)NNC(=O)c2cccc(C)c2)CCS(=O)(=O)CC1 784399460 NUVMFIVOUGKTLJ-UHFFFAOYSA-N 411.480 -0.144 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)N1 1131723559 XYCBARIEVXLJFX-SMDDNHRTSA-N 412.443 -0.348 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 1464999673 ZGYZXISNXKYAPT-UHFFFAOYSA-N 420.470 -0.178 50 10 HBGE CCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(C)CCN2C)c2ccccc2c1=O 1471601609 MIBQZMZBWUSWMZ-BBRMVZONSA-N 415.498 -0.005 50 10 HBGE CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2C[C@@H](O)CN2c2ccncn2)cc1 1569520519 VCHUUAZLPWIJSC-UKRRQHHQSA-N 406.468 -0.190 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(O)CC2)cc1 1635877325 ADPNSTVCEVSACF-UHFFFAOYSA-N 424.479 -0.785 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267390918 KYRMUWPIJZFIJX-LKFCYVNXSA-N 403.291 -0.748 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282334374 AJINFKTUNPUIBL-QWRGUYRKSA-N 402.282 -0.868 50 10 HBGE Cc1nc(S(=O)(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)c(B(O)O)n1C 2282335662 SMZBSNBOSXMHOQ-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE O=S(=O)(NC[C@@]1(O)CCCN(Cc2ccccc2)C1)c1cscc1B(O)O 2282741619 PZVGCAAZCYJJIV-KRWDZBQOSA-N 410.326 -0.267 50 10 HBGE COC1([C@@H](NC(=O)OC(C)(C)C)C(=O)N=c2nc(B(O)O)[nH]s2)CCCC1 2284058494 MVCAATKGKCJILD-VIFPVBQESA-N 400.266 -0.569 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(NS(=O)(=O)c3sccc3B(O)O)CO[C@H]1C2 2359281066 NDMFBGJOELNVRO-ZIBATOQPSA-N 418.302 -0.469 50 10 HBGE O=S(=O)(N1CCc2scc(B(O)O)c2C1)N1CC(OCc2ccccc2)C1 2361576428 AAOXLVAHWXVTKQ-UHFFFAOYSA-N 408.310 -0.068 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1ccccc1B(O)O 2369652522 NUIGOEFBLXIYNQ-QWHCGFSZSA-N 402.253 -0.056 50 10 HBGE Nn1c(N/N=C/c2cccc(O)c2)nnc1SCC(=O)NNC(=O)C(F)(F)F 20915833 XASQALGHQXMXMZ-BLLMUTORSA-N 418.361 -0.055 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COCCO1 810462394 OGDDWMSORVRDKN-LLVKDONJSA-N 422.257 -0.710 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@]2(c3ccccc3)CC2(C)C)n(C)c1=O 1445556536 ZGQBBFDLILTSTE-OAQYLSRUSA-N 424.461 -0.051 50 10 HBGE O=C(COc1ccccc1Br)NNC(=O)Cn1ncn2nccc2c1=O 1462493955 NOGDVTWBTFYUCE-UHFFFAOYSA-N 421.211 -0.120 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)c3cn(C)nn3)CC2)cc1 1557479564 UPJUNYMSZBWFRF-BQYQJAHWSA-N 413.438 -0.510 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)[C@H]1CCC(=O)N1 1557664275 NYAOAPWHGCAMAJ-SNVBAGLBSA-N 409.251 -0.302 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cn1nc(C(F)(F)F)c2c1CCCC2 1648534576 LKAZJTOLGKAWOW-MRVPVSSYSA-N 411.406 -0.134 50 10 HBGE COC(=O)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1683913001 GXKGPYSNMILPKW-UHFFFAOYSA-N 401.445 -0.421 50 10 HBGE CC(C)(C)OC(=O)NCC(CO)(CO)Nc1ncc(Br)cc1B(O)O 2254551249 IWEZYJOJGARPKJ-UHFFFAOYSA-N 420.069 -0.816 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cc(B(O)O)sn1 2255773977 FWQHADYHTOIAIS-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2267388469 YVAJXOGCVBDLRC-VHSXEESVSA-N 406.291 -0.693 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N2CCC(CNC(=O)OCc3ccccc3)CC2)n1 2267455081 WTGQUKUFWWGYFP-UHFFFAOYSA-N 401.232 -0.727 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282382733 PFIKMVFEQWCGLV-RPIAUOFESA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2282384870 RXCJOENZENURSA-JQWIXIFHSA-N 417.318 -0.406 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)[C@H]2COC[C@H]12 2282507884 NMEHWBBHUVSCEF-JLLWLGSASA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@H]1CO 2282699372 JQWVEOIQXYSGTH-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2285190873 ZEDRWDNNPIBIAL-QGZVFWFLSA-N 413.239 -0.163 50 10 HBGE CN(Cc1csc(B(O)O)c1)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 704308992 BFVKWJGTCLYMOA-UHFFFAOYSA-N 422.293 -0.124 50 10 HBGE O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NNC(=O)[C@H]1COCCO1 744645526 TVRIKEAKXRVQPF-CYBMUJFWSA-N 403.370 -0.278 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1[C@H]2COC[C@H]21 793443931 ITAKQMQJGDCUPW-FICVDOATSA-N 410.452 -0.704 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)n1 796130179 VFQINHIYAYZSEV-GFCCVEGCSA-N 403.530 -0.503 50 10 HBGE C[S@](=O)C1(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)CCN(C(=O)OC(C)(C)C)CC1 1148929268 MEDNBVUPYRIPTE-DNMZCBJRSA-N 416.500 -0.439 50 10 HBGE CS(=O)(=O)N1CCC(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1530611438 UKNMSSPKYKTJKA-UHFFFAOYSA-N 424.527 -0.098 50 10 HBGE Cc1onc(CO)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278560 IEOKMLKJAYCHEZ-UHFFFAOYSA-N 401.423 -0.306 50 10 HBGE O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cccc(F)n1 1633984477 WCIUCDBNRXMPAH-UHFFFAOYSA-N 401.402 -0.099 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(Br)c2ccccn12 1648534792 UGHVFQQAJNYWRN-ZETCQYMHSA-N 404.246 -0.205 50 10 HBGE CN(C(=O)OCc1ccccc1)C1CN(C(=O)c2cc(B(O)O)c(O)cc2O)C1 2267810949 WCKBFINEPZPFJU-UHFFFAOYSA-N 400.196 -0.129 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@](C)(NC(=O)OC(C)(C)C)C1 2282708508 NMEYKUYIGLZNQP-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC[C@H](CCNC(=O)OC(C)(C)C)C2)n1 2282741782 SHUZYWKKFHANTF-NSHDSACASA-N 402.282 -0.975 50 10 HBGE C[C@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286910042 ZHDUTLSPOGMMNJ-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE C[C@](O)(Cn1ccccc1=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 790482691 AIUYSDKHVKUKSF-KRWDZBQOSA-N 407.452 -0.646 50 10 HBGE O=C1C[C@H](C(F)(F)F)[C@H](C(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)CN1 1159504162 GUGSWDIQFMPVEI-PTRXPTGYSA-N 412.324 -0.100 50 10 HBGE CCOC(=O)[C@@H]1C[C@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1457671504 OFWZOHWZPZMKMR-CHWSQXEVSA-N 411.484 -0.340 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(B(O)O)ccc1F 1540277661 VSTSBJXLBSFBEK-UHFFFAOYSA-N 414.246 -0.521 50 10 HBGE NC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)O1 1566281809 ZJJYFUMHJCLDGY-JKSUJKDBSA-N 423.901 -0.362 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282067292 YBYWUEHWAKKRKN-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](F)CN1S(=O)(=O)c1ccccc1B(O)O 2282091045 DHTXDNRREUPZEE-RYUDHWBXSA-N 402.253 -0.008 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C)c1B(O)O 2282407850 DCWDOABRXYZCMG-OAHLLOKOSA-N 422.334 -0.401 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3sccc3B(O)O)CO[C@H]2C1 2282703483 WYPIKRBZRFLUAQ-DLOVCJGASA-N 418.302 -0.660 50 10 HBGE C[C@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282710770 SGUKPSGRXKIROI-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)c1B(O)O 2282735571 CMPLKUQKAVWJBQ-LLVKDONJSA-N 422.334 -0.449 50 10 HBGE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ccsc1B(O)O 2282857851 NSHLHOQEGRXNNT-PSASIEDQSA-N 414.236 -0.211 50 10 HBGE Cn1c(N)c(C(=O)COC(=O)C(C#N)=Cc2ccc3c(c2)OCO3)c(=O)n(C)c1=O 2297348595 FSGIMFPXAFLTPS-UHFFFAOYSA-N 412.358 -0.272 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC[C@@H](B(O)O)C2)S(=O)(=O)C(C)(C)C1 2368347304 BKRWNBSMFHLWQU-NEPJUHHUSA-N 404.294 -0.126 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1)Nc1ccc(F)cc1 746000106 ZOIZGOPWJCWBFW-HNNXBMFYSA-N 409.418 -0.462 50 10 HBGE NC(=O)c1ccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1 1622153335 BODAAVXUBHOWTK-UHFFFAOYSA-N 424.461 -0.672 50 10 HBGE CC[C@@](C)(O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1630996673 PPOVADQOMJMLRY-GOSISDBHSA-N 412.512 -0.390 50 10 HBGE C[C@@]1(C(=O)NNC(=O)CN2CCCC2=O)C[C@H](O)CN1C(=O)OCc1ccccc1 1635877740 IYUQATGUJSQWQU-YWZLYKJASA-N 418.450 -0.082 50 10 HBGE CN(CCN(C)c1ccc(S(N)(=O)=O)cc1)C(=O)c1cc(B(O)O)ccc1F 1637698649 BNQQUQAGXRXHFW-UHFFFAOYSA-N 409.248 -0.639 50 10 HBGE O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)cc2)CCN1 1639948325 XBJCEHFCVHBPJK-BPLDGKMQSA-N 422.463 -0.864 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CS1(=O)=O 1674203347 BLESCDSRKRTIRY-CMPLNLGQSA-N 403.482 0.000 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@@H]1CNC(=O)OC(C)(C)C 2282362169 BTBHSUXQCKINFI-PWSUYJOCSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H]1CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282363755 QHYVKPMUJPZABS-GFCCVEGCSA-N 400.237 -0.041 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282715193 CMOUHAQDLWXXCH-QWHCGFSZSA-N 402.253 -0.008 50 10 HBGE C[C@@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286860828 LRHISOZKNANIQF-PWSUYJOCSA-N 402.282 -0.834 50 10 HBGE O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)[C@H]1COCCO1 747413629 UPXPIZNLPZIPLU-MRXNPFEDSA-N 406.439 -0.496 50 10 HBGE CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNC(=O)[C@H]3CCCO3)cn2)CC1 814636283 DYQCWUUOPBQVBU-CYBMUJFWSA-N 412.472 -0.505 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1ccc(NCCN2CCOCC2)c(F)c1 1454876125 DMWQBSZQOSTUBP-UHFFFAOYSA-N 407.446 -0.047 50 10 HBGE CCOC(=O)CS[C@H](CNC(=O)NNC(=O)[C@H]1CCC(=O)N1)C(F)(F)F 1479166501 PZHYEQOKRZFCTR-HTQZYQBOSA-N 400.379 -0.177 50 10 HBGE CS(C)(=O)=NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1 1598014516 ZWEAPJSIFYALCL-UHFFFAOYSA-N 404.470 -0.211 50 10 HBGE CS(=O)(=O)SCCNC(=O)[C@@H](CC(N)=O)NC(=O)Cc1cccc(F)c1 1636475644 QUGSMJDLZNEWRR-GFCCVEGCSA-N 405.473 -0.463 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2255674258 WPJPQHFRURDQSV-UHFFFAOYSA-N 404.253 -0.087 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267208522 YSWAWZCTNHPFIL-HBNTYKKESA-N 402.303 -0.038 50 10 HBGE CN(CCOCCNS(=O)(=O)c1sccc1B(O)O)C(=O)OC(C)(C)C 2267210265 GHNFAARQLRPUNN-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1sccc1B(O)O 2267606702 BNZJMIZXECDLBZ-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281877440 PXNWKXKMPOGRLG-YKBSNTEPSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282102372 JDLPQDRAQJIOIR-VXGBXAGGSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282348584 NCBOCOFZDAGLHW-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)sc1C 2282367723 GJQDSZQSMLGXJX-GHMZBOCLSA-N 420.318 -0.351 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282729039 XHGRIXULPUMYCH-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE CN(C(=O)OC(C)(C)C)C1CCN(S(=O)(=O)Cc2ncsc2B(O)O)CC1 2282739463 JUPZBBNITTYTIT-UHFFFAOYSA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282742942 JKAMZAMYBZQZSM-LLVKDONJSA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ccccc2B(O)O)CCO1 2282858014 QKGSXUWFBMTOAV-CYBMUJFWSA-N 400.262 -0.273 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cnsc1B(O)O 2315692365 YZAVHNJFWZGLQU-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)[C@H]2COCCO2)ccc1OC(F)F 746022796 NLHNNAJFAMVSAK-GFCCVEGCSA-N 403.338 -0.411 50 10 HBGE CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1 748215959 YIMKOXWIQJJRKC-HNNXBMFYSA-N 411.461 -0.092 50 10 HBGE CCCn1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)N(C)C)c2ccccc2c1=O 1135537924 HQYHZKBZBFLSGQ-UHFFFAOYSA-N 424.483 -0.694 50 10 HBGE COc1cc(C(=O)NNC(=O)C[C@@]2(C)CCS(=O)(=O)N2)cc(OC)c1OC 1264306315 CKAAYFAYVJFKIQ-MRXNPFEDSA-N 401.441 -0.055 50 10 HBGE C[C@@H](CC(=O)NNC(=O)CN1CCCC1=O)NS(=O)(=O)c1cccnc1Cl 1302575068 BUEPWNVPHJLARI-JTQLQIEISA-N 417.875 -0.438 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)nc1)N[C@@H]1CCS(=O)(=O)C1 1323661797 KUWGUPYUGXUXPR-SSDOTTSWSA-N 402.376 -0.220 50 10 HBGE COc1cc(C(=O)NNC(=O)[C@@]2(OC)CCS(=O)(=O)C2)cc(OC)c1OC 1354184289 RHOZEARCKGEKLS-MRXNPFEDSA-N 402.425 -0.323 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)c2ccccc2c1=O 1463597677 WXXBMZBQLZQQEB-UHFFFAOYSA-N 407.452 -0.370 50 10 HBGE O=C(CCN1C(=O)CCNC1=S)NNC(=O)C1CCN(c2ncccn2)CC1 1628700228 JYVBPZOVVPHFMM-UHFFFAOYSA-N 405.484 -0.663 50 10 HBGE NNC(=O)COc1cccnc1NC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 1858836440 WUSXZCGGTSMIRW-UHFFFAOYSA-N 402.367 -0.091 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(NS(=O)(=O)Cc3ncsc3B(O)O)[C@@H]2C1 2267391971 ILCWPJQQYLCMPP-RKDXNWHRSA-N 403.291 -0.892 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2269794710 ZQTYZAKGWXSGOE-JTQLQIEISA-N 408.307 -0.676 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)Nc1n[nH]c(CNC(=O)OC(C)(C)C)n1 2282376694 HTSFTVYMCNJGPS-UHFFFAOYSA-N 417.278 -0.320 50 10 HBGE Cn1cccc1C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 731598748 XIBGRLAQAJYJGA-BFHYXJOUSA-N 410.496 -0.104 50 10 HBGE O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNC(=O)[C@@H]1COCCO1 745818399 NRZGMYUZAYMWTA-INIZCTEOSA-N 411.503 -0.543 50 10 HBGE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)c1cccc(C#N)c1 749556354 AVQUEWPFXJVGEH-SRABZTEZSA-N 414.418 -0.256 50 10 HBGE Cn1ccn2c(CCNC(=O)NNC(=O)c3cc(Br)c[nH]3)nnc2c1=O 1255503835 JSWORCUOQHCRRI-UHFFFAOYSA-N 423.231 -0.295 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cn(C)nn3)cc2)C[C@@H](C)O1 1279012153 ZFKNFZWZOSHCLA-VXGBXAGGSA-N 422.467 -0.312 50 10 HBGE NS(=O)(=O)c1ccc(NC(=O)NNC(=S)NCCN2CCOCC2)cc1 1322062503 JRACHKIXQVYBME-UHFFFAOYSA-N 402.502 -0.833 50 10 HBGE CCOC(=O)[C@](C)(NC(=O)c1cccc(B(O)O)c1)c1ccc(S(C)(=O)=O)cc1 1467546942 LZPMZOXVPAFSIV-LJQANCHMSA-N 419.264 -0.022 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1 1630862303 FOCSKFFWKRVGKI-UHFFFAOYSA-N 417.509 -0.404 50 10 HBGE COC(=O)N(C)CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1636972877 NPPNCXPIJMLNPF-UHFFFAOYSA-N 415.472 -0.356 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)C1CCCC1 1683688860 JFRJSMWOWMCFKO-KBUPBQIOSA-N 417.532 -0.161 50 10 HBGE C[C@@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ccnc(B(O)O)c1 2108227764 KFDPGERMNCYCIZ-QGZVFWFLSA-N 421.215 -0.473 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@@](C)(=O)=NC(=O)c2csnc2B(O)O)C1 2267050860 IQNZHIZNFCWXRE-AREMUKBSSA-N 403.291 -0.072 50 10 HBGE CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(B(O)O)cs1 2282073343 MSSLGWGJDWDZSJ-KRWDZBQOSA-N 410.326 -0.315 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282103497 SGDDFLJVRDXJID-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCCO1 2282508335 VAKBTWIBYGDXLH-NSHDSACASA-N 420.318 -0.268 50 10 HBGE COC1(CCNS(=O)(=O)c2ccc(B(O)O)s2)CN(C(=O)OC(C)(C)C)C1 2282715703 KAZWRAUNEWYTHL-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE O=S(=O)(c1ccc(B(O)O)s1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2282716155 QBGNFBUWSJYABM-HUUCEWRRSA-N 408.310 -0.298 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CO)CCCN(S(=O)(=O)c2cscc2B(O)O)C1 2282734512 MGNZRCDZZBTQJD-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CC(N(C2CC2)S(=O)(=O)Cc2ncsc2B(O)O)C1 2282742403 BYNBPIXXMMPEAC-UHFFFAOYSA-N 417.318 -0.264 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](NC(=O)C(F)(F)F)CC1 2286120805 NUONPFCJDWWLAS-SECBINFHSA-N 414.236 -0.042 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCCNS(=O)(=O)c2cscc2B(O)O)C1 2362288935 SCYGZJMWKIDGLZ-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCOC2=O)c1 728397577 MVXIDHYIZILYPJ-UHFFFAOYSA-N 413.456 -0.277 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(F)(F)Oc2ccccc2)n(C)c1=O 741593825 LXMWPPHQDXQSPZ-UHFFFAOYSA-N 422.348 -0.747 50 10 HBGE CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)n1 746004419 WMNAYOGUOIAPSM-OLZOCXBDSA-N 412.447 -0.559 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(N2CCOCC2)n1 773265876 KFQKEXAFJOXMLL-UHFFFAOYSA-N 402.411 -0.228 50 10 HBGE CNC(=O)NC[C@H]1CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCO1 1460446005 AKGPGVTXMXCBSG-ZDUSSCGKSA-N 409.443 -0.905 50 10 HBGE COc1nn(C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1608469811 MWIUYOCUWCYQIB-UHFFFAOYSA-N 423.451 -0.476 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 1682008386 IQJNASJNVCNGRR-KOLCDFICSA-N 406.411 -0.002 50 10 HBGE C[C@@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cc(B(O)O)cs1 2008405121 LGYPBIAPVMLOIK-SNVBAGLBSA-N 408.266 -0.296 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1sccc1B(O)O 2267607152 IWYYITYXLUZSOE-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE CCCN(CCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267627089 SNIBULBPDPGEBD-UHFFFAOYSA-N 407.323 -0.111 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](F)CN1S(=O)(=O)c1ccccc1B(O)O 2282091040 DHTXDNRREUPZEE-NEPJUHHUSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@H]2C[C@@H]21 2282345006 FHSQTSVJWAHHRX-SCVCMEIPSA-N 417.318 -0.360 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282710179 KWJWNGYTPUBVGR-NSHDSACASA-N 420.318 -0.268 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 2282711665 FXAZKEQSYDQQCS-VHSXEESVSA-N 402.282 -0.930 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1CCO 2282719253 JFVKBDFFQSMKPM-NSHDSACASA-N 420.318 -0.580 50 10 HBGE O=C(O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1B(O)O 2284396729 YFCISBPSQVSNLI-CQSZACIVSA-N 413.644 -0.032 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)Nc1ccc(F)c(N2CCCS2(=O)=O)c1 756498579 XQDBSCBENIDOII-ZDUSSCGKSA-N 402.404 -0.066 50 10 HBGE COc1cc(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1C 765726597 CGGHGZMPAUCAOD-UHFFFAOYSA-N 414.422 -0.859 50 10 HBGE CCC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1 772063902 LYFOGGMNKDTOEF-DIFFPNOSSA-N 416.434 -0.049 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCN=C2C1=NNN2C 816828113 REBLEYMXXOVMBA-SNVBAGLBSA-N 406.472 -0.726 50 10 HBGE CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)CN1CCCC1=O 1152015502 WRADPOFTYXTDQD-LBPRGKRZSA-N 411.484 -0.251 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O 1647996813 GIPDNAHXBVUSNJ-SECBINFHSA-N 418.269 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1CC(NS(=O)(=O)CI)(C(N)=O)C1 1881749980 OAWJULCWADXHBI-UHFFFAOYSA-N 419.241 -0.227 50 10 HBGE C[C@H](NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1nscc1B(O)O 2066556394 JJZXILTTYHTLCZ-JTQLQIEISA-N 423.281 -0.510 50 10 HBGE C[C@@H](C[S@@](C)(=O)=NC(=O)c1nn(C)c(Cl)c1B(O)O)NC(=O)OC(C)(C)C 2281662942 DHQPXVPWUNOPCJ-UQTVHIPJSA-N 422.700 -0.096 50 10 HBGE CN(Cc1ccccc1)[C@]1(CNS(=O)(=O)c2sccc2B(O)O)CCOC1 2282064793 FKXBNXAKPFVBAH-KRWDZBQOSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282704171 HFAYZSLBDVQGLD-UONOGXRCSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@]2(NS(=O)(=O)Cc3ncsc3B(O)O)C[C@H]2C1 2282861184 LDDLVPDQAJUJKS-ZUZCIYMTSA-N 417.318 -0.358 50 10 HBGE CC(=O)N[C@@H]1[C@H](OC(=O)CCl)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 256020604 WRIXCIGJYAONQN-CHUNWDLHSA-N 423.802 -0.576 50 10 HBGE CN(Cc1cc(B(O)O)cs1)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 704310175 LORYBZJZELVRON-UHFFFAOYSA-N 422.293 -0.124 50 10 HBGE CCOCCCn1c(NNC(=O)CN2CC(=O)NC2=O)nc2ccccc2c1=O 733365748 QILVVQVFLGMCID-UHFFFAOYSA-N 402.411 -0.182 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)cn1 776055599 WGSFZVWTCQXMPR-IRXDYDNUSA-N 411.466 -0.037 50 10 HBGE CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN(S(N)(=O)=O)C1 1135736142 XNUDUXTYGNIGMW-GFCCVEGCSA-N 408.484 -0.338 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)C2CCOCC2)cc1 1153079438 MVLJQMQMRBBFOQ-UHFFFAOYSA-N 413.452 -0.284 50 10 HBGE O=C(NNC(=S)Nc1ccccn1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 1154057472 YGAWAGSRLXMUHL-JTQLQIEISA-N 410.481 -0.435 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1293155268 ZBTSMOOXVHTRBP-AWEZNQCLSA-N 412.855 -0.236 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@H]2COCC[C@@H]21)NNC(=O)c1cccc(Cl)c1 1460221549 KMJWBLDIRMZUNK-KBPBESRZSA-N 401.872 -0.011 50 10 HBGE O=C(NCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ncccc1O 1466474195 JEEBRXRPXFLYJJ-UHFFFAOYSA-N 421.273 -0.657 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ncc[nH]1 1540482306 ZTGYASUMDGVKAX-UHFFFAOYSA-N 421.479 -0.247 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 1557734421 LOECRTXDGJDJID-UHFFFAOYSA-N 423.900 -0.070 50 10 HBGE O=C(c1ccc(B(O)O)cc1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1 1623887601 WKZCTSXZNRAQMR-UHFFFAOYSA-N 410.207 -0.209 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)Cc2cccc(B(O)O)c2)C1 2255890191 MMIWVXDRVTZGIJ-UHFFFAOYSA-N 404.253 -0.193 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267205798 WVRZWDZHBQVRNN-REFGNXHDSA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2(B(O)O)CCC2)[C@@H]2CS(=O)(=O)C[C@H]21 2282165207 AOKQJDAZLURWAB-VXGBXAGGSA-N 402.278 -0.372 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282339990 ZWIQTWJIADEKBJ-GFCCVEGCSA-N 420.318 -0.517 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282378547 HXZQQKDLWOKIEY-UONOGXRCSA-N 400.262 -0.922 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@@H]2CCN(Cc3ccccc3)[C@H]2C1 2282384364 LXMBPODAHCZFAC-HOCLYGCPSA-N 407.326 -0.141 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741146 KBGSOUINRQSRMX-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)Cc3cnn(C)c3)cc2)CC1 787134972 LMIKLQLQAFMELK-QGZVFWFLSA-N 422.511 -0.597 50 10 HBGE CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816879425 OHGDXIBANIGNTR-HXPMCKFVSA-N 417.470 -0.121 50 10 HBGE COc1cc(C(=O)NNC(=O)CN2CCCCS2(=O)=O)cc(OC)c1OC 1351475003 GADPNOWAAWFMQW-UHFFFAOYSA-N 401.441 -0.101 50 10 HBGE O=C(c1cn(C[C@H]2CCOC2)nn1)N1CCN(S(=O)(=O)CBr)CC1 1466474929 CLBNAMOYACMBNR-LLVKDONJSA-N 422.305 -0.245 50 10 HBGE C/C(=C\C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN1CCOCC1 1538535105 UKSSRJCNJRQKQO-SDNWHVSQSA-N 410.496 -0.024 50 10 HBGE NC(=O)N[C@@H](CO)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 1542453175 ZUABJZWVKJIDPT-ROUUACIJSA-N 411.462 -0.210 50 10 HBGE Cn1nnc(Br)c1C(=O)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1569618142 VGMKSZVMRAPWAS-MRVPVSSYSA-N 407.184 -0.210 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)ccc1OC 1587114300 LNQATFFYMKLFQR-LBPRGKRZSA-N 412.468 -0.235 50 10 HBGE CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(C(=O)c2cccc(B(O)O)c2)C1 1631479443 GPYNMFINUYMWOA-OAHLLOKOSA-N 419.287 -0.141 50 10 HBGE Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1645053764 KNJHNXVDNZBVET-MRXNPFEDSA-N 424.523 -0.018 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3cscc3B(O)O)C[C@H]2C1 2267386931 BDBVFBQQGDAQGO-PHIMTYICSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NS(=O)(=O)c2cscc2B(O)O)C1 2267625978 YZEQFQGYKBNDDU-USOBGDSLSA-N 424.331 -0.118 50 10 HBGE CN(C[C@H](O)CN(C)C(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2281653745 XBNAHMPKUJQKET-SECBINFHSA-N 404.660 -0.947 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@H](B(O)O)C2)[C@H]2CS(=O)(=O)C[C@@H]21 2281876780 IBVQGCNLECIJII-CYDGBPFRSA-N 402.278 -0.516 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 2282074147 RYQRTOUMSUDQOF-WDEREUQCSA-N 402.282 -0.786 50 10 HBGE CN(Cc1nc(NS(=O)(=O)c2sccc2B(O)O)n[nH]1)C(=O)OC(C)(C)C 2282084967 SQHZHXIBUHUUQW-UHFFFAOYSA-N 417.278 -0.286 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@H](NS(C)(=O)=O)C2)cc1OC 735079022 ZZIKEQVONXHDHP-LBPRGKRZSA-N 400.457 -0.912 50 10 HBGE CCN1CCN(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1 746332898 RLMIHCFLAFVMNR-UHFFFAOYSA-N 411.528 -0.212 50 10 HBGE O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)NNC(=O)[C@H]1COCCO1 773345357 BRBKSTMULDWNNJ-CQSZACIVSA-N 416.431 -0.389 50 10 HBGE O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)[C@H]1CCCO1 817213983 PTDAKASHPGILRH-HUUCEWRRSA-N 401.423 -0.137 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 1152015005 IEQAQHKVUGRBDT-ZIAGYGMSSA-N 408.455 -0.262 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-n3cncn3)n2)c1 1586905268 KMECOFOQZWXGAT-UHFFFAOYSA-N 415.435 -0.013 50 10 HBGE CC(C)Oc1ccc(NC(=S)NNC(=O)[C@@H](C)NC(=O)Cn2cnnn2)cc1 1633769056 KUEMEYADSNYVGG-LLVKDONJSA-N 406.472 -0.017 50 10 HBGE O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2)N1 1638870678 FOYLHZLWRQKZNQ-INIZCTEOSA-N 415.450 -0.141 50 10 HBGE C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCN(C)CC1 1687871310 QAFUPDSIPJSMJB-ZDUSSCGKSA-N 401.471 -0.487 50 10 HBGE CN([C@@H]1CC[C@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1cc(B(O)O)nn1C 2267616205 PBXKKONFRKKOFP-ZIAGYGMSSA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(CNS(=O)(=O)c2cscc2B(O)O)C1 2267624229 VDSGXMRJMJLFIG-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282092405 PIKLJXRBFBVAMI-STQMWFEESA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1c(Cl)cccc1B(O)O 2282362349 FCGYQHLEFSDGFB-NWDGAFQWSA-N 420.680 -0.410 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)[C@H]1COCCO1 767467089 OSRLSUFTAPYFFM-IAQYHMDHSA-N 404.416 -0.034 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)[C@H]1CCc2nncn2C1 816885551 CIFMRELVMJNTKZ-RYUDHWBXSA-N 424.508 -0.097 50 10 HBGE Cc1nn(CCO)c(C)c1C=NNc1nc(SCC(=O)NNC(=O)C(C)C)n[nH]1 1084238067 WIYCXEHSGLNCRU-UHFFFAOYSA-N 423.503 -0.048 50 10 HBGE CNC(=O)CN1CCCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1 1197958671 BFPGDNSIFKXCQB-UHFFFAOYSA-N 411.890 -0.137 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)c1 1313165544 BLPICFRPXKISLM-IBGZPJMESA-N 406.439 -0.360 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 1452256114 IUSNSHPALBNNMM-BTQDYEIMSA-N 415.443 -0.478 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1456035920 FLURCGZECPQDJE-CYBMUJFWSA-N 413.475 -0.972 50 10 HBGE C/C=C/[C@H](O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1463714987 AIJJBHJUROPDOD-KZSQQDEKSA-N 411.480 -0.276 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C/CCc2ccccc2)n(C)c1=O 1587964948 ZNJCNQIWIAVZAY-YRNVUSSQSA-N 410.434 -0.230 50 10 HBGE COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)CC(=O)N2C2CC2)c1 1641667212 MYCWAYIWOFUKGT-YOEHRIQHSA-N 409.464 -0.061 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1nnc2c(=O)n(C)ccn12 1683683587 SXJWRPMLTLZGRT-JTQLQIEISA-N 403.374 -0.135 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)N2CC(Cl)C2)[C@@H](S(C)(=O)=O)C1 2254232288 RMBWVSNVIYJPFR-QWRGUYRKSA-N 417.937 -0.224 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1sccc1B(O)O 2267199333 KUTQWOLOTJPYDN-IONNQARKSA-N 400.209 -0.352 50 10 HBGE Cc1ccc(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c(B(O)O)c1 2360638946 ZHDJGWFEVRTRJG-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE CC(=O)N1CCN(C(=O)/C(C#N)=C\NCCc2ccc(S(N)(=O)=O)cc2)CC1 216993379 HJJYFSSAQAQRLW-SSZFMOIBSA-N 405.480 -0.436 50 10 HBGE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)cc2)C1 745692747 YOZRLQVVXKJFKJ-ZBFHGGJFSA-N 405.455 -0.366 50 10 HBGE O=C(NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)NNC(=O)[C@H]1COCCO1 745781803 VZCZWMHCVCTSHV-JKSUJKDBSA-N 406.439 -0.159 50 10 HBGE C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 750661647 GJEWTDFZBWAEHT-OSAQELSMSA-N 423.495 -0.110 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(C)C[C@@H](O)CN2C)c1 1289966631 FLTLVVAKEVSTPX-KDOFPFPSSA-N 412.512 -0.067 50 10 HBGE CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c(C)o1 1471977014 DTROZXQIFVNDAS-ZDUSSCGKSA-N 400.457 -0.490 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)c1c2c(nn1C)CCS(=O)(=O)C2 1540473879 VLKCGJOFMJKCHS-UHFFFAOYSA-N 402.436 -0.078 50 10 HBGE Cc1c(Br)cnc(O)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1625563955 NNRVDBQINWVDDZ-ZETCQYMHSA-N 407.246 -0.011 50 10 HBGE Cc1nc(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)s1 2267443761 PWYAWZPLZBYUFE-AWEZNQCLSA-N 419.268 -0.101 50 10 HBGE CC[C@@H]1[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282091281 FMPMBXXLDFEZQH-VXGBXAGGSA-N 402.282 -0.834 50 10 HBGE CCn1cc(B(O)O)cc1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2282280110 AVRCLGYTEOUXHI-KRWDZBQOSA-N 415.255 -0.045 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NC(=O)c2ncc(B(O)O)cc2F)C1 2282292860 BDXWZTOPAFBWAP-FLESLCNUSA-N 401.225 -0.194 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)[C@@H]2COC[C@@H]12 2282708872 SKONBZUGISLYGI-HBNTYKKESA-N 418.302 -0.660 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 2282728081 OMEHUPSLKZOFHA-HNNXBMFYSA-N 420.318 -0.613 50 10 HBGE COc1ccc(C=NNC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)cc1[N+](=O)[O-] 27527412 WJSNMLWKUYVDQG-UHFFFAOYSA-N 415.366 -0.499 50 10 HBGE CN(C)c1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 766633974 CUHAMKQVLJDWOD-UHFFFAOYSA-N 417.401 -0.900 50 10 HBGE CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c(Cl)s1 770637873 REIFHNXYPHJYJN-ZCFIWIBFSA-N 404.875 -0.470 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)NNC(=O)[C@@H]1COCCO1 776056978 RGRNQTLYTKXEEW-BBWFWOEESA-N 417.466 -0.669 50 10 HBGE O=C(NNC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1)C1CCN(c2ncccn2)CC1 1125953762 AJAODIUBRVPAMC-SJORKVTESA-N 418.498 -0.280 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NN(C)C[C@H](C)O 1141853661 WUZWRDBRDMCCAE-GXTWGEPZSA-N 401.485 -0.428 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(F)c1 1182609351 LFINHWKAYDWQRO-LJWDBELGSA-N 400.432 -0.570 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1 1306514751 ZEKHBIDFMWRHCW-DGCLKSJQSA-N 406.468 -0.407 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@]2(c3ccccc3)CC2(C)C)n(C)c1=O 1445556532 ZGQBBFDLILTSTE-NRFANRHFSA-N 424.461 -0.051 50 10 HBGE O=C(c1ccc(-n2cnnn2)cn1)N1CCN(S(=O)(=O)CBr)CC1 1446966608 YVBZIFOQIQHRHR-UHFFFAOYSA-N 416.261 -0.503 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1457689929 TXXKRMLNXYHKLS-ZJUUUORDSA-N 408.358 -0.818 50 10 HBGE C=CCCn1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1 1472517940 RTMREDXFRLWUGQ-UHFFFAOYSA-N 420.499 -0.058 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCCS(=O)(=O)N1CCCC1 1479430778 ZXZZNXDFKXLBBJ-UHFFFAOYSA-N 405.521 -0.315 50 10 HBGE CC(C)(C)OC(=O)NC1CCN(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CC1 1623509489 IZRCMOMPJVBLGP-GFCCVEGCSA-N 418.516 -0.442 50 10 HBGE CCOC(=O)C[C@H](O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1634402854 FKTUYPCSSXFTOV-ZDUSSCGKSA-N 401.441 -0.535 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)NNC(=O)[C@@H]3CCO[C@H]3C)C2)cc1 1635069384 VTOIVCUPHOHPSW-XHDPSFHLSA-N 412.468 -0.177 50 10 HBGE CON(C)C(=O)[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1687213126 YDXMGDAOSBTEDM-GFCCVEGCSA-N 415.472 -0.646 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ncc(B(O)O)cc1F 2256390828 BFPVEQKQHRZXJK-UHFFFAOYSA-N 407.188 -0.672 50 10 HBGE C[C@@H]1CN(C(=O)c2cn(C)c(B(O)O)n2)C[C@@H](C)N1C(=O)OCc1ccccc1 2266891350 GNHGXOKLPBOBKU-ZIAGYGMSSA-N 400.244 -0.029 50 10 HBGE Cn1nc(B(O)O)c(C(=O)NCCSSCCNC(=O)OC(C)(C)C)n1 2267448461 YUAPTLZTCUSIEC-UHFFFAOYSA-N 405.311 -0.869 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cscc2B(O)O)[C@@H](S(C)(=O)=O)C1 2281606970 LMBHSLIVQUDNOV-RYUDHWBXSA-N 418.302 -0.810 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 2282083830 RKTLYWRMIHAMRQ-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282084979 SWMZRKOAIOXPIP-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE O=C(N1CCCC[C@H]1CNS(=O)(=O)Cc1ccsc1B(O)O)C(F)(F)F 2282333613 QTVRICNTMCHFDS-JTQLQIEISA-N 414.236 -0.209 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ccc(B(O)O)cc1O 2282871317 FETJDQPFABXZNJ-INIZCTEOSA-N 414.223 -0.161 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1sccc1S(=O)(=O)NCc1ccco1 744644726 NISOSHGKGYEABV-LLVKDONJSA-N 415.449 -0.004 50 10 HBGE O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)[C@H]1COCCO1 744649544 SVYFACBKKPJUQB-ZBFHGGJFSA-N 402.407 -0.975 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cn1 1265051259 DXQJOABHMWRXED-CQSZACIVSA-N 412.454 -0.373 50 10 HBGE CC(=O)Nc1ccc(N2C[C@H](C(=O)NNC(=O)N3CCN(C)CC3)CC2=O)cc1 1296987773 HEAIHSLHZNSZSM-CQSZACIVSA-N 402.455 -0.014 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCS2(=O)=O)cc1 1558896855 HUYCINAYHWVEDA-CYBMUJFWSA-N 403.482 -0.660 50 10 HBGE O=C(NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 1625003946 QLQPLUSOUGGZNX-QPUJVOFHSA-N 412.324 -0.004 50 10 HBGE CN(C)S(=O)(=O)NCCNC(=O)NNC(=O)c1ccccc1Br 1672943709 RYDFULGKYZXWOE-UHFFFAOYSA-N 408.278 -0.211 50 10 HBGE CN1C[C@@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 1684165275 XUSVEXLTHISEDS-LBPRGKRZSA-N 411.484 -0.251 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCCS(=O)(=O)Nc1cc(B(O)O)ccn1 2089787139 UAQZXDQJUTUUSV-UHFFFAOYSA-N 417.252 -0.030 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267206619 JDQLZLQSONSNBZ-NSHDSACASA-N 406.291 -0.658 50 10 HBGE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(C(=O)c2scc(B(O)O)c2Cl)C1 2282474461 ANXWNWVPNCVZOC-UHFFFAOYSA-N 417.680 -0.372 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282728709 HBHQWLRFUYTUOM-GHMZBOCLSA-N 402.253 -0.055 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1ccnc(B(O)O)c1 2283972957 GHAXXLWGQNYZOL-LLVKDONJSA-N 401.250 -0.972 50 10 HBGE COC(=O)[C@H](CC(=O)NCc1sc(B(O)O)cc1C)NC(=O)OC(C)(C)C 2284012300 UYQHTNPJLZCUSN-JTQLQIEISA-N 400.262 -0.191 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1nc(B(O)O)ccc1Cl 2360527798 NBEQJHZMFNKVAC-SECBINFHSA-N 421.668 -0.709 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](Nc2cc(B(O)O)c(F)cn2)[C@H](S(C)(=O)=O)C1 2370019605 MCQNWLCQILYSPY-VXGBXAGGSA-N 403.241 -0.655 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2COCCO2)s1 744652668 LZQKTJJNJXTGAQ-VXGBXAGGSA-N 403.482 -0.228 50 10 HBGE CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)[C@@H]3COCCO3)ccc2O1 751549106 QRJWOQUBZGXWMP-KBPBESRZSA-N 400.409 -0.722 50 10 HBGE CCn1cnc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 753068052 LBLXNTWBILMYQO-UHFFFAOYSA-N 401.470 -0.223 50 10 HBGE C#CCn1ccc(CN(CCOC)C(=O)NNC(=O)CNC(=O)c2ccco2)n1 789839350 DIJAXRYOCBGXNU-UHFFFAOYSA-N 402.411 -0.272 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)COc2ccccc2F)C1 804867910 OEZRWCHPURCEHS-GFCCVEGCSA-N 417.463 -0.194 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNc2cccc(S(C)(=O)=O)c2)C1 807577867 MBGYUKBNMCENLJ-CYBMUJFWSA-N 419.529 -0.013 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)[C@H]1c1cnn(C)c1 1135437936 KJEVKMOLEWWBKB-BRWVUGGUSA-N 408.418 -0.080 50 10 HBGE C[S@](=O)C1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)CCN(C(=O)OC(C)(C)C)CC1 1148929267 MEDNBVUPYRIPTE-CTUXIKGSSA-N 416.500 -0.439 50 10 HBGE CCOCc1nc(Cl)cc(NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)n1 1233945297 RQOUPNGFABPVCH-UHFFFAOYSA-N 407.884 -0.217 50 10 HBGE Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)CN1CCCC1=O 1471222556 URSFGQWLNKHIOE-UHFFFAOYSA-N 406.443 -0.970 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2CCC(=O)N2)s1 1533745190 XKZJOQITHFDEGP-GHMZBOCLSA-N 400.482 -0.364 50 10 HBGE O=C(N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(B(O)O)cc1 1585447553 DGSYNYBUZXDFFI-QGZVFWFLSA-N 411.271 -0.608 50 10 HBGE O=C(CCn1cnnn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 1622166487 UWWUPHMWLMNCRK-UHFFFAOYSA-N 406.878 -0.318 50 10 HBGE CN1CC[C@@](C)(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1629793096 LSYREGQDBIFWMA-FQEVSTJZSA-N 401.467 -0.540 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)C1CCOCC1 1672892989 RCMYVEXEILXULM-UHFFFAOYSA-N 415.468 -0.002 50 10 HBGE Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c(B(O)O)c1Cl 2255489832 ZCWRFMIGTUMELE-TXEJJXNPSA-N 406.635 -0.060 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1CO 2282086621 OHZIQMFWNLUDFE-MNOVXSKESA-N 420.318 -0.676 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282334492 CAUQBYIRJIRGTQ-SNVBAGLBSA-N 406.241 -0.988 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(B(O)O)c2)[C@H]2C[C@H]21 2282346185 UFZRZPZSTSCFPM-KGLIPLIRSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CCNS(=O)(=O)c2cscc2B(O)O)C1 2282359226 KXNLQNPAJBAHPW-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@H]2C1 2282381636 WAOFIMUZVVPRHS-GHMZBOCLSA-N 417.318 -0.549 50 10 HBGE NCC1(NS(=O)(=O)c2ccc(B(O)O)s2)CCN(Cc2ccccc2)CC1 2282707876 DYAHBTHKNYGCOR-UHFFFAOYSA-N 409.342 -0.300 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)CC2)n1 2282727711 KYFMEIJZGDKXJY-NSHDSACASA-N 402.282 -0.832 50 10 HBGE C=C(CS(=O)(=O)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1)B(O)O 2282729068 JPWLGLBXISEBTE-CQSZACIVSA-N 403.310 -0.489 50 10 HBGE CCCN(C(=O)OC(C)(C)C)[C@H]1COC[C@@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2283945617 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COc1ccc(S(=O)(=O)N2CCCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1 1137736040 XMNNGTNAMUQVDA-UHFFFAOYSA-N 418.280 -0.088 50 10 HBGE CN1CCN(Cc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)s2)CC1 1442179463 CKYYSEQIVRHXLQ-GFCCVEGCSA-N 415.541 -0.373 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)c1cc(B(O)O)ccc1F 1466263459 VUAGWBSEUQJEDX-UHFFFAOYSA-N 406.653 -0.071 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCN(C)C3=O)cc2)CC1 1545921811 IIXWVZLFQMTNDV-INIZCTEOSA-N 409.512 -0.066 50 10 HBGE O=C(Cn1ncc2ccccc2c1=O)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1625003469 KUIQYGIUWHYSID-INIZCTEOSA-N 405.370 -0.005 50 10 HBGE CO[C@@H]1COC[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1686890080 YJEPUGRCNZLWRE-HUUCEWRRSA-N 412.468 -0.171 50 10 HBGE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNS(=O)(=O)c1ccc(B(O)O)s1 2267204168 AHPPCKQZMHKRIZ-UHFFFAOYSA-N 402.263 -0.602 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1O 2282071179 ODRVSYDJNJVJRR-GMTAPVOTSA-N 420.318 -0.630 50 10 HBGE Cn1nc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(B(O)O)c1Cl 2282248654 XDBKJANPTCFDPV-LURJTMIESA-N 414.577 -0.061 50 10 HBGE CN(CC(C)(C)N(C)S(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2288925050 WAOYTYPOCFLIJE-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE CC(=O)N1CCN(C(=O)/C(C#N)=C\N(CCN(C)C)[C@H]2CCS(=O)(=O)C2)CC1 216992852 IDXVHIJSBZLHJX-NOCRFKNCSA-N 411.528 -0.865 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c(Br)c1 745978585 NDEOLOPPDNVJCK-SNVBAGLBSA-N 423.241 -0.039 50 10 HBGE O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)[C@@H]1COCCO1 746333598 WCHZCQOGUXAMTR-CABCVRRESA-N 417.422 -0.901 50 10 HBGE CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1456039819 UVINPGBJVBAPLG-HZPDHXFCSA-N 416.544 -0.019 50 10 HBGE CO[C@@H]1C[C@H](C(=O)NNC(=O)[C@@H]2COCCO2)N(C(=O)OCc2ccccc2)C1 1514955084 YHLGNAHLMNJICO-OAGGEKHMSA-N 407.423 -0.025 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 1539067542 RQDMCNUKHXBQES-HNNXBMFYSA-N 415.560 -0.426 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@](F)(C(=O)NNC(=O)[C@H]2COCCO2)C1 1634838630 UZRCLWNIYYWYDE-PIGZYNQJSA-N 403.407 -0.475 50 10 HBGE Cc1nn(C)c(C)c1C(=O)NC1(C(=O)NNC(=O)CN2CCCC2=O)CCCC1 1643804060 CCLGANBZHJKCHM-UHFFFAOYSA-N 404.471 -0.151 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NS(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2267387105 DMPAICDSWDNXKQ-JBLDHEPKSA-N 402.303 -0.038 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2267606795 CXGQXPFFXPEKKK-VXNVDRBHSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)Cc2ncsc2B(O)O)CC1 2267625012 IPVKNSLAICJWPJ-UHFFFAOYSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272653561 SBJYNKYBEBQZEJ-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@@](C)(CO)C1 2282708407 MAOXLJKVPHNULI-OAHLLOKOSA-N 420.318 -0.580 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)c1cc(B(O)O)nn1C 2282711392 BTXGXVPJDSUCQW-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cnc(B(O)O)s1)[C@@H](O)C(C)(C)C 2284061927 HOSFUEAIHUTFHZ-GHMZBOCLSA-N 401.294 -0.261 50 10 HBGE CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccccn2)cc1 741922468 DVDQFGMPMUDLQN-UHFFFAOYSA-N 404.448 -0.053 50 10 HBGE COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)c1 746001745 HAJBFVAOIOJWNS-INIZCTEOSA-N 422.438 -0.382 50 10 HBGE CCOC(=O)c1cnc(N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)s1 746002213 IVTJEYREIPGAQJ-LLVKDONJSA-N 413.456 -0.402 50 10 HBGE C[C@H](CC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765726646 DFOWVBNFHYJFRQ-LLVKDONJSA-N 416.413 -0.086 50 10 HBGE COCCN1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1=O 787254623 GLPUERIIFVCQJH-UHFFFAOYSA-N 402.415 -0.803 50 10 HBGE Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1 816881113 ZHCAUAPGAYZSIX-HIFRSBDPSA-N 413.417 -0.094 50 10 HBGE CCN(CCO)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)cc(OC)c1OC 1163280464 BREMLZZZEQXTSV-UHFFFAOYSA-N 417.484 -0.316 50 10 HBGE C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCc1nnc2c(=O)n(C)ccn12 1313302728 SBBPCZMJTSDNPX-NSHDSACASA-N 417.401 -0.093 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NN(CC)CCO 1452337733 WTSFRSRSRWRDDH-UHFFFAOYSA-N 414.528 -0.020 50 10 HBGE CCN1CCN(S(=O)(=O)c2cccc(NC(=O)c3ccc(B(O)O)cc3)c2)CC1 1623891091 HNKLTKCEQFYJQI-UHFFFAOYSA-N 417.296 -0.055 50 10 HBGE O=C([C@@H]1COCCN1CC(F)F)N1CCN(S(=O)(=O)CBr)CC1 1631773154 RIPKOYVBEVTBNQ-JTQLQIEISA-N 420.276 -0.221 50 10 HBGE C[C@@H](NNC(=O)CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1)C(F)(F)F 1646071524 QJKZYXXKCTWWSK-MRVPVSSYSA-N 403.404 -0.060 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)CO1 2282703364 VMWUVHUFESVTRL-PWSUYJOCSA-N 420.318 -0.364 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C2(CC2)C1 2282731463 QWLNORKSGKFYQL-NSHDSACASA-N 417.318 -0.358 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N2CCC[C@@H](NC(=O)OCc3ccccc3)C2)n1C 2337403862 VJHXWJWNJWAYDG-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE O=C(CN1CCC(NC(=O)NNC(=O)[C@@H]2COCCO2)CC1)Nc1ccccc1 745415238 GMJXDXUZKVSFNR-INIZCTEOSA-N 405.455 -0.165 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cn2cncn2)cc1 749211613 OAJTTZVYQFWNRV-ZDUSSCGKSA-N 409.472 -0.374 50 10 HBGE Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H]2COCCO2)c(C)s1 771992097 JKBNHBFRQJXMJQ-LLVKDONJSA-N 406.486 -0.611 50 10 HBGE CC(C)C[C@H](C(N)=O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1137298795 BRVVYBPHYDYYSF-MRXNPFEDSA-N 403.483 -0.261 50 10 HBGE COC(=O)[C@@H]1CN(C)C(=O)CN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC 1198431554 YQLHFQHMBJRKBP-LBPRGKRZSA-N 412.830 -0.575 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2267626407 HTYPSXSLDVZXDB-VHSXEESVSA-N 405.307 -0.502 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2268721858 RCUHFXITHMVCPY-YVEFUNNKSA-N 420.256 -0.606 50 10 HBGE Cc1c(C(=O)N2CCC[C@H](NC(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2278565686 QJLZRSAHXHGQDF-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1cc(C)sc1B(O)O)NC(=O)OC(C)(C)C 2281889437 RSTMRKHLPWUEPC-LLVKDONJSA-N 400.262 -0.077 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@@H]1CNC(=O)OC(C)(C)C 2282361634 UGLIDEQJKSFIIF-QWRGUYRKSA-N 420.318 -0.446 50 10 HBGE C[C@@H]1CC[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 2282367174 YMQOMTNSOYGKEW-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282372978 GOEWNIQFHQGEOL-UHFFFAOYSA-N 406.216 -0.257 50 10 HBGE Cn1ccnc1CN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 733310150 MFVFCRMZWQTUQA-UHFFFAOYSA-N 401.427 -0.093 50 10 HBGE CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)OCCO2 764815756 DXVYSBDYFNLVOV-UHFFFAOYSA-N 412.406 -0.255 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1)N[C@@H]1CCS(=O)(=O)C1 1442184620 QFZORKNXHBJMOS-SNVBAGLBSA-N 409.399 -0.497 50 10 HBGE CN(C)S(=O)(=O)NCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 1465303787 XBRHSUDLTFYATJ-UHFFFAOYSA-N 407.493 -0.823 50 10 HBGE CN(C)CCn1c(O)nc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc21 1624585653 PEVVQYFWABENCN-LBPRGKRZSA-N 409.468 -0.501 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2cccnc2)C[C@@H](C)O1 1638063374 QZJLPUKOFFETNP-OHHBCXFOSA-N 419.482 -0.373 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](Nc2nccc(B(O)O)c2F)[C@H](S(C)(=O)=O)C1 2240310602 RIANFCNUOMEMKM-GHMZBOCLSA-N 403.241 -0.655 50 10 HBGE CCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2267388872 FKKAMSFOWBPZKN-UHFFFAOYSA-N 405.307 -0.406 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272655006 LICJYEPEAMBUEX-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC[C@H](CN(CC)S(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282069235 NIWSRJKCTDBJTI-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1ccc(B(O)O)cc1 2282428666 ILIUBUYKYWAAFN-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CF)(NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282720037 UPCMBKNZYQEQEA-INIZCTEOSA-N 402.253 -0.006 50 10 HBGE O=C(NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)NNC(=O)[C@@H]1COCCO1 745781801 VZCZWMHCVCTSHV-HOTGVXAUSA-N 406.439 -0.159 50 10 HBGE COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)[C@@H]3COCCO3)cc2)CC1 756391909 FGBOBPUOJJGFAK-INIZCTEOSA-N 421.454 -0.450 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)n(C)c1=O 765723882 FHYKJAPDHIJYIX-STQMWFEESA-N 414.397 -0.476 50 10 HBGE NS(=O)(=O)CCN1CCN(C(=O)NNC(=O)c2cccc3cccnc23)CC1 799905765 YPMMSJGZVQFACO-UHFFFAOYSA-N 406.468 -0.505 50 10 HBGE CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)CCNCC2 814877230 KSILDZHEMYRZLC-UHFFFAOYSA-N 423.477 -0.338 50 10 HBGE CN1CC[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H](c2cnn(C)c2)C1 849486433 KNUSHPAQDUKPCF-IAGOWNOFSA-N 409.454 -0.108 50 10 HBGE O=C(CCc1nn[nH]n1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1 1149650035 VSEXSFOMOSMRMX-UHFFFAOYSA-N 406.878 -0.249 50 10 HBGE CCCN1C[C@@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1=O 1182816093 OPUIACUTZHLQEJ-AWEZNQCLSA-N 424.527 -0.281 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1CCCCC(=O)C1=O 1521489969 SDVDLHZENHFMHO-UHFFFAOYSA-N 415.494 -0.072 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CCC(=O)N(c2cccc(F)c2)C1 1654295128 WMCLRHBUZCUMSB-QWRGUYRKSA-N 400.432 -0.346 50 10 HBGE CN1C[C@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 1684165274 XUSVEXLTHISEDS-GFCCVEGCSA-N 411.484 -0.251 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2267621537 HNSULTAKSLZMIM-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE CC(C)[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267626752 NJBQNPDVRJDGIE-JTQLQIEISA-N 407.323 -0.208 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)n1 2282251253 JJXBVNUSNDSTEO-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282719473 MRNREYBQZNHMHS-MNOVXSKESA-N 402.282 -0.882 50 10 HBGE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1sc(C)cc1B(O)O 2283971155 XFSPHHFHKXOYDF-LBPRGKRZSA-N 400.262 -0.191 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(Oc2ncc(B(O)O)cn2)CCCS(=O)(=O)C1 2368395271 VDJWAVNLCXMJCB-HNNXBMFYSA-N 401.250 -0.993 50 10 HBGE COc1c(C=NNC(=O)c2nnn(-c3nonc3N)c2C)ccc([N+](=O)[O-])c1O 254497484 DIWGVGXVDCFJKY-UHFFFAOYSA-N 403.315 -0.073 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccn1 731596057 REFMOIOCSYBOCY-MELADBBJSA-N 408.480 -0.048 50 10 HBGE C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)C1 746000881 BHIHWZMGEHQFIU-OAGGEKHMSA-N 411.503 -0.735 50 10 HBGE CN(C)c1ncc(Br)c(C(=O)NNC(=O)CNC(=O)c2cccnc2)n1 1182942375 TXGJLMDNPPAXCN-UHFFFAOYSA-N 422.243 -0.109 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NCc1nnc2n1CCNC2=O 1471203286 BJRGLLJUDZLULP-UHFFFAOYSA-N 411.220 -0.733 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1 1479131970 LRWGDXXDBRDTIB-IBGZPJMESA-N 406.439 -0.414 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@@H]1CCCCO1 1526855905 NURSCNUSWLECTC-AWEZNQCLSA-N 400.457 -0.624 50 10 HBGE CC(=O)c1cn(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1 1566278630 LBIWIXFRHCKXKJ-UHFFFAOYSA-N 413.438 -0.914 50 10 HBGE O=C(NNC(=O)c1cn2c(n1)CCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648392944 AKKWSSLPJFEGKG-UHFFFAOYSA-N 419.463 -0.075 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267368195 FOSAPGXUKVCRMX-UWVGGRQHSA-N 405.307 -0.502 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C)CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267627474 ZKZGWANXVNSMDU-CQSZACIVSA-N 405.307 -0.358 50 10 HBGE Cc1ccnc(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2281886240 JCPGVIUALQIICW-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)c1scc(B(O)O)c1Cl 2282474825 GHPOUPLBOPNOKN-YWVKMMECSA-N 420.680 -0.848 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(NS(=O)(=O)c3ccc(B(O)O)s3)CO[C@H]1C2 2359281342 LDZVKHSVFJJBKT-AMJWSMQMSA-N 418.302 -0.469 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)[C@@H]1COCCO1 745816103 UHPMVZFONBLKQH-JTQLQIEISA-N 418.394 -0.706 50 10 HBGE O=C(O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c(Br)c1 747616871 GTSCQTHUZKXCQN-SECBINFHSA-N 409.214 -0.128 50 10 HBGE CS(=O)(=O)NC[C@H]1CCC[C@H]1NC(=O)NNC(=O)Cc1cn2ccccc2n1 800054788 IXIDQISZVWOOCE-TZMCWYRMSA-N 408.484 -0.075 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C/C=C\Cc2ccccc2)n(C)c1=O 1149622065 IPYITGWBOBKEOH-SREVYHEPSA-N 410.434 -0.230 50 10 HBGE COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3ncon3)CC2=O)cc1OC 1289421227 XKEFRRHUTSYGKC-GFCCVEGCSA-N 403.395 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1292039241 WHCLSHOMWTWSMR-WHOHXGKFSA-N 402.473 -0.241 50 10 HBGE COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)c2cccc(B(O)O)c2)cc1 1568809099 CPJBGMWTNXVFJE-ZDUSSCGKSA-N 414.223 -0.073 50 10 HBGE O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1625003415 IUVSLDRLMDHSAT-TVQRCGJNSA-N 411.461 -0.495 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)c1B(O)O 2281833788 HTLMDHCYFBZJAA-BLBHWQHRSA-N 400.266 -0.686 50 10 HBGE O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)N1CCOCC1 731620658 DWQDHEZHSZCCCN-MELADBBJSA-N 416.500 -0.831 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)[C@@H]1COCCO1 744642814 FIIOMWWJGKCGMP-RYUDHWBXSA-N 403.482 -0.146 50 10 HBGE O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)[C@H]1Cc2ccccc2O1 748280597 UENSFRLLOOCFLT-CQSZACIVSA-N 400.416 -0.124 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@H]2CCCO[C@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 779713794 RTUCJRYMBAESGJ-BZUAXINKSA-N 409.464 -0.107 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1cccc(Br)c1C#N 1182608900 DAPUVSQIKCYBJQ-MRVPVSSYSA-N 419.257 -0.215 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(CCO)c3)CC2)cc1 1294590824 PTNRATZUELXDKL-UHFFFAOYSA-N 400.483 -0.237 50 10 HBGE NC(=O)C1CCN(Cc2ccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)cc2)CC1 1478822109 UTRDZENTILYRSF-KRWDZBQOSA-N 419.482 -0.370 50 10 HBGE CN1C(=O)C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]1c1cccc(F)c1 1543752689 JTPSNUJSHXQWAG-VNHYZAJKSA-N 412.443 -0.137 50 10 HBGE O=C(C[C@H]1CCCS1(=O)=O)N1CCN(S(=O)(=O)CBr)CC1 1546252349 ZQQAOCMECUZBFZ-SNVBAGLBSA-N 403.320 -0.220 50 10 HBGE Cc1cccc([C@@H]2C[C@H]2C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 1635500430 IPTYDKMCYBEVQY-UONOGXRCSA-N 410.434 -0.307 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)c(OC)c1 1638558786 GQVHQBASXNFVRZ-INIZCTEOSA-N 401.441 -0.149 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)c1cc(B(O)O)ccc1F)C1CCCC1 1642455631 YCLCYJMEAOBKDX-HNNXBMFYSA-N 401.269 -0.810 50 10 HBGE COC(=O)[C@@H]1CC[C@@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1654359978 ZLKXEALRGCYRGE-QWHCGFSZSA-N 411.484 -0.340 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCO[C@@H]2CCOC2)cc1 1687698749 VWYCGBXRNLYQCW-CQSZACIVSA-N 414.484 -0.249 50 10 HBGE Cn1nc(C(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2266914408 WUGPZKYBCAPMJI-AREMUKBSSA-N 408.673 -0.484 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N=[S@@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2267081655 CIKRDWKWHFYQMW-SANMLTNESA-N 403.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NS(=O)(=O)c2sccc2B(O)O)C1 2267209477 XGXNHKSFNZTWHQ-USOBGDSLSA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282087516 VBRXHZOQYZGPKR-QWHCGFSZSA-N 400.262 -0.985 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1ncc(B(O)O)cc1F)OCc1ccccc1 2282292304 TUAKXZOKYTVCJA-HZPDHXFCSA-N 417.202 -0.286 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282327240 FDRRIHYJGOKUTL-PSASIEDQSA-N 414.236 -0.353 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NS(=O)(=O)c2sccc2B(O)O)CCO1 2282699448 KFCOVCNFAMVQRE-MNOVXSKESA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cnc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284130290 SFKZGPVDVCZVDK-JGVFFNPUSA-N 413.183 -0.744 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2359274243 LRCWVGQPVLPZIK-HERUPUMHSA-N 400.237 -0.208 50 10 HBGE CC(=NNC(=O)[C@H]1COCCO1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 745213244 OQCIWUSPCNKJGH-CQSZACIVSA-N 419.481 -0.332 50 10 HBGE COc1ccc(C(=O)NNC(=O)NNC(=O)[C@H]2COCCO2)cc1Br 745999211 UYUNGEFCPZMUQJ-LLVKDONJSA-N 417.216 -0.152 50 10 HBGE COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1OC 790068932 QNIQOORJWKMGDO-SNVBAGLBSA-N 408.816 -0.140 50 10 HBGE O=C(NNC(=O)[C@H]1CCc2nncn2C1)NNC(=O)C(F)(F)Oc1ccccc1 814305130 DZEKTGDBDNVCGB-JTQLQIEISA-N 409.353 -0.126 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)[C@H]1COCCO1 815736222 REEDQIVDDVUEIJ-QRWLVFNGSA-N 416.434 -0.062 50 10 HBGE COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=S)NCCSC 1137579522 YQYTYCZXBOGZNF-UHFFFAOYSA-N 408.527 -0.177 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1=O 1298837642 JTTVDZNKOHSDHG-LBPRGKRZSA-N 412.468 -0.208 50 10 HBGE CS(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 1334937593 UCGDNLONHGRGGV-DGCLKSJQSA-N 415.493 -0.431 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)c1cccc(F)n1 1684006181 QHZROVSYHUOXTB-UHFFFAOYSA-N 416.413 -0.061 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267712620 GQJYMXUFCVKCRB-NXEZZACHSA-N 405.307 -0.312 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282247294 DBWOTQQMCFOYCM-MHZLTWQESA-N 420.684 -0.389 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CO)CCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282698681 DAWKFMJXRPYORQ-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccccc1B(O)O 2282709023 UUIQTDCAYQTGOY-OLZOCXBDSA-N 416.330 -0.004 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1cc(B(O)O)cs1 2334264151 NLULUNNPKALXCX-DLOVCJGASA-N 402.303 -0.038 50 10 HBGE C=CCNC(=O)CN1CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1 29153247 DWHCYUIYDNNOKV-UHFFFAOYSA-N 419.482 -0.615 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccn3)c2)CCN1 729395185 LYBPOENBWPXXEW-UHFFFAOYSA-N 417.447 -0.794 50 10 HBGE COC(=O)[C@@H](F)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1255353664 OGWAYPQFLRYFBJ-LBPRGKRZSA-N 404.420 -0.543 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)c1cnn(C)c1)C1CCCC1 1312942265 KIEXRQKVADUQOI-CYBMUJFWSA-N 401.493 -0.681 50 10 HBGE CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c1 1530230500 IKPUUTDJCBKCFP-JTQLQIEISA-N 404.242 -0.108 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C2(C(=O)NNC(=O)CN3CCCC3=O)CCC2)C1 1557979027 FQNAWHBAWRKKEY-UHFFFAOYSA-N 410.471 -0.092 50 10 HBGE C[C@@]1(c2cccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)c2)NC(=O)NC1=O 1645053596 JDEZDSPMCYFXQP-QRWLVFNGSA-N 415.450 -0.245 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@@H](C(=O)O)C1 2282069706 UHMDWGZSBMXPKQ-SNVBAGLBSA-N 420.274 -0.878 50 10 HBGE CCON(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccc(B(O)O)cc1 2282369611 JFSAJHAUGZMXOW-UHFFFAOYSA-N 402.278 -0.026 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282707481 ZHZNNXWUGKELEB-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC[C@@H]1CNC(=O)OC(C)(C)C 2282725003 UTCIYUDGQWVCQM-GFCCVEGCSA-N 400.262 -0.337 50 10 HBGE CN(C[C@@H]1CCCN1S(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2282727211 HDBDIWPDOZVLBC-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282740863 GRZBYFMRZSVYBW-NEPJUHHUSA-N 420.680 -0.722 50 10 HBGE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCc2sc(B(O)O)cc2C1 2283946023 ISKPHWIGFUENOQ-LLVKDONJSA-N 400.262 -0.216 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1nscc1B(O)O 2283956439 KIROANUCHMMRSY-GZMMTYOYSA-N 401.250 -0.544 50 10 HBGE O=C(O)C1(COCc2ccccc2)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2284397320 KXGZOCZAXSBBRZ-UHFFFAOYSA-N 411.266 -0.280 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)N2CCC[C@H]2C)cc1 769861429 BSXSNIINWHSWOQ-CYBMUJFWSA-N 404.514 -0.035 50 10 HBGE NC(=O)[C@@H](NC(=O)NNC(=O)[C@H]1COCCO1)c1cccc(Br)c1 792970149 HPRDNIIXXCEFJY-MNOVXSKESA-N 401.217 -0.279 50 10 HBGE O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CC(=O)N(CC2CC2)C1 1245995900 RSAJKFNVDGEGQH-GFCCVEGCSA-N 408.484 -0.065 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)C2CCOCC2)c1 1288226320 LMTCCDUGFVEXPJ-UHFFFAOYSA-N 414.484 -0.547 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CN1C(=O)c2ccccc2S1(=O)=O 1440639075 HEAAQRMTMMRQFZ-UHFFFAOYSA-N 400.482 -0.295 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 1557734001 DQLIDMDKRHDTCM-ZDUSSCGKSA-N 403.482 -0.578 50 10 HBGE Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1586805977 UVJTUFUJKKPESC-PWSUYJOCSA-N 417.871 -0.215 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCO[C@@H]2C)cc1 1643602792 OHXOMPPSPBGAIU-RISCZKNCSA-N 413.452 -0.286 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1sccc1B(O)O 2029312039 NYPIUUIENGIFPU-UHFFFAOYSA-N 422.293 -0.076 50 10 HBGE O=C(OCc1ccccc1)N1CCC(NS(=O)(=O)c2cncc(B(O)O)c2)CC1 2267222659 CEUCBUZAMOFVGG-UHFFFAOYSA-N 419.268 -0.159 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CC[C@H]1NC(=O)OC(C)(C)C 2282084835 YLYRRLSLDZOHDZ-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)CCO1 2282335736 UCLQHBNZWJODBO-LBPRGKRZSA-N 420.318 -0.517 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CCC1 2282699902 MZPOULHPRYGQJZ-LLVKDONJSA-N 402.282 -0.928 50 10 HBGE C[C@@H](NC(=O)[C@@](C)(NC(=O)C(F)(F)F)C(F)(F)F)c1nscc1B(O)O 2284015806 RYPNRXRJVVOCTL-ALFREKQPSA-N 407.101 0.000 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncc(B(O)O)s1)[C@H](O)C(C)(C)C 2284063375 QLEXHKCNHAWOJM-NEPJUHHUSA-N 401.294 -0.261 50 10 HBGE C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)[C@@H]3COCCO3)cn2)C[C@@H](C)O1 756839275 QNOVZKZOOZLYLU-BZPMIXESSA-N 410.431 -0.913 50 10 HBGE COCCOCCN(C)CCC(=O)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1159503667 CCXDQWNFUSXQIU-MRXNPFEDSA-N 406.439 -0.430 50 10 HBGE COCCOCC(=O)NNC(=O)CNS(=O)(=O)c1cccc(Br)c1 1586766997 UVGUWQDJAGBKRF-UHFFFAOYSA-N 424.273 -0.462 50 10 HBGE Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)CNC(=O)c1cccnc1)C2=O 1611015201 JYLGVCLQIBRCOV-LBPRGKRZSA-N 409.402 -0.048 50 10 HBGE COCCOCC(=O)NNC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C 1635056989 JJZVMQLMISXTJG-GFCCVEGCSA-N 402.473 -0.210 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1cncc(B(O)O)c1 2267221943 ZQWRKRVIRNUCEE-RUZDIDTESA-N 407.279 -0.927 50 10 HBGE Cc1cc(S(=O)(=O)N2CCOCCN2C(=O)OC(C)(C)C)sc1B(O)O 2267383644 BZSSWANREPMSPE-UHFFFAOYSA-N 406.291 -0.091 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1ccc(B(O)O)s1)C(=O)OC(C)(C)C 2267611402 SEPCNZVLWPFVCR-SNVBAGLBSA-N 408.307 -0.724 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2267626452 INGOWYZBJNACFQ-SNVBAGLBSA-N 405.307 -0.454 50 10 HBGE CN1CCN(C(=O)c2cc(B(O)O)c(Cl)s2)[C@H](CNC(=O)C(F)(F)F)C1 2281905022 WVPOJGBTSCSPJZ-SSDOTTSWSA-N 413.614 -0.484 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)n1 2282371604 LXOMFPQXTZLMIC-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 2282384363 LXMBPODAHCZFAC-GOEBONIOSA-N 407.326 -0.141 50 10 HBGE COC(=O)[C@H](CC(=O)Nc1nc(B(O)O)ccc1Cl)NC(=O)OC(C)(C)C 2284011975 ROOIYSGWTURXSP-VIFPVBQESA-N 401.612 -0.190 50 10 HBGE CCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 730316517 IEPIOAJXKTVKQH-SMDDNHRTSA-N 423.447 -0.172 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)CN1CCCc2ccccc21 755041736 RXNSRGURGLIFQC-CYBMUJFWSA-N 420.495 -0.313 50 10 HBGE O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)NNC(=O)[C@H]1COCCO1 776056987 RGRNQTLYTKXEEW-YESZJQIVSA-N 417.466 -0.669 50 10 HBGE C[C@@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCC(=O)NC1 798980185 GQCCEWXULKFPRH-HXUWFJFHSA-N 401.467 -0.492 50 10 HBGE CN1CCOC[C@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1234558582 KQFYSRFJVSKIMI-GOSISDBHSA-N 404.515 -0.140 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)n(C)c1=O 1445556167 YJRXREJBOKBKQF-BBBLOLIVSA-N 410.381 -0.738 50 10 HBGE CCOC(=O)CS[C@H](CNC(=O)NNC(=O)[C@@H]1CCC(=O)N1)C(F)(F)F 1479166503 PZHYEQOKRZFCTR-JGVFFNPUSA-N 400.379 -0.177 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)c2)C[C@@H](C)O1 1543093504 GJKSYGFXSQLSFZ-LALPHHSUSA-N 424.479 -0.476 50 10 HBGE COc1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)ccc1OCC(N)=O 1635371428 COTACHQIEMBZEG-AWEZNQCLSA-N 406.439 -0.426 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cscc1B(O)O 2267389475 PBRLYINFPOOMHH-MNOVXSKESA-N 406.291 -0.660 50 10 HBGE CN(CCCNC(=O)OC(C)(C)C)CCCNC(=O)c1nscc1B(O)O 2282287214 WFYKTTUKQQFLSE-UHFFFAOYSA-N 400.310 -0.211 50 10 HBGE CN(C(=O)OC(C)(C)C)C1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)CC1 2282708584 ONSYLDXBTSZZJQ-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)NNC(=O)[C@@H]1COCCO1 746004641 WUTFQFKWOYCVID-HNNXBMFYSA-N 415.468 -0.053 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)[C@@H]2COCCO2)CCO1 760780291 LPHAOYBJHHVVLJ-AVGNSLFASA-N 402.448 -0.243 50 10 HBGE O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CC(=O)N(CC2CC2)C1 1245995933 RSAJKFNVDGEGQH-LBPRGKRZSA-N 408.484 -0.065 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1(S(C)(=O)=O)CC1 1323137729 LRHBHRQXPMGGEA-SNVBAGLBSA-N 403.482 0.000 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CN([C@@H]3CCOC3)C2)cc1 1649390538 JBCNJTXOMXYDRH-OAHLLOKOSA-N 410.496 -0.516 50 10 HBGE CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1652302223 VXLACXPESFEHSC-KGLIPLIRSA-N 422.573 -0.552 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@H]3[C@H]2CCCN3CCO)cc1OC 1655019998 NLSQTAFGSZGGMA-CVEARBPZSA-N 406.483 -0.004 50 10 HBGE Cc1cc(B(O)O)sc1CN(C)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 2039340340 WMVCHOBXPLEMRM-UHFFFAOYSA-N 422.293 -0.206 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNS(=O)(=O)c1sccc1B(O)O 2267209372 WDZXRGMILVOLHH-JBLDHEPKSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C[C@@H]1O 2282074127 RUBOYFLKYLYFJJ-JLLWLGSASA-N 420.318 -0.630 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)C(F)(F)F 2282338424 RIFMZPQTICGVBJ-HTQZYQBOSA-N 415.224 -0.958 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2282353720 XLMWOOCBZLTNOT-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)cc3F)C[C@@H]21 2282354039 LFIDZFSUWDYUNT-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)C(=O)c1cc(B(O)O)sn1 2282427250 NYBZMRALKGNWTC-UHFFFAOYSA-N 400.310 -0.259 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)c1sccc1B(O)O 2282710759 SDGGDUSQXIYZQE-NSHDSACASA-N 419.334 -0.743 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@@H]2C)sc1B(O)O 2282735025 UKAIQHPHJHNRIM-DTWKUNHWSA-N 414.236 -0.044 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282741154 KCKZEKQONISTLI-NSHDSACASA-N 419.334 -0.111 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=CC=Cc2ccc([N+](=O)[O-])o2)n(C)c1=O 2328607553 BUZVKQCFNCIRSM-UHFFFAOYSA-N 401.339 -0.250 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(F)c(B(O)O)c1 2360548900 JDUDJRAZWCGHDI-GFCCVEGCSA-N 404.225 -0.618 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)n1C 2362566721 JIHOUQFRPLQJDA-UHFFFAOYSA-N 400.266 -0.733 50 10 HBGE CC[C@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)N(C)C1 616590001 UHQYIIRIOVIPLI-RYQMADEFSA-N 410.964 -0.001 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2nc3n(c2=O)CCCC3)c1 1135502722 QELTYPPUZWCZBM-UHFFFAOYSA-N 422.467 -0.907 50 10 HBGE O=C(NNc1ncc(Br)cn1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 1557235222 AQJFRAUPJJXDKU-SCZZXKLOSA-N 418.273 -0.282 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cn3c(n2)COCC3)CC1 1610948402 ZOAHICWFSBOOEE-UHFFFAOYSA-N 421.483 -0.499 50 10 HBGE NS(=O)(=O)CCOCCNC(=O)NNC(=O)CCSc1ccc(F)cc1 1673448772 MXYOPJIHQYKNNJ-UHFFFAOYSA-N 408.477 -0.057 50 10 HBGE CC(C)[C@@H](C(=O)NNC(=O)CN1CCN(C)CC1)N1C(=O)c2ccccc2C1=O 1865759044 FOFWLWWFGHHRGB-KRWDZBQOSA-N 401.467 -0.298 50 10 HBGE Cc1c(C(=O)N(C)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2266864840 MIJHILFOCUUWMS-OAHLLOKOSA-N 400.244 -0.109 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201422 OMWOMKGYTYYMMW-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)CCCNC(=O)OC(C)(C)C 2282362098 ARMPSWMHYWUKRV-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE C[C@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282377747 WDBGRKUQBQMERA-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(B(O)O)cs2)[C@@H](S(C)(=O)=O)C1 2282388045 LUZPWMUQEGOOFT-JQWIXIFHSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)NCCn1cc(NS(=O)(=O)c2sccc2B(O)O)cn1 2282706586 NPAYNQHWZCEOKG-UHFFFAOYSA-N 416.290 -0.050 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282707480 ZHZNNXWUGKELEB-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1 2282708934 UEUAYAMYQXCYMI-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282738122 PTUKJLNISIEGDL-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CN(NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)S(=O)(=O)C1CCC1 2365320984 NPTABMKMMBNXGO-LRDDRELGSA-N 407.489 -0.436 50 10 HBGE COC(=O)/C=C\c1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 747602494 SRIUACPNHJMGEN-DJFZKKHWSA-N 402.450 -0.383 50 10 HBGE COC(=O)c1cc(F)c(C)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 769860856 ZVQKAXCKFILFNG-VIFPVBQESA-N 408.429 -0.335 50 10 HBGE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1623509845 LUZXKBYWJBWAFM-NWDGAFQWSA-N 406.505 -0.587 50 10 HBGE O=C1CNC(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2N1 1635372133 ORCZMJIOALBDAQ-OAHLLOKOSA-N 401.423 -0.617 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cc[nH]n3)CC2)c1 1640341228 PTJFCMTWZNYRBP-UHFFFAOYSA-N 406.468 -0.369 50 10 HBGE COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)CS(C)(=O)=O)CC(=O)N2C2CC2)c1 1641667204 MYCWAYIWOFUKGT-RHSMWYFYSA-N 409.464 -0.061 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)c1nc2ncc(Br)cn2n1 1652301524 OFKMAOCLELCSMV-NSHDSACASA-N 424.259 -0.099 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCNC(=O)C2(B(O)O)CCC2)C1 2282290447 SBIWFHFIMZHMMA-LBPRGKRZSA-N 404.294 -0.076 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C)c1B(O)O 2282390829 OSAVQCDKHGOELU-MHZLTWQESA-N 402.282 -0.487 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H](NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282725989 KOCHVLBHPKVTBT-LBPRGKRZSA-N 400.237 -0.041 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(Oc2ncc(B(O)O)cn2)CCCS(=O)(=O)C1 2368395272 VDJWAVNLCXMJCB-OAHLLOKOSA-N 401.250 -0.993 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cn2cncn2)cc1 749211591 OAJTTZVYQFWNRV-CYBMUJFWSA-N 409.472 -0.374 50 10 HBGE COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)N2CCOCC2)c1OC 771596526 OUOSRQFWMSFGDB-UHFFFAOYSA-N 403.413 -0.275 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1OCC(=O)N(CC)[C@@H]1c1nccn1C 1297654410 IYMMLDJASAUCPQ-KBPBESRZSA-N 411.459 -0.355 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cnn1-c1ccc(O)nn1 1558458542 JDCDNRWNGKWAES-AWEZNQCLSA-N 401.427 -0.309 50 10 HBGE CSCCNC(=S)NNC(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1F 1630723154 NOZCNJNIGPHWRJ-LLVKDONJSA-N 401.489 -0.342 50 10 HBGE Cc1cc(CC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)n[nH]1 1631027994 ZNXVYBOEPTZMBA-UHFFFAOYSA-N 407.452 -0.257 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cccc(B(O)O)c1 2282098449 SLNUQHIZLGZJRM-CYBMUJFWSA-N 400.262 -0.072 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CCCCN2C(=O)C(F)(F)F)sc1B(O)O 2282420241 WHDVODRBVNRYFL-VIFPVBQESA-N 414.236 -0.042 50 10 HBGE Cc1c(C(=O)N[C@@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282431842 ZAYWQCGFMDAQKO-HUUCEWRRSA-N 416.243 -0.778 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](Nc2cc(B(O)O)c(Cl)cn2)[C@H](S(C)(=O)=O)C1 2294913128 ASBQZSBZZSWEFG-VXGBXAGGSA-N 419.696 -0.141 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCc2ccc(F)cc2)n(C)c1=O 765721571 DDHCLTNNFNQRGZ-UHFFFAOYSA-N 402.386 -0.647 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C/C=C/c2cccc(F)c2)n(C)c1=O 766635225 AKJPBSCCWJLGNI-GQCTYLIASA-N 414.397 -0.176 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1 1178420389 JDQNHHPCCNOFRY-XHSDSOJGSA-N 403.439 -0.642 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccn2nnnc12 1630996872 XVUCCNLFTAMENY-UHFFFAOYSA-N 408.422 -0.657 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C 1643603309 ZEJZSMBDINMVGC-WOPDTQHZSA-N 407.489 -0.113 50 10 HBGE Cc1c(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2281848650 FIGIKRLGJOHKLP-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)CC1(C)C 2282072663 HXJVJTYQUKPASW-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282363468 OAQVGMFLZCAFBC-NSHDSACASA-N 402.282 -0.880 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282368056 KSKDDLNWYVFQNE-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C 2282437644 VKHCXXQECMRWOX-IQSLBTHBSA-N 402.282 -0.440 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCC2(C)CN(C(=O)OC(C)(C)C)C2)n1 2282726358 QBVFOPGZNDKWFW-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728052 BYGQTTIZPBVIMZ-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE CN(NC(=O)[C@@H]1[C@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C)S(=O)(=O)C1CCC1 2365267641 FMQFPZQDSZRTMD-FRRDWIJNSA-N 407.489 -0.437 50 10 HBGE N#Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2I)c2ncnc(N)c12 26949119 IMAPDARMZOMLIG-IQEPQDSISA-N 401.164 -0.061 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N[C@H]1CS(=O)(=O)C[C@H]1Cl 703997056 ZQZJOPRLAKCGDE-OLZOCXBDSA-N 420.896 -0.004 50 10 HBGE COC(=O)Cn1cc(S(=O)(=O)NNC(=O)c2cc(Br)cn2C)cn1 742255626 NPXGEJBTOYJCPH-UHFFFAOYSA-N 420.245 -0.220 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)[C@H]1COCCO1 744644191 TUXPJMPWCGTDJA-GFCCVEGCSA-N 403.482 -0.362 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 778295916 XYTIKORUYOZVOW-LXXRFIIISA-N 418.450 -0.537 50 10 HBGE COCCN1CCCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1=O 787364491 UUZGMANZPFTSKP-UHFFFAOYSA-N 408.455 -0.355 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 809732304 APRMQFVRCABDKO-KTKRTIGZSA-N 402.407 -0.278 50 10 HBGE CCS(=O)(=O)N[C@@H](C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1138054080 WRFRLPFVPRRXDH-LBPRGKRZSA-N 421.520 -0.050 50 10 HBGE Cn1cc(C(=O)NC[C@H]2CCCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1175202055 AUQDIJSIGBLZHK-QGZVFWFLSA-N 409.450 -0.053 50 10 HBGE O=C1CSC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)N1 1472472219 MHMPLSLASJLVKZ-ZDUSSCGKSA-N 412.493 -0.536 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1546175455 QHMABZYADQQYSD-JGVFFNPUSA-N 403.379 -0.118 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CCOCC2)cc1 1583257226 MZBOSWRHPOSPKI-UHFFFAOYSA-N 412.468 -0.161 50 10 HBGE Cn1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CN(C(=O)OC(C)(C)C)C3)C2)cn1 1638849728 PHPRNJVLWUKRTM-GFCCVEGCSA-N 421.458 -0.416 50 10 HBGE Cn1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C3CN(C(=O)OC(C)(C)C)C3)C2)cn1 1638849729 PHPRNJVLWUKRTM-LBPRGKRZSA-N 421.458 -0.416 50 10 HBGE C[C@@H]1[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CCN1C 1676207198 RLUJDGBULOTNDO-UKRRQHHQSA-N 411.532 -0.264 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CC(=O)N[C@H]2CS(=O)(=O)C[C@H]2Cl)C1 2195883703 PZARGZJTTCPYNQ-YTWAJWBKSA-N 419.853 -0.104 50 10 HBGE O=C(NC[C@@H]1CCCN(S(=O)(=O)c2sccc2B(O)O)C1)C(F)(F)F 2267615823 JLGOPCWKVHEEKH-QMMMGPOBSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)CO1 2282072813 JGDUUANPHOZSAB-QWRGUYRKSA-N 420.318 -0.364 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccccc2B(O)O)[C@@H](O)C1 2282090952 SFRKXMKPYIRQBV-STQMWFEESA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282336947 IARVRCACQKGXQA-NEPJUHHUSA-N 420.318 -0.782 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C(C)(C)C1 2282732841 MFRJVMPIINTJAK-NSHDSACASA-N 419.334 -0.112 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741149 KBGSOUINRQSRMX-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2362354287 RSXJRRVQTGNWPI-UHFFFAOYSA-N 410.239 -0.107 50 10 HBGE CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 746002923 NUARVSVAKBIPLW-KRWDZBQOSA-N 419.482 -0.039 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 746022353 BIUZATIFJJWHLQ-UKRRQHHQSA-N 413.452 -0.680 50 10 HBGE CC1(C)CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCS1(=O)=O 756914939 WMIAWOBPVWVRRZ-UHFFFAOYSA-N 417.513 -0.157 50 10 HBGE Cn1cnc2c1c(=O)n(CC(=O)OCCCI)c(=O)n2C 781223429 URJYHXUGTZIZPU-UHFFFAOYSA-N 406.180 -0.198 50 10 HBGE C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 793306472 ZUWJTXLSJQQJMU-IFXJQAMLSA-N 416.434 -0.247 50 10 HBGE CC(C)C[C@@H](C(N)=O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1137298794 BRVVYBPHYDYYSF-INIZCTEOSA-N 403.483 -0.261 50 10 HBGE CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1471977165 IGQYANWWIDOMJP-HOTGVXAUSA-N 416.544 -0.019 50 10 HBGE CC(C)(C)OC(=O)CN1CCCC[C@@H](NC(=O)NNC(=O)[C@@H]2COCCO2)C1=O 1565246733 IGMJUTKPGURSMY-OLZOCXBDSA-N 414.459 -0.545 50 10 HBGE Cc1ccc(C(=O)NNC(=O)CN2CCN(C[C@@H]3CCCS3(=O)=O)CC2)cc1 1655337272 AYVCLLQCJAIIRE-KRWDZBQOSA-N 408.524 -0.049 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)C[C@@H]1NC(=O)C(F)(F)F 2195883745 QRBFEBPCSKSBRM-CHWFTXMASA-N 419.853 -0.104 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1NC(=O)C(F)(F)F 2267613486 CSTBVQDFVREESC-SFYZADRCSA-N 400.209 -0.495 50 10 HBGE COc1ccc(S(=O)(=O)NOCCCNC(=O)OC(C)(C)C)cc1B(O)O 2282366584 QDTSPPNHHNMTIU-UHFFFAOYSA-N 404.250 -0.500 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282707482 ZHZNNXWUGKELEB-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccccc1B(O)O 2282720370 ZGIDUOYSFSFYPR-GFCCVEGCSA-N 400.262 -0.072 50 10 HBGE Cc1cc(S(=O)(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C)sc1B(O)O 2282736453 QOEPWTXBJIVPGE-LLVKDONJSA-N 422.334 -0.415 50 10 HBGE O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)[C@@H]1Cc2ccccc2O1 748280590 UENSFRLLOOCFLT-AWEZNQCLSA-N 400.416 -0.124 50 10 HBGE O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)CN1 1159504160 GUGSWDIQFMPVEI-AUTRQRHGSA-N 412.324 -0.100 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)N1 1287237757 HAGZJJRHDMNKRU-ZDUSSCGKSA-N 419.463 -0.727 50 10 HBGE C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3cnn(C)c3)CC2)C[C@@H](C)O1 1290837062 KGDMMBBZGYXHSI-CIXHOMRHSA-N 422.511 -0.175 50 10 HBGE O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)[C@H]1CCN1C1CCOCC1 1471976508 MFGQBXILXORDSY-MRXNPFEDSA-N 410.496 -0.244 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](O)C3CCC3)CC2)cc1 1630996616 NQNXQIRZFQIJHY-GOSISDBHSA-N 424.523 -0.390 50 10 HBGE CC(C)(C)OC(=O)NC(CO)(CO)CNS(=O)(=O)CI 2241808467 KXXUOUVDTCBSCR-UHFFFAOYSA-N 424.257 -0.454 50 10 HBGE O=C(NC1CN(S(=O)(=O)Cc2cccc(B(O)O)c2)C1)OCc1ccccc1 2255753886 XGRZKBBKGVOOMA-UHFFFAOYSA-N 404.253 -0.193 50 10 HBGE O=C(N[C@@H]1CCN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)c(O)cc1O 2267814020 ZAWAQMBLYMHJPO-CYBMUJFWSA-N 400.196 -0.082 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1CO 2282071460 RNKJAQQDRNLVBZ-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COC[C@@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282729607 PKYLYUHTQRBJGE-QWRGUYRKSA-N 420.318 -0.446 50 10 HBGE CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cnc2c(cnn2C)c1=O 10099168 ZBVYHPUQWMTHJB-UHFFFAOYSA-N 408.422 -0.110 50 10 HBGE O=C(NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 746385542 GHBUIJIEMCGCRJ-AWEZNQCLSA-N 405.411 -0.464 50 10 HBGE Cn1nccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 766327321 BQSSUDQLPCPSSL-UHFFFAOYSA-N 407.452 -0.555 50 10 HBGE CN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1 805044514 VGWRYRDYNMYRJF-LLVKDONJSA-N 417.513 -0.426 50 10 HBGE O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)[C@@H]1CCc2nncn2C1 816876079 OFEMMKGQKDOPPL-MRVPVSSYSA-N 411.216 -0.227 50 10 HBGE O=C(NNC(=O)[C@H]1CCN1C1CCOCC1)[C@H]1CC(=O)N(Cc2ccccn2)C1 1558458430 GICFLVAOVRSWMV-WMLDXEAASA-N 401.467 -0.169 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)co1 1596922663 CLYWOEJMGVACMJ-ZDUSSCGKSA-N 400.457 -0.456 50 10 HBGE CCOC(=O)N1CCC(NC(=O)CCCNC(=O)c2cc(B(O)O)ccc2F)CC1 1624573796 OVNMDJRGWREWKI-UHFFFAOYSA-N 423.250 -0.247 50 10 HBGE CCNC(=O)COc1ccc(CNC(=O)c2cc(B(O)O)ccc2F)cc1OC 1630233177 AESCAVJYPXBDEH-UHFFFAOYSA-N 404.203 -0.041 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCOCCNC(=O)OC(C)(C)C 2267626902 POIINACJCYCIMU-UHFFFAOYSA-N 408.307 -0.444 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC(CCCNC(=O)OC(C)(C)C)C1 2282074870 PHIARIFTTWOYRI-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE COc1ccc(S(=O)(=O)N(C)CCCNC(=O)OC(C)(C)C)cc1B(O)O 2282356492 VWFYCBMVRJPAIR-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@H]1CNC(=O)OC(C)(C)C 2282361633 UGLIDEQJKSFIIF-MNOVXSKESA-N 420.318 -0.446 50 10 HBGE CC[C@@](C)(CNC(=O)OC(C)(C)C)N(C)S(=O)(=O)c1nn(C)cc1B(O)O 2282424311 AOXDUUVDCWMHPL-HNNXBMFYSA-N 404.298 -0.586 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282699828 MGPPCKSQKKIPBX-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)c1cc(B(O)O)nn1C 2282702403 HYTHYOTUWLPUKV-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1ccccc1B(O)O 2283954153 BKCGQTPTZGUDKV-CYBMUJFWSA-N 400.262 -0.367 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1C 2362574465 UAHKNZJRHNKPNH-CABCVRRESA-N 416.243 -0.778 50 10 HBGE NNC(=O)C1CCN(C(=O)Cn2cncc(I)c2=O)CC1 97633031 XFASUYHNDOPZLA-UHFFFAOYSA-N 405.196 -0.924 50 10 HBGE COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)[C@@H]1COCCO1 790069014 ROVXXULMLSNMKB-NSHDSACASA-N 421.859 -0.225 50 10 HBGE CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1 793400062 HNPOJZCFPGUBPF-CQSZACIVSA-N 402.425 -0.265 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccc(B(O)O)c1 1291595512 HYTFLJQZBVBRQS-QGZVFWFLSA-N 418.280 -0.246 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 1354835831 LGDHJEJWTOEBEQ-LLVKDONJSA-N 412.449 -0.526 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)CC2=O)cn1 1645964139 YBENEAKMXBAIRS-WCQYABFASA-N 406.443 -0.070 50 10 HBGE CCON(CC)C(=O)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 1674430829 DYKCVXLWCGDJHY-UHFFFAOYSA-N 400.461 -0.276 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3cscc3B(O)O)[C@@H]2C1 2282733294 SZCBPUJZKMSYCO-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@H]3COCCO3)n(C)c2)C1 744654555 XXDKWXCOAMLSFQ-SWLSCSKDSA-N 414.484 -0.378 50 10 HBGE C[C@@H](Cn1cncn1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 749211264 LUEDLFWIKSMVEQ-ZDUSSCGKSA-N 423.503 -0.676 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(C)(C)c2ccc(F)cc2)n(C)c1=O 766633419 BUHFFSUCLJUPLP-UHFFFAOYSA-N 416.413 -0.302 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)n(C)c1 816876108 OPRVMCSDZSQODF-GFCCVEGCSA-N 423.499 -0.329 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(n3cccn3)CC2)CC1 1457671215 KXAVBCOQCFILEY-UHFFFAOYSA-N 405.484 -0.153 50 10 HBGE CCn1nc(C(=O)NNC(=O)N[C@H](C)[C@H]2CN(C)CCN2C)c2ccccc2c1=O 1471601615 MIBQZMZBWUSWMZ-CZUORRHYSA-N 415.498 -0.005 50 10 HBGE C[S@](=O)C1(C(=O)NNC(=O)[C@@H]2COCCO2)CCN(C(=O)OC(C)(C)C)CC1 1620975604 YVSGWPFEHKAZLE-JNFKXCBWSA-N 419.500 -0.303 50 10 HBGE CN([C@@H]1CC[C@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1c(B(O)O)cnn1C 2267199317 KQXXUYHRPYJGBI-HUUCEWRRSA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267383086 UHKWPAGNVDGGFW-SECBINFHSA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272655976 SHIRCZDPWNNHQY-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE CC1(C[S@@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2281869081 PYHPVFSHLZEUQT-HHHXNRCGSA-N 400.266 -0.416 50 10 HBGE C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282073333 MQVODINIJQPCDF-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE C[C@@H]1CC[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282079904 CAPOCCFSTNCEOT-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@@H](F)C1 2282736485 RHLUIXQXKIFHPG-VHSXEESVSA-N 423.297 -0.410 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccccc1B(O)O 2285302379 YJNCQPWMJYDRTM-GFCCVEGCSA-N 402.278 -0.737 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(NS(=O)(=O)c3cscc3B(O)O)CO[C@H]1C2 2359273910 LXZDTHMXXZVKBB-ZIBATOQPSA-N 418.302 -0.469 50 10 HBGE CNS(=O)(=O)c1ccccc1N1CCN(CC(=O)NNC(=O)C(C)(C)C)CC1 744396266 DXXRZPHPABMOHJ-UHFFFAOYSA-N 411.528 -0.090 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@H]2CCc3nncn3C2)CC1=O 816886373 VRRQRFSNUMCHGK-RRFJBIMHSA-N 403.487 -0.679 50 10 HBGE CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(NN=Cc2c(C)nn(CCO)c2C)n1 1084365231 DDGKLOUMCMVULT-SNVBAGLBSA-N 409.476 -0.296 50 10 HBGE O=C([C@H]1CCc2nnc(O)n2C1)N1CCN(S(=O)(=O)CBr)CC1 1546252080 QFGWBCPTVBEMTN-VIFPVBQESA-N 408.278 -0.628 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1635371990 MREVRLBZLFGFNN-HNNXBMFYSA-N 414.459 -0.495 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2ccccc2B(O)O)C1 2255673740 SNFOLQVVGFSGRO-UHFFFAOYSA-N 404.253 -0.087 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201897 VEAYZOXBJZGUMM-VXNVDRBHSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NS(=O)(=O)c2sccc2B(O)O)s[nH]1 2267210726 JCRPINQHRQFQMQ-UHFFFAOYSA-N 420.303 -0.473 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282380833 OQNRUYKTCWHITR-MNOVXSKESA-N 419.334 -0.018 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CNS(=O)(=O)c1sccc1B(O)O 2282710758 SDGGDUSQXIYZQE-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2cncc(B(O)O)c2)C1 2282714218 OVGDUZLFHOLVBK-CYBMUJFWSA-N 403.241 -0.755 50 10 HBGE COC(=O)[C@H](CC(=O)NCc1scc(C)c1B(O)O)NC(=O)OC(C)(C)C 2284010906 IDKSWCDKEYZKSC-JTQLQIEISA-N 400.262 -0.191 50 10 HBGE CCN1CCN(c2ccccc2NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC1 755473807 BNHWLWSZMJSSBA-ZDUSSCGKSA-N 412.516 -0.081 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)CS(C)(=O)=O 1470661765 UGCWOTOSDZTTLY-UHFFFAOYSA-N 417.509 -0.025 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)c1cccc(CN2C(=O)CNC2=O)c1 1596923956 YVYIMMZJKNFSOO-INIZCTEOSA-N 415.450 -0.247 50 10 HBGE COCc1nn(C)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1622153637 NGZRJPDYKNJCLW-UHFFFAOYSA-N 414.466 -0.215 50 10 HBGE Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1635372305 RIJQQRDAOOFZHK-HNNXBMFYSA-N 402.455 -0.005 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)ccc1=O 1653053386 DTSGRCWHQKFUNB-ZDUSSCGKSA-N 421.454 -0.338 50 10 HBGE CNC(=O)[C@H](CNC(=O)NNC(=O)[C@H]1COCCO1)Cc1ccc(OC)c(F)c1 1673913097 LKKQYJANMXMFRM-SWLSCSKDSA-N 412.418 -0.515 50 10 HBGE O=S(=O)(NCCN1CCN(Cc2ccccc2)CC1)c1sccc1B(O)O 2282065178 KGPGBULXYLNETM-UHFFFAOYSA-N 409.342 -0.476 50 10 HBGE CCN(CCN(CC)S(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282072636 HOMUEIVHMHETNR-UHFFFAOYSA-N 404.298 -0.633 50 10 HBGE O=S(=O)(NCCN1CCN(Cc2ccccc2)CC1)c1cc(B(O)O)cs1 2282072879 BDSWDPRSFDWVCK-UHFFFAOYSA-N 409.342 -0.476 50 10 HBGE CN([C@]1(CNC(=O)OC(C)(C)C)CCOC1)S(=O)(=O)c1sccc1B(O)O 2282081593 DNBHMCRHKBONSH-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282378183 BPTVWRSKJNTLFV-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COCCN2S(=O)(=O)c2cc(B(O)O)cs2)C1 2282698662 CZGROKBOWLQWHL-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE C[C@H]1CC[C@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cscc2B(O)O)C1 2282725026 VBIOGPIVBWSRHE-DTWKUNHWSA-N 414.236 -0.104 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741147 KBGSOUINRQSRMX-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1cc(F)c(F)cc1B(O)O 2326739326 HWXMQEOSTVZDCS-UHFFFAOYSA-N 410.163 -0.318 50 10 HBGE COc1ccc(OC)c(/C=N/NC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)c1 10038258 DXFSHKORIBMLFW-DNTJNYDQSA-N 400.395 -0.399 50 10 HBGE Cn1nc(SCC(=O)NN=CC2CN(C(=O)OC(C)(C)C)C2)c(=O)n(C)c1=O 758870342 VTWMNEODDRNATO-UHFFFAOYSA-N 412.472 -0.460 50 10 HBGE CCC[C@@H]1C[C@@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CCO1 779934782 FFIXFBLQWOXTKD-NWDGAFQWSA-N 406.443 -0.824 50 10 HBGE C[C@@](O)(Cn1ccccc1=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794077504 WQMQMCKXOLKTPW-LJQANCHMSA-N 402.407 -0.327 50 10 HBGE CC[C@@H](C)[C@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)NCCN1CCOCC1 1143965638 SQLQRGLWRHEATA-DYVFJYSZSA-N 409.267 -0.902 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCc3nc[nH]c3C2)CC1 1610947951 LLSZSEOTLXMYEM-ZDUSSCGKSA-N 419.511 -0.011 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)[C@H]1C[C@@H](O)CN1c1ccncn1 1623534496 QFNDVYJTVSYULN-ZYHUDNBSSA-N 409.244 -0.022 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CCCN(CC(F)(F)F)C1=O 1650867584 LQHMGEPOHLDBEE-LLVKDONJSA-N 401.345 -0.240 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267206618 JDQLZLQSONSNBZ-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2sncc2B(O)O)CC1 2281910494 SCWFEKCLVKCCTJ-HHHXNRCGSA-N 418.306 -0.471 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)sc1B(O)O 2282741420 NJXPKLUFRCTZSA-WDEREUQCSA-N 420.318 -0.758 50 10 HBGE COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)[C@@H](C)Sc2n[nH]c(=O)[nH]c2=O)c1O 169890658 OSMOJAFUXCLPNN-SVSQBPIJSA-N 410.368 -0.289 50 10 HBGE CC(=O)NNC(=O)C[S@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 586304761 XKBKIVLSZNDZFT-UQTVHIPJSA-N 414.509 -0.174 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)ccc1=O 1134635363 TZGCPTFYUOIWHD-ZDUSSCGKSA-N 412.402 -0.029 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1 1149617769 SFKSDQXNYPUBEC-SNVBAGLBSA-N 409.511 -0.517 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1350637300 DGFQPLUDUJDARP-UHFFFAOYSA-N 411.528 -0.372 50 10 HBGE NC(=O)c1ccc(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)cn1 1546252056 PPWSHRQEVKNKBZ-UHFFFAOYSA-N 405.274 -0.451 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(Cc2nnnn2-c2ccccc2)CC1 1584648477 SGLTYBRZSDMFKK-UHFFFAOYSA-N 410.218 -0.561 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1=C2CCCN=C2NN1 1634403511 LEVZLHKRBYXNQM-UHFFFAOYSA-N 406.468 -0.295 50 10 HBGE COC(=O)c1ccc2c(c1)CC[C@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)N2 1652788709 YTCOTOHRCROKEE-INIZCTEOSA-N 400.171 -0.025 50 10 HBGE COc1cc(Cl)ccc1C(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1684747176 STVGRPIAOONAAO-QGZVFWFLSA-N 412.830 -0.080 50 10 HBGE C[C@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ccnc(B(O)O)c1 2108227763 KFDPGERMNCYCIZ-KRWDZBQOSA-N 421.215 -0.473 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1cscc1B(O)O 2255885120 KROUOXMODBCTSK-UHFFFAOYSA-N 400.234 -0.134 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@@H]2CN1S(=O)(=O)c1sccc1B(O)O 2267212511 WAKBTFYSIFUQEQ-JFGNBEQYSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(NS(=O)(=O)c2cscc2B(O)O)n[nH]1 2267384376 LUXYWOVTFIELTA-UHFFFAOYSA-N 403.251 -0.629 50 10 HBGE Cn1nc(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c(B(O)O)c1Cl 2281651858 WHJTUYYIJBAXRV-SECBINFHSA-N 402.644 -0.881 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282067306 YDSHIGKYCSGBDA-ZDDJMSTPSA-N 418.302 -0.613 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1 2282084127 NKXAHZOMBJKSJN-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CCN(NS(=O)(=O)c2c(Cl)cccc2B(O)O)CC1 2282727016 FRXVFFITHCNWKO-UHFFFAOYSA-N 419.696 -0.234 50 10 HBGE Cc1cc(NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)cc(B(O)O)c1 2360552029 WAYUPOJBBKDWIB-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)[C@H]3COCCO3)cn2)C[C@@H](C)O1 756839388 QNOVZKZOOZLYLU-YRGRVCCFSA-N 410.431 -0.913 50 10 HBGE CN1C(=O)C[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(F)cc1 758676396 MYNDLUYBAOSEMJ-KCQAQPDRSA-N 412.443 -0.137 50 10 HBGE COc1ccnc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)n1 920087359 PEJOXKQWUXRXNY-UHFFFAOYSA-N 405.484 -0.238 50 10 HBGE COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)N(C)C)cc1Br 1136634690 MMTOBNXPNYJBMD-UHFFFAOYSA-N 409.262 -0.385 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@H]2COCCO2)C[C@H](O)CN1C(=O)OCc1ccccc1 1545111644 YWZPPIPIUYPEAR-QMTMVMCOSA-N 407.423 -0.289 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCS1(=O)=O 1627449256 VEAVLURXBLSOOW-XQQFMLRXSA-N 419.500 -0.017 50 10 HBGE CN1CCO[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1=O 1628159877 RAFLEEWKYDTFBF-OAHLLOKOSA-N 424.479 -0.521 50 10 HBGE COc1ccccc1NCC(=O)NNC(=O)c1c2c(nn1C)CCS(=O)(=O)C2 1641116521 LYZNHRNNOIEKJK-UHFFFAOYSA-N 407.452 -0.227 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnn2cccc(Br)c12 1641246817 KZUJYXXHRQAFSC-ZETCQYMHSA-N 404.246 -0.205 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2271974903 HJOAKIZKERMBIN-ZJUUUORDSA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272655806 SBJYNKYBEBQZEJ-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE Cc1nn(C)c(C(=O)N2CCC[C@@H](NC(=O)OCc3ccccc3)C2)c1B(O)O 2278563965 KAMVZCDDBOUHHJ-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282334372 AJINFKTUNPUIBL-GHMZBOCLSA-N 402.282 -0.868 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1B(O)O 2282730893 JFQBSSYNFXKSAI-NSHDSACASA-N 402.278 -0.091 50 10 HBGE C=C(CS(=O)(=O)N1CC(n2cc(CNC(=O)OC(C)(C)C)nn2)C1)B(O)O 2282731711 VGSGAMLWPHJYQU-UHFFFAOYSA-N 401.254 -0.943 50 10 HBGE CC(C)[C@H](NC(=O)C(C#N)=CN(CCN(C)C)[C@@H]1CCS(=O)(=O)C1)C(=O)O 2324993984 SIPDKYIVQOSXKA-CABCVRRESA-N 400.501 -0.330 50 10 HBGE O=C(CN1CCN(CC(=O)N2CCOCC2)CC1)NNC(=O)c1ccccc1Cl 23302841 USDGWINLQNDGNI-UHFFFAOYSA-N 423.901 -0.423 50 10 HBGE CC(=O)Oc1ccc(C(C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 254845418 CLEVKTOOTKBNAU-UHFFFAOYSA-N 412.406 -0.101 50 10 HBGE Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 728372960 VZJYEWDKNYJACN-LBPRGKRZSA-N 403.482 -0.754 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 744650193 PEQCGFQJLMXFAJ-CQSZACIVSA-N 417.415 -0.977 50 10 HBGE CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)[C@H]2COCCO2)CC1 808279307 ZWRUANGPJKPPEV-TZMCWYRMSA-N 406.505 -0.475 50 10 HBGE Cc1cc(F)c(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 1294587770 KVOFBHDGQIIHBH-UHFFFAOYSA-N 420.376 -0.590 50 10 HBGE Cn1ccn2c(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)nnc2c1=O 1471185317 VVBCWTIDTYFPSP-UHFFFAOYSA-N 409.204 -0.337 50 10 HBGE COC(OC)[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1479156477 JXEJQFDVWUJLRJ-GFCCVEGCSA-N 402.473 -0.047 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1539401650 HPBAHULEFRFNLV-KBPBESRZSA-N 411.455 -0.201 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)cs1 1623309305 QZXDUJGKIYLTLN-UHFFFAOYSA-N 413.261 -0.583 50 10 HBGE O=C(COc1ccccc1O)NNC(=O)NCC1(N2CCOCC2)CCOCC1 1686728909 LTNPPMOWQABPTH-UHFFFAOYSA-N 408.455 -0.017 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2cscc2B(O)O)C1 2267382674 OHGKAWCPHNVZSE-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cscc1B(O)O 2267623472 JGGJPEHHEPESQF-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)c2cscc2B(O)O)CC1)C(F)(F)F 2270594677 HYSACURXDSRGRK-QMMMGPOBSA-N 400.209 -0.350 50 10 HBGE CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282072366 DPZGQXIOTOOICE-NSHDSACASA-N 402.282 -0.880 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282334080 WYPFWWPNKMQQET-QWRGUYRKSA-N 419.334 -0.255 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C 2282358013 SAYYZUMZJVOABM-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 729453477 CAYMQZMWHYUTMC-UHFFFAOYSA-N 413.481 -0.114 50 10 HBGE O=C(NNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1)[C@@H]1COCCO1 746002792 MSLCTJPOPVDUMP-HNNXBMFYSA-N 416.438 -0.391 50 10 HBGE C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1148918781 FYOBDGVRJMZYIA-GZMMTYOYSA-N 422.385 -0.202 50 10 HBGE COC(=O)[C@@H](F)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1255354807 YFKGAIZVXCRLRG-LBPRGKRZSA-N 418.451 -0.845 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)c2cc(Br)cn2C)C1 1470963451 BCTPMMDCOWZTTQ-UHFFFAOYSA-N 423.293 -0.778 50 10 HBGE COc1ccc(C(=O)NNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)cc1Br 1542899108 QNVBURLOJIJSSC-NQBHXWOUSA-N 401.213 -0.369 50 10 HBGE Cc1cc(=O)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cn1C 1638390174 QBRVVBYHIIRAGI-UHFFFAOYSA-N 420.495 -0.218 50 10 HBGE Cc1nnc2n1C[C@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1ccc(C#N)cc1)C2 1656451426 YWJZVXBOCPCCOV-OAHLLOKOSA-N 410.438 -0.808 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H]2C(NC(=O)OC(C)(C)C)[C@H]2C1 2267393531 ZSZKEEIOPSAIGA-UWVGGRQHSA-N 402.303 -0.120 50 10 HBGE C[C@H]1CN(C(=O)c2cc(B(O)O)n(C)n2)C[C@H](C)N1C(=O)OCc1ccccc1 2267426857 KHMMRKYMMRKVDU-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE CC(C)(C)OC(=O)NCC12CC(NS(=O)(=O)c3sccc3B(O)O)(CO1)C2 2282088171 YUCDTSNWGQRIQH-UHFFFAOYSA-N 418.302 -0.468 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccccc2B(O)O)[C@@H](O)C1 2282090948 SFRKXMKPYIRQBV-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE COC1(CCNC(=O)c2ncncc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2282220095 GEGKXNDOYRATJX-UHFFFAOYSA-N 414.227 -0.686 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)Cc3ccsc3B(O)O)[C@H]2C1 2282338476 NWZZAKYIOPQUQK-CHWSQXEVSA-N 416.330 -0.040 50 10 HBGE CC[C@@H](CNS(=O)(=O)c1cc(B(O)O)ccc1OC)NC(=O)OC(C)(C)C 2282721601 UESSDDDMIHRRET-LBPRGKRZSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1cscc1B(O)O 2334267264 SSBRXKLKJKEXNT-UMNHJUIQSA-N 402.303 -0.038 50 10 HBGE CC[S@@](=O)CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 741424886 OFMFAHDPHYNORJ-RUZDIDTESA-N 404.514 -0.285 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@@H]1COCCO1 745638645 VNZOSPJVIUUDJC-HNNXBMFYSA-N 412.468 -0.283 50 10 HBGE COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 745979580 WUHMCYYVFZCWKX-NSHDSACASA-N 423.241 -0.039 50 10 HBGE CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)O1 793037943 MWAJRVVKJDKFNE-HUUCEWRRSA-N 421.454 -0.121 50 10 HBGE N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1 810274835 GMUDOGXSZINDLU-MRXNPFEDSA-N 400.416 -0.012 50 10 HBGE N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1 810275262 OARJVOSORQQOFZ-MRXNPFEDSA-N 400.416 -0.012 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)c2ccccc2C1=O 1168868638 GFDYJXCRFZBQQX-LBPRGKRZSA-N 413.477 -0.404 50 10 HBGE O=C(CNC(=O)CNC(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2)NCc1ccccc1 1255243026 RPCSRMIYQISQAY-QLFBSQMISA-N 403.439 -0.683 50 10 HBGE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1303883066 PLXCZOHABCIZDO-HUUCEWRRSA-N 402.517 -0.507 50 10 HBGE COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CO)N(S(C)(=O)=O)CC2 1457506999 YGRNEMAIAZJMOA-GFCCVEGCSA-N 401.441 -0.908 50 10 HBGE O=C(C[C@@H]1CCCS1(=O)=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1465792199 WARUXNCLOANWBQ-INIZCTEOSA-N 422.507 -0.441 50 10 HBGE CN(NC(=O)C1=NN2CCCN=C2N1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1466673771 UKRJTUQTLVTMIF-UHFFFAOYSA-N 408.463 -0.400 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)c1 1540291364 SWWBNTJICCDCOM-CBDOYQQHSA-N 406.464 -0.387 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)c2ccccc2c1=O 1618241506 PALWYZSZMBACHV-UHFFFAOYSA-N 422.463 -0.200 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)N1 1623368576 QYLSQKPWQAPIEW-FZMZJTMJSA-N 400.391 -0.499 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)[C@H]1CCC(=O)N1 1642270201 HPIBKWWZQMVKDI-OAHLLOKOSA-N 404.448 -0.066 50 10 HBGE COC(=O)[C@H]1C[C@@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1 1654359688 HHFOBQAUWBDGAQ-BETUJISGSA-N 411.484 -0.340 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)[C@@H]1CCCCO1)C1CCCC1 1674042473 VBUQBHINDBGINM-KBPBESRZSA-N 405.521 -0.159 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1sccc1B(O)O 2267606703 BNZJMIZXECDLBZ-JGVFFNPUSA-N 400.209 -0.352 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cscc1B(O)O 2267623475 JGGJPEHHEPESQF-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE Cc1oc(B(O)O)cc1C(=O)N1CCS(=O)(=O)CCN1C(=O)OC(C)(C)C 2281600385 ZADHFZPWDRGKGJ-UHFFFAOYSA-N 402.234 -0.709 50 10 HBGE C[C@@H](CCCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282364341 UTYSNBLEGPWORI-NSHDSACASA-N 404.298 -0.586 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCCC[C@@H]2CNC(=O)OC(C)(C)C)n1 2282377270 OSYJNXKYMPYLLS-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCCCCCNC(=O)OC(C)(C)C)n1 2282737019 YMAKSDBWWVPJEG-UHFFFAOYSA-N 404.298 -0.537 50 10 HBGE COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CSCN2C(C)=O)cc1OC 730311553 MCMCBSDWHLEHIK-GFCCVEGCSA-N 411.436 -0.071 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cnc2c1c(=O)n(C)c(=O)n2C 747842107 XMWIFOOOOGHFNJ-CQSZACIVSA-N 409.402 -0.295 50 10 HBGE Cc1ccc2[nH]c(C(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c(C)c2c1 766635150 AALKQNQHLNKODD-UHFFFAOYSA-N 423.433 -0.007 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCCCO3)cc2S1(=O)=O 1129265096 BWXHSIHLJUERLK-ZDUSSCGKSA-N 411.436 -0.192 50 10 HBGE 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C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1472504777 IISKFWNWPHCZRP-WYUUTHIRSA-N 404.489 -0.141 50 10 HBGE CN(C)CCn1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1628315953 JVPVLNPMDKABER-UHFFFAOYSA-N 408.484 -0.230 50 10 HBGE CN(CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCC[C@H]1O 1629942072 GLQDKBMAJZQMNJ-HZPDHXFCSA-N 412.512 -0.004 50 10 HBGE C[C@H](C(=O)NNC(=O)N1CCN(C)CC1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1635084350 RBNILAMMHXSCML-CYBMUJFWSA-N 412.491 -0.558 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2nn(C)cc2I)nn1 1686449927 HZBRRJOXVWGMOJ-UHFFFAOYSA-N 404.172 -0.703 50 10 HBGE O=C1CC[C@H](N2Cc3c(NC(=O)c4ccc(B(O)O)cc4)cccc3C2=O)C(=O)N1 1866097148 GZFSVSPNSSYJEQ-INIZCTEOSA-N 407.191 -0.620 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@@]1(C)CCN1C(=O)OC(C)(C)C 2282071932 XUQBXTFYMGWUPO-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@H]1CNC(=O)OC(C)(C)C 2282247647 ITJILOBWOMJMDU-NXEZZACHSA-N 400.672 -0.014 50 10 HBGE CC1(NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282358568 BAFHMGFAULSILB-UHFFFAOYSA-N 406.216 -0.068 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1C[C@]2(CCN(C(=O)OC(C)(C)C)C2)CO1)B(O)O 2282376266 BAEHIKYJXAJQLI-BBRMVZONSA-N 404.294 -0.110 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@](F)(CNS(=O)(=O)c2cncc(B(O)O)c2)C1 2282720231 XGCNGFSTWAJQAZ-WGRBQBNCSA-N 403.241 -0.565 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCc1c[nH][nH]c1=NC(=O)OC(C)(C)C 2282726951 VKIAMFSLVXVXQH-UHFFFAOYSA-N 416.290 -0.293 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)([C@H](F)C(=O)Nc2nc(B(O)O)ccc2Cl)C1 2284034501 FQADNHFJMOAQAK-SNVBAGLBSA-N 403.603 -0.327 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2285207433 XYUOZOSBELBQQI-IAGOWNOFSA-N 413.239 -0.116 50 10 HBGE NS(=O)(=O)c1cnn(CC(=O)NNC(=O)c2ccccc2Br)c1 748554010 XOWWIDPLHFMRLJ-UHFFFAOYSA-N 402.230 -0.246 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1178420134 DPJRASYFXYCQCL-SRVKXCTJSA-N 413.418 -0.390 50 10 HBGE CCC[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)S(N)(=O)=O 1540277321 GCJJJJFSSASKTE-MRXNPFEDSA-N 411.528 -0.197 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)C1CCOCC1 1624972639 QEBHMEXFQFKGDM-UHFFFAOYSA-N 418.493 -0.308 50 10 HBGE CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NC(C)(C)C)s1 1628887550 UFMNGUSTXNHPJJ-UHFFFAOYSA-N 421.570 -0.044 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc2c1CCC2 1646044229 HBHHTKHVYPUEFX-INIZCTEOSA-N 422.507 -0.163 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2267210956 KWOAQEIJEBFRCO-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282706494 MINWMOBLOFOTHN-LLVKDONJSA-N 404.298 -0.682 50 10 HBGE CN(Cc1ccccc1)[C@@]1(CNS(=O)(=O)c2cscc2B(O)O)CCOC1 2282734881 ROXUWENYTPYTST-QGZVFWFLSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1(C)C 2282736599 SVVYJPUFQUMXKC-MNOVXSKESA-N 419.334 -0.066 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)Cc2ncsc2B(O)O)CC1)C(F)(F)F 2282740042 SWLKEYZRJHIXIP-UHFFFAOYSA-N 415.224 -0.957 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H](CN(C)Cc1ccccc1)C(=O)O 2284411788 ONSDWPUTXKWBCR-ZDUSSCGKSA-N 412.298 -0.400 50 10 HBGE COc1ccc(CC(=O)NCC(=O)NN=C2C(=O)N(CC(N)=O)c3ccccc32)cc1 254771320 WGXBYVUUBYVKQN-UHFFFAOYSA-N 423.429 -0.294 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 744640991 HDDNDURTVPCDKX-HIFRSBDPSA-N 413.452 -0.680 50 10 HBGE O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)ccc1Br 745979527 UUMILYSTHGCXKO-SNVBAGLBSA-N 409.214 -0.128 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2scnc2C2CC2)n(C)c1=O 760734506 JUXLJGHUGXLVNY-UHFFFAOYSA-N 403.424 -0.771 50 10 HBGE O=C(NCc1ccccc1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 787367085 XBSHIDHIFDKVAT-CYBMUJFWSA-N 407.452 -0.318 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3CN(S(C)(=O)=O)C3)CC2)cc1 1445564356 HHXKCNZLMKLMCH-UHFFFAOYSA-N 423.539 -0.849 50 10 HBGE C=CCn1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1 1457671315 LTELBUOQDSMUOZ-UHFFFAOYSA-N 406.472 -0.448 50 10 HBGE CN1CCC[C@@](O)(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1 1622153505 IJMMWGHVYSOONB-OAQYLSRUSA-N 417.510 -0.561 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN(C)C[C@@H](O)CNC(=O)OC(C)(C)C)n1 1654508477 LOCLGJRLRSFXMZ-LBPRGKRZSA-N 415.516 -0.041 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@@H]2CN1S(=O)(=O)c1ccc(B(O)O)s1 2267207636 DHCRKKQRBBJLFX-OUAUKWLOSA-N 402.303 -0.038 50 10 HBGE CN([C@@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2267611606 UFTDTAJEVYEHLY-CQSZACIVSA-N 422.272 -0.869 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282853427 CSSQCBDZVYTDSO-GFCCVEGCSA-N 420.318 -0.517 50 10 HBGE O=c1cc(CCl)c2cc(F)c(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(F)c2o1 106382296 ATTAHAWLQLRXSU-IFYLGZELSA-N 408.737 -0.011 50 10 HBGE O=C(CN1CCC(NC(=O)NNC(=O)[C@H]2COCCO2)CC1)Nc1ccccc1 745415239 GMJXDXUZKVSFNR-MRXNPFEDSA-N 405.455 -0.165 50 10 HBGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765726865 HBVIEXVTRRHRQV-DHZHZOJOSA-N 414.397 -0.176 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cc3ccccn3)CC2)cn1C 765758598 OJYDKMXAWUIJJJ-UHFFFAOYSA-N 421.483 -0.587 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(I)n1 1135771144 GDQPMIFLGHNQHV-ZCFIWIBFSA-N 412.209 -0.780 50 10 HBGE CCOc1ccc(C(=O)NCC(=O)NNC(=O)CS(C)(=O)=O)cc1OCC 1149617664 PPVFAXBPXBSQHC-UHFFFAOYSA-N 401.441 -0.594 50 10 HBGE O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1540374041 FLEARNLIYYRJPJ-HNNXBMFYSA-N 417.443 -0.207 50 10 HBGE O=C(NNC(=O)c1c(Br)nc2n1CCC2)N[C@@H]1CCS(=O)(=O)C1 1597426811 WCSJIMJJCYELRJ-SSDOTTSWSA-N 406.262 -0.277 50 10 HBGE CN1CCC(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1 1622153332 BGQXHFJUFNGTFU-UHFFFAOYSA-N 417.510 -0.297 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc(OC)c1OC 1648139284 XJDVBWCCVCUVLB-UHFFFAOYSA-N 418.406 -0.398 50 10 HBGE COC(=O)[C@@H]1C[C@@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231658126 APIOVTYZFCDBCX-CABCVRRESA-N 401.184 -0.512 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2sccc2B(O)O)C1 2267209475 XGXNHKSFNZTWHQ-IJRMKIOGSA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272655146 LICJYEPEAMBUEX-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE Cc1ccnc(C(=O)N[C@@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c1B(O)O 2281889962 YTCWXKBJDNFILE-HZPDHXFCSA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@](CO)(NS(=O)(=O)c2cscc2B(O)O)C1 2282373732 QTGRGBGODLNROR-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC1(CNS(=O)(=O)Cc2ncsc2B(O)O)CC(NC(=O)OC(C)(C)C)C1 2282743259 NBUGKTPLFKNKSY-UHFFFAOYSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2cnsc2B(O)O)C1 2362498072 ZQELTQBKXIPPOM-UHFFFAOYSA-N 407.204 -0.830 50 10 HBGE Cc1cc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)nc2c1c(=O)n(C)c(=O)n2C 737821398 BNRSLPFPSQKSAN-AWEZNQCLSA-N 409.402 -0.295 50 10 HBGE CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)ccc1OC 751549625 WDMVKEDLDPUPJS-AWEZNQCLSA-N 401.441 -0.554 50 10 HBGE COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2 758030950 UHQQRBNYPHFDPT-LLVKDONJSA-N 414.484 -0.853 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 758043247 GLEHQBRPKJJJKM-DUFXMDAXSA-N 400.432 -0.570 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNc1ccccc1S(=O)(=O)N1CCOCC1 765728655 OCDOMWOQBVOCKA-UHFFFAOYSA-N 419.463 -0.024 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2C3CC4CC(C3)CC2C4)n(C)c1=O 766641803 CLSYLNYUGXGIAG-UHFFFAOYSA-N 414.466 -0.347 50 10 HBGE C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1 816873239 BJNXJLMKBJWNLV-ZDUSSCGKSA-N 404.452 -0.234 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)cn1 1350199260 MDUFXQSYQKUUIR-GFCCVEGCSA-N 405.436 -0.362 50 10 HBGE CC(C)(C)OC(=O)C1(C(=O)NNC(=O)CN2CCCC2=O)CCS(=O)(=O)CC1 1454878198 LHWHSTUKKQVEPK-UHFFFAOYSA-N 417.484 -0.707 50 10 HBGE CN(CCNC(=O)NNC(=O)[C@H]1CCC(=O)N1)S(=O)(=O)c1ccc(F)cc1 1478531890 IQSILMGIAUZZRT-GFCCVEGCSA-N 401.420 -0.945 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CN(C3CCOCC3)C2)c1 1538534738 LYKNSDXIFPTYTQ-UHFFFAOYSA-N 410.496 -0.191 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=S)N[C@@H](C)C1CC1 1557285502 BEZMPVPJURBAQE-WCBMZHEXSA-N 402.546 -0.002 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CS1(=O)=O 1565030590 DJSHZFLNDOVZJD-GXTWGEPZSA-N 410.500 -0.011 50 10 HBGE CCc1nn(C)c(C(=O)N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)c1B(O)O 2282389797 HVCYAOPTUFAYQR-UKPHBRMFSA-N 412.255 -0.198 50 10 HBGE O=C(O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2284403854 UXYUGGCVYLMBKO-OAHLLOKOSA-N 413.644 -0.032 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1cccc(B(O)O)c1 2365476110 BOZUTUQOYFWOHE-AWEZNQCLSA-N 402.278 -0.675 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)nn1 1147207254 GWKDGWSEKXUSOV-UHFFFAOYSA-N 406.346 -0.427 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)Cc1ccccn1)C1CCCC1 1230509707 BDCGWAUEFHLZHZ-HNNXBMFYSA-N 412.516 -0.091 50 10 HBGE Cn1cc(Br)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1=O 1292045588 UFMFLIXGOQSGNL-ZETCQYMHSA-N 407.246 -0.721 50 10 HBGE CCCn1nc(C(=O)NNC(=O)C2(OC)CS(=O)(=O)C2)c2ccccc2c1=O 1348601817 CQQOYAORPQECNO-UHFFFAOYSA-N 408.436 -0.619 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC(O)(COCCO)CC2)cc1OC 1460802870 VRWCIQXOEARSOZ-UHFFFAOYSA-N 411.455 -0.699 50 10 HBGE C[C@]1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCCS1(=O)=O 1466476014 QOENKAZMHDXBDL-LLVKDONJSA-N 403.320 -0.220 50 10 HBGE O=C(NCCC1CS(=O)(=O)C1)NNC(=O)c1csc(N2CCOCC2)n1 1564573446 LYICNXRHASTGQS-UHFFFAOYSA-N 403.486 -0.642 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1=CS(=O)(=O)CCC1 1587969284 XTJFULGCMNXIHR-UHFFFAOYSA-N 420.491 -0.316 50 10 HBGE CC(C)N1CC[C@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)[C@@H](c2cnn(C)c2)C1 1623510087 QGSKWSIECZKMKO-CWRNSKLLSA-N 411.528 -0.184 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCc2nnc(O)n2C1 1623945576 LAODTOYNHGYUSL-OAHLLOKOSA-N 413.482 -0.094 50 10 HBGE C[C@]1(NNC(=O)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)CCS(=O)(=O)C1 1673834902 GWKUFPWJNBEZDS-ABAIWWIYSA-N 403.482 -0.398 50 10 HBGE O=C(NCCS(=O)(=O)C1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2 1681278952 RLQIGOGJCYRCCW-UHFFFAOYSA-N 413.452 -0.004 50 10 HBGE N#C/C(=C\c1cccc(Br)c1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 1866131084 XLHZEAYLLWABSI-ONGUXMQPSA-N 413.224 -0.728 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)NCCN(OCc1ccccc1)C(=O)OC(C)(C)C 2243409758 OGSDHBMKRJWDTO-UHFFFAOYSA-N 419.247 -0.406 50 10 HBGE C[C@@H]1C[C@H](CNS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282081812 GARBAHUYYXXRCC-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ccsc1B(O)O 2282327706 MEUSGKRHEUCVSP-PSASIEDQSA-N 414.236 -0.211 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2C[C@@H]2CNC(=O)OC(C)(C)C)cc1B(O)O 2282367650 FFOCINDIILWDHG-MFKMUULPSA-N 400.262 -0.434 50 10 HBGE CN(C[C@@H]1CCCN1S(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282367976 JZDWJIPWWZGJHJ-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c(B(O)O)c1 2282373470 MXLGWLDCCMNABJ-STQMWFEESA-N 400.262 -0.755 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NC(=O)c2n[nH]cc2B(O)O)C(C)(C)C1 2282396320 XXWHTRNWSLDIGN-HHHXNRCGSA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]21 2282414014 MVTBJBAQEKXDRW-USWWRNFRSA-N 417.318 -0.360 50 10 HBGE COC(=O)[C@H](CC(=O)N(C)Cc1csc(B(O)O)c1)NC(=O)OC(C)(C)C 2284012648 XIQSLXDZGOBSHL-NSHDSACASA-N 400.262 -0.157 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)n1C 2362572365 ZURDKUIKWXHBOQ-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE Cn1nc(Br)c(Br)c1C(=O)Nc1ncc(B(O)O)cn1 2364227949 GSDNPFLBOPIZIB-UHFFFAOYSA-N 404.815 -0.333 50 10 HBGE C[C@H](c1cc(B(O)O)cs1)N(C)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2370330794 GFRCTSJTNRFSFS-SNVBAGLBSA-N 402.278 -0.805 50 10 HBGE C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)C1 745999441 XQBJPJQMEBXYBY-OWCLPIDISA-N 411.503 -0.545 50 10 HBGE C#CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)[C@H]1CCS(=O)(=O)C1 756587164 ZLTTYLVHHYIWGL-AWEZNQCLSA-N 409.464 -0.413 50 10 HBGE COc1c(O)nc(O)nc1C(=O)N1CCN(S(=O)(=O)CBr)CC1 1137882038 JKEYQIYRHVRAEI-UHFFFAOYSA-N 411.234 -0.664 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3ncon3)CC2=O)cc1OC 1289421257 XKEFRRHUTSYGKC-LBPRGKRZSA-N 403.395 -0.061 50 10 HBGE Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN(S(=O)(=O)CBr)CC1 1446959135 MHYHNONRCKUOJE-UHFFFAOYSA-N 410.250 -0.074 50 10 HBGE CCn1nc(C(=O)NNC(=O)CCC(=O)N2CCC(O)CC2)c2ccccc2c1=O 1540379850 HZDWEIGVFJGULS-UHFFFAOYSA-N 415.450 -0.059 50 10 HBGE O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@@H]1CCCCO1 1569674027 RWXDUAQASRXRNL-AWEZNQCLSA-N 413.452 -0.157 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C(=O)O1 1638100807 JXTGBEGFLQQKAL-DGCLKSJQSA-N 412.472 -0.652 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NS(=O)(=O)Cc1ccsc1B(O)O 2267716219 JSQIXGAZPPUAOX-GRYCIOLGSA-N 402.303 -0.145 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 2282066012 PTUNGTCWWMUGIA-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2282076349 HBJHZGIXCARZDP-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1NS(=O)(=O)c1cscc1B(O)O 2282741152 KCBJOOPQGPJQPT-MHNYQROPSA-N 418.302 -0.613 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(Br)cn1C 728463193 WQVYDOUDVGFGOM-LLVKDONJSA-N 414.260 -0.324 50 10 HBGE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2COCCO2)c(OC)c1 744650211 WHMIOZHQLDRUIO-ZBFHGGJFSA-N 407.423 -0.129 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)n(C)c2n(C)c1=O 748161330 JKFPIUOUVLRFSE-UHFFFAOYSA-N 405.436 -0.264 50 10 HBGE O=C(NNC(=O)c1cnn2cc(Br)cnc12)N[C@@H]1CCS(=O)(=O)C1 1319963815 ZBVGKJAIWRKCHM-MRVPVSSYSA-N 417.245 -0.377 50 10 HBGE C/C(=C/C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN1CCOCC1 1538535104 UKSSRJCNJRQKQO-KAMYIIQDSA-N 410.496 -0.024 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267199772 QOXCOEZOHQNWOR-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2267382194 HJLQYULGPXVQNP-UWVGGRQHSA-N 402.303 -0.038 50 10 HBGE Cc1cc(S(=O)(=O)NN2CCN(C(=O)OC(C)(C)C)CC2)sc1B(O)O 2267382983 SEQOKXYTTCIBNB-UHFFFAOYSA-N 405.307 -0.518 50 10 HBGE COCC1(CNS(=O)(=O)c2cc(B(O)O)cs2)CN(C(=O)OC(C)(C)C)C1 2282071841 WYWVFTWCDKBKIV-UHFFFAOYSA-N 420.318 -0.410 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1ccccc1B(O)O 2282102240 JWUBINOSRGGFOJ-LBPRGKRZSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C12CC2 2282369777 LGWIURMWZQUYQW-LLVKDONJSA-N 417.318 -0.216 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)[C@@H](C)CN1C(=O)OC(C)(C)C 2282505346 BYPINEPZCYSQCQ-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@@](C)(NC(=O)OC(C)(C)C)C1 2282712150 LVVGWXPGKULJQG-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE O=S(=O)(c1ccc(B(O)O)s1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2282716154 QBGNFBUWSJYABM-GJZGRUSLSA-N 408.310 -0.298 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COCCN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282731888 XYMNIJJTJUVSDC-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282850169 LTQKGZQLYRGAFU-QWRGUYRKSA-N 402.253 -0.055 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1cc(N2CCCS2(=O)=O)ccc1F 756154567 KWTRZTNWVYXISV-CYBMUJFWSA-N 402.404 -0.066 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)[C@H]1COCCO1 794589564 LAISASNIKKJECC-MRVPVSSYSA-N 400.381 -0.592 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)c1 1116114122 DZKYKBWGLYSWSM-AGUYFDCRSA-N 409.464 -0.060 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)N2CCC(O)CC2)cc1 1148561993 YGHRJYXZBPGCOR-OAHLLOKOSA-N 413.452 -0.992 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1254316560 WLZCRBTYHACMNE-GOSISDBHSA-N 408.411 -0.968 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cn1 1618233955 ALPNZMNFMDDMLL-LLVKDONJSA-N 409.406 -0.519 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2CCC(C3CC3)CC2)n(C)c1=O 1629793902 ZXCWUNBIWYJGNK-UHFFFAOYSA-N 402.455 -0.203 50 10 HBGE Cn1nc(C(=O)NNC(=O)NCC[C@H]2CCCS2(=O)=O)c2ccccc2c1=O 1684995052 FMEBLLUWZHFPSY-LLVKDONJSA-N 407.452 -0.155 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](O)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267385524 LNKANRRYVIIITL-JTQLQIEISA-N 408.669 -0.816 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cscc1B(O)O 2267618163 BYSQCVCZDLFUQS-SNVBAGLBSA-N 406.291 -0.011 50 10 HBGE CC(C)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cncc(B(O)O)c1 2282104958 DLEKFMLAMCTVPO-UHFFFAOYSA-N 401.294 -0.067 50 10 HBGE CC(C)(C)OC(=O)NCc1nnc(NS(=O)(=O)Cc2ccsc2B(O)O)o1 2282350205 KCVBISAURQJYFS-UHFFFAOYSA-N 418.262 -0.223 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)sc1C 2282367724 GJQDSZQSMLGXJX-MNOVXSKESA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2ccccc2B(O)O)C1 2282717420 JENJSWPPEMWBCN-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)c1ccccc1B(O)O 2282717566 LIGBKBJWOYAUMR-DGCLKSJQSA-N 400.262 -0.816 50 10 HBGE C=CCC1(NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282742473 CUHMDIGHIVNIEC-UHFFFAOYSA-N 417.318 -0.192 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 729454074 HPRZMXVWOQQZGB-UHFFFAOYSA-N 423.476 -0.353 50 10 HBGE COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCCO2)cc1OC 814343971 IBPKMTZMHVENCW-CYBMUJFWSA-N 401.441 -0.301 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)Cn1nnc2ccccc2c1=O 1156083669 OJCJQRDQASPTRU-ZDUSSCGKSA-N 402.411 -0.052 50 10 HBGE CCOCc1nc(Cl)cc(NNC(=O)NC[C@@]23COCCN2C(=O)COC3)n1 1235027248 GXFXDYGRMLKSDZ-INIZCTEOSA-N 414.850 -0.080 50 10 HBGE O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)CN1CCCC1=O 1557978776 RUYATRMYNHAGAX-UHFFFAOYSA-N 417.466 -0.289 50 10 HBGE C[C@]1(NNC(=O)N[C@@H]2CCCN(CCN3CCOCC3)C2)CCS(=O)(=O)C1 1565265771 WRWZJVOSHDKYLC-WBVHZDCISA-N 403.549 -0.836 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)CN2CCCc3ccccc32)C1=O 1624318146 UPHWYEJSKUHEJH-OAHLLOKOSA-N 402.451 -0.002 50 10 HBGE Cn1cc(/C=C\C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)c(=O)n(C)c1=O 1645022236 YYNJUKNYHRJIPN-ZHRWSRJISA-N 407.427 -0.746 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C)CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267627473 ZKZGWANXVNSMDU-AWEZNQCLSA-N 405.307 -0.358 50 10 HBGE O=C(N[C@H]1C(F)(F)C12CC(NC(=O)c1cc(B(O)O)n[nH]1)C2)OCc1ccccc1 2281839375 GETJPAQRBGLUDG-GMQFJONSSA-N 420.181 -0.088 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)n1 2281879476 JHHISYNECURMNH-FLESLCNUSA-N 402.282 -0.266 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCC1(CNC(=O)OC(C)(C)C)CC1 2282082202 YOTSGQNHZLYJFV-UHFFFAOYSA-N 402.282 -0.927 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2ccccc2B(O)O)C1 2282103412 RGBLOYNXHPOCTR-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)c1scc(B(O)O)c1Cl 2282474824 GHPOUPLBOPNOKN-WCABBAIRSA-N 420.680 -0.848 50 10 HBGE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1cc(B(O)O)cs1 2283962040 CQKHTXIIDXPDBV-LBPRGKRZSA-N 400.262 -0.157 50 10 HBGE C[C@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@H]1CCCN1C(=O)OC(C)(C)C 2286908544 WTPDBLICDNAYRW-CMPLNLGQSA-N 402.282 -0.834 50 10 HBGE C[C@@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(S(=O)(=O)N(C)C)c1 745799599 ILGDYNUXGQQYAZ-RISCZKNCSA-N 400.457 -0.256 50 10 HBGE CN(CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)[C@H]1CCS(=O)(=O)C1 794070396 URBSQCPHWAEHEK-AWEZNQCLSA-N 412.468 -0.821 50 10 HBGE O=C(N1CCN(S(=O)(=O)CBr)CC1)C1(n2cnnn2)CCOCC1 1137882445 UHMPKSIAXSVCIL-UHFFFAOYSA-N 423.293 -0.995 50 10 HBGE O=C(C[C@H]1CC(=O)NC1=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 1465796087 ZGFDLVZTBZDQAD-CQSZACIVSA-N 421.885 -0.342 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1Cc2nnc(C)n2C[C@H]1C(=O)N(C)C 1473871898 AMCRZNFTRWSMHA-INIZCTEOSA-N 413.482 -0.443 50 10 HBGE C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1558458814 LQRZQWSZBJAJBF-LAUBAEHRSA-N 416.478 -0.206 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCc2nnnn2CC1 1586861378 OMOQCGPOLDLZNG-INIZCTEOSA-N 412.498 -0.015 50 10 HBGE O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@H]1CCC(=O)N1 1623368868 YCADCWWAFFXMEG-LLVKDONJSA-N 408.212 -0.415 50 10 HBGE COC1(CNS(=O)(=O)c2cc(B(O)O)cs2)CN(C(=O)OC(C)(C)C)C1 2267201830 UHGBYHWMCWRHEZ-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@H]1NC(=O)C(F)(F)F 2267206920 NAIMLKRZVZABAB-HTQZYQBOSA-N 400.209 -0.495 50 10 HBGE CN([C@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2267611605 UFTDTAJEVYEHLY-AWEZNQCLSA-N 422.272 -0.869 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNC(=O)c1nn(C)c(Cl)c1B(O)O 2282247738 JXBDBPFTWOTYLX-ZJUUUORDSA-N 400.672 -0.014 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C 2282365319 XHUAWFPMENSMDP-CBAPKCEASA-N 414.236 -0.044 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282378546 HXZQQKDLWOKIEY-KGLIPLIRSA-N 400.262 -0.922 50 10 HBGE Cc1nc(S(=O)(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282850494 POCHYCJBXBCPKE-UHFFFAOYSA-N 404.298 -0.668 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@H](C)CNS(=O)(=O)c1nc(C)n(C)c1B(O)O 2282867875 FMPWUZDZFVEOOA-SNVBAGLBSA-N 404.298 -0.668 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CP(C)(C)=O)C(=O)NCc1cnc(B(O)O)s1 2335464932 ALKJOGGJAWKZEL-JTQLQIEISA-N 405.222 -0.045 50 10 HBGE O=c1cc(CCl)c2cc(F)c(O[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(F)c2o1 106382303 ATTAHAWLQLRXSU-YQSCNITHSA-N 408.737 -0.011 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C/c2ccnc(Cl)c2)n(C)c1=O 761952881 KWDHECVVFLQBMS-ONEGZZNKSA-N 417.813 -0.657 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)C1 813421863 XLRJLXPGIMCXKL-MNOVXSKESA-N 408.452 -0.291 50 10 HBGE CN(CC(=O)NNC(=O)[C@H]1CCc2nncn2C1)C1=NS(=O)(=O)c2ccccc21 816871377 HSDHAGWHZKXPRY-NSHDSACASA-N 417.451 -0.931 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)C[C@@H](C)O1 1160415996 HXWBPVFUFKXKMB-VXGBXAGGSA-N 413.500 -0.849 50 10 HBGE CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1301441880 QQMPBDULNQCNIZ-KBPBESRZSA-N 408.480 -0.271 50 10 HBGE CO[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1312973414 RSWHTRGQONDCSS-LBPRGKRZSA-N 400.457 -0.314 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2COCCN2C)cc1 1313153780 KNLDWBUZRQKLND-AWEZNQCLSA-N 413.500 -0.723 50 10 HBGE CCS(=O)(=O)C1(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 1684045926 KOASLCYQHWPSBH-UHFFFAOYSA-N 407.452 -0.155 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)c1cncn1-c1ccccc1 1687345478 WOGDPIUSQRLBJL-LJQANCHMSA-N 414.422 -0.556 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1sccc1B(O)O)NC(=O)OC(C)(C)C 2267607099 IGHYGJLGBWJUEG-SNVBAGLBSA-N 408.307 -0.364 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1ccccc1B(O)O 2282103407 RFHJGYRXVZXYGF-UHFFFAOYSA-N 402.278 -0.424 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282740866 GRZBYFMRZSVYBW-VXGBXAGGSA-N 420.680 -0.722 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNC(=O)CN3CCCc4ccccc43)cnc2n(C)c1=O 29394710 ZXGBHMGJZIXAAR-UHFFFAOYSA-N 422.445 -0.154 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@]3(C)C[C@@H](O)CN3C)CC2)cc1 1137300269 LHOMRJHCHXCITR-WIYYLYMNSA-N 403.527 -0.285 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCN(S(=O)(=O)C3CC3)CC2)n1 1174641113 BXTVXFDJWGZAOW-UHFFFAOYSA-N 401.514 -0.749 50 10 HBGE COc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2cn(C)cn2)cc1F 1297138729 UBXCPTBQIPLDRV-UHFFFAOYSA-N 416.460 -0.136 50 10 HBGE C[C@@H](C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1532641401 WWNMPANYRQKHLR-SIJPQNPESA-N 422.482 -0.373 50 10 HBGE C[C@@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)NCC(F)(F)F 1556392521 XNTHIERRZWROLL-HTRCEHHLSA-N 404.392 -0.332 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1sccc1S(=O)(=O)N1CCC(O)CC1 1566168534 IYKYIZZSURCBCY-LLVKDONJSA-N 419.481 -0.930 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)ccc1=O 1598526511 BXZDHAOOOINYEN-GOEBONIOSA-N 416.409 -0.510 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)ccc1=O 1639798074 XNXPELIYYNDIHQ-UHFFFAOYSA-N 400.363 -0.597 50 10 HBGE O=C(NNC(=O)c1cc(=O)cc[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1 1650649674 FDAXWXWMJJQYSS-UHFFFAOYSA-N 406.420 -0.529 50 10 HBGE CC(C)(C)OC(=O)N1CC(ONS(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2267418623 KDVVNGXJKVGHQR-UHFFFAOYSA-N 406.653 -0.151 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1NC(=O)C(F)(F)F 2267614575 PVMQRKDQBWYTAP-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N1CCC[C@H](NC(=O)OCc2ccccc2)C1 2278569120 ZJXWVKMFUYKNAU-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE CN1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H](CNC(=O)OC(C)(C)C)C1 2282074670 NVACJJQBZZZHIX-GFCCVEGCSA-N 419.334 -0.743 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCC[C@H](NC(=O)OC(C)(C)C)C1 2282082832 LLVJGLGTFKAPOL-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NCCCC1CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282342429 HMGNBOZKQXLZCD-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)n1 2282728667 GRPUVGLUGFAMOK-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282729605 PKYLYUHTQRBJGE-GHMZBOCLSA-N 420.318 -0.446 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282743811 UJUGDIISESLDMR-LLVKDONJSA-N 402.282 -0.914 50 10 HBGE CCCN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2283945619 CZLNJYYOMFSHGR-ZJUUUORDSA-N 400.266 -0.760 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(CCNC(=O)OC(C)(C)C)C[C@@H](C)O 2285413370 OKAKPJGHXBNAIO-SNVBAGLBSA-N 422.334 -0.367 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1cnsc1B(O)O)OCc1ccccc1 2315645454 ORWMGWJEJBGGEB-KBPBESRZSA-N 405.241 -0.363 50 10 HBGE CCN(CC)CCN(C(=O)c1cc(B(O)O)ccc1F)[C@H]1CCS(=O)(=O)C1 1446310419 QDFFWSAUBUDKDH-AWEZNQCLSA-N 400.281 -0.523 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccncc2)C3=O)N1 1588263019 QOKNDLBHTQYOSG-HNNXBMFYSA-N 407.386 -0.083 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCC3(C2)OCCO3)c1 1685332186 QOVOBPCCQFGXHF-UHFFFAOYSA-N 412.468 -0.517 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2sccc2B(O)O)[C@H](O)C1 2267200441 FTBICSTYLJQGKC-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272653559 SBJYNKYBEBQZEJ-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2282268601 FUVVZWRMLRNICO-UHFFFAOYSA-N 411.227 -0.712 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@@H](NS(=O)(=O)c2cscc2B(O)O)C1 2282368872 XJRWBAYWDMTZRQ-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@H]1NC(=O)OC(C)(C)C 2282380241 GIHDMAAXGGXMLJ-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2282430332 CXCQDGQXXJOLNL-HUUCEWRRSA-N 416.243 -0.778 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2282701052 UUYWQYKNIBKLFM-LBPRGKRZSA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCc2ccc(B(O)O)s2)CCS(=O)(=O)C1 2284053082 KMVCROYNYSLPPY-HNNXBMFYSA-N 418.302 -0.874 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1 732246987 ZDGSXTYCEPIWLV-LLVKDONJSA-N 405.502 -0.116 50 10 HBGE O=C(NCc1ccc(CN2CCS(=O)(=O)CC2)cc1)c1cccc(B(O)O)c1 1142744908 JHGMBOMZGZGKHY-UHFFFAOYSA-N 402.281 -0.473 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 1152015004 IEQAQHKVUGRBDT-UONOGXRCSA-N 408.455 -0.262 50 10 HBGE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NNC(=O)c1cc(F)ccc1Br 1464797685 PRYHVHQYYFDYCZ-SSDOTTSWSA-N 414.195 -0.459 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](C)N(C)C)CC2)cc1 1465790106 HJEKEMSDMCTXBX-OAHLLOKOSA-N 411.528 -0.601 50 10 HBGE Cc1nn(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n1C 1556102230 WWAXPWBXRDAPKO-UHFFFAOYSA-N 411.463 -0.474 50 10 HBGE COC(=O)Cc1ccc(NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)cc1 1583794438 SOUSZPVNRMHHCA-BRWVUGGUSA-N 401.423 -0.231 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1csnc1B(O)O 2255779761 LHXJLGPCCJJWAV-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cscc2B(O)O)C1 2267385062 HRBXNRDSOSBBPJ-SFYZADRCSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@H](C#N)C1 2267387162 FJYZGDGAUJQRBF-JTQLQIEISA-N 401.275 -0.439 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2272655245 NWIYQKGCEZGTNI-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ncc(B(O)O)cc1F 2281650802 GTVUNMVEKQPGBJ-HNNXBMFYSA-N 417.202 -0.332 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2281840976 CMXVQBIIAOAKDT-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNC(=O)c1nn(C)c(Cl)c1B(O)O 2282247736 JXBDBPFTWOTYLX-UWVGGRQHSA-N 400.672 -0.014 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ccccc1B(O)O 2282350291 KSBRPCDZNWIPFE-UHFFFAOYSA-N 400.262 -0.321 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](CC(=O)N=c2nc(B(O)O)[nH]s2)OCC1(C)C 2284038366 GCJPMCRWNMJREI-SECBINFHSA-N 400.266 -0.617 50 10 HBGE O=C(NCC1CC1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 731617446 KXKMUUIUWKADSY-BFHYXJOUSA-N 400.501 -0.164 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)C(C)(C)c1ccccc1 1136731144 NHSCIGAYUMPDTK-UHFFFAOYSA-N 412.512 -0.054 50 10 HBGE CC(C)(C)OC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(B(O)O)ccc1F 1161585972 IJJQXJVPNCJHSV-CYBMUJFWSA-N 401.221 -0.914 50 10 HBGE Cc1cc(B(O)O)sc1CNS(=O)(=O)CCN1C(=O)c2ccccc2C1=O 1950861595 XYPHDHZOWQSWSI-UHFFFAOYSA-N 408.266 -0.548 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H](O)C1 2267610331 ZEQXALFJCQKCIN-NSHDSACASA-N 406.291 -0.970 50 10 HBGE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NC(=O)c1scc(B(O)O)c1Cl 2281785391 LXZYQEPNPCOPGP-UHFFFAOYSA-N 415.668 -0.091 50 10 HBGE COC1(CNS(=O)(=O)c2ccccc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282092419 PNICFAIVSJENEF-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)n1 2282240984 OYDXHHWXDPTMBR-JGFSIVIASA-N 400.266 -0.747 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@]1(NC(=O)OC(C)(C)C)CCOC1 2282724571 YVBKEAYBAXKYID-OAHLLOKOSA-N 420.318 -0.302 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282857324 GSNPCQXRNBKIHF-JQWIXIFHSA-N 419.334 -0.112 50 10 HBGE O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@@H]1COCCO1 744640694 BJUZMRPMMPLCMQ-LBPRGKRZSA-N 411.212 -0.278 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)[C@H]2COCCO2)CCO1 760780292 LPHAOYBJHHVVLJ-RWMBFGLXSA-N 402.448 -0.243 50 10 HBGE CN(C)C(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1C 774611247 LJBXUNSGGIYUTD-HNNXBMFYSA-N 408.436 -0.124 50 10 HBGE O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)[C@H]1CCc2nncn2C1 814333768 WTAXIEXHDYJYRP-WDEREUQCSA-N 405.381 -0.566 50 10 HBGE CCN(CC)CCN(C(=O)c1cc(B(O)O)ccc1F)[C@@H]1CCS(=O)(=O)C1 1446310420 QDFFWSAUBUDKDH-CQSZACIVSA-N 400.281 -0.523 50 10 HBGE O=C(NNC(=O)c1ccc(C(=O)N2CCOCC2)cc1)N[C@@H]1CCS(=O)(=O)C1 1583281176 PFMPABUCHGFZTE-CQSZACIVSA-N 410.452 -0.710 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 1611087350 OXXROXXTRLUNNA-YUMQZZPRSA-N 413.232 -0.535 50 10 HBGE C[C@@H]1[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2267392540 YLRUDCMEIUHORZ-ZJUUUORDSA-N 405.307 -0.360 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)CO1 2282072808 JGDUUANPHOZSAB-GHMZBOCLSA-N 420.318 -0.364 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)c2ccc(B(O)O)cc2F)C1 2282366955 VUJOYRSZWZUGJL-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE C[C@@H](C1CN(C(=O)OC(C)(C)C)C1)N(C)S(=O)(=O)Cc1ncsc1B(O)O 2282735855 HKTBMSFGLCGNAZ-JTQLQIEISA-N 419.334 -0.160 50 10 HBGE Cc1nc(S(=O)(=O)N(C)C[C@@H]2CCN2C(=O)OC(C)(C)C)c(B(O)O)n1C 2282741678 QYNKMGBXQNONDF-NSHDSACASA-N 402.282 -0.962 50 10 HBGE Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)C2=O 1635372281 QYPVVKDRMLEYTN-INIZCTEOSA-N 400.435 -0.008 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC2(CN(C(=O)OC(C)(C)C)C2)C1 2267384200 KNWQMGUHVYUNOG-UHFFFAOYSA-N 402.303 -0.022 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cscc1B(O)O 2267386986 BQPYRGZNGUJAKI-UHFFFAOYSA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2sccc2B(O)O)[C@H](S(C)(=O)=O)C1 2282206759 JHOJNEGHZLVOBT-WDEREUQCSA-N 418.302 -0.810 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282711401 BUWVSRTZULNGKJ-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)c1ccc(F)cc1B(O)O 2282739842 QPDQXCDQMBRYQQ-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 729612599 ZOFSULOUPYQFLX-UHFFFAOYSA-N 412.454 -0.517 50 10 HBGE O=C(NCCN1CCNC1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1251104934 RPYYTKQTARVPBU-UHFFFAOYSA-N 424.483 -0.560 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@H](NC(=O)c3cc(B(O)O)ccc3F)CC2=O)C1 1304620572 BSALJJBRQBTPAD-GFCCVEGCSA-N 421.234 -0.545 50 10 HBGE O=C(NNC(=O)[C@H](C[C@@H]1COCCO1)C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 1442180920 GZLPRSXCBUOMNA-BBBLOLIVSA-N 403.379 -0.512 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC3(CC2)C[C@@H](O)CNC3=O)cc1OC 1460876788 GOXFBZVHMWZRRS-CQSZACIVSA-N 420.466 -0.572 50 10 HBGE COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2)c1 1534064245 DYVFQHYAQPGXCT-MRXNPFEDSA-N 418.450 -0.018 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)nn1 1587243969 JBZPHCJCZHQDEJ-UHFFFAOYSA-N 409.200 -0.236 50 10 HBGE O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)[C@@H]1CCC(=O)N1 1647271928 VPRXIJLTWRLKOC-HNNXBMFYSA-N 423.495 -0.155 50 10 HBGE COC1(CCNC(=O)c2cc(B(O)O)n[nH]2)CN(C(=O)OCc2ccccc2)C1 2267021746 XWQTWEUOCCQNTF-UHFFFAOYSA-N 402.216 -0.753 50 10 HBGE CCc1nn(C)c(C(=O)N[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267021933 AJYOGUWNRDDCNB-CQSZACIVSA-N 400.244 -0.197 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267203883 WONPLNPWPRKXHA-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)nn(C)c1B(O)O 2281609483 SPPKSIUJLGKSAC-IQSLBTHBSA-N 402.282 -0.440 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CNCCN1Cc1ccccc1 2282357212 HAJZZKPHFSXWBS-HNNXBMFYSA-N 409.342 -0.511 50 10 HBGE CO[C@@H]1C[C@H](CNS(=O)(=O)c2cscc2B(O)O)N(C(=O)OC(C)(C)C)C1 2282368357 PBZGGVDNJKCYSO-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282713472 FQABXXROLQLGPU-AREMUKBSSA-N 419.290 -0.833 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282713473 FQABXXROLQLGPU-SANMLTNESA-N 419.290 -0.833 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cccnn3)CC2)c1 1537019981 LGUNWCRZIVMJII-UHFFFAOYSA-N 418.479 -0.302 50 10 HBGE Cc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(F)c1F 1587963596 FZOPFLXRLNZVNQ-UHFFFAOYSA-N 406.349 -0.518 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)cc1 1684252560 UGDMCOIJEDELLB-INIZCTEOSA-N 401.441 -0.392 50 10 HBGE COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cn(C)nn3)C2=O)c(OC)c1 1686407840 MEKQUYZPLHTWHW-CYBMUJFWSA-N 417.426 -0.423 50 10 HBGE CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncc(B(O)O)cn2)C1 2235611308 VWGTWCBSBCDOIZ-BEFAXECRSA-N 414.227 -0.089 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2267081896 GUCKNBPCTRBWLV-CQSZACIVSA-N 419.268 -0.101 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267201591 QMVHKCPIRGNKBR-YUMQZZPRSA-N 400.209 -0.495 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N1CCS(=O)(=O)CCN1C(=O)OC(C)(C)C 2281885504 PHTKAJRYPXSOEK-UHFFFAOYSA-N 419.290 -0.846 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(F)cc1B(O)O 2282364941 YXWCTVYQCZPKQU-UHFFFAOYSA-N 406.241 -0.987 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@@H]1CCOC[C@H]1OCc1ccccc1 2282384446 MTEZZSDYKLNMPG-UKRRQHHQSA-N 412.298 -0.383 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NC(=O)c2cc(B(O)O)cs2)C1 2282388046 LUZPWMUQEGOOFT-PWSUYJOCSA-N 418.302 -0.810 50 10 HBGE CO[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2cscc2B(O)O)C1 2282736897 XCQMKLCDIXSTOB-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2cnsc2B(O)O)CC1 2362501423 RXSKCSMXXZOCOZ-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE C[C@@H](CC(=O)NNC(=O)[C@@H]1COCCO1)NS(=O)(=O)c1cccnc1Cl 760694703 CKTRXDTYYYXLOJ-UWVGGRQHSA-N 406.848 -0.645 50 10 HBGE COCCN1CCCN(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1=O 793224774 DNBMZBAGKLLJKF-UHFFFAOYSA-N 421.454 -0.166 50 10 HBGE O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)[C@@H]1CCc2nncn2C1 816872072 ATLKRFNWQDHTPJ-LLVKDONJSA-N 410.431 -0.504 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)cc1S(=O)(=O)N1CCCC1 1131507758 FFWHRFRZWRGCMM-LBPRGKRZSA-N 410.452 -0.481 50 10 HBGE CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)cc1 1251277733 MEVNPSYDPORPSG-GFCCVEGCSA-N 417.488 -0.421 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1292039240 WHCLSHOMWTWSMR-FIQHERPVSA-N 402.473 -0.241 50 10 HBGE O=C(NCC1CCS(=O)(=O)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 1633873591 YOSGVDZEWWDUJZ-UHFFFAOYSA-N 410.500 -0.152 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@H](O)C1 2267615379 BPUYTRWTXMEJAM-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2269794711 ZQTYZAKGWXSGOE-SNVBAGLBSA-N 408.307 -0.676 50 10 HBGE Cc1ccc(S(=O)(=O)N(CCO)CCNC(=O)OC(C)(C)C)c(B(O)O)c1 2282367072 XDXYXOHULCQODK-UHFFFAOYSA-N 402.278 -0.817 50 10 HBGE O=C(CO)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br 753451594 GEHLSIFFIHXRAP-UHFFFAOYSA-N 422.257 -0.777 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1)Nc1ccccc1F 756074408 LBRHLZSTKKGATK-HNNXBMFYSA-N 409.418 -0.462 50 10 HBGE CCOC(=O)[C@H]1CCC(=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@@H]1C 758115982 BGZXDGRXBJLOMT-AAEUAGOBSA-N 418.454 -0.095 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H]1CCS(=O)(=O)C1 914444911 HIQGXLWZILRRLF-GXTWGEPZSA-N 415.493 -0.578 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CS(=O)(=O)NC(C)(C)C 919690978 XJKZLEZRHVBZBD-UHFFFAOYSA-N 419.529 -0.233 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCS1(=O)=O 1137298963 IJUIKNZOJRDMLT-OAHLLOKOSA-N 408.480 -0.831 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(C3CCOCC3)C2=O)c1 1233962054 GVCBSXUFDJJMLF-HNNXBMFYSA-N 424.479 -0.186 50 10 HBGE Cn1cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N=S(C)(C)=O)CC2)cn1 1468029123 LRFKGHKBJIWOPG-JYRVWZFOSA-N 400.486 -0.556 50 10 HBGE O=C(NNc1ncccn1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1 1564891176 MQTUYUWMRNHUFF-UHFFFAOYSA-N 406.424 -0.053 50 10 HBGE C[C@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NCCSS(C)(=O)=O 1636470375 LFKUUJHSIQQCFZ-WPRPVWTQSA-N 402.541 -0.415 50 10 HBGE Cn1c(CC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)OC3)nc2ccccc21 1637846192 AKDKOSDMZGEIKJ-SFHVURJKSA-N 402.411 -0.333 50 10 HBGE CN(C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)CC1 1641450906 JPNZTLWZACVZSR-AWEZNQCLSA-N 401.423 -0.021 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267625786 VYXIHLIFFYTIAC-AOOOYVTPSA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282336694 AYGBZFIRLLEKNR-NXEZZACHSA-N 423.297 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1ccc(F)cc1B(O)O 2282727413 YRFJSRHAITZWJU-AREMUKBSSA-N 424.281 -0.183 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COCCN(C(=O)OC(C)(C)C)C1 2282728764 VCUQISFISNSWKW-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2cc(B(O)O)co2)CC1 2285997311 PLMQZUDAUZEFGE-MHZLTWQESA-N 401.250 -0.335 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N2CCC[C@H](NC(=O)OCc3ccccc3)C2)n1C 2337403861 VJHXWJWNJWAYDG-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1C 2365421788 MOLNIVHAHLUIJO-ZDUSSCGKSA-N 402.278 -0.507 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)[C@H]2COCCO2)CC1 745784402 AALUQBQESMDLDG-CYBMUJFWSA-N 401.464 -0.715 50 10 HBGE Cc1ccc(C(=O)NNC(=O)N2CCn3c(nn(CC(=O)N(C)C)c3=O)C2)cc1F 786138497 OFXYTGDYYAZECV-UHFFFAOYSA-N 419.417 -0.549 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCO3)c2)CC1 814342964 WDZDHFQGXADQNK-MRXNPFEDSA-N 424.479 -0.521 50 10 HBGE O=C(C[C@H]1CC(=O)NC1=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1 1294603242 QABCCWOJTGLDIV-CQSZACIVSA-N 421.885 -0.342 50 10 HBGE O=C(Cc1cncc(O)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1306200417 KUXORVDUCDQDMH-UHFFFAOYSA-N 420.447 -0.188 50 10 HBGE COC[C@]1(C(=O)NNC(=O)CN2CCCC2=O)CN(C(=O)OC(C)(C)C)CCO1 1454878985 MHCIAKRPPYJRDP-SFHVURJKSA-N 414.459 -0.591 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNC(=O)[C@H]1CCN1C(=O)OC(C)(C)C 1558448072 NQTXRBPVCUWCIL-LLVKDONJSA-N 401.445 -0.322 50 10 HBGE COCCOCCN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 1646561852 PCISZUNMTWAIRY-UHFFFAOYSA-N 409.443 -0.364 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267205797 WVRZWDZHBQVRNN-JUTIIYIPSA-N 424.331 -0.118 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)sc1B(O)O 2267420778 YAXKTUIBHMEWPR-PEGIJTEDSA-N 402.303 -0.120 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN2S(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282356635 YAZLXRYQTHESFQ-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE Cc1cc(S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)ccc1B(O)O 2282733566 XQKAJZLTIJTRAH-GFCCVEGCSA-N 402.278 -0.819 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)[C@@H](CN(C)C)NC(=O)OC(C)(C)C 2283963501 LXDJEBFWLWRRRT-ZYHUDNBSSA-N 400.310 -0.203 50 10 HBGE C[C@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1c(B(O)O)cnn1C 2284006067 YBHXTCWHKDHUPD-LLVKDONJSA-N 404.298 -0.681 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2337135827 AIKLTCCXKZAFBW-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@H]2COCCO2)c1 744642607 KMTKNNKTNFYLNG-CQSZACIVSA-N 401.441 -0.904 50 10 HBGE CCOc1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1C 765726991 IIYHPBKHBJTOJT-UHFFFAOYSA-N 414.422 -0.398 50 10 HBGE O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)[C@H]1CCc2nncn2C1 816876360 UUMJQXSBNFCKHN-HNNXBMFYSA-N 423.433 -0.940 50 10 HBGE Cn1cc(I)c(C(=O)NNC(=O)c2ccc(=O)n(C)c2)n1 1289431554 ZFLHBDLVRJXDDS-UHFFFAOYSA-N 401.164 -0.202 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCCN(C(=O)OCc2ccccc2)C1 2267467096 LLTAWDIGAVUTRT-AWEZNQCLSA-N 422.272 -0.821 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1NC(=O)C(F)(F)F 2267613487 CSTBVQDFVREESC-YUMQZZPRSA-N 400.209 -0.495 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H]2C[C@@H](C1)[C@@H](NC(=O)OC(C)(C)C)[C@H]2CO)B(O)O 2282721781 XACDZMRLWRJQRC-ZOBORPQBSA-N 404.294 -0.662 50 10 HBGE CN(C[C@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1cscc1B(O)O 2282734663 OOWAMJPNMCBEMV-QGZVFWFLSA-N 410.326 -0.315 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N(CCO)CCNC(=O)OC(C)(C)C)c1B(O)O 2282741787 SKEHJLMFNLWXFC-UHFFFAOYSA-N 422.334 -0.448 50 10 HBGE N#C[C@@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)CCN1Cc1ccccc1 2282857625 KRPYKLZJKFRCHG-MRXNPFEDSA-N 405.310 -0.032 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H](COCc2ccccc2)C(=O)O)c1B(O)O 2284396825 YYFKAOVLVAJQMD-CYBMUJFWSA-N 413.282 -0.007 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 744640993 HDDNDURTVPCDKX-ZFWWWQNUSA-N 413.452 -0.680 50 10 HBGE Cc1ccc(Cl)cc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 753297385 HGIZSMFUIREEAJ-UHFFFAOYSA-N 404.814 -0.143 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccnn2-c2ccccc2)n(C)c1=O 790294266 HVYPJTXKDFGHEV-UHFFFAOYSA-N 406.406 -0.230 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)ccc1=O 1289430948 MDCBYOXAWQSXLS-UHFFFAOYSA-N 410.408 -0.926 50 10 HBGE C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1(S(C)(=O)=O)CC1 1322567103 GOWSYVQURIEZOG-GFCCVEGCSA-N 410.500 -0.011 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)N1 1461838100 PBYIMSMQCVRZJX-BDAKNGLRSA-N 420.900 -0.019 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)NNC(=O)C2CCOCC2)C1 1650889352 QXIMQMACDLCCRA-ZDUSSCGKSA-N 419.500 -0.015 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H]3COCO3)nc2)CC1 1684765803 QSTXRUFIZFMTGW-LBPRGKRZSA-N 400.461 -0.983 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](CO)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267387363 HXLMSOSHWAVNIQ-JTQLQIEISA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267712626 GQJYMXUFCVKCRB-ZJUUUORDSA-N 405.307 -0.312 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282714098 NCRFIAKGBZEEOR-NSHDSACASA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282717436 JMJBEQTXIBNWOO-SANMLTNESA-N 418.302 -0.228 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CF)(NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282718864 DGYKLSJTTNNDOD-MRXNPFEDSA-N 402.253 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CF)(NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282720038 UPCMBKNZYQEQEA-MRXNPFEDSA-N 402.253 -0.006 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)c1nn(C)cc1B(O)O 2282736275 NRTKFAHJPMCVRH-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(C(=O)N(C)C)CC2)CC1 806873085 SEVCQTHRLRXVHN-UHFFFAOYSA-N 410.500 -0.671 50 10 HBGE O=C(CC1CS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1124435148 UPDCGFBXNFWBHL-UHFFFAOYSA-N 415.493 -0.333 50 10 HBGE CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CS(C)(=O)=O)c1 1168877756 WRWAIEWCHBNOID-UHFFFAOYSA-N 409.461 -0.340 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)[C@H]1CCCN(S(C)(=O)=O)C1 1456006330 QRMZRIDEBRDKIB-RYUDHWBXSA-N 404.489 -0.185 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1586340294 ZHBJLYBWALERJK-FKGLVLAHSA-N 408.455 -0.761 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)N1 1623505360 CWNYNUNSZQXNFV-VIFPVBQESA-N 415.371 -0.664 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNc2ccccc2S(C)(=O)=O)[C@H]1c1cnn(C)c1 1629713742 LEOWKESTVXVUSC-RBSFLKMASA-N 407.452 -0.543 50 10 HBGE C[C@]1(C(=O)N2CCN(CC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)C[C@H]1Br 1629842292 YZTAKFZUVFPRRG-ZOWXZIJZSA-N 422.345 -0.393 50 10 HBGE COC(=O)c1ccc2c(c1)CC[C@@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)N2 1652788716 YTCOTOHRCROKEE-MRXNPFEDSA-N 400.171 -0.025 50 10 HBGE CCN(CCCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267424434 ZVZYYMUHFIYRPP-UHFFFAOYSA-N 407.323 -0.111 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1scc(C)c1B(O)O)NC(=O)OC(C)(C)C 2281890180 BHRLQBLSAGLWOT-JTQLQIEISA-N 400.262 -0.077 50 10 HBGE CC[C@@H]1[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282070003 XPQWVMXICUYPDW-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CCC1(CNS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282368090 LBBYTHUIFJLWSK-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CCC2)n1 2282368843 XBYSTZFFELUKKK-LBPRGKRZSA-N 402.282 -0.928 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 2282719134 HVRIOGQFFYPLFL-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1 2337202813 ORSPSSHXASSIKL-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@]3(C)CCC(=O)NC3)cc2)CC1 798982181 FUGREWGIJVAJHJ-GOSISDBHSA-N 409.512 -0.018 50 10 HBGE CO[C@@H]1CS(=O)(=O)[C@H]2CN(CC(=O)NNC(=O)c3cccc(Cl)c3)C[C@@H]12 1174641077 ATIFPGJWKLJGJQ-MJBXVCDLSA-N 401.872 -0.155 50 10 HBGE COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)[C@@H]1CCC(=O)N1)CC2 1470498853 SGEKAHHJNWYDII-AWEZNQCLSA-N 418.450 -0.205 50 10 HBGE O=C(NNC(=O)c1cc2ncc(Br)cn2n1)N[C@H]1CCS(=O)(=O)C1 1625568685 ZCBYVKACVNJPPS-QMMMGPOBSA-N 417.245 -0.377 50 10 HBGE Cc1ccc(C(=O)NNC(=O)NCCN2CCOCC2)cc1S(=O)(=O)N(C)C 1857991353 LQVAPYAOVFVHCK-UHFFFAOYSA-N 413.500 -0.478 50 10 HBGE Cn1nc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(B(O)O)c1Cl 2281651532 QWOQJKJBCXQIPB-LURJTMIESA-N 414.577 -0.061 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282078630 LKBYWKBSZNYCNC-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2ccccc2B(O)O)CC1 2282104476 YYQVMRAFTWASEU-UHFFFAOYSA-N 418.302 -0.226 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2282161472 MXDKYBYUJALMJC-XTCNOXHKSA-N 400.266 -0.369 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282362569 HROYEZWAUIYKPN-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 2282700618 RONNUODYEANGKA-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)Cc1cccc(B(O)O)c1 2282867049 SNGLFCZRGSDSIF-UHFFFAOYSA-N 400.262 -0.320 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCC(=O)N(C)C2)cc1 739052321 PFIDYAWCGDBIMY-CYBMUJFWSA-N 411.484 -0.433 50 10 HBGE O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NNC(=O)[C@@H]1COCCO1 744645527 TVRIKEAKXRVQPF-ZDUSSCGKSA-N 403.370 -0.278 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCN=C3C2=NNN3C)c2ccccc2c1=O 816806110 RXDJCNQJFPGRJD-ZDUSSCGKSA-N 410.438 -0.037 50 10 HBGE CC(C)c1ccc(S(=O)(=O)N2C[C@H](O)C[C@@H]2C(=O)NNC(=O)C(C)(C)O)cc1 1556228148 DOBIHMBAZOOYAV-UKRRQHHQSA-N 413.496 -0.148 50 10 HBGE CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)[C@H]2CCC(=O)N2)CC1 1563864950 NOIUVCFIYJJCGL-OAHLLOKOSA-N 402.455 -0.536 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3C[C@@H]3C#N)CC2)cc1 1566278880 UYWRXHCPPQSAED-GDBMZVCRSA-N 405.480 -0.392 50 10 HBGE O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)[C@H]1CCN1C1CCOCC1 1652302236 WICHQWJQGZQYOL-CYBMUJFWSA-N 416.525 -0.183 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1ccc(B(O)O)s1 2267206260 CSDWFYWRKVSEFR-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1sccc1B(O)O 2267473480 GRNZHKGBGRKCHN-UHFFFAOYSA-N 406.291 -0.011 50 10 HBGE CN1CCN(Cc2ccccc2)[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282079624 YTDGIPWMZGBLFS-HNNXBMFYSA-N 409.342 -0.478 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282079654 YZSFPJSWZABVCC-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE C[C@@H]1C[C@H](CNS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2282732635 JIYDNASDFVJBQK-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE O=C(N1CCCC[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O)C(F)(F)F 2282739380 ILCOAZKJDAVTSJ-QMMMGPOBSA-N 415.224 -0.814 50 10 HBGE COc1ccnc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)n1 729228741 IRXZZVNYZNDJDC-UHFFFAOYSA-N 419.467 -0.161 50 10 HBGE NS(=O)(=O)c1cnn(CCC(=O)NNC(=O)CN2CCCc3ccccc32)c1 749719941 RWDWSBLJWQGHNX-UHFFFAOYSA-N 406.468 -0.479 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCCc3cc(C#N)cnc32)n(C)c1=O 788435129 OVDWHIODQBHVAT-UHFFFAOYSA-N 406.406 -0.443 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1630431617 LROJYOYXALUKNN-VCHBTMOCSA-N 416.356 -0.602 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)CC1=O 1652302523 ZHHPTBOOEKQKLP-KBAYOESNSA-N 421.542 -0.280 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCO[C@@H]2CCOC2)c1 1684327608 UVYJFBYVYFVNHL-CYBMUJFWSA-N 400.457 -0.314 50 10 HBGE C[C@]1(NS(=O)(=O)c2cncc(B(O)O)c2)CCN(C(=O)OCc2ccccc2)C1 2267410426 JDTOVVAVKMHGAD-SFHVURJKSA-N 419.268 -0.159 50 10 HBGE C[C@H](O)CN(CCNC(=O)c1ncc(B(O)O)cc1Cl)C(=O)OC(C)(C)C 2281896728 MDKWDMHPQYOFOW-JTQLQIEISA-N 401.656 -0.238 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)C[C@@H](C)N1C(=O)OC(C)(C)C 2282077940 BMRUOZVHIJCTIV-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE Cc1nn(C)c(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)c1B(O)O 2282152968 MTFPYARKLGVYPI-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)C(F)(F)F 2282338425 RIFMZPQTICGVBJ-JGVFFNPUSA-N 415.224 -0.958 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](NC(=O)C(F)(F)F)C[C@@H]1C 2282361235 OADMEVGXDDMQIM-IONNQARKSA-N 414.236 -0.044 50 10 HBGE COC1(CCNC(=O)OC(C)(C)C)CN(S(=O)(=O)c2sccc2B(O)O)C1 2282710248 LYTALQUUZHHRHL-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)NC1CC2(C1)[C@@H](C(=O)N=c1nc(B(O)O)[nH]s1)C2(F)F 2284047344 HUWXMXGTPATKAX-MWBVSFINSA-N 404.204 -0.483 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2343823721 WAOXUKQPZOAUBQ-QMMMGPOBSA-N 405.669 -0.534 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1 763825012 OSLRNYWGNMEZLA-UHFFFAOYSA-N 419.463 -0.412 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=CCS(=O)(=O)C2)c1 1289967012 QWTBMBUSODKXBV-UHFFFAOYSA-N 415.493 -0.167 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 1290349717 WLNRJRNRPVCUDX-BZNIZROVSA-N 405.473 -0.406 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2cn(CCCNC(=O)OC(C)(C)C)nn2)CC1 1568122788 ZWINXNOZDGLWKT-UHFFFAOYSA-N 410.479 -0.205 50 10 HBGE COC(=O)CCN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 1616746374 UTENCGAMNHWQGK-CYBMUJFWSA-N 407.427 -0.075 50 10 HBGE O=C(NNC(=O)[C@H]1CCN1C1CCOCC1)c1nc2ncc(Br)cn2n1 1652301523 OFKMAOCLELCSMV-LLVKDONJSA-N 424.259 -0.099 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCCCN1CCCS1(=O)=O 1683192812 IODBDFVCOMMIPK-UHFFFAOYSA-N 405.521 -0.315 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cscc2B(O)O)[C@H](O)C1 2267417673 FMJBQUSDDZMEQZ-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H](C#N)C1 2267475552 LVZZLUJAMQYMLA-LLVKDONJSA-N 401.275 -0.439 50 10 HBGE Cc1ccc(CNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)cc1B(O)O 2278722843 JXTZXXBAJXXAFH-UHFFFAOYSA-N 416.264 -0.219 50 10 HBGE Cn1nc(C(=O)N=[S@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1B(O)O 2281915489 ZMOOCJDRNKPYHJ-JGFSIVIASA-N 400.266 -0.747 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@@H](C)CN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282336385 CJOYPVWMTRJMST-JTQLQIEISA-N 404.298 -0.716 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)[C@H](F)C1 2282429895 YAWZKQBVWDIVIA-KGLIPLIRSA-N 402.253 -0.008 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2282701050 UUYWQYKNIBKLFM-GFCCVEGCSA-N 419.334 -0.743 50 10 HBGE C[C@@H](OCc1ccccc1)[C@@H](NS(=O)(=O)Cc1ccsc1B(O)O)C(=O)O 2284418448 YNBWDXZZZHNFPT-BXUZGUMPSA-N 413.282 -0.094 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1 2362350830 XCIICQRRUZUZLQ-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2c[nH]c(C(F)(F)F)c2)n(C)c1=O 815826982 HROAAESHJSYLHS-UHFFFAOYSA-N 413.316 -0.758 50 10 HBGE O=C(NNC(=O)N1CCOCC1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1464538806 CZGCKLDOMJSYIB-GFCCVEGCSA-N 406.848 -0.948 50 10 HBGE O=C(CN1CCCCC(=O)C1=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1465413087 ILAHJWCOIQGDAH-UHFFFAOYSA-N 424.479 -0.268 50 10 HBGE Cn1cc(I)c(CNC(=O)NNC(=O)c2cccnn2)n1 1470146841 JQVLNTBHVNNJDZ-UHFFFAOYSA-N 401.168 -0.041 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3nnnn3CC2)c1 1538534878 PPPYOIGMGVSBTA-LLVKDONJSA-N 407.456 -0.663 50 10 HBGE CS(=O)(=O)N1CC[C@H](O[C@@H]2CS(=O)(=O)C[C@H]2I)C1 2257832367 OWCRLRXQJXNUSC-DJLDLDEBSA-N 409.267 -0.363 50 10 HBGE C[C@H]1CN(C(=O)c2cnn(C)c2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267321706 LZEDKMVBOYIITN-OKILXGFUSA-N 400.244 -0.029 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2cc(B(O)O)cs2)CCOC1 2267474267 ROSRAZMYWSZNOK-AWEZNQCLSA-N 406.291 -0.610 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)n1 2281879477 JHHISYNECURMNH-GFVXYOJSSA-N 402.282 -0.266 50 10 HBGE CO[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2sccc2B(O)O)C1 2282071601 TZCULTURZJPLIU-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE O=S(=O)(NCC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(B(O)O)s1 2282077212 SIDMKAUAWDXXNG-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC1(CNC(=O)OC(C)(C)C)CCCC1 2282079134 RXDATNXDTSJKJD-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282327242 FDRRIHYJGOKUTL-WCBMZHEXSA-N 414.236 -0.353 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COCC[C@H]1NC(=O)OC(C)(C)C 2282742560 DTLJJMLKPBUFJK-MNOVXSKESA-N 420.318 -0.303 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])o2)n(C)c1=O 606629582 BUZVKQCFNCIRSM-XMZGAWNLSA-N 401.339 -0.250 50 10 HBGE O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CN1CCCc2ccccc21 742472597 RJBYVIWVMVHXAJ-RGCFKVTRSA-N 412.446 -0.251 50 10 HBGE COc1cc2ncn(CCCC(=O)NNC(=O)[C@H]3COCCO3)c(=O)c2cc1OC 744646378 XSOBFCKCKAOMKK-MRXNPFEDSA-N 420.422 -0.243 50 10 HBGE COCC(=O)NNC(=O)CSc1nnc(NN=Cc2cnn(C(C)C)c2)n1N 1084468263 CBFJOURVYMLHTD-UHFFFAOYSA-N 410.464 -0.899 50 10 HBGE CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)[C@H]1COCCO1 1354837553 XZSXEBYIZJFQRE-DGCLKSJQSA-N 400.457 -0.458 50 10 HBGE CN1CC(=O)Nc2cc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cnc21 1538589286 VRCZOIYUENTSRG-UHFFFAOYSA-N 407.390 -0.208 50 10 HBGE CC(C)Oc1ccc(NC(=S)NNC(=O)[C@H](C)NC(=O)Cn2cnnn2)cc1 1558199677 KUEMEYADSNYVGG-NSHDSACASA-N 406.472 -0.017 50 10 HBGE CN(C)N(C(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1)[C@H]1CCS(=O)(=O)C1 1629230953 VMHSFOWBWAIDQX-LBPRGKRZSA-N 403.482 -0.949 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)CS(=O)(=O)C1CC1 1629793710 XKPSOCPCORKICJ-UHFFFAOYSA-N 408.480 -0.831 50 10 HBGE CN(C)c1ccc(NC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1 1637742469 ANHNJUAETDPSRJ-GOSISDBHSA-N 406.443 -0.284 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2267203174 MZNVHKHKAWHCLC-GHMZBOCLSA-N 402.303 -0.181 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@@]1(C)CNC(=O)OC(C)(C)C 2282066804 UWDLXHKZGDZOGW-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)c3ccc(B(O)O)c(F)c3)[C@H]2C1 2282365390 YAZWADIGHPUSRJ-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CCc1nn(C)c(C(=O)N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)c1B(O)O 2282389794 HVCYAOPTUFAYQR-KMFMINBZSA-N 412.255 -0.198 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282719205 ISPSGYWABGOTGZ-AREMUKBSSA-N 418.302 -0.228 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282731739 VNRIWSNGVFJHEB-UFBFGSQYSA-N 406.216 -0.164 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccncc1 731595942 LSFKYVOQUQNPQW-QLFBSQMISA-N 408.480 -0.048 50 10 HBGE Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H]2COCCO2)c(C)s1 771992098 JKBNHBFRQJXMJQ-NSHDSACASA-N 406.486 -0.611 50 10 HBGE O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1CCc2nncn2C1 816880696 QBZBGEMGDNBVQQ-AOAWJKDVSA-N 419.463 -0.043 50 10 HBGE Cc1[nH]nc(I)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1290349902 ZYMRESPMONAECM-ZCFIWIBFSA-N 412.209 -0.482 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(F)cc1 1440420313 ZDXDJRQLAJDEPI-XJKSGUPXSA-N 403.366 -0.096 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)O1 1457475187 BEAYYAJJDOWFMA-KGLIPLIRSA-N 413.452 -0.516 50 10 HBGE CN(CCCC(=O)NNC(=O)CS(C)(=O)=O)S(=O)(=O)c1ccc(F)cc1 1641668077 ZVNPSRAZJPKQQK-UHFFFAOYSA-N 409.461 -0.582 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1 2266899159 JQEAOPWHCZKNLY-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2267621538 HNSULTAKSLZMIM-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)N1CCC(SCC(=O)N=c2nc(B(O)O)[nH]s2)CC1 2268639030 XOQUYDRCDSRJOC-UHFFFAOYSA-N 402.307 -0.289 50 10 HBGE CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1c(B(O)O)cnn1C 2282073503 NMDWMEJRCFRFIZ-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cn1nc(C(=O)NC[C@]2(F)C[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282250591 ZNOWQZRUNXZHGF-HWJBBNHMSA-N 404.635 -0.122 50 10 HBGE Cn1nc(C(=O)N=c2nc(CNC(=O)OC(C)(C)C)[nH]s2)c(B(O)O)c1Cl 2282293633 MARKWGQDRITGCE-UHFFFAOYSA-N 416.656 -0.696 50 10 HBGE C=C(CS(=O)(=O)NC[C@H]1C[C@]2(CCN(C(=O)OC(C)(C)C)C2)CO1)B(O)O 2282376267 BAEHIKYJXAJQLI-CJNGLKHVSA-N 404.294 -0.110 50 10 HBGE C[C@@H](OC(C)(C)C)[C@H](NC(=O)OC(C)(C)C)C(=O)N=c1nc(B(O)O)[nH]s1 2283979556 OPJDJFBVNDBPAN-BDAKNGLRSA-N 402.282 -0.325 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1cc(B(O)O)ccc1C 2365421411 HTRZOWIWRLRAGE-ZDUSSCGKSA-N 402.278 -0.507 50 10 HBGE CC1CCC2(CC1)NC(=O)N(CC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)C2=O 728178197 DTJGLQYYDCYMMX-JZLYGMAVSA-N 400.501 -0.021 50 10 HBGE O=C(NCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccnc1 758514086 YRTYRIWZBUFOKI-UHFFFAOYSA-N 405.274 -0.362 50 10 HBGE Cc1csc(CC(=O)NNC(=O)COC(=O)[C@](C)(O)Cn2ccccc2=O)n1 1116863894 RPEMNGREUTXNIK-QGZVFWFLSA-N 408.436 -0.702 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cnn(C)c3)C2)c2ccccc2c1=O 1135359598 MUAORRUVDBNOIZ-GFCCVEGCSA-N 423.433 -0.036 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(NC(=O)C(F)(F)F)cc1 1306514287 OJEDCPCAXCNZLC-QMMMGPOBSA-N 410.374 -0.185 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@H]1CCCCO1 1523624423 AQYLIFGOISAIGX-CYBMUJFWSA-N 418.493 -0.165 50 10 HBGE 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CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282365097 UHHNNNOBIMXCCJ-MGPLVRAMSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)NCC[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2282416991 DMHCIFUICKPVGW-NSHDSACASA-N 420.318 -0.268 50 10 HBGE C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)C1 746000883 BHIHWZMGEHQFIU-XHSDSOJGSA-N 411.503 -0.735 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nccn(C)c2=O)C1 747938065 OUUXJHFLNWDLEI-LBPRGKRZSA-N 410.456 -0.071 50 10 HBGE C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)[C@@H]3COCCO3)cn2)C[C@@H](C)O1 756839387 QNOVZKZOOZLYLU-SCRDCRAPSA-N 410.431 -0.913 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](O)Cc3cnn(C)c3)CC2)cc1 787128461 ZKYGYXCVJYYDQE-IBGZPJMESA-N 414.510 -0.403 50 10 HBGE O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)[C@H]1COCCO1 810462498 SOZODMWWPCZSRQ-SNVBAGLBSA-N 411.358 -0.454 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1 1440415685 YCCCAIOEDKWXJI-ZDUSSCGKSA-N 420.397 -0.064 50 10 HBGE 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O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1nscc1B(O)O)OCc1ccccc1 2255739930 RLGHTPUYEXSDKR-UONOGXRCSA-N 405.241 -0.363 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282078244 GEFYKTRYXMJHSE-MNOVXSKESA-N 402.282 -0.882 50 10 HBGE O=S(=O)(NCC[C@@H]1CN(Cc2ccccc2)CCO1)c1cscc1B(O)O 2282358259 WQIUYWFTHQJPIF-OAHLLOKOSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282731737 VNRIWSNGVFJHEB-PRHODGIISA-N 406.216 -0.164 50 10 HBGE COc1ccc(OC)c(CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)c1 746003313 PJSXYDZMZBSJER-KRWDZBQOSA-N 408.455 -0.022 50 10 HBGE CN(C)S(=O)(=O)N1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1 810091498 YAQAPWQMQGSPIS-UHFFFAOYSA-N 417.919 -0.085 50 10 HBGE CO[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1479061102 QPEOEEIOSGDJPL-HDJSIYSDSA-N 412.468 -0.171 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)cc2)C[C@@H](C)O1 1543093852 ONUULUMCDXZZFB-ZOWXZIJZSA-N 424.479 -0.476 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@@](F)(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)C1 1630431509 HMQFJLXHOKIQGP-BTDLBPIBSA-N 400.407 -0.612 50 10 HBGE O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1CCC(=O)N1 1633924832 FCXWUFJCDMNFOZ-JTQLQIEISA-N 404.242 -0.351 50 10 HBGE CC(C)CN1C(=O)c2ccc(C(=O)NNC(=O)CN3CCN(C)CC3)cc2C1=O 1865760389 VJAZADTTXZYZRY-UHFFFAOYSA-N 401.467 -0.053 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2sccc2B(O)O)C1 2267209476 XGXNHKSFNZTWHQ-OLUQVHSISA-N 424.331 -0.118 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@@H](C)[C@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282360848 INVPORHIBUVRID-VXNVDRBHSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)CCO1 2282420082 ZZQYNKAXVQESPE-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C(C)(C)C1 2282727606 JOHYTMSMYAFLNU-UHFFFAOYSA-N 419.334 -0.016 50 10 HBGE O=C(N1CCC(CNS(=O)(=O)Cc2ncsc2B(O)O)CC1)C(F)(F)F 2282734615 NWRQWJLSAZRXKT-UHFFFAOYSA-N 415.224 -0.957 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282852204 MDKRZZZWFXEJJB-UHFFFAOYSA-N 420.318 -0.735 50 10 HBGE CC(C)(C)OC(=O)NCCS(=O)(=O)CCOc1cc(B(O)O)c(Cl)cn1 2335770109 YFZMXIHIYZKAAC-UHFFFAOYSA-N 408.669 -0.267 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]1C2 2359281364 NIKWJQZIIZBZRR-JRPNMDOOSA-N 418.302 -0.469 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2Cc3ccccc3S2)n(C)c1=O 765726825 GSONSQVRGNOLAG-GFCCVEGCSA-N 414.447 -0.702 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)N1 1287237756 HAGZJJRHDMNKRU-CYBMUJFWSA-N 419.463 -0.727 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)nn1 1300748697 NNNZYZVZISKLNX-UHFFFAOYSA-N 423.274 -0.621 50 10 HBGE Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c1C 1313099921 WKGGZUZCRZNYFX-ZDUSSCGKSA-N 413.500 -0.108 50 10 HBGE C[C@@]1(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCS(=O)(=O)N1 1349692346 ONOKVVXDFSQRKK-IBGZPJMESA-N 423.539 -0.182 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2cn(C3CN(C(=O)OC(C)(C)C)C3)nn2)CC1 1448412703 OBUPJWHBVXFBJM-UHFFFAOYSA-N 408.463 -0.328 50 10 HBGE COc1ccccc1NC(=S)NNC(=O)CN1CCN(S(C)(=O)=O)CC1 1463671767 FCONRWISOHGRIO-UHFFFAOYSA-N 401.514 -0.410 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN2CCC(N3CCCS3(=O)=O)CC2)cc1 1559905395 BQLSXQAZYJQGMH-UHFFFAOYSA-N 405.480 -0.181 50 10 HBGE CN1C[C@@H](O)C[C@]1(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1586780039 GEUKQMWPJVPADO-KBXCAEBGSA-N 410.496 -0.313 50 10 HBGE CCN1CC[C@@H]1C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1629793270 PEWQPDUQXFEYPM-QGZVFWFLSA-N 423.539 -0.457 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 1636625795 DITZMZOXBBNRGB-ZDUSSCGKSA-N 412.182 -0.357 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267393257 VYXIHLIFFYTIAC-MGCOHNPYSA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267607494 NYDCTNLESPRAHP-MNOVXSKESA-N 406.291 -0.612 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1cccc(B(O)O)c1 2282344943 XZLSJZZQYBCKSR-AWEZNQCLSA-N 402.278 -0.986 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2282383742 DAVHHEXYLUWNSK-YWVKMMECSA-N 420.680 -0.848 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282707417 YQOMPJVDWXIPEX-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282727948 MXMRRXATNACZQV-HNNXBMFYSA-N 406.241 -0.941 50 10 HBGE Cc1ccc(NS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)c(F)c1B(O)O 2327856161 SHCGAEAFXVVHGO-UHFFFAOYSA-N 406.200 -0.148 50 10 HBGE O=C(NCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccn1 758512664 OWWANCUYBKVILB-UHFFFAOYSA-N 405.274 -0.362 50 10 HBGE CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)[C@@H]2COCCO2)CC1 808279303 ZWRUANGPJKPPEV-JSGCOSHPSA-N 406.505 -0.475 50 10 HBGE CN1C[C@@H](C(=O)NNC(=O)c2ccc(=O)n(C)c2)N(C(=O)OC(C)(C)C)CC1=O 1304258849 PEOBHRFFYNOJHF-LBPRGKRZSA-N 407.427 -0.776 50 10 HBGE Cc1cc(C(F)(F)F)n2nc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2n1 1472505284 SVKWLHXOVURAEF-SSDOTTSWSA-N 408.362 -0.245 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN(CC(F)(F)F)C1=O)N[C@H]1CCS(=O)(=O)C1 1542285178 HDXWFVLLHWWWGA-DTWKUNHWSA-N 400.379 -0.695 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)NCC(F)(F)F)cc1OC 1556392511 XCNUXBIBTQLTAT-UHFFFAOYSA-N 414.362 -0.125 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)Cn3ccc4ccccc43)c2S1(=O)=O 1633079936 RGLNMAZCTWXPOV-UHFFFAOYSA-N 402.436 -0.067 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(N(C)C)ncc1Br 1648534313 ATLUUHGCOOUGCU-ZCFIWIBFSA-N 409.266 -0.996 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2sc(B(O)O)cc2C1 2085452552 KLUXZVGDKNXRFM-UHFFFAOYSA-N 420.277 -0.588 50 10 HBGE C[C@@H](O)CN(CCNS(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2267386540 VQOZNGUKSXZBFJ-SNVBAGLBSA-N 408.307 -0.676 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)n1 2281887704 UXILFLAHQXOKBA-JKSUJKDBSA-N 416.243 -0.604 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282334472 BSEFHXIIGMZLSD-SNVBAGLBSA-N 404.298 -0.810 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@H](CNC(=O)C(F)(F)F)C2)sc1B(O)O 2282362781 JQCLXLNYFWAVMO-SECBINFHSA-N 414.236 -0.184 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282384292 LGMFYTCPMFEBDJ-GHMZBOCLSA-N 419.334 -0.064 50 10 HBGE CC[C@@]1(NS(=O)(=O)c2c(B(O)O)cnn2C)CCN(C(=O)OC(C)(C)C)C1 2282710062 IXUIJAFMVXWWBH-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H]1CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282859046 HGJDAZPWPXTFSV-NSHDSACASA-N 400.237 -0.041 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)N[C@H]2CCC=C2B(O)O)C1 2283986197 CNHYDZOOHMLIED-YPMHNXCESA-N 402.278 -0.372 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@H]1COCCO1)C1=NS(=O)(=O)c2ccccc21 744643468 VSCAFBZLFBUWGT-CYBMUJFWSA-N 410.452 -0.590 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)cnc2n(C)c1=O 748138343 LRDQSVONKLJSLP-UHFFFAOYSA-N 403.420 -0.207 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1CCc2nncn2C1 816879154 IQIFEQZRTNAIPX-LLVKDONJSA-N 410.431 -0.504 50 10 HBGE O=C(CNC(=O)c1cnc(Cl)c(Cl)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1 1135990449 NIFIBBDXHKDFRQ-ZETCQYMHSA-N 409.251 -0.300 50 10 HBGE CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CS(C)(=O)=O)cc1 1149617899 VURXEARAUFESLX-UHFFFAOYSA-N 419.525 -0.156 50 10 HBGE CN(CCN(C)C(=O)c1cccc(B(O)O)c1)CCN1C(=O)c2ccccc2C1=O 1298756895 TWJKGEUJMAJXRX-UHFFFAOYSA-N 409.251 -0.334 50 10 HBGE COCCOCCN(C)CCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 1440442128 GDJMWKKOSUYTIR-UHFFFAOYSA-N 405.455 -0.321 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@H]1CCN1C1CCOCC1 1635371991 MREVRLBZLFGFNN-OAHLLOKOSA-N 414.459 -0.495 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1B(O)O 2267387119 DTPPGWFBHADGAR-UHFFFAOYSA-N 400.209 -0.656 50 10 HBGE CCCC1(NS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282083770 RELOTXXVSQKOOS-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083860 LLOJUEIUHWAGKA-KBPBESRZSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282378548 HXZQQKDLWOKIEY-ZIAGYGMSSA-N 400.262 -0.922 50 10 HBGE Cn1c(CC(=O)NNC(=O)NCCCN2CCCS2(=O)=O)nc2ccccc21 726276289 AJBLQQHGQUUJFS-UHFFFAOYSA-N 408.484 -0.128 50 10 HBGE C[C@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 745681065 OQLKPNQLPZPNOR-FZMZJTMJSA-N 400.457 -0.256 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)N[C@H](C2CC2)C(F)(F)F)n(C)c1=O 808866661 CGBCEQSZADREHF-SNVBAGLBSA-N 417.348 -0.895 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)c1cccn1CCN1CCOCC1 1471977778 WUIBBIULIROCGH-SFHVURJKSA-N 405.499 -0.165 50 10 HBGE CN1C(=O)CS/C1=C/C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 1472475930 NENRXAYPQFKQSF-LFYBBSHMSA-N 404.857 -0.205 50 10 HBGE C[C@H](C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1532641399 WWNMPANYRQKHLR-FPVZYODXSA-N 422.482 -0.373 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1 1630866916 LFSLTBZRTGOOFK-NSHDSACASA-N 417.871 -0.241 50 10 HBGE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(B(O)O)ccc1F)CCS2(=O)=O 1636976362 WKPLBSQGNBRCEN-JKIHBJTHSA-N 413.232 -0.866 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C[C@@H](F)C1 2282101349 CMOUHAQDLWXXCH-OLZOCXBDSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2coc(B(O)O)c2)CC1 2282240349 IYDOCFOWUTWUJE-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@H]1CO 2282358899 GRSBMWOEJGOAGA-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)[C@@H]1COCCO1 745408878 VDPJYRLZUAJUMC-HNNXBMFYSA-N 414.484 -0.240 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cncc(Br)c2)n(C)c1=O 767386091 AQKDDRODMSMWBP-UHFFFAOYSA-N 420.227 -0.259 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1)N[C@@H]1CCS(=O)(=O)C1 919888637 PHGMRHJBVQSOCO-YPMHNXCESA-N 414.509 -0.201 50 10 HBGE CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCC(=O)N1)C2=O 1470497687 ISOIHQJPJBTQPX-DKXWOSEQSA-N 407.471 -0.061 50 10 HBGE C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)[C@@H]1CCC(=O)N1 1623404479 KNINBWNCBLLPFX-BBRMVZONSA-N 409.512 -0.020 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3nnc(C)n3C)c2)CC1 1641992522 KSWRNHWVXWMRCL-UHFFFAOYSA-N 421.483 -0.267 50 10 HBGE CN(C)CC#CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1685773431 WQWCXDIULUMRFD-UHFFFAOYSA-N 423.495 -0.784 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2267378642 QZIUPNBKSPVKTO-NXEZZACHSA-N 405.307 -0.360 50 10 HBGE O=C(N[C@H]1CC[C@@H]1NC(=O)c1cc(B(O)O)c(O)cc1O)OCc1ccccc1 2267811285 XWLDAPHLFBHHAC-GJZGRUSLSA-N 400.196 -0.035 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272655809 SBJYNKYBEBQZEJ-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC1(C[S@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2281869082 PYHPVFSHLZEUQT-MHZLTWQESA-N 400.266 -0.416 50 10 HBGE CN(Cc1nc(NS(=O)(=O)c2cc(B(O)O)cs2)n[nH]1)C(=O)OC(C)(C)C 2282068448 DCQKGHZDTFLEDG-UHFFFAOYSA-N 417.278 -0.286 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282326940 AOHSPBIGVYPFHX-NSHDSACASA-N 402.282 -0.914 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC1(C)CC(NC(=O)OC(C)(C)C)C1 2282700942 UESRUNFGQQSMIZ-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1 2282731863 XPEFPMRSQZMKQJ-VIFPVBQESA-N 414.236 -0.184 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282850773 SSYVRCDGDJUCQK-PHIMTYICSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](C(=O)N=c2nc(B(O)O)[nH]s2)OC(C)(C)C1 2284045464 NCMIGFBWJIEKJT-IUCAKERBSA-N 400.266 -0.571 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1sccc1S(=O)(=O)NCc1ccco1 744644727 NISOSHGKGYEABV-NSHDSACASA-N 415.449 -0.004 50 10 HBGE COc1ccc(N2CCN(CCCNC(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 745348966 FVAOPTMDDKHRSX-SFHVURJKSA-N 421.498 -0.047 50 10 HBGE O=C(NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@@H]1COCCO1 746000100 ZIWMCCQFDPWKNK-YPMHNXCESA-N 401.803 -0.110 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COCCO2)ccc1Br 746022793 MTIUMLXWHWYORM-VIFPVBQESA-N 408.230 -0.727 50 10 HBGE Cn1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c(=O)n(C)c1=O 809245676 MRSTXUVFAZRJPR-SREVYHEPSA-N 420.809 -0.245 50 10 HBGE CO[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)[C@@H]1CCOC1 1182816473 SESJGONYTHVRIP-HIFRSBDPSA-N 413.500 -0.488 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1287239073 SOXMWDAFYIGGFD-AWEZNQCLSA-N 410.452 -0.944 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1=CCS(=O)(=O)C1 1293965745 ATBPTSKCDQHMAX-UHFFFAOYSA-N 401.466 -0.495 50 10 HBGE CN(C)c1ncc(Br)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)n1 1597431278 AHJCWOGJFZNKCX-SSDOTTSWSA-N 421.277 -0.564 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@H]2CCC(=O)[C@@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393773 XTQROLCGOXYBMY-NUEKZKHPSA-N 407.448 -0.306 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H]2C[C@@H]21 2267624977 IDKVSFGLWUTYTK-QWRGUYRKSA-N 403.291 -0.654 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2272655243 NWIYQKGCEZGTNI-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)n1 2281879478 JHHISYNECURMNH-JGFSIVIASA-N 402.282 -0.266 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 2282079108 RPMVCERQAGNJMU-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@H](O)C1 2282097399 FGTVAYCGNVNETF-ZIAGYGMSSA-N 400.262 -0.985 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@H]1CNC(=O)OC(C)(C)C 2282362168 BTBHSUXQCKINFI-JQWIXIFHSA-N 400.262 -0.434 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)n1 2282441570 HLZCXSHRJYZZMH-UHFFFAOYSA-N 400.266 -0.558 50 10 HBGE O=S(=O)(c1sccc1B(O)O)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 2282701466 APHYCQMBPKOBPQ-JKSUJKDBSA-N 408.310 -0.298 50 10 HBGE CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cncc(B(O)O)c1 2282708931 UECXBXLHGGOCRE-INIZCTEOSA-N 401.294 -0.021 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)c2ccccc2B(O)O)C1 2282716661 XGZYDPPFDGCEEL-MRXNPFEDSA-N 400.262 -0.983 50 10 HBGE CCc1nc(C(=O)N(CCNC(=O)OC(C)(C)C)C[C@@H](C)O)c(B(O)O)s1 2285351672 YJUIRXPHSHCMQV-SNVBAGLBSA-N 401.294 -0.267 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734812001 LQOMPSJCHPTIFE-IVMMDQJWSA-N 424.479 -0.268 50 10 HBGE CC(C)NS(=O)(=O)NCCNC(=O)NNC(=O)C(F)(F)Oc1ccccc1 759025380 FPMAQSQTDRNHMO-UHFFFAOYSA-N 409.415 -0.179 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)NCC2(N3CCOCC3)CCN(C)CC2)n1 1251865521 JUFYDOZTQSPNAB-UHFFFAOYSA-N 407.519 -0.373 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1306513846 GGUWONGEXBAURI-NNYUYHANSA-N 404.489 -0.426 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)C2)s1 1557735204 UUCXAVIWJNVWRZ-LLVKDONJSA-N 423.538 -0.351 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1sncc1B(O)O)OCc1ccccc1 2255687259 DQBFFWRUUMZMMN-KGLIPLIRSA-N 405.241 -0.363 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@H]2CN1S(=O)(=O)c1sccc1B(O)O 2267212505 WAKBTFYSIFUQEQ-HOSYDEDBSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2267374898 YVCPVMIRDVHHBR-SNVBAGLBSA-N 405.307 -0.501 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@H]2CN(C(=O)OCc3ccccc3)CC23CCC3)n1 2281864829 OTMDGBIXXUHJHO-AWEZNQCLSA-N 413.243 -0.584 50 10 HBGE C[C@@H]1CC[C@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2sccc2B(O)O)C1 2282068791 HWMPUJBANSMYBJ-RKDXNWHRSA-N 414.236 -0.104 50 10 HBGE CC(C)(C)OC(=O)NCCc1nnc(NS(=O)(=O)c2cc(B(O)O)cs2)o1 2282079075 REDKYEVIMSHRJF-UHFFFAOYSA-N 418.262 -0.321 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)CO1 2282357830 PHDTUFCCULAIPT-SECBINFHSA-N 408.188 -0.526 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(F)(F)F 2337195259 WMJKBVXNAUQWLM-NSHDSACASA-N 414.149 -0.313 50 10 HBGE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2COCCO2)c(OC)c1 744650208 WHMIOZHQLDRUIO-HOCLYGCPSA-N 407.423 -0.129 50 10 HBGE CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@H]2COCCO2)c1 745504847 ZLTNXSUCFBATDS-CQSZACIVSA-N 400.457 -0.381 50 10 HBGE O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1)[C@H]1COCCO1 746002844 NGVIFIPKMUQAEA-OAHLLOKOSA-N 412.468 -0.461 50 10 HBGE Cn1cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1C(=O)NCC(F)(F)F 775675684 IIEWGBRMDUNTTA-JTQLQIEISA-N 414.362 -0.958 50 10 HBGE CC(C)NC(=S)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1318636946 WPQOKDWYPOJREA-RWMBFGLXSA-N 404.558 0.000 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2ccc3ncc(I)n3c2)N1 1461835922 IVRLXAQAIDNRGS-QMMMGPOBSA-N 413.175 -0.022 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1 1542683726 AKARIOHCLVLGJI-LBPRGKRZSA-N 409.443 -0.292 50 10 HBGE COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)CN2CCCC2=O)cc1 1587516339 SBRCEQSRJBKIHU-UHFFFAOYSA-N 404.423 -0.456 50 10 HBGE COc1cccc([C@]2(C)NC(=O)N(NC(=O)c3cc(B(O)O)ccc3F)C2=O)c1 1634476789 IZVAGNFULFOQDM-SFHVURJKSA-N 401.159 -0.374 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2267626238 DTEHCZQFIMYJNP-UHFFFAOYSA-N 408.282 -0.194 50 10 HBGE Cn1nc(C(=O)N[C@H]2COCC[C@H]2NC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281654793 MFYUSIOHWQHUPX-BDAKNGLRSA-N 402.644 -0.835 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2ccc(B(O)O)cc2)CCOC1 2282078005 CGTLOUGWHJDRDF-MRXNPFEDSA-N 400.262 -0.672 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)Cc1ncsc1B(O)O 2282376417 DIMGDCREZCCOJS-PHIMTYICSA-N 417.318 -0.264 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@@H]1CO 2282699373 JQWVEOIQXYSGTH-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCN(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)CC1 2282741668 QUCQWYRCLKRVJD-UHFFFAOYSA-N 403.241 -0.749 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)([C@@H](F)C(=O)Nc2nc(B(O)O)ccc2Cl)C1 2284034498 FQADNHFJMOAQAK-JTQLQIEISA-N 403.603 -0.327 50 10 HBGE COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@H]2COCCO2)c1 744646904 SKIIEIXJGVTJGL-CYBMUJFWSA-N 421.859 -0.559 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cc(F)ccc2F)n(C)c1=O 765729957 BSRJVOZIOQNVPV-UHFFFAOYSA-N 406.349 -0.898 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@@H]2CCCCO2)c1 1274118652 HRLWPCQLDPJBQH-AWEZNQCLSA-N 414.484 -0.405 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(=O)n(C)c3)CC2=O)cn1 1627130967 VFXHSNLJJMKRTR-ZDUSSCGKSA-N 402.411 -0.958 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC(NC(=O)OCc2ccccc2)C1 2267625818 WISNGZCQTQDWOT-UHFFFAOYSA-N 420.252 -0.326 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@@](C)(CO)C1 2282082519 JYAYQENRFHJLPC-OAHLLOKOSA-N 420.318 -0.580 50 10 HBGE Cc1c(C(=O)N=[S@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)nn(C)c1B(O)O 2282293870 PBLBYGSMXWAWMU-BLBHWQHRSA-N 400.266 -0.686 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@H]1C[C@H]1NC(=O)OC(C)(C)C 2282356450 VLUUVAHEADLTIM-CMPLNLGQSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282363203 MSESTKUMCQWHJO-NSHDSACASA-N 420.318 -0.410 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1 2282707813 DIXHJURHRCIUGS-PHIMTYICSA-N 402.282 -0.786 50 10 HBGE CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(NN=Cc2c(C)nn(CCO)c2C)n1 1084365230 DDGKLOUMCMVULT-JTQLQIEISA-N 409.476 -0.296 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCC(O)CC3)cc2)cn1 1147403714 PYRPUDZQLWWYQZ-UHFFFAOYSA-N 407.452 -0.360 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1OC 1235026858 GNIUTTYVXCTWNY-LJQANCHMSA-N 422.438 -0.334 50 10 HBGE Cn1nc(I)cc1C(=O)NNC(=O)c1ccc(=O)n(C)c1 1463158699 QWIGVPCGQFENTA-UHFFFAOYSA-N 401.164 -0.202 50 10 HBGE CN(C)C(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12 1464538143 GHRAPPJGPAEELP-WOPDTQHZSA-N 404.489 -0.041 50 10 HBGE O=C(N[C@H]1Cc2cc(Br)cnc2NC1=O)c1cc(B(O)O)ccc1F 1558708625 ARKGOCYTLBJXMO-LBPRGKRZSA-N 407.992 -0.044 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)cc1 1643602790 OHXOMPPSPBGAIU-BXUZGUMPSA-N 413.452 -0.286 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2OC)cc1OC 1682618213 LSGCEKZSHCQJMC-BXUZGUMPSA-N 401.441 -0.150 50 10 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O=c1cc(CCl)c2cc(F)c(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(F)c2o1 256094265 ATTAHAWLQLRXSU-AWJRLRCMSA-N 408.737 -0.011 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@H]1COCCO1 744640920 FITPCKHKXYYYSA-OAHLLOKOSA-N 414.436 -0.426 50 10 HBGE C=CCn1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)nn1 1312898807 URPLPWZUKPTOFB-UHFFFAOYSA-N 421.483 -0.076 50 10 HBGE COCCOCC(=O)NNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 1470923447 ICZBNUAKQPUODH-FPLPWBNLSA-N 420.466 -0.290 50 10 HBGE Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)[C@@H]3CCCCO3)cnc21 1595465014 SRWYVIGRFIYOBZ-QMMMGPOBSA-N 413.232 -0.391 50 10 HBGE CCOC(=O)N1CCC(NC(=O)CCCNC(=O)c2ccc(B(O)O)cc2)CC1 1625624208 WRBVZHWXQDGNKI-UHFFFAOYSA-N 405.260 -0.387 50 10 HBGE Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2 1628649162 IFUWPLBDIOZVEC-BPLDGKMQSA-N 405.455 -0.025 50 10 HBGE Cn1ncc(I)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1628907976 CADNIYZAEZOCNW-ZCFIWIBFSA-N 412.209 -0.780 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ncc(Br)cn1 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-0.136 50 10 HBGE CC(C)(C)OC(=O)COCCOCCNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1 1471557361 AFNLZMIEZDVCPP-INIZCTEOSA-N 409.505 -0.258 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCc3c(cccc3S(N)(=O)=O)C2)n1 1659912533 IFEROYNOHHBGGZ-UHFFFAOYSA-N 423.520 -0.153 50 10 HBGE C[C@H]1CN(C(=O)c2cnn(C)c2B(O)O)C[C@H](C)N1C(=O)OCc1ccccc1 2267321705 LZEDKMVBOYIITN-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1nc(C)sc1B(O)O)NC(=O)OC(C)(C)C 2281643232 HQRLSOHRGFGTMM-SECBINFHSA-N 401.250 -0.682 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@H]1C[C@@H]1NC(=O)OC(C)(C)C 2282356452 VLUUVAHEADLTIM-PWSUYJOCSA-N 400.262 -0.434 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@H](NC(=O)C(F)(F)F)C[C@H]1C 2282361233 OADMEVGXDDMQIM-APPZFPTMSA-N 414.236 -0.044 50 10 HBGE C=C(CS(=O)(=O)N1CCO[C@]2(CCCN(C(=O)C(F)(F)F)C2)C1)B(O)O 2282362836 KAMVKWJHWBVTMW-LBPRGKRZSA-N 400.184 -0.860 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CCNS(=O)(=O)c2sccc2B(O)O)C1 2282706539 MZTMGCJLLFKJKI-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)CC1 1544186236 RHPWZLRWMPVGCP-UHFFFAOYSA-N 404.489 -0.328 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CC3(C2)CS(=O)(=O)C3)c1 1586905329 MMBFEWQUWJIKAL-UHFFFAOYSA-N 415.493 -0.477 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1 1630862551 MFVAEBYYDOHUCG-SECBINFHSA-N 418.269 -0.006 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)CC2=O)cn1 1645964137 YBENEAKMXBAIRS-AAEUAGOBSA-N 406.443 -0.070 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C#N)n2C)CC1 1648592440 CNVMKEMVYMIXEQ-UHFFFAOYSA-N 403.468 -0.015 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2282372999 GTPYGUAAJXICIA-RYUDHWBXSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C2(CC2)C1 2282738195 QTTMKLJXFGQVHX-UHFFFAOYSA-N 417.318 -0.262 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282738808 ZNPYOTGCQHORNA-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H](COCc2ccccc2)C(=O)O)c1B(O)O 2284415668 YYFKAOVLVAJQMD-CYBMUJFWSA-N 413.282 -0.007 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)N1CCC(B(O)O)CC1 2285909747 KRAALJXPCOTQIB-CYBMUJFWSA-N 404.294 -0.124 50 10 HBGE NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)[C@H]3COCCO3)c2)C1 745810000 VXBHBJXMFOGCCL-IAGOWNOFSA-N 419.482 -0.370 50 10 HBGE CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)[C@H]3COCCO3)ccc2O1 751549130 QRJWOQUBZGXWMP-ZIAGYGMSSA-N 400.409 -0.722 50 10 HBGE CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2CCCO2)c(OC)c1 814216538 QKBYAGNKCVWJIO-LLVKDONJSA-N 407.470 -0.055 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN(C)[C@@H](C)CO)c1 1143340775 IVOLJPMCRAPACB-ZDUSSCGKSA-N 400.501 -0.209 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CSCC(=O)N3)CC2)cc1 1545426410 STFPGTYDQGTTLH-INIZCTEOSA-N 405.524 -0.508 50 10 HBGE O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCCN(CCN2CCOCC2)C1 1683674179 JEADVMBNFZQBSM-INIZCTEOSA-N 421.498 -0.102 50 10 HBGE Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)c1 1684632668 DMXXFONXLDUOGK-LJQANCHMSA-N 406.439 -0.360 50 10 HBGE O=S(=O)(NCCNS(=O)(=O)N1CCC(Br)CC1)C(F)F 2162206732 KKZNBCSHBROWGU-UHFFFAOYSA-N 400.267 -0.178 50 10 HBGE Cn1nc(C(=O)N[C@@H]2COCC[C@@H]2NC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281654794 MFYUSIOHWQHUPX-DTWKUNHWSA-N 402.644 -0.835 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2282073496 NMDNDKJHURTSHP-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CC(N(C2COC2)S(=O)(=O)c2ccc(B(O)O)s2)C1 2282074599 MSUJKRVUBINGCJ-UHFFFAOYSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282383107 UVBJBBINXXRNBG-GFVXYOJSSA-N 400.266 -0.273 50 10 HBGE C=C(CS(=O)(=O)N1CCC2(CC1)COCCN2C(=O)OC(C)(C)C)B(O)O 2282418427 IJLCJMOAMOTPOJ-UHFFFAOYSA-N 404.294 -0.014 50 10 HBGE C[C@@H](NS(=O)(=O)c1ccc(B(O)O)cc1)C1(O)CN(C(=O)OC(C)(C)C)C1 2282425322 OEPPMEQDDXSHHA-LLVKDONJSA-N 400.262 -0.985 50 10 HBGE C=C(CS(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2)B(O)O 2282736330 OMKDLZNIJGMWMM-CYBMUJFWSA-N 404.294 -0.110 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2360642771 SADURCJNWHKSLE-VIFPVBQESA-N 421.668 -0.709 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ccc(F)c(B(O)O)c1 704311521 UQCMMZXVXLSYER-UHFFFAOYSA-N 406.200 -0.067 50 10 HBGE COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)[C@H]3COCCO3)n2)cc1 744644967 NDKTZSRUFWDBLG-OAHLLOKOSA-N 405.411 -0.223 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)C(F)(F)Oc1ccccc1 755405270 WQZZXOPZOGGDEG-JTQLQIEISA-N 417.394 -0.094 50 10 HBGE C[C@@]1(NNC(=O)N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)CCS(=O)(=O)C1 807609277 LLILBFGZWONPBV-XJKSGUPXSA-N 416.525 -0.169 50 10 HBGE O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1CCCO1 814343831 XAMNFALRYPMXTI-CQSZACIVSA-N 413.452 -0.157 50 10 HBGE CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816879834 XCRNUNGHKNLSKV-CYBMUJFWSA-N 406.468 -0.012 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CN2CCCC2=O)ccc1Cl 1471221738 ALSMLVURZARVLR-UHFFFAOYSA-N 402.860 -0.026 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)c1 1628649843 UNKSRPROPLRMLN-BPLDGKMQSA-N 424.479 -0.618 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1sccc1B(O)O 2267200278 UNDMXEBQGMKLLE-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 2267388470 YVAJXOGCVBDLRC-ZJUUUORDSA-N 406.291 -0.693 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H]2COC[C@H]21 2282070929 LGDTYFINKXBSJQ-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)c1nn(C)cc1B(O)O 2282740832 GHYYVVBCSIYSER-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE C[C@H](NC(=O)[C@@](C)(NC(=O)C(F)(F)F)C(F)(F)F)c1nscc1B(O)O 2284015805 RYPNRXRJVVOCTL-AJAUBTJJSA-N 407.101 0.000 50 10 HBGE C[C@H](NC(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1nscc1B(O)O 2284061463 FDWAUEOIFDDTFA-KWQFWETISA-N 403.241 -0.680 50 10 HBGE O=C(COc1ccccc1Br)NNC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 1153523763 KWHJONNUMOLPSU-JTNHKYCSSA-N 401.213 -0.612 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O 1352938894 SFFZYOCDVYGLJT-LBPRGKRZSA-N 423.422 -0.115 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)n(C)c2)C1 1530230943 QIWGTSVIUOSXSC-AAEUAGOBSA-N 411.484 -0.515 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc2ncc(Br)cn2n1 1628912053 KWPGIWKEJYNGFQ-ZETCQYMHSA-N 402.230 -0.313 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CS(C)(=O)=O)n(C)c2)C1 1634355663 OYWWRTMFRCZXTM-NSHDSACASA-N 420.513 -0.749 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@@H]2CCC(=O)[C@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393774 XTQROLCGOXYBMY-VNQPRFMTSA-N 407.448 -0.306 50 10 HBGE Cn1cnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 1684711710 CRTSBXNVXAQOOX-UHFFFAOYSA-N 422.467 -0.415 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNS(=O)(=O)N1CCC(Cl)CC1 2231892138 ABVHATQEUAHWCL-FRRDWIJNSA-N 413.924 -0.135 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2255663807 HDSOFRCZXDFRES-UHFFFAOYSA-N 404.253 -0.087 50 10 HBGE CN([C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)c1cscc1B(O)O 2267387947 QIISNWGONSHNCN-IWIIMEHWSA-N 402.303 -0.086 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@@](C)(=O)=NC(=O)c2sncc2B(O)O)C1 2267444808 WITOOTYIKCTFHS-AREMUKBSSA-N 403.291 -0.072 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C)n1 2281881008 UDWIJMKPARWTJO-MHZLTWQESA-N 402.282 -0.312 50 10 HBGE CC(C)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282076887 NYBSTKHGTGZQRH-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1CO 2282083187 NFUMEMOHZZLQFW-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NC(=O)c2ncc(B(O)O)cc2F)C1 2282292859 BDXWZTOPAFBWAP-BLBHWQHRSA-N 401.225 -0.194 50 10 HBGE C=C(CS(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)OCC)B(O)O 2282360028 WOZJXZBEOOKOEN-LBPRGKRZSA-N 406.266 -0.631 50 10 HBGE CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282363952 RNLGROGMMWQGMD-HNNXBMFYSA-N 404.298 -0.682 50 10 HBGE CCN(CCN(CC)S(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282377437 QQJHVUYFSNJQJK-UHFFFAOYSA-N 404.298 -0.633 50 10 HBGE Cc1cc(B(O)O)c(C(=O)N2CCS(=O)(=O)CCN2C(=O)OC(C)(C)C)s1 2282421387 MWIRAPAGGOUKMN-UHFFFAOYSA-N 418.302 -0.241 50 10 HBGE CN(CCCNC(=O)OC(C)(C)C)CCCNC(=O)c1cc(B(O)O)sn1 2282434830 PEOBXXNMKOTQPH-UHFFFAOYSA-N 400.310 -0.211 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCC1(C)CN(C(=O)OC(C)(C)C)C1 2282705408 XTJAKZOTJRFPTA-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H]1CCCCN1C(=O)OC(C)(C)C 2282714314 QHFHFZWBSXCEPW-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CC2CC1(CNS(=O)(=O)Cc1ncsc1B(O)O)C2 2282738190 QRBHDJQXFPQCLD-UHFFFAOYSA-N 417.318 -0.358 50 10 HBGE CN(Cc1csc(B(O)O)c1)C(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284055193 PIVDYNVDGNLDAT-GFCCVEGCSA-N 402.253 -0.294 50 10 HBGE Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc(F)c2)c1CN1CCOCC1 27497664 SBQUOYSBKHHSKY-AWQFTUOYSA-N 415.389 -0.032 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 744653340 WJBVBPDTSFLPBH-FQUUOJAGSA-N 413.496 -0.154 50 10 HBGE Cc1cccnc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 752227020 DDPFRDVKSIBNAM-UHFFFAOYSA-N 417.447 -0.415 50 10 HBGE C[C@H](C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765728970 APKUDUXEZWOOBP-JTQLQIEISA-N 402.386 -0.476 50 10 HBGE N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1 810275261 OARJVOSORQQOFZ-INIZCTEOSA-N 400.416 -0.012 50 10 HBGE O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)[C@@H]1CCc2nncn2C1 816879664 SVYSBSDURRBYOA-XCLFUZPHSA-N 423.433 -0.619 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)[C@@H]3COCCO3)C2)cc1 915052345 QDUPQXREOYETAR-HOCLYGCPSA-N 411.480 -0.041 50 10 HBGE CCN1CCN(C(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(B(O)O)cc2)CC1 1305523225 CXZCIBCTDKOYHF-FQEVSTJZSA-N 409.295 -0.128 50 10 HBGE CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1596922703 DAVLJCZFEVTFKL-MRXNPFEDSA-N 410.496 -0.001 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNc2ncc(Br)cn2)[C@H]1c1cnn(C)c1 1647016454 WKPSULZUOTXSQL-GMTAPVOTSA-N 410.232 -0.394 50 10 HBGE O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)CN1CCCC1=O 1648935187 YAJYWVLYOKQLKJ-UHFFFAOYSA-N 422.385 -0.247 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2)C1CCCC1 1683688858 JFRJSMWOWMCFKO-CBBWQLFWSA-N 417.532 -0.161 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)c2cccc(Br)c2)C1 1684311683 IDWXLLRWAXBGOW-UHFFFAOYSA-N 420.289 -0.116 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@](C)(NC(=O)C(F)(F)F)C1 2267384009 IBPBFUGPWRRIEH-NSHDSACASA-N 400.209 -0.432 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2267606794 CXGQXPFFXPEKKK-IONNQARKSA-N 400.209 -0.352 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)n1 2282240974 OYDXHHWXDPTMBR-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(CNS(=O)(=O)Cc3ccsc3B(O)O)[C@@H]2C1 2282338478 NWZZAKYIOPQUQK-STQMWFEESA-N 416.330 -0.040 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2C[C@@H]21 2282345005 FHSQTSVJWAHHRX-NHCYSSNCSA-N 417.318 -0.360 50 10 HBGE CN([C@@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)Cc1ncsc1B(O)O 2282381220 SFXBPIRKWQEPEX-LBPRGKRZSA-N 419.334 -0.112 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1F 2365477354 MRIRZQFZSLPPPS-NSHDSACASA-N 406.241 -0.677 50 10 HBGE COC(=O)C[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)Cc1ccccc1C 1175228638 ILJKQXHYCFOGAX-HNNXBMFYSA-N 411.480 -0.653 50 10 HBGE CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cccc(B(O)O)c1 1445041044 ZYFFXOZEBTZQMC-HNNXBMFYSA-N 406.244 -0.009 50 10 HBGE CNS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)CC1 1456016008 FMFGBMLOFLVYKP-LBPRGKRZSA-N 419.504 -0.681 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2ccc(B(O)O)cc2C1 2093519172 RNBPMOCSUKJOEU-UHFFFAOYSA-N 414.248 -0.650 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267614028 IEMXXCLUKKBJTF-QWRGUYRKSA-N 406.291 -0.660 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2281912078 FXVWPAOSUMGBJK-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@](C)(CNC(=O)OC(C)(C)C)C1 2282076561 JZFBNCYUFMMORF-OAHLLOKOSA-N 402.282 -0.975 50 10 HBGE CCCC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282414691 WNRPXOAYNVRHGJ-NSHDSACASA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@H]1CO 2282717103 DEBYVQSRKQEGGK-QWRGUYRKSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)Cc2ccsc2B(O)O)CCOC1 2282852180 LSWANHXCQVXABC-HNNXBMFYSA-N 420.318 -0.469 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)S(=O)(=O)C1CCOCC1 1156183677 FONYUJNLAMRFET-IUODEOHRSA-N 403.501 -0.631 50 10 HBGE CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)ccc1F 1178420736 PPQWMLVDDQJRKV-CQSZACIVSA-N 414.459 -0.252 50 10 HBGE C#C[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1252433204 ZFOMTGIYFGYQEB-AWEZNQCLSA-N 408.480 -0.008 50 10 HBGE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NNC(=O)c1cccnn1 1312981426 BVZGEBCLPFQWOV-UHFFFAOYSA-N 404.452 -0.144 50 10 HBGE COC(=O)[C@@H](F)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1471334805 MADGPVFNEWTAHX-ZDUSSCGKSA-N 416.431 -0.074 50 10 HBGE O=C(NNC(=O)c1c[nH]nc1I)N[C@H]1CCS(=O)(=O)C1 1631029242 KLBFAVBYTVEKPV-YFKPBYRVSA-N 413.197 -0.855 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(S(C)(=O)=O)C1 1683565242 KRYKBGLKXAZQOE-GFCCVEGCSA-N 400.457 -0.172 50 10 HBGE Cc1nn(C)c(C(=O)N(C)CC2CN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267016056 XZMFDDGDVJKJBW-UHFFFAOYSA-N 400.244 -0.251 50 10 HBGE CN1CCN(Cc2ccccc2)[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282079182 SONZMYJUWTYRMJ-OAHLLOKOSA-N 409.342 -0.478 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1ncc(B(O)O)cc1F)OCc1ccccc1 2282292305 TUAKXZOKYTVCJA-JKSUJKDBSA-N 417.202 -0.286 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C)c1B(O)O 2282407849 DCWDOABRXYZCMG-HNNXBMFYSA-N 422.334 -0.401 50 10 HBGE C[C@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1c(B(O)O)cnn1C 2282704602 MFEQXKZWOBWUMR-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCC[C@H](NC(=O)OC(C)(C)C)C1 2282705913 DYPOPJBKMNDOHQ-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cc1cc(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)ccc1B(O)O 2360636027 MHULLGUZRBHUFV-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC3)c1 1160733133 MWDRFAZWQDFFNF-JSGCOSHPSA-N 420.495 -0.099 50 10 HBGE Cc1cc(CC(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)n[nH]1 1163241535 HAVRRUZANBIJCO-UHFFFAOYSA-N 423.231 -0.686 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cnn(C)n2)CC1 1182816585 VLMGBHXMCWPDKF-UHFFFAOYSA-N 408.488 -0.778 50 10 HBGE COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NN(C)[C@@H](C)CO)c1OC 1299925686 IWFOULABZTWIQJ-LBPRGKRZSA-N 417.484 -0.318 50 10 HBGE CN(C)C(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12 1464537959 GHRAPPJGPAEELP-GRYCIOLGSA-N 404.489 -0.041 50 10 HBGE CCOC(=O)N1CCC(NC(=O)CCCNC(=O)c2cccc(B(O)O)c2)CC1 1540806916 LBDSYSCLTZKOLJ-UHFFFAOYSA-N 405.260 -0.387 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCCO1 1628548400 XLBLOWPNGWMZBN-XQLPTFJDSA-N 415.512 -0.187 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NN(C)[C@@H](C)CO)o1 1631070567 IUXHZUOITPWOJY-RYUDHWBXSA-N 403.457 -0.047 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 1642598716 CDBQQUGDZSYXIC-IRXDYDNUSA-N 420.491 -0.013 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1 1647996616 BINLZTSNOLTISY-VIFPVBQESA-N 418.269 -0.006 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)sc1B(O)O 2282372234 VUTUIYQSWGFHPW-QGZVFWFLSA-N 410.326 -0.348 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H](CN(C)Cc1ccccc1)C(=O)O 2284411787 ONSDWPUTXKWBCR-CYBMUJFWSA-N 412.298 -0.400 50 10 HBGE Cc1ccc(B(O)O)c(NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1 2360550683 FPRIGBMLNKCDOQ-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE CCCN(C)S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 765015819 QNXSAFSPYTWMCK-UHFFFAOYSA-N 420.513 -0.472 50 10 HBGE CCn1cnc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1 765117482 GBXFTCJKLLFEHK-UHFFFAOYSA-N 420.495 -0.330 50 10 HBGE O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cnc3n2CCC3)CC1 772945363 BVCHVMDRDRYYFT-UHFFFAOYSA-N 413.319 -0.182 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3C[C@@H](C)CO3)CC2)cc1 1545424398 YVXWQDXCPRLHDG-WBVHZDCISA-N 424.523 -0.126 50 10 HBGE O=C1CCc2cc(OC[C@@H](O)CNC(=O)c3cc(B(O)O)ccc3F)ccc2N1 1622505289 JIWYVZTZYCYWNY-ZDUSSCGKSA-N 402.187 -0.440 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1cccc(C#N)c1)C2 1655840912 AHVJHKLYWYZLAT-HNNXBMFYSA-N 410.438 -0.808 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 1670983877 HYBAWKOJUXKEDI-UGSOOPFHSA-N 421.479 -0.057 50 10 HBGE C[C@@H](CNS(=O)(=O)Cc1ncsc1B(O)O)CN(C)C(=O)OC(C)(C)C 2267391302 BXYYHZUJWFJCDI-JTQLQIEISA-N 407.323 -0.255 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](OCCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282698300 ATXSZKRULODYCH-LBPRGKRZSA-N 420.318 -0.268 50 10 HBGE CN(Cc1ccccc1)[C@@]1(CNS(=O)(=O)c2cc(B(O)O)cs2)CCOC1 2282706712 PLPVFVSKIQHKHV-QGZVFWFLSA-N 410.326 -0.003 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2282714764 WNSSHCBSVPHEBJ-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE COC(=O)[C@H](CC(=O)N=c1ccc(Cl)c(B(O)O)[nH]1)NC(=O)OC(C)(C)C 2283926245 KWEUWRSUIHIYTH-VIFPVBQESA-N 401.612 -0.768 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1cscc1B(O)O 2334273517 QYBOIANLAZLTSB-FOGDFJRCSA-N 402.303 -0.038 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)Cc1cn2ccccc2n1 800054785 IXIDQISZVWOOCE-JSGCOSHPSA-N 408.484 -0.075 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CN([C@@H]4CCOC4)C3)cc2)CC1 1137652014 WNKLQZCFQVURJQ-QGZVFWFLSA-N 423.539 -0.214 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@@H]1C(=O)NNC(=O)c1ncon1 1179588918 RINJGXWZOZUCJJ-BZNPZCIMSA-N 401.301 -0.184 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cnn(CCOC)c2)C1 1636211784 ZFOSJHPUNGGREM-CYBMUJFWSA-N 411.459 -0.181 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21 1650777733 RIPKFNVVCBIYMD-QMMMGPOBSA-N 406.367 -0.910 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267205799 WVRZWDZHBQVRNN-UXMMLNGASA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1sccc1B(O)O 2267212504 WAKBTFYSIFUQEQ-CKYFFXLPSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1ccsc1B(O)O 2281626847 UGRLWCYHPVFSPA-UHFFFAOYSA-N 402.278 -0.284 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282422338 ZWHMXWCOEUHJAD-HTQZYQBOSA-N 415.224 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](NS(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2282715844 MEQWDMMVDHZOBI-VWYCJHECSA-N 418.302 -0.660 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@H](C)[C@@H](NC(=O)C(F)(F)F)C1 2282724004 UQJUTDWMFXBJQO-CBAPKCEASA-N 414.236 -0.186 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)CC[C@H]1NC(=O)OC(C)(C)C 2282740768 FHECREAZZYSOTI-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 2337202812 ORSPSSHXASSIKL-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1c(C)sc(C)c1B(O)O 2365422310 SSASFVGFRZCQLA-NSHDSACASA-N 422.334 -0.137 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NCCCN2CCCS2(=O)=O)cc1 726276371 DCDZBCHDZDMEQD-UHFFFAOYSA-N 400.457 -0.170 50 10 HBGE O=C(NNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CCS(=O)(=O)C1 1136389822 LBDOXIIUBLOONX-LLVKDONJSA-N 418.422 -0.068 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cccc(C3CC3)c2)n(C)c1=O 1294587745 KCXDTAKLARESKH-UHFFFAOYSA-N 410.434 -0.299 50 10 HBGE Cn1ncc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)c1I 1439796687 SLVKFYIYHRCOAZ-UHFFFAOYSA-N 401.164 -0.202 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN(CCNC(=O)OC(C)(C)C)C2=O)cn1 1444420635 YHJSRMWOGXMNTG-CYBMUJFWSA-N 408.459 -0.056 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@H]3CS(=O)(=O)C[C@H]3C2)cc1OC 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CCCn1nc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)CC)c2ccccc2c1=O 1290067584 MAUOYFDHTVNKCI-LLVKDONJSA-N 409.468 -0.105 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=O)Cc2ccccc2O)[C@H]1c1nccn1C 1470580569 QGHIUDXPOQPNNS-IRXDYDNUSA-N 401.423 -0.196 50 10 HBGE CO[C@@H]1COC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1564893287 QZOOVFCRARRIAR-LSDHHAIUSA-N 412.468 -0.171 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3cnn(C)c3)CC2)cn1C 1566296121 FDVLDLBHRQFMIF-NVNXTCNLSA-N 403.468 -0.098 50 10 HBGE CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cc(B(O)O)ccc2F)c1 1567436028 JIKZRZRIQFCDJP-UHFFFAOYSA-N 409.248 -0.402 50 10 HBGE COC[C@]1(C(=O)NNC(=O)[C@@H]2COCCO2)CN(C(=O)OC(C)(C)C)CCO1 1587237798 BJIQILWXUHPGHW-SJCJKPOMSA-N 403.432 -0.798 50 10 HBGE CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 1631029594 MAGFMBZDOBPPHA-WCQYABFASA-N 420.557 -0.258 50 10 HBGE C[C@@]1(c2ccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2)NC(=O)NC1=O 1646045872 VSVGFLMKOMFIEX-YWZLYKJASA-N 415.450 -0.245 50 10 HBGE 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CC(C)(C)OC(=O)NC[C@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1sccc1B(O)O 2334273060 WAKBTFYSIFUQEQ-FOGDFJRCSA-N 402.303 -0.038 50 10 HBGE CN(NC(=O)[C@@H]1[C@@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C)S(=O)(=O)C1CCC1 2365267556 FMQFPZQDSZRTMD-AGIUHOORSA-N 407.489 -0.437 50 10 HBGE CN(CCNC(=O)NNC(=O)[C@H]1COCCO1)S(=O)(=O)c1ccc(F)cc1 798066899 KDIITKGWZDOVBH-CYBMUJFWSA-N 404.420 -0.808 50 10 HBGE O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816884616 DJJRCZMLOLDBMD-JTQLQIEISA-N 413.369 -0.511 50 10 HBGE O=C(NNC(=O)[C@H]1CCN(c2ccc(F)c(F)c2)C1=O)N[C@@H]1CCS(=O)(=O)C1 919888755 REIRJDIVVFOYET-MWLCHTKSSA-N 416.406 -0.165 50 10 HBGE CCC[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)S(N)(=O)=O 1295731129 ROJJMLPICLPWOV-SECBINFHSA-N 406.324 -0.730 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 1302576193 SEZXCMDGRQHHSH-ZDUSSCGKSA-N 402.407 -0.420 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)NCCNS(=O)(=O)N(C)C 1564797327 OJAASKBUYSYOHX-UHFFFAOYSA-N 405.502 -0.486 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1624585795 RQMQWTDQXGUTQE-SRVKXCTJSA-N 405.473 -0.502 50 10 HBGE CCOC(=O)[C@@](C)(NC(=O)c1ccc(B(O)O)cc1)c1ccc(S(C)(=O)=O)cc1 1639631384 DYJOWWACPZYTNO-IBGZPJMESA-N 419.264 -0.022 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2267378646 QZIUPNBKSPVKTO-VHSXEESVSA-N 405.307 -0.360 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2267388468 YVAJXOGCVBDLRC-UWVGGRQHSA-N 406.291 -0.693 50 10 HBGE CC(C)(CCNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ncsc1B(O)O 2267391891 TXWRBJRXYLPKET-UHFFFAOYSA-N 407.323 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1sccc1B(O)O 2267606739 CBNOBXLQBMSQKG-FOGDFJRCSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2272655372 NWIYQKGCEZGTNI-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282103500 SGDDFLJVRDXJID-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE C=CC1(NS(=O)(=O)c2ccc(B(O)O)cc2F)CN(C(=O)OC(C)(C)C)C1 2282367941 JKUKIKHXLYEZCI-UHFFFAOYSA-N 400.237 -0.041 50 10 HBGE Cc1nc(S(=O)(=O)NCCC[C@H](C)NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282417972 LENVOFNRNKSYQO-JTQLQIEISA-N 404.298 -0.620 50 10 HBGE CC[C@](C)(CNC(=O)OC(C)(C)C)N(C)S(=O)(=O)c1nn(C)cc1B(O)O 2282424312 AOXDUUVDCWMHPL-OAHLLOKOSA-N 404.298 -0.586 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 744645366 RINWDYGVDGYWOO-IUODEOHRSA-N 415.443 -0.211 50 10 HBGE CC(C)C(=O)NNC(=O)CN1CCC(NS(=O)(=O)NCC(F)(F)F)CC1 1169474611 SIKFIFZSGMABCV-UHFFFAOYSA-N 403.427 -0.760 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)nn1 1253263564 SPDMYOVZHCQSQD-NSHDSACASA-N 409.447 -0.072 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)c1cccc(B(O)O)c1 1296831867 KAGBFJWSKNHNRY-UHFFFAOYSA-N 400.624 -0.133 50 10 HBGE O=C(C[C@@H]1CC(=O)NC1=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 1465796086 ZGFDLVZTBZDQAD-AWEZNQCLSA-N 421.885 -0.342 50 10 HBGE 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CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267199775 QOXCOEZOHQNWOR-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2sccc2B(O)O)C1 2267199950 SGCYRDODANQPIZ-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NS(=O)(=O)c2sccc2B(O)O)C1 2267199951 SGCYRDODANQPIZ-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]2C1 2267391970 ILCWPJQQYLCMPP-JZYVYDRUSA-N 403.291 -0.892 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCc2cnc(NC(=O)OC(C)(C)C)s2)n1 2282377939 YLJRDWQJTZKWIY-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282714097 NCRFIAKGBZEEOR-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282861659 QVIYMLRCVBQYCS-JBLDHEPKSA-N 417.318 -0.502 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2cscc2B(O)O)C1 2337153146 KVLHPHOIWIJRLN-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE 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O=C(N[C@H]1COCC[C@H]1NC(=O)c1ncsc1B(O)O)OCc1ccccc1 2255470773 JSBIDABSQAYENN-OLZOCXBDSA-N 405.241 -0.363 50 10 HBGE C[C@H]1CN(C(=O)c2cn(C)c(B(O)O)n2)C[C@H](C)N1C(=O)OCc1ccccc1 2266891348 GNHGXOKLPBOBKU-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1C(=O)c1csc(B(O)O)c1 2282221862 CXJBVKCZAGDGPT-MRXNPFEDSA-N 400.262 -0.844 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282710280 MPCRGFCMNNWSCY-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CN(C)CCN(CC(=O)N=c1ccc(Cl)c(B(O)O)[nH]1)C(=O)OC(C)(C)C 2284067417 LSHZPVMPIDAQAV-UHFFFAOYSA-N 400.672 -0.426 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cc(B(O)O)cs1)[C@@H](O)C(F)(F)F 2284130782 VWQMYVWEDQQPPR-NXEZZACHSA-N 412.195 -0.139 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)C(=O)c1nn(C)c(Cl)c1B(O)O 2285414409 YQBWAQFBWHWWDB-SECBINFHSA-N 404.660 -0.899 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2nscc2B(O)O)C1 2288535569 CVNBDRWPIKDXKF-UHFFFAOYSA-N 407.204 -0.830 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Cl 749756597 WZKXRPFMTKULIY-QMMMGPOBSA-N 410.857 -0.129 50 10 HBGE O=C(Cn1ccc(Br)cc1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1292039394 XZJFRZJJPBBIFQ-SECBINFHSA-N 407.246 -0.872 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1cccc(Cl)n1 1300836472 MXXQIIRDEXRMNV-ZJUUUORDSA-N 400.844 -0.468 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1306514568 VUQHAFPCBPEQBV-DGCLKSJQSA-N 414.459 -0.698 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)N1 1530230257 BFVDCMXHOOYNEP-GHMZBOCLSA-N 400.482 -0.283 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1 1636625794 DITZMZOXBBNRGB-CYBMUJFWSA-N 412.182 -0.357 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1639934467 JJTBHMZMQVSHMD-AIEDFZFUSA-N 415.512 -0.332 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1ccccc1B(O)O 2267621886 XRPMDQBJYWBCFZ-RUZDIDTESA-N 406.291 -0.322 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 2282076536 JKERMCJCLOHNAX-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(C)cc1B(O)O 2282355922 NEKZRAXDXSUXQR-UHFFFAOYSA-N 400.262 -0.154 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cscc1B(O)O 2282372997 GTPYGUAAJXICIA-NEPJUHHUSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)NCC12CC(NS(=O)(=O)c3ccc(B(O)O)s3)(CO1)C2 2282708456 MXJCRKPKFVCZFQ-UHFFFAOYSA-N 418.302 -0.468 50 10 HBGE C[C@H](NC(=O)[C@@H](CCN(C)C)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284055328 RCGWRPDYFAVWHI-CMPLNLGQSA-N 400.310 -0.155 50 10 HBGE C[C@H](OC(C)(C)C)[C@H](NC(=O)OC(C)(C)C)C(=O)N=c1nc(B(O)O)[nH]s1 2284060541 OPJDJFBVNDBPAN-IUCAKERBSA-N 402.282 -0.325 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2359391048 FJSDVTWASYLCTQ-FRRDWIJNSA-N 400.624 -0.701 50 10 HBGE CN([C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1cccc(B(O)O)c1 2369652140 JCMXHCJLPRXMPX-KBPBESRZSA-N 402.253 -0.056 50 10 HBGE CN(C)CCOc1ccccc1N1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1 746004637 WTZKELWJFUIMBT-GOSISDBHSA-N 421.498 -0.095 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cnc2n(C)c1=O 788871300 IGTZOPQGRCBMMM-HOCLYGCPSA-N 423.429 -0.034 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)NNC(=O)[C@@H]3COCCO3)O2)C1 1313031968 DYSHZCLOCPVYFY-OLZOCXBDSA-N 414.459 -0.099 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1533477185 SWIQOLVUWXQJOP-RYUDHWBXSA-N 400.432 -0.983 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)[C@H]1c1cnn(C)c1 1597999281 FCICLJSNOBLMHR-RBSFLKMASA-N 407.452 -0.543 50 10 HBGE O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(B(O)O)ccc1F 1633567602 VSEJLJUIQQSRQE-GOSISDBHSA-N 400.215 -0.295 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)NNC(=O)CNC(=O)c2cccnc2)C1 1638452584 CTJNVOBAIRSUSU-LJQANCHMSA-N 421.454 -0.015 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267208519 YSWAWZCTNHPFIL-AXFHLTTASA-N 402.303 -0.038 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)c1nc(NS(=O)(=O)c2ccc(B(O)O)s2)n[nH]1 2282072353 DKVGDGYXNUGEJB-SSDOTTSWSA-N 417.278 -0.068 50 10 HBGE CN([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282345538 PPZVGYLQYISWJV-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282377105 MQZVMNGKCUURLT-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@]1(CO)CCN(C(=O)OC(C)(C)C)C1 2282722233 CWEKBSPTHCKXFF-OAHLLOKOSA-N 420.318 -0.613 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1cccc(B(O)O)n1 2283957596 ZJKQTOLSAFYUCA-JTQLQIEISA-N 401.250 -0.972 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](CC(=O)N=c2nc(B(O)O)[nH]s2)OCC1(C)C 2284038369 GCJPMCRWNMJREI-VIFPVBQESA-N 400.266 -0.617 50 10 HBGE C[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284043702 ZXJFKRCWRKKLHN-WCBMZHEXSA-N 400.266 -0.841 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2cocc2B(O)O)CC1 2286017125 YREZUMCGNKDRSN-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1cc(C)c(B(O)O)s1 2339878008 GTEUDPSSOAMCRD-SNVBAGLBSA-N 408.307 -0.446 50 10 HBGE CC(=O)NNC(=O)C[S@@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 586304760 XKBKIVLSZNDZFT-OPQPVAGWSA-N 414.509 -0.174 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(OC)c1 742643772 DDFMOOUNTWCISN-BHTHQVBYSA-N 403.391 -0.373 50 10 HBGE O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1COCCO1 745789953 SOAAUWJERAQQGE-MRXNPFEDSA-N 405.455 -0.529 50 10 HBGE Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(S(C)(=O)=O)cc2)cn1C 748131618 QARCFEKTTSQZDP-UHFFFAOYSA-N 415.497 -0.056 50 10 HBGE O=C(CS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919888981 JIAHWRNUVOABAU-SNVBAGLBSA-N 409.873 -0.369 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN(C)[C@H](C)CO)c1 1143340774 IVOLJPMCRAPACB-CYBMUJFWSA-N 400.501 -0.209 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc2[nH]nnc12 1294587880 QIDIUZHUDUOZNT-UHFFFAOYSA-N 408.422 -0.428 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1 1479131972 LRWGDXXDBRDTIB-LJQANCHMSA-N 406.439 -0.414 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1)[C@@H]1CCS(=O)(=O)C1 1539401653 HPBAHULEFRFNLV-ZIAGYGMSSA-N 411.455 -0.201 50 10 HBGE Cn1nc(C(=O)NCC2CN(C(=O)OCc3ccccc3)C2)c(B(O)O)c1Cl 2255487125 KCYPZACWSOVYDO-UHFFFAOYSA-N 406.635 -0.248 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1 2267201874 UTPVNFIIDZADIS-NSHDSACASA-N 406.291 -0.658 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC1CC(NC(=O)OC(C)(C)C)C1 2282361639 UGUJVJDEPFUINS-UHFFFAOYSA-N 400.262 -0.291 50 10 HBGE CN(CCOCCN(C)S(=O)(=O)c1sccc1B(O)O)C(=O)OC(C)(C)C 2282719254 JGDOBRJSGVVXFN-UHFFFAOYSA-N 422.334 -0.068 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Nc2ccccc2Cl)n(C)c1=O 765312468 FTHAUNOBGZJWKT-UHFFFAOYSA-N 405.802 -0.060 50 10 HBGE Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1 790318000 JZPQGVUBWGTPQK-BBRMVZONSA-N 407.452 -0.582 50 10 HBGE Cn1ncc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1 1124435032 PYZIIEGFWRMFGK-UHFFFAOYSA-N 406.468 -0.007 50 10 HBGE O=C1C[C@H](C(F)(F)F)[C@H](C(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)CN1 1159504163 GUGSWDIQFMPVEI-VDDIYKPWSA-N 412.324 -0.100 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1sccc1S(=O)(=O)N1CCC(O)CC1 1566168535 IYKYIZZSURCBCY-NSHDSACASA-N 419.481 -0.930 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)[C@H]2CCC(=O)N2)ccc1OC(F)F 1633925900 SWVAMTGLLZPQJC-SECBINFHSA-N 400.338 -0.548 50 10 HBGE O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C1(n2cnnn2)CC1 1635520721 WAALJKZRCHPFHW-UHFFFAOYSA-N 418.889 -0.219 50 10 HBGE O=C(CN1CCC(CNC(=O)C(F)(F)F)CC1)N[C@@H]1CS(=O)(=O)C[C@H]1Cl 2195882508 ANJPNNPUARNKSQ-GHMZBOCLSA-N 419.853 -0.103 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267374280 PGCLBQDQMOALLU-XPTSAGLGSA-N 403.291 -0.748 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282064796 FLIYTMATXJKXBZ-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282099012 BDUXERPXMAHGDV-RYUDHWBXSA-N 403.241 -0.613 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282336974 CVMRRWDBPHQYCP-HNNXBMFYSA-N 402.282 -0.914 50 10 HBGE CC(C)(C)OC(=O)N1CCC(CCF)(C(=O)N=c2nc(B(O)O)[nH]s2)CC1 2284049568 RZLNVPXWHVNEFX-UHFFFAOYSA-N 402.257 -0.045 50 10 HBGE COCC[C@@]1(C(=O)N=c2nc(B(O)O)[nH]s2)CCCN1C(=O)OC(C)(C)C 2284124201 DSHNVHGCDWJFCI-OAHLLOKOSA-N 400.266 -0.616 50 10 HBGE CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1 808096962 NKVCQJLHJUQTFU-ZDUSSCGKSA-N 407.470 -0.900 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN(CCNC(=O)OC(C)(C)C)C2=O)cn1 1444420636 YHJSRMWOGXMNTG-ZDUSSCGKSA-N 408.459 -0.056 50 10 HBGE COC(=O)C1CC2(C1)C[C@@H](NC(=O)NNC(=O)[C@H]1CCCO1)CCS2(=O)=O 1471538401 IWASFPOMOHWTBU-LZUBYRBGSA-N 403.457 -0.605 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)NC)CC2)cc1C 1618258290 YABXKUYQUGNRFS-UHFFFAOYSA-N 403.530 -0.538 50 10 HBGE COC(=O)[C@@H]1C[C@@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231654200 APIOVTYZFCDBCX-CABCVRRESA-N 401.184 -0.512 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267209394 WIZDGHCXGZPJNZ-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)c1cc(B(O)O)c(Cl)s1 2267399788 MDMWLFGDAXPVQV-UHFFFAOYSA-N 408.669 -0.941 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](OCCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282075037 PZWUETODDOWQNT-NSHDSACASA-N 420.318 -0.268 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)n1 2282377092 MMBKSLVRURLLTJ-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)n1 2282739407 IYSMHUWQGAMHCW-NSHDSACASA-N 402.282 -0.832 50 10 HBGE C[C@@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@H]1CCCN1C(=O)OC(C)(C)C 2286913619 WTPDBLICDNAYRW-ZYHUDNBSSA-N 402.282 -0.834 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccn1 731596055 REFMOIOCSYBOCY-BFHYXJOUSA-N 408.480 -0.048 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H]3COCCO3)n(C)c2)C1 744654556 XXDKWXCOAMLSFQ-WFASDCNBSA-N 414.484 -0.378 50 10 HBGE COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1OC 771604203 DUDKYDSUMJJETC-SNVBAGLBSA-N 404.397 -0.785 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)NNC(=O)[C@@H]1COCCO1 799376111 OCNKFQNNFJEPET-NSHDSACASA-N 424.838 -0.497 50 10 HBGE CNC(=O)[C@H](CNC(=O)NNC(=O)[C@H]1CCC(=O)N1)Cc1ccc(OC)c(F)c1 1230367734 ACIUGBOAFKMKBT-WCQYABFASA-N 409.418 -0.652 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(F)c(N2CCOCC2)c(F)c1 1290349195 OVTZUVKJFZBSED-JTQLQIEISA-N 403.407 -0.003 50 10 HBGE CN1CCCC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1545424324 VTHBTFZCDBWFPK-KRWDZBQOSA-N 415.494 -0.150 50 10 HBGE C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1 1565374027 MWLKSGFFHZGJGZ-KOLCDFICSA-N 403.486 -0.643 50 10 HBGE C[C@H]1CN(C(=O)Cn2cc(NC(=O)c3cc(B(O)O)ccc3F)cn2)C[C@@H](C)O1 1587246426 FGDGCURWWAOVPZ-TXEJJXNPSA-N 404.207 -0.410 50 10 HBGE C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1587661663 QSMUQRBBUWADFB-KCPJHIHWSA-N 411.422 -0.013 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1 1617888343 QNHBPPIIQAMQGD-UHFFFAOYSA-N 411.528 -0.455 50 10 HBGE CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)CN1CCS(=O)(=O)CC1 1629551193 ITVFKFOEMHWTJT-UHFFFAOYSA-N 420.532 -0.051 50 10 HBGE O=C(NC[C@H]1CCCS(=O)(=O)C1)NNC(=O)C1CCN(c2ncccn2)CC1 1673280361 OHXRGDOFODVDFC-CYBMUJFWSA-N 410.500 -0.152 50 10 HBGE C[C@H]1CN(C(=O)c2cn(C)nc2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267070956 MGVFCOXOULAQHH-OKILXGFUSA-N 400.244 -0.029 50 10 HBGE COC[C@@]1(NS(=O)(=O)c2cc(B(O)O)cs2)CCN(C(=O)OC(C)(C)C)C1 2282706703 PHAANOVUCKAHTI-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 2282719135 HVRIOGQFFYPLFL-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C[C@@H]1O 2282734156 HZYAQONLKGKSCX-JLLWLGSASA-N 420.318 -0.630 50 10 HBGE CC[C@@H](CN(CC)S(=O)(=O)c1nn(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282742001 WDWMTOMOMVKZEV-NSHDSACASA-N 404.298 -0.586 50 10 HBGE CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)cc1F 765647452 OWYMIMQJQKQVCU-GFCCVEGCSA-N 411.433 -0.688 50 10 HBGE Cc1ccc(/C=C/CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 766643818 KOPUGRKVDMFLFL-SNAWJCMRSA-N 410.434 -0.007 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 1301698078 VMDHYDKMHAOBDF-GFCCVEGCSA-N 403.482 -0.721 50 10 HBGE CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCC(=O)N2)c1 1530230508 IKPUUTDJCBKCFP-SNVBAGLBSA-N 404.242 -0.108 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@@H]1CCC(=O)N1 1530230608 JSOVRORMNQNIGU-LBPRGKRZSA-N 411.436 -0.562 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1[C@@H](c2cnn(C)c2)N(C)C(=O)[C@@H]1O 1624030578 KIDLOENRFNACQC-ZWMNYZCKSA-N 419.413 -0.336 50 10 HBGE O=C(Cc1ccccc1S(=O)(=O)C(F)F)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1624584748 CHOYJRPBVOIANW-SNVBAGLBSA-N 410.420 -0.193 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ncc(B(O)O)cc1F 2281650803 GTVUNMVEKQPGBJ-OAHLLOKOSA-N 417.202 -0.332 50 10 HBGE O=S(=O)(NCC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(B(O)O)s1 2282077213 SIDMKAUAWDXXNG-OAHLLOKOSA-N 410.326 -0.003 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2ccccc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282105375 KAKONWCFIVBLGH-CHWSQXEVSA-N 400.262 -0.721 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)c1ccccc1B(O)O)C(=O)OC(C)(C)C 2282423022 JHNFXEQQCKUMOB-LBPRGKRZSA-N 402.278 -0.737 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282720849 HCVPDBBHSAIALG-UHFFFAOYSA-N 412.195 -0.056 50 10 HBGE Cc1cc(B(O)O)sc1CNC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360552350 ZOLWGUGNNYRLAQ-SNVBAGLBSA-N 420.318 -0.710 50 10 HBGE O=C(NCCCN1CCOCC1)C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1544375039 CTIKCUPOKADFIG-UHFFFAOYSA-N 403.288 -0.943 50 10 HBGE Cc1cc(C)n(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)c(=O)n1 1546252058 PQLKMZNUACRLKJ-UHFFFAOYSA-N 407.290 -0.313 50 10 HBGE CN1C[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)NC1=O 1566281562 OBTGLTBUIWBICH-OAHLLOKOSA-N 408.890 -0.371 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCOC[C@@H]2CNS(C)(=O)=O)cc1C 1620472127 JJSHFNKVCDVTRO-LBPRGKRZSA-N 418.541 -0.370 50 10 HBGE C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2267392750 NMBHWYTYVHVPPR-VHSXEESVSA-N 405.307 -0.360 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2cscc2B(O)O)C1 2267625979 YZEQFQGYKBNDDU-UVJXUPGXSA-N 424.331 -0.118 50 10 HBGE CC[C@@]1(NC(=O)c2nn(C)nc2B(O)O)CCCN(C(=O)OCc2ccccc2)C1 2282144336 WJXCWYVYICDQMI-LJQANCHMSA-N 415.259 -0.194 50 10 HBGE Cn1nc(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282247293 DBWOTQQMCFOYCM-HHHXNRCGSA-N 420.684 -0.389 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@H](C)[C@H](NC(=O)C(F)(F)F)C1 2282724005 UQJUTDWMFXBJQO-IONNQARKSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)Nc1ccc(Cl)cc1B(O)O 2284048586 OWRPLJVVUGBRJS-XQQFMLRXSA-N 400.624 -0.701 50 10 HBGE O=C(CCSCCC(=O)NNC(=O)[C@H]1CCCO1)NNC(=O)[C@H]1CCCO1 817215720 OPYTYZGZKXTGGA-VXGBXAGGSA-N 402.473 -0.847 50 10 HBGE Cc1sc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1646038934 KRIQXIIKVOYEAC-LBPRGKRZSA-N 402.498 -0.282 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1ccccc1B(O)O 2089784816 OMDIMROFIUVJQS-UHFFFAOYSA-N 416.264 -0.138 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613906 GSTHGVQRDQGXLQ-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CN(C[C@@H](O)COCc1ccccc1)S(=O)(=O)Cc1ncsc1B(O)O 2267627494 ZQZPRJTVCNRVTD-CYBMUJFWSA-N 400.287 -0.838 50 10 HBGE Cn1ncc(CNS(=O)(=O)c2sccc2B(O)O)c1NC(=O)OC(C)(C)C 2282065853 PDOXHJFKZVZHTC-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282077827 AJBAUGBFWGWZGO-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C2)n1 2282363841 JWTVHKRLBVZFMQ-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c(B(O)O)n1C 2282860671 DYTPWFUKGYZZGM-NSHDSACASA-N 402.282 -0.914 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccc(OCCN(C)C)cc1 1182609041 FACBKAKBUIOVSE-ZDUSSCGKSA-N 400.501 -0.355 50 10 HBGE Cc1nc(-c2ccn(C)n2)sc1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1292038461 GFXVMVICZPICLX-SNVBAGLBSA-N 412.497 -0.088 50 10 HBGE Cc1cc(CC(=O)NNC(=O)[C@@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)n[nH]1 1570719263 QZAAULWDCSQNKS-HOCLYGCPSA-N 403.414 -0.248 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)c2ccc(B(O)O)cc2F)C1 2255884008 QIVBOMBKDMFEEI-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2281914089 AZISNEYTEAANLI-JGFSIVIASA-N 400.266 -0.512 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](F)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282108024 SILQVILGSVCRCB-STQMWFEESA-N 402.253 -0.008 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@]1(C)CCN1C(=O)OC(C)(C)C 2282710450 OOTLVPXLRSFTHK-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@@H]1CO 2282717101 DEBYVQSRKQEGGK-GHMZBOCLSA-N 420.318 -0.676 50 10 HBGE CS(=O)(=O)N1CCN(C=C(C#N)C(=O)Nc2ccc(S(=O)(=O)O)cc2)CC1 2324196964 NJQVZVSXAUJOHC-UHFFFAOYSA-N 414.465 -0.144 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)[C@@H]1COCCO1 745978903 VGEKVDFJAPIEPT-AWEZNQCLSA-N 419.481 -0.804 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc(O)n(C)c3=O)CC2)cc1 766643111 SZUKPELYLDFERJ-UHFFFAOYSA-N 414.466 -0.627 50 10 HBGE COc1c[nH]c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1=O 1149623364 XZJAEVQJPOZWRS-UHFFFAOYSA-N 413.434 -0.398 50 10 HBGE CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)CN2CCCC2=O)c2ccccc21 1152014604 ADUOJKWRDXTGNC-FQEVSTJZSA-N 402.451 -0.168 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)Cn3cnc4ccccc43)cc2S1(=O)=O 1160385759 RLBOTQQKUGTTRN-UHFFFAOYSA-N 403.424 -0.672 50 10 HBGE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 1290065763 YUWVSPQKEFNHDR-CQSZACIVSA-N 421.479 -0.199 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1464440432 BBVWOJPTPXSYHW-NWDGAFQWSA-N 419.504 -0.945 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)NCCc2nnc3c(=O)n(C)ccn23)c1 1479342543 PUYDXTNIUSBVCT-UHFFFAOYSA-N 413.438 -0.003 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1557185391 MSTWCHQQNABDNP-BIMULSAOSA-N 405.860 -0.448 50 10 HBGE O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1558950208 ILOQGFQZNLNIBA-VHSXEESVSA-N 409.390 -0.021 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ncc[nH]3)CC2)cc1 1587963662 HZXYMEKJWHKWEA-UHFFFAOYSA-N 406.468 -0.514 50 10 HBGE O=C(NCCN1CCC2(C1)OCCO2)NNC(=O)c1nnc(O)c2ccccc12 1685408976 RRMKAIJCBHWYCI-UHFFFAOYSA-N 402.411 -0.272 50 10 HBGE Cc1nc(S(=O)(=O)NC2CC(NC(=O)OCc3ccccc3)C2)c(B(O)O)n1C 2267374889 YNEFBRGAGBHYQJ-UHFFFAOYSA-N 422.272 -0.856 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1C(=O)c1cscc1B(O)O 2282290622 VKSXGBMPUDHQHC-MRXNPFEDSA-N 400.262 -0.844 50 10 HBGE CC(C)(C)OC(=O)NCc1c[nH]nc1NS(=O)(=O)c1cscc1B(O)O 2352330963 IXYQTPOMGSEMFT-UHFFFAOYSA-N 402.263 -0.024 50 10 HBGE CN(NC(=O)[C@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)S(=O)(=O)C1CCC1 2365267645 FMQFPZQDSZRTMD-XQQFMLRXSA-N 407.489 -0.437 50 10 HBGE CC[S@](=O)CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 741424888 OFMFAHDPHYNORJ-VWLOTQADSA-N 404.514 -0.285 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cn(C3CC3)nn2)CC1 1182815958 LAOZMOPKCOCKRU-UHFFFAOYSA-N 406.472 -0.299 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)c1 1355970826 NPVJBDSCKOYKDP-ZBFHGGJFSA-N 411.480 -0.269 50 10 HBGE O=C(NNC(=O)c1nc2ncccn2n1)c1cccc(S(=O)(=O)N2CCCC2)c1 1531048077 FELFRLGQGNRWDZ-UHFFFAOYSA-N 415.435 -0.016 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCCC2)cc1 1638675785 ZURMSOPOTJEHNV-UHFFFAOYSA-N 400.457 -0.170 50 10 HBGE Cn1cc([C@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 1654356136 GAMHUMMJCLYWLP-HOLBHBGLSA-N 420.451 -0.105 50 10 HBGE CN([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2267393457 YWKGHDQPCAIQSK-JTQLQIEISA-N 405.307 -0.406 50 10 HBGE CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2282381911 XYRQTKXEYFFBAN-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE COC1(CCNS(=O)(=O)c2cscc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282419674 WYJAOIXHFBBGCI-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1 2282698801 FDUMCDYJXSLBGK-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282704050 FRHFFARNWSCUIQ-CQSZACIVSA-N 402.253 -0.150 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H]1CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282725978 KJWPOFXQOKELJK-NSHDSACASA-N 400.237 -0.041 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 744653341 WJBVBPDTSFLPBH-RQJABVFESA-N 413.496 -0.154 50 10 HBGE CN(NC(=O)[C@@H](O)Cc1cnn(C)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 787269030 KFNYKTYGKYFPGZ-AWEZNQCLSA-N 410.475 -0.041 50 10 HBGE CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)NNC(=O)[C@H]1COCCO1 808096280 FYQYFSINYPLDCK-CYBMUJFWSA-N 422.504 -0.401 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCCC(=O)C2=O)c1 1135502756 RHRBUOOACUGZBD-UHFFFAOYSA-N 410.452 -0.721 50 10 HBGE CO[C@@H]1CS(=O)(=O)[C@H]2CN(CC(=O)NNC(=O)c3ccccc3Cl)C[C@@H]12 1174642137 RZXLGJQEEQCGNS-YUTCNCBUSA-N 401.872 -0.155 50 10 HBGE CC[C@@H](CN1CCOCC1)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 1471395447 NLDCXVCQUMDITD-ZDUSSCGKSA-N 402.455 -0.012 50 10 HBGE Cn1cc([C@@H]2[C@H](C(=O)NNC(=O)CN3CCCC3=O)CC(=O)N2C(C)(C)C)cn1 1648934542 ALUYUKCSPIOQQV-CXAGYDPISA-N 404.471 -0.122 50 10 HBGE Cc1nc(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)s1 2266896962 FKDSQSPYZPUVEE-AWEZNQCLSA-N 419.268 -0.101 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2cc(B(O)O)sn2)C1 2267062753 SQWDQTHOUPCNIN-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE CC(C)N(CCCNS(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2282711834 HVLUSAZEOKEIKX-UHFFFAOYSA-N 404.298 -0.586 50 10 HBGE CCCN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2283945616 CZLNJYYOMFSHGR-NXEZZACHSA-N 400.266 -0.760 50 10 HBGE CN(Cc1cc(B(O)O)cs1)C(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284058554 NTFNDKXWQNTGEQ-GFCCVEGCSA-N 402.253 -0.294 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)cc1 745978830 CNSUFJBJATZNQO-CQSZACIVSA-N 421.497 -0.558 50 10 HBGE CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)N1CCN(C)CC1 1139085391 UHGCVIJOCQCBLI-CYBMUJFWSA-N 412.516 -0.032 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)CCOC(=O)CNC(=O)C(C)(C)C)C[C@@H](C)O1 1182158130 OXWIWZBIKGQMGV-ZIAGYGMSSA-N 414.503 -0.271 50 10 HBGE CO[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCOC1 1445568617 XLZVRTIEEZPLAX-AEFFLSMTSA-N 404.467 -0.357 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CS(=O)(=O)c1cccc(Br)c1 1586190984 DPYSMJCOOAFOLN-UHFFFAOYSA-N 413.271 -0.585 50 10 HBGE C[C@@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCCSS(C)(=O)=O 1636470369 LFKUUJHSIQQCFZ-PSASIEDQSA-N 402.541 -0.415 50 10 HBGE CCN1CC[C@@H]1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1637958970 NMEJAFMUCFVOGT-CQSZACIVSA-N 411.532 -0.262 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N(C)CC1CN(C(=O)OCc2ccccc2)C1 2267439970 ZBPXZFOAYWRQGR-UHFFFAOYSA-N 400.244 -0.077 50 10 HBGE CN1CCN(Cc2ccccc2)[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282074075 JUNMANWFXHNCFR-MRXNPFEDSA-N 409.342 -0.478 50 10 HBGE C[C@H]1[C@H](C)N(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2282339753 ZXQRNGCTAFWHDQ-QWRGUYRKSA-N 419.334 -0.018 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 2282698689 DDNABGCPEUGYKY-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE C[C@H](NC(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(B(O)O)cs1 2284041956 UOQBDZQBVVVYHV-CABZTGNLSA-N 402.253 -0.075 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)[C@H]2COCCO2)CC1 745618160 VEXXRGUZXFZNTC-CQSZACIVSA-N 415.491 -0.325 50 10 HBGE COCCn1cc(N2C[C@H](C(=O)NNC(=S)NCCSC)CC2=O)cn1 1137579113 IWHPFGODPXFLSR-LLVKDONJSA-N 400.530 -0.259 50 10 HBGE CCS(=O)(=O)N[C@H](C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1147903079 RDOHEVPDEPEWIS-GFCCVEGCSA-N 420.513 -0.522 50 10 HBGE COC(=O)[C@@H]1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)[C@@H](C(=O)OC)C1 1192443010 GGSYKHLNIXGLHM-HUUCEWRRSA-N 402.407 -0.254 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(N2CCOCC2)CCOCC1 1251759208 KPXBTDSMAQFKIS-UHFFFAOYSA-N 409.443 -0.779 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cn(C)nn2)(c2ccccc2)CC1 1461534109 WYZYAKINIRHIBD-UHFFFAOYSA-N 420.495 -0.040 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cnnn3C)cc2)CC1 1472569671 FIYDDFRQHODMEM-UHFFFAOYSA-N 407.456 -0.575 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNC(=S)Nc2cccc(Br)c2)N1 1628874026 WBJRSQBWVYNAEY-VIFPVBQESA-N 421.298 -0.320 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1=C2CCCN=C2NN1 1635505247 PCZDKJLLYBJTNR-UHFFFAOYSA-N 411.466 -0.854 50 10 HBGE COC[C@@H](OC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393476 PCINHNJVIUNQGJ-CQSZACIVSA-N 401.441 -0.870 50 10 HBGE COC(=O)[C@H]1C[C@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231658129 APIOVTYZFCDBCX-LSDHHAIUSA-N 401.184 -0.512 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2267622976 YJQMSKBVZXAORX-SNVBAGLBSA-N 408.307 -0.724 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1CO 2282071458 RNKJAQQDRNLVBZ-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@](C)(CO)C1 2282082518 JYAYQENRFHJLPC-HNNXBMFYSA-N 420.318 -0.580 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714822 XKKVWSHVPPKCED-KBPBESRZSA-N 400.262 -0.721 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCC1(O)CN(C(=O)OC(C)(C)C)C1 2282736344 OUUNNMQKHRKAAX-UHFFFAOYSA-N 420.318 -0.613 50 10 HBGE C[C@@H](c1cscc1B(O)O)N(C)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2370319276 DCGRPQLVYRQNME-JTQLQIEISA-N 402.278 -0.805 50 10 HBGE COc1ccc(C(=O)NNC(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c(OC)c1 730027336 QRPDPZSFXGTLGG-UHFFFAOYSA-N 419.438 -0.519 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cn(C)nn3)cc2)C[C@H](C)O1 1279012136 ZFKNFZWZOSHCLA-RYUDHWBXSA-N 422.467 -0.312 50 10 HBGE C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3cnn(C)c3)CC2)C[C@@H](C)O1 1290837073 KGDMMBBZGYXHSI-HHAKBXFJSA-N 422.511 -0.175 50 10 HBGE O=C(C[C@H]1CCCS1(=O)=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1465792210 WARUXNCLOANWBQ-MRXNPFEDSA-N 422.507 -0.441 50 10 HBGE O=C(NC[C@H](NC(=O)c1cc(B(O)O)n[nH]1)C(F)(F)F)OCc1ccccc1 2255548835 DDUWKAZIXNYQBB-NSHDSACASA-N 400.122 -0.323 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)sc1C 2267383208 VTNPGLOSZQSZOP-UHFFFAOYSA-N 406.291 -0.092 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N(C)[C@H]1CC[C@@H]1NC(=O)OCc1ccccc1 2267425221 NCLLTFCIYLXZAI-GJZGRUSLSA-N 400.244 -0.062 50 10 HBGE CCc1nc(C(=O)N=c2nc(CNC(=O)OC(C)(C)C)[nH]s2)c(B(O)O)s1 2281628411 OCDRUYHBWJRPOK-UHFFFAOYSA-N 413.290 -0.064 50 10 HBGE NCC1(NS(=O)(=O)c2sccc2B(O)O)CCN(Cc2ccccc2)CC1 2282078011 CJJNAHBFZWRYKE-UHFFFAOYSA-N 409.342 -0.300 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ccsc1B(O)O 2282327709 MEUSGKRHEUCVSP-WPRPVWTQSA-N 414.236 -0.211 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@H]1NC(=O)C(F)(F)F 2282350591 PEFDVHXMIRDQBY-WCBMZHEXSA-N 414.236 -0.353 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1 2282363207 MTGTUFGXJGSGFA-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1cc(B(O)O)cs1 2283962038 CQKHTXIIDXPDBV-GFCCVEGCSA-N 400.262 -0.157 50 10 HBGE CN(Cc1cccc(B(O)O)c1)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 704309006 GNXDRUAKCWUQBY-UHFFFAOYSA-N 416.264 -0.186 50 10 HBGE Cc1nn(C)c(C)c1[C@H](NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)C(F)(F)F 757893278 PCTRPWMEYOQPBT-XCBNKYQSSA-N 414.410 -0.092 50 10 HBGE CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc(B(O)O)ccc2F)CC1 1586569825 LXMZUKOVVQWWRU-UHFFFAOYSA-N 409.223 -0.086 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CC(S(=O)(=O)N2CCc3ccccc32)C1 1637066542 FUICSRJMFVTMTP-UHFFFAOYSA-N 404.228 -0.278 50 10 HBGE CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CS(=O)(=O)C[C@H]2OC)cc1 1682617513 DVXJJWYCXSDTPQ-BYCMXARLSA-N 415.468 -0.005 50 10 HBGE CC(=O)NCCN1C[C@@H](C(=O)N2CCC[C@H](C(=O)NNc3ccccn3)C2)CC1=O 1872962436 SZDRDBSKSLWGNE-HOTGVXAUSA-N 416.482 -0.252 50 10 HBGE CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1sccc1B(O)O 2282069879 WJEFHBBTDRHJSH-KRWDZBQOSA-N 410.326 -0.315 50 10 HBGE O=S(=O)(NCC1(O)CCN(Cc2ccccc2)CC1)c1sccc1B(O)O 2282076854 NOTSGHYJFIDXMU-UHFFFAOYSA-N 410.326 -0.267 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1 2282241449 RYWKICUDIRCQFG-FLESLCNUSA-N 400.266 -0.653 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H]2CCON(C(=O)OC(C)(C)C)C2)c(B(O)O)c1 2282380044 CTFFHERBXLOBRG-LBPRGKRZSA-N 400.262 -0.106 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)c1cc(B(O)O)nn1C 2282711393 BTXGXVPJDSUCQW-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)N[C@@H]2CCC=C2B(O)O)C1 2283986195 CNHYDZOOHMLIED-DGCLKSJQSA-N 402.278 -0.372 50 10 HBGE COC[C@]1(C(=O)N=c2nc(B(O)O)[nH]s2)CCCCN1C(=O)OC(C)(C)C 2284058797 PDMVFSDXGSJEDO-HNNXBMFYSA-N 400.266 -0.616 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2380428716 UJCWNMCEWRJZOM-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)cc1Br 748084515 GLZJFJBIKYNNBG-VIFPVBQESA-N 408.230 -0.727 50 10 HBGE CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)CCc1ccco1 812880595 CQAYZBNFDRQJAR-GFCCVEGCSA-N 400.457 -0.422 50 10 HBGE O=C(CSc1ccccc1[N+](=O)[O-])NNC(=O)CN1CCS(=O)(=O)CC1 1145047677 FBTHQTTVGFEHBC-UHFFFAOYSA-N 402.454 -0.435 50 10 HBGE CCN(OC)C(=O)CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 1230354041 ZVXUXHSKIXRZAT-UHFFFAOYSA-N 400.461 -0.358 50 10 HBGE CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)c2C1 1456037991 LMYXGKJFMCWRMR-WMLDXEAASA-N 418.498 -0.404 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1c[nH]c2ncccc12 1540420353 NTNKUEYJQKARON-UHFFFAOYSA-N 414.513 -0.285 50 10 HBGE CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cn1 1596923485 PDIJGNGHGFWVAO-AWEZNQCLSA-N 411.484 -0.654 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ncc(Br)cn1 1631310063 LMYGBXHPRKTCQH-SSDOTTSWSA-N 404.250 -0.217 50 10 HBGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2267626194 CWDBZYJKSVNTAK-ZJUUUORDSA-N 405.307 -0.360 50 10 HBGE O=S(=O)(NCC1(O)CCN(Cc2ccccc2)CC1)c1cscc1B(O)O 2282375010 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Cc1c(C(=O)N[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2266860945 SXYBUZLZSQYKMX-IBGZPJMESA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267612699 NDNINOHIXATERJ-UVJXUPGXSA-N 424.331 -0.118 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)[C@@H](C)CN1C(=O)OC(C)(C)C 2282368616 SRAHXSACBHMWTE-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2CC(O)(CNC(=O)OC(C)(C)C)C2)c1B(O)O 2282377933 YIBMXIUWODDOBR-UHFFFAOYSA-N 420.318 -0.695 50 10 HBGE Cn1ncc(CNC(=O)OC(C)(C)C)c1NS(=O)(=O)c1cc(B(O)O)cs1 2282507257 DZKXNTHFMKQIIY-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE Cc1cc(S(=O)(=O)N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C)sc1B(O)O 2282736454 QOEPWTXBJIVPGE-NSHDSACASA-N 422.334 -0.415 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1ccc(B(O)O)s1 2334264235 UJKKEEIKFJHAMB-DCAQKATOSA-N 402.303 -0.038 50 10 HBGE Nc1nonc1-n1nnc(CN2CCOCC2)c1C(=O)NN=Cc1ccccc1O 254405165 XQSHTPVPRHVQLF-UHFFFAOYSA-N 413.398 -0.466 50 10 HBGE C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816886053 OARSEBNZUSHLGS-CYBMUJFWSA-N 402.436 -0.787 50 10 HBGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1457481052 TVGJILAPYDXZLW-NHYWBVRUSA-N 405.432 -0.332 50 10 HBGE CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@H](C)OCCOC)C2)nc1 1478421713 DCENUJPGHKMJJX-LBPRGKRZSA-N 409.443 -0.171 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)c1cc(B(O)O)cs1)C(F)(F)F 2267202245 ZUYMADGGZFKUQZ-SECBINFHSA-N 400.209 -0.350 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2csc(B(O)O)c2)[C@@H](S(C)(=O)=O)C1 2282220724 OLPXAMABHHKBQL-QWRGUYRKSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NS(=O)(=O)c2cscc2B(O)O)C1 2282368873 XJRWBAYWDMTZRQ-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE Cc1nc(C(C)C)sc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765728409 QIEBLCSAZVFWRJ-UHFFFAOYSA-N 419.467 -0.217 50 10 HBGE NS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)s1 1156184068 LMEKAZNHNGBOGB-LBPRGKRZSA-N 402.498 -0.661 50 10 HBGE NC(=O)C1CCN(C(=O)C2CCN(CC(=O)NNC(=O)c3cccs3)CC2)CC1 1307415984 BPSLFSZYNIKJJJ-UHFFFAOYSA-N 421.523 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@](F)(C(=O)NNC(=O)CN2CCCC2=O)C1 1557977598 HDKKKHQMOVPLNZ-GOSISDBHSA-N 414.434 -0.268 50 10 HBGE C[C@H](O)CN(C)NC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1629362854 VICKTGJLZIQFME-GXTWGEPZSA-N 407.514 -0.888 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1ccc2c(c1)OCCO2 1683459769 IVCGTGVPMWKZHC-SFHVURJKSA-N 406.395 -0.970 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ncsc1B(O)O 2255725401 WVNKUSTUGUXXAY-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](F)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282108021 SILQVILGSVCRCB-CHWSQXEVSA-N 402.253 -0.008 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1ncc(B(O)O)cc1F)OCc1ccccc1 2282292303 TUAKXZOKYTVCJA-HOTGVXAUSA-N 417.202 -0.286 50 10 HBGE Cc1ccc(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)COC2)c(B(O)O)c1 2282721789 XEIDUKHSIOGTAU-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1cccc(B(O)O)n1 2283957598 ZJKQTOLSAFYUCA-SNVBAGLBSA-N 401.250 -0.972 50 10 HBGE CN(C)CCN(C=C(C#N)C(=O)N(C)C1CCN(C)CC1)[C@@H]1CCS(=O)(=O)C1 2324778004 GWQYIGDCMXCHDM-GOSISDBHSA-N 411.572 -0.003 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2cnsc2B(O)O)C1 2337340295 DUOLQERFFVGIFC-SANMLTNESA-N 403.291 -0.072 50 10 HBGE CN(NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)S(=O)(=O)C1CCC1 2365264909 NPTABMKMMBNXGO-BLLLJJGKSA-N 407.489 -0.436 50 10 HBGE CN(Cc1ccccc1B(O)O)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 704373571 SNRAUWYLCYQZQI-UHFFFAOYSA-N 402.237 -0.576 50 10 HBGE Cc1ccc(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(Cl)n1 807091853 PAKCTKCCPMZNRS-UHFFFAOYSA-N 419.829 -0.819 50 10 HBGE COC(OC)[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1479156478 JXEJQFDVWUJLRJ-LBPRGKRZSA-N 402.473 -0.047 50 10 HBGE O=C(NNC(=O)C1=NN(c2ccc(F)cc2)C(=O)CC1)N[C@@H]1CCS(=O)(=O)C1 1543752340 FHKNFXSYTRGSSQ-LLVKDONJSA-N 411.415 -0.174 50 10 HBGE CON1CCC(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 1564947690 WIGLDAYFBWOVPH-UHFFFAOYSA-N 413.500 -0.028 50 10 HBGE CCOCCCn1c(NNC(=O)[C@@H]2CCS(=O)(=O)N2)nc2ccccc2c1=O 1565755328 JTFOWRQZJGJEHO-AWEZNQCLSA-N 409.468 -0.042 50 10 HBGE C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1CN(C)CCN1C 1687863515 KVXGESLDZTYXDM-GOEBONIOSA-N 404.519 -0.342 50 10 HBGE CC(C)(C)OC(=O)NC1(C(N)=O)CN(c2ncc(Br)cc2B(O)O)C1 2223679965 WXUNPKJZPZHZRC-UHFFFAOYSA-N 415.053 -0.907 50 10 HBGE O=C(NC1CN(S(=O)(=O)Cc2ccc(B(O)O)cc2)C1)OCc1ccccc1 2255756626 IMUIIKADHSLDNP-UHFFFAOYSA-N 404.253 -0.193 50 10 HBGE Cc1nc(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)s1 2266888833 RTQIVEMPPLMNDB-AREMUKBSSA-N 403.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2nscc2B(O)O)C1 2267361925 KEFPTTVWDULGKC-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE CC(C)N(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267393429 YNIOZGALOXIOPG-UHFFFAOYSA-N 407.323 -0.112 50 10 HBGE Cn1ncc(C(=O)N=[S@@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)c1B(O)O 2282249736 MOSCGYDQFVOMED-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284060644 PSYZFGCAYIRLGO-RKDXNWHRSA-N 413.183 -0.744 50 10 HBGE O=C(CN1CCN(CC(=O)NNC(=O)C2CC2)[C@@H]2CCCC[C@H]21)NNC(=O)C1CC1 815251752 LGHFCKBYPUNELZ-HZPDHXFCSA-N 420.514 -0.970 50 10 HBGE CCN(CC)c1nc(NNC(=O)CN(C)S(C)(=O)=O)nc(N(CC)CC)n1 1142246743 WEMOMGKOZDLZRC-UHFFFAOYSA-N 402.525 -0.102 50 10 HBGE O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)c1cc(B(O)O)ccc1F 1292374133 LBJJMBGJCLMSEX-UHFFFAOYSA-N 400.219 -0.631 50 10 HBGE COc1cc(C(=O)NNC(=O)[C@]2(OC)CCS(=O)(=O)C2)cc(OC)c1OC 1354184287 RHOZEARCKGEKLS-INIZCTEOSA-N 402.425 -0.323 50 10 HBGE Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1ccc(=O)n(C)c1 1463155835 HMCWOVIBIOWBBJ-UHFFFAOYSA-N 416.438 -0.580 50 10 HBGE Cc1sc(=O)n(CC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1-c1ccccc1 1558927130 JNEYCOLAXFYFMW-JTQLQIEISA-N 412.493 -0.030 50 10 HBGE CNC(=O)NC[C@@H]1COCCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC 1648118898 MWIRTOJSWFZVIX-GFCCVEGCSA-N 413.862 -0.261 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNS(=O)(=O)CCOCCCl 2218609706 ONFOFSMHTXABTL-WOPDTQHZSA-N 402.897 -0.498 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2267372139 JXVDQFPUMBZOPK-MNOVXSKESA-N 406.291 -0.861 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C 2267385006 HFMZEOYRRXCQBI-JTQLQIEISA-N 408.307 -0.758 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282065102 JGASWTQGVSUOKR-GFCCVEGCSA-N 420.318 -0.268 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282366092 IYUDCRWLMZZRKR-LBPRGKRZSA-N 400.262 -0.337 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)sc1B(O)O 2282369765 LCIPGCIYZOOXGT-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)c1ccc(B(O)O)s1)CCO2 2288442392 YFIAXBWHDXGLQQ-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1(C)C 2380427789 IHZUNDCOIYLJDW-NSHDSACASA-N 402.282 -0.834 50 10 HBGE COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]2COCCO2)C1=O 771263821 JDEWETAKBDFHLI-IFXJQAMLSA-N 420.422 -0.667 50 10 HBGE CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816879835 XCRNUNGHKNLSKV-ZDUSSCGKSA-N 406.468 -0.012 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 1135830096 QHSNIINPAYGHTF-NSHDSACASA-N 420.561 -0.422 50 10 HBGE Cn1ncc(I)c1CNC(=O)NNC(=O)[C@H]1COCCO1 1471161609 CUUJLRCBNCYPCV-SECBINFHSA-N 409.184 -0.730 50 10 HBGE Cc1nc(S(=O)(=O)NCCC(C)(C)NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282333234 LWABUAXIGJAPNY-UHFFFAOYSA-N 404.298 -0.620 50 10 HBGE CC(C)(C)OC(=O)N1CCC(CO)(NS(=O)(=O)c2sccc2B(O)O)CC1 2282703398 VYWXHXYAZQVKQA-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE C[C@@H](NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cscc1B(O)O 2360534514 YHHBXCYONKEGOZ-SKDRFNHKSA-N 420.318 -0.457 50 10 HBGE CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1 748213618 LVMZNLLTKKDKIQ-HNNXBMFYSA-N 411.461 -0.092 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C/C=C\c2cccc(F)c2)n(C)c1=O 766635229 AKJPBSCCWJLGNI-XQRVVYSFSA-N 414.397 -0.176 50 10 HBGE O=C(CN1CCOCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 790472080 LLBIKJJQJNKZFV-UHFFFAOYSA-N 424.479 -0.519 50 10 HBGE O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)[C@H]1CCc2nncn2C1 816878873 BUQKTJSPZBTKME-VIFPVBQESA-N 414.394 -0.755 50 10 HBGE NC(=O)[C@@H]1CC[C@H](CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)O1 1137882648 ZUDXOWOJEISCBR-MNOVXSKESA-N 412.306 -0.374 50 10 HBGE O=C(CN1CCOCC1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 1149650110 XSOUFVQQFVKYIR-UHFFFAOYSA-N 409.918 -0.063 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1254316567 WNFHRMVGAQEGRD-SFHVURJKSA-N 424.479 -0.255 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCC(O)CC2)cn1 1444414396 CKRCZKNVMGWHHF-UHFFFAOYSA-N 413.481 -0.298 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1CCC(=O)N1 1470496406 CYHSGCSYJVRNMX-JTQLQIEISA-N 419.257 -0.847 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(F)cc1)NNc1nccc(N2CCOCC2)n1 1472527931 DXJVCJYRNHZGBD-UHFFFAOYSA-N 410.431 -0.126 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1558926937 BVCRSGLEBCXKIA-AXFHLTTASA-N 410.468 -0.333 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)[C@H]1C[C@@H](O)CN1c1ccncn1 1645963016 ABACKWXYRTWNEE-JHJVBQTASA-N 406.443 -0.427 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)OC)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1 1659462710 UUSFHPNKHHTEON-HUUCEWRRSA-N 402.407 -0.254 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN2S(=O)(=O)Cc2ccsc2B(O)O)C1 2267365503 QBIMGEGBWFYAGT-UHFFFAOYSA-N 402.303 -0.047 50 10 HBGE C[C@H]1[C@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2267626193 CWDBZYJKSVNTAK-VHSXEESVSA-N 405.307 -0.360 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N1CCOCCN1C(=O)OC(C)(C)C 2282364590 WXUGVLJGOQZWCN-UHFFFAOYSA-N 400.262 -0.152 50 10 HBGE CN(C(=O)OC(C)(C)C)C1CN(S(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282366121 JJVXFAHXASVBFE-UHFFFAOYSA-N 406.216 -0.116 50 10 HBGE C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282368057 KSKDDLNWYVFQNE-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282710237 LTRACJSKUAOLMO-KBPBESRZSA-N 400.262 -0.721 50 10 HBGE CC[C@@]1(NS(=O)(=O)c2nn(C)cc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282740050 SZCCDCFSPQLDDJ-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 732308214 UXHUMOSAZRZHTE-UWVGGRQHSA-N 407.445 -0.925 50 10 HBGE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1=O 750661040 ACSPCBNIHDVLCX-WZRBSPASSA-N 408.484 -0.067 50 10 HBGE CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)O1 793037944 MWAJRVVKJDKFNE-LSDHHAIUSA-N 421.454 -0.121 50 10 HBGE C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)ccc1F 816876207 QPUYMLYNXPGIPR-GFCCVEGCSA-N 422.442 -0.095 50 10 HBGE CS(=O)(=O)c1ccc(NCC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1156184402 RRFUUNVKGWRGEK-MRXNPFEDSA-N 410.496 -0.097 50 10 HBGE COC(=O)C[C@@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccccc1Cl 1175226862 AYXCHBRLXCNQCL-LLVKDONJSA-N 417.871 -0.237 50 10 HBGE COC(=O)c1cc(NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)ccc1F 1467998150 AINYKWGPBKLIHA-RBSFLKMASA-N 405.386 -0.021 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)OCC(F)(F)F)c2)CCN1 1641440283 ZCBDGZPIYGBCNJ-UHFFFAOYSA-N 424.357 -0.260 50 10 HBGE COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CS(C)(=O)=O 1647999831 FOUMKPSBHWXDAE-CYBMUJFWSA-N 401.441 -0.490 50 10 HBGE COC1(CCNC(=O)c2c[nH]nc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2267021401 SLRFLKWRSWIEFQ-UHFFFAOYSA-N 402.216 -0.753 50 10 HBGE Cc1nn(C)c(C(=O)N(C)[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2267022431 HJZWYOAPRRBWCF-GJZGRUSLSA-N 400.244 -0.062 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C)nn(C)c1B(O)O 2281609525 SYDOIFXUNXTVGE-HHHXNRCGSA-N 402.282 -0.487 50 10 HBGE COC1(CCNC(=O)c2cncc(B(O)O)c2)CN(C(=O)OCc2ccccc2)C1 2281754584 VLYXXMYRTREBNL-UHFFFAOYSA-N 413.239 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50 10 HBGE O=C(N1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)Cc1ccsc1B(O)O)C(F)(F)F 2282862694 HDLODVNEWARXJN-AOOOYVTPSA-N 412.220 -0.505 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)Cc1ccccc1B(O)O 2282863193 OJEWGGURVNFEIH-UONOGXRCSA-N 400.262 -0.922 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)Cc1ccccc1B(O)O 2282863194 OJEWGGURVNFEIH-ZIAGYGMSSA-N 400.262 -0.922 50 10 HBGE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](C)c1nscc1B(O)O 2283945950 HPDYGCDZGHLZMI-GXSJLCMTSA-N 403.266 -0.186 50 10 HBGE O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)[C@H]1COCCO1 744647249 KRBMWHVNXVLZPO-CQSZACIVSA-N 424.479 -0.152 50 10 HBGE Cn1ccc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)n1 1161284667 LNGKVYYOPSDJPF-ZDUSSCGKSA-N 415.497 -0.355 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNC(=O)NNC(=O)[C@H]2COCCO2)C1 1248485625 RAJXXFRGNNDWND-SJKOYZFVSA-N 402.448 -0.242 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC(=O)NCCN2C(=O)c2ccc(B(O)O)cc2)C1 1557741374 VXESVJURUIDTEP-UHFFFAOYSA-N 403.244 -0.682 50 10 HBGE 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Cc1sc(C(=O)NC(CO)(CO)CNC(=O)OC(C)(C)C)c(B(O)O)c1C 2282479493 RYEKCMYLYKIBQZ-UHFFFAOYSA-N 402.278 -0.977 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)c1cc(B(O)O)nn1C 2282711395 BTXGXVPJDSUCQW-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)Nc2ncc(B(O)O)s2)C1 2283986590 FVUSTSCHXCQUDB-SECBINFHSA-N 419.290 -0.814 50 10 HBGE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@]2(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2284057631 BRVPMMNNOVOBBZ-HUUCEWRRSA-N 400.241 -0.292 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1)N[C@H]1CCS(=O)(=O)C1 919888628 PHGMRHJBVQSOCO-AAEUAGOBSA-N 414.509 -0.201 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 1452254114 GERUVAVSOOLRLE-YPMHNXCESA-N 413.452 -0.301 50 10 HBGE COc1ccccc1NCC(=O)NNC(=O)c1cc2n(n1)CCN(C)S2(=O)=O 1608568287 MEDAUHOJJUQESW-UHFFFAOYSA-N 408.440 -0.601 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@]12C[C@H]1CCCN2C(=O)OC(C)(C)C 1610347162 JAVMMGFOMZIVFE-USBNGQNGSA-N 404.489 -0.139 50 10 HBGE O=C(CCN1C(=O)CCNC1=S)NNC(=O)c1csc(N2CCOCC2)n1 1617995493 LGRZODGNKGSAEL-UHFFFAOYSA-N 412.497 -0.762 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1CC(=O)NNC(=O)C(C)(C)C 1620428300 GKRVHTLLPLIIEL-GOSISDBHSA-N 402.492 -0.232 50 10 HBGE O=C(COc1ccc(Br)cn1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1626650019 JPEYGKQGGIYXSV-VIFPVBQESA-N 407.246 -0.260 50 10 HBGE CC(C)(C)OC(=O)NC(CO)(CO)CNS(=O)(=O)N1CCC(Cl)CC1 2258275092 KCMPUGKLJTWICC-UHFFFAOYSA-N 401.913 -0.228 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 2267207939 VAGJJEXBTBDVHF-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)cc1 2267616621 WRKOYNJJFNWNRC-VWLOTQADSA-N 406.291 -0.322 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1C(=O)c1cc(B(O)O)cs1 2281905891 HIAAKYMKLRACBH-INIZCTEOSA-N 400.262 -0.844 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282104703 ZMVLBLCAADYSAU-MRXNPFEDSA-N 400.262 -0.983 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282360845 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10 HBGE CCOCCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1255775827 BQYOCPJUCBOQIZ-UHFFFAOYSA-N 402.473 -0.066 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 1302576192 SEZXCMDGRQHHSH-CYBMUJFWSA-N 402.407 -0.420 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnn3c2OCCC3)CC1 1610947953 LPPQXOOLUKDBAY-UHFFFAOYSA-N 421.483 -0.246 50 10 HBGE CN1C[C@H](Br)[C@@H](NS(=O)(=O)c2c(Br)nnn2C)C1 2029861596 BYFBKHDHLYNAJI-WDSKDSINSA-N 403.100 -0.067 50 10 HBGE CCON(C(=O)c1nn(C)c(Cl)c1B(O)O)C1CN(C(=O)OC(C)(C)C)C1 2282170305 UQPNPGNFYIRYRM-UHFFFAOYSA-N 402.644 -0.234 50 10 HBGE O=C(N[C@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1cscc1B(O)O)C2)C(F)(F)F 2282367804 HVRWUFIHFLPJQY-FKTZTGRPSA-N 412.220 -0.352 50 10 HBGE Cc1cc(S(=O)(=O)N(CCO)CCCNC(=O)OC(C)(C)C)sc1B(O)O 2282373619 OZAPVUFQHHMUFO-UHFFFAOYSA-N 422.334 -0.366 50 10 HBGE C[C@@H]1CC[C@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282707116 VCAWLGKURDMPOF-PSASIEDQSA-N 414.236 -0.104 50 10 HBGE CN(CCOCCN(C)S(=O)(=O)c1ccc(B(O)O)s1)C(=O)OC(C)(C)C 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CC(C)[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)CS(C)(=O)=O 1470661249 MROHPUBSAIWHTR-CQSZACIVSA-N 402.448 -0.159 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1546175457 QHMABZYADQQYSD-YUMQZZPRSA-N 403.379 -0.118 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=S)NCCSC)[C@H]1c1ccnn1C 1596322203 IAVYWKPDARCRCY-OLZOCXBDSA-N 400.530 -0.433 50 10 HBGE Cc1ccc(C(=O)NNC(=O)c2cccnn2)cc1S(=O)(=O)N1CCOCC1 1598371720 USDZWHXIVTYMSA-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(c2ncc(Br)cc2B(O)O)C1 2217196721 IBYPMYOOOHCRJU-UHFFFAOYSA-N 402.054 -0.400 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCOCCN1C(=O)OC(C)(C)C 2267382440 LIVPZZHAYONPRX-UHFFFAOYSA-N 406.291 -0.091 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N1CCC[C@@H](NC(=O)OCc2ccccc2)C1 2278569122 ZJXWVKMFUYKNAU-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2S(=O)(=O)c2cc(B(O)O)cs2)C1 2282076251 FSNOCJSCFMSVKD-NSHDSACASA-N 418.302 -0.827 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1ccccc1B(O)O)C(=O)OC(C)(C)C 2282720016 UJFOZEDJOOGKTN-GFCCVEGCSA-N 402.278 -0.785 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)n1C 2337404847 JDZGAQBTBIFKLL-GJZGRUSLSA-N 400.244 -0.062 50 10 HBGE O=C(O)c1cc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)s1 769632257 CNLHPFDHDRYRKZ-LURJTMIESA-N 415.243 -0.066 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)NNC(=O)N2CCOCC2)C1 1136453239 YVYXQVRVZIRAOP-LBPRGKRZSA-N 420.488 -0.516 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1318896302 ANYXZVYRUBSBPJ-HRCADAONSA-N 422.507 -0.119 50 10 HBGE C[C@H]1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CS1(=O)=O 1565030591 DJSHZFLNDOVZJD-JSGCOSHPSA-N 410.500 -0.011 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N[C@@H](C)CO)cc1 1628717491 BBWOABCKSOHTHO-LBPRGKRZSA-N 418.541 -0.167 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](O)C3CCC3)CC2)cc1 1630996617 NQNXQIRZFQIJHY-SFHVURJKSA-N 424.523 -0.390 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)[C@@H]1CCCCO1)C1CCCC1 1674042474 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-0.334 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)s1 1586191322 TWQQBNDHRYKYLU-UHFFFAOYSA-N 423.538 -0.343 50 10 HBGE O=C(CS(=O)(=O)C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1617979605 HWCRPOVGAFNZLB-UHFFFAOYSA-N 415.493 -0.191 50 10 HBGE Cn1cc([C@@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 1654356139 GAMHUMMJCLYWLP-WNNBVUDTSA-N 420.451 -0.105 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)S(=O)(=O)N1CC(OCc2ccccc2)C1 2186590462 JTHYEFSVWJZXHY-LBPRGKRZSA-N 411.314 -0.039 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272653560 SBJYNKYBEBQZEJ-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281837923 MXDKYBYUJALMJC-FVOZGUDWSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282073461 FTCLZMVRGKGSQS-CQSZACIVSA-N 420.274 -0.830 50 10 HBGE Cn1nc(C(=O)NCC2(CNC(=O)OC(C)(C)C)COC2)c(B(O)O)c1Cl 2282299761 VZVITMXQYGKMNB-UHFFFAOYSA-N 402.644 -0.976 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1S(=O)(=O)c1nn(C)cc1B(O)O 2282367769 HBRMGAPABPQSCK-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cscc2B(O)O)C1 2282732621 JHASIHWJFQEZNH-AWEZNQCLSA-N 420.274 -0.830 50 10 HBGE COc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1Cl 814414074 QVODEJCDWCRTNN-UHFFFAOYSA-N 420.813 -0.443 50 10 HBGE CN(NC(=O)C1CN(S(C)(=O)=O)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1138053167 BDQPZNSJQWEULZ-UHFFFAOYSA-N 419.504 -0.487 50 10 HBGE Cc1ccc(F)c(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 1294588095 ZFGYZMQIZQYVGI-UHFFFAOYSA-N 402.386 -0.729 50 10 HBGE C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)C1 1633319156 AWVVHINXUJBSRO-GDBMZVCRSA-N 405.279 -0.042 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2255755060 KDTHYZWCCNYHAY-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NC(=O)c2ccsc2B(O)O)C1 2282226238 NZWGQJJXEJXOSO-MNOVXSKESA-N 418.302 -0.810 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@@H]1CN(Cc2ccccc2)CCO1 2282408633 JKKOISPDWLJANE-MRXNPFEDSA-N 410.326 -0.252 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)COC1 2282728737 VAJYKVGCZXYOHJ-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282862986 LFXQKHCEBKKVOW-NSHDSACASA-N 419.334 -0.016 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2362081076 OKVGZQIVMMYUCD-NSHDSACASA-N 404.298 -0.682 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1cnsc1B(O)O)C(=O)O 2362570524 ZNRJZARCNMPKKV-JTQLQIEISA-N 401.250 -0.299 50 10 HBGE COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)[C@H]3COCCO3)C2=O)c1 747952916 DSJRAHMYGNPPCA-HUUCEWRRSA-N 408.411 -0.445 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1457618814 NECKHADVPAEANN-QWRGUYRKSA-N 406.505 -0.035 50 10 HBGE O=C(CN1CC[C@H](c2ccccc2)NC1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1583281158 OMNNZGJVGQGEPT-UONOGXRCSA-N 409.468 -0.340 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1630591808 NUUWGHFNZGQSJL-AWEZNQCLSA-N 412.855 -0.236 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)c1sccc1S(=O)(=O)N1CCC(O)CC1 1637856567 LFEGEIVMLOLCOM-LLVKDONJSA-N 403.482 -0.167 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)[C@@H](C)OCCOC)cc1 1683440518 ANDYZAQAODNWGS-GFCCVEGCSA-N 402.473 -0.481 50 10 HBGE Cn1c(O)nnc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1683611003 BVCXLANRYAKCNO-UHFFFAOYSA-N 402.459 -0.437 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCCN(CCN3CCOCC3)C2)n1 1684837193 ZKLLGZVNEJEFOV-QGZVFWFLSA-N 407.519 -0.373 50 10 HBGE Cn1nc(C(=O)N[C@@H]2C[C@@H](F)CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282286929 RVMMNCNJYDUSAO-RKDXNWHRSA-N 404.635 -0.169 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282361539 SDLBEQQSDDDGSU-UHFFFAOYSA-N 421.306 -0.475 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282710281 MPCRGFCMNNWSCY-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](NC(=O)C(F)(F)F)C1 2282730011 WAKOVOZJEQHKAE-CBAPKCEASA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CP(C)(C)=O)C(=O)NCc1ncc(B(O)O)s1 2335466637 PYGHKTBABPVHNC-SECBINFHSA-N 405.222 -0.045 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1cc(B(O)O)ccn1 704294215 DQHLYEMCVPVBJI-UHFFFAOYSA-N 417.252 -0.175 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)NCCCN1CCCS1(=O)=O 726276944 DYMPIIKTRDVHBE-UHFFFAOYSA-N 403.486 -0.766 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H](F)CC2CCCCC2)n(C)c1=O 793672456 BHTYHQHDKONUTM-GFCCVEGCSA-N 408.434 -0.110 50 10 HBGE CNC(=O)[C@@H](CNC(=O)NNC(=O)c1cn(C)nn1)Cc1ccc(OC)c(F)c1 1230370501 POKHUQNGUBJPEG-LLVKDONJSA-N 407.406 -0.488 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2COCCO2)c(CN2C(=O)c3ccccc3C2=O)n1 1265592320 YKMXNVHBUGNENA-HNNXBMFYSA-N 413.390 -0.607 50 10 HBGE C[C@@H](CC(=O)NNC(=O)CN1CCCC1=O)/N=C1/NS(=O)(=O)c2ccccc21 1302582848 MTMAMJOSNLUSDP-NSHDSACASA-N 407.452 -0.727 50 10 HBGE C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCc1nnc2c(=O)n(C)ccn12 1313302727 SBBPCZMJTSDNPX-LLVKDONJSA-N 417.401 -0.093 50 10 HBGE O=C(c1ccc(B(O)O)cc1)N1CCN(CCNS(=O)(=O)c2ccccc2)CC1 1646097232 MFMKKMVFTRKBGO-UHFFFAOYSA-N 417.296 -0.897 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 2282083829 RKTLYWRMIHAMRQ-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)c3ccc(F)c(B(O)O)c3)[C@H]2C1 2282341061 NCBOCOFZDAGLHW-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]2C1 2282380354 HYBUCCAAKPNOAB-GARJFASQSA-N 417.318 -0.502 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(O)CCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282708813 ROVLFAYZXNUAGY-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728886 HXNWARBFAXGXOF-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE Cn1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1=O 729510124 TXTGFSIUQKSPRK-UHFFFAOYSA-N 420.447 -0.519 50 10 HBGE CCNC(=O)COc1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1OC 745462288 LAQSGAPIPODRDL-OAHLLOKOSA-N 410.427 -0.544 50 10 HBGE CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)CC1 745999627 FXNSQVIXAIMYSI-GPANFISMSA-N 411.503 -0.545 50 10 HBGE COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ncccn1 1130013836 PXOPUSIGTWMAND-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H]1C(=O)NCC12CCOCC2 1176505698 RWQDMQADGQVKKL-HNNXBMFYSA-N 410.858 -0.006 50 10 HBGE COCCn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1 1465792365 ZXFFGHQXBXVOTC-UHFFFAOYSA-N 414.466 -0.252 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)NNC(=O)[C@@H]3CCC(=O)N3)O2)C1 1565094656 KCZTYZNIWAMPQB-NEPJUHHUSA-N 411.459 -0.236 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2Cc3ccc(Cl)cc32)n(C)c1=O 1635500643 METBTDMKBNWPHV-LBPRGKRZSA-N 416.825 -0.426 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCCN(CCN2CCOCC2)C1 1684835837 AZRVDOGQWZIWHS-HNNXBMFYSA-N 422.486 -0.864 50 10 HBGE Cn1nc(C(=O)N[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)c1Cl 2255725297 LXKWSWPULOLICZ-NWDGAFQWSA-N 406.635 -0.060 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CN(S(=O)(=O)N3CC(Cl)C3)CCN2C1=O 2265388061 VUPMDVMIWQWKIS-RYUDHWBXSA-N 408.908 -0.036 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1NC(=O)OC(C)(C)C 2267211856 RNZYJCBKNAWVJR-UWVGGRQHSA-N 406.291 -0.660 50 10 HBGE Cn1cc(C(=O)N=[S@@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(B(O)O)n1 2282166235 CHNBRWWOJOSCCB-FLESLCNUSA-N 400.266 -0.747 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1nn(C)cc1B(O)O 2282367767 HBRMGAPABPQSCK-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282373720 QMHAMDYLENMETO-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2cc(B(O)O)sn2)CC1 2282427922 XKVIPOXEKJSLMZ-HHHXNRCGSA-N 418.306 -0.471 50 10 HBGE CNC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(N)=C(C#N)[C@@H]1c1cccc(F)c1 2297508294 QODPJEDAZUKXTP-AWEZNQCLSA-N 414.418 -0.653 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CSCC(=O)Nc1ccc(F)cc1 758043034 DEMDPKYIAJUYGU-VIFPVBQESA-N 406.461 -0.418 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ncccn3)CC2)c1 1276342234 BSBSKFNQNMKCGL-UHFFFAOYSA-N 418.479 -0.302 50 10 HBGE CCc1ccccc1OCC(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1313166697 KTRCRHAGVVOLMI-LJQANCHMSA-N 406.439 -0.414 50 10 HBGE Cn1nc(C(=O)NNC(=O)NCC(C)(C)CS(C)(=O)=O)c2ccccc2c1=O 1565330685 HOUJNDGDAKWVQV-UHFFFAOYSA-N 409.468 -0.052 50 10 HBGE O=C(/C=C\CN1CCOCC1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1629793414 QNJCCNQJJLCHBI-DAXSKMNVSA-N 415.494 -0.520 50 10 HBGE CC(C)(C)OC(=O)NCc1cn(C2CN(C(=O)c3cc(B(O)O)ccc3F)C2)nn1 1633136425 ITBLORXWLXVAQF-UHFFFAOYSA-N 419.222 -0.181 50 10 HBGE CCn1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 1641080904 GETZFPJXPGGMTQ-UHFFFAOYSA-N 407.452 -0.001 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282084786 XWYOYBMEVSHVSI-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE C[C@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 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406.302 -0.273 50 10 HBGE CNC(=O)COc1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1OC 1558458488 HNFBQHJHWIFCMK-HNNXBMFYSA-N 420.466 -0.166 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=S)NCCSC)[C@H]1c1nccn1C 1631879323 BPLRVAXIBSJUSC-RYUDHWBXSA-N 400.530 -0.433 50 10 HBGE CNC(=O)COc1cccc(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1652301992 SJWHYHFMGLJQSK-QGZVFWFLSA-N 404.467 -0.245 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nnn(-c2ccccc2)c1C(F)F 1654294778 JPBAGARLKGTTJR-MRVPVSSYSA-N 402.383 -0.096 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1nc2ccccc2s1 1675304133 SQJPJQHMWGDCIU-KRWDZBQOSA-N 405.436 -0.132 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cscc1B(O)O 2267625345 NYKSWMUWWGSMRM-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282366154 JTJYSMJNBZOWIQ-OAHLLOKOSA-N 422.696 -0.426 50 10 HBGE Cc1cc(C(=O)N2CCS(=O)(=O)CCN2C(=O)OC(C)(C)C)oc1B(O)O 2282387895 JYYUSJQTIIUJRW-UHFFFAOYSA-N 402.234 -0.709 50 10 HBGE 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CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(F)cc1B(O)O 2282374348 ZZJNCLVJKRGQMY-VXGBXAGGSA-N 404.225 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2ccccc2B(O)O)CCO1 2282858015 QKGSXUWFBMTOAV-ZDUSSCGKSA-N 400.262 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2284046880 FJSDVTWASYLCTQ-XQQFMLRXSA-N 400.624 -0.701 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1sc(Cl)cc1B(O)O 2343821660 PAXQFMDFWJOGGR-UHFFFAOYSA-N 405.669 -0.662 50 10 HBGE Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2ccc(Cl)cc2)n(C)c1=O 18229512 HSDQEXSKPMWXBV-UHFFFAOYSA-N 404.814 -0.062 50 10 HBGE CC(=O)NNC(=O)C[S@](=O)CC(=O)Nc1nc(C)c(C(=O)OC(C)C)s1 586313591 GFGHCNCQPXNENY-AREMUKBSSA-N 404.470 -0.129 50 10 HBGE CCC(=O)NNC(=O)CSc1n[nH]c(NN=Cc2c(C)nn(CCO)c2C)n1 1084594367 FACUTNCLDTWIRC-UHFFFAOYSA-N 409.476 -0.294 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)ccc1=O 1157843704 BSQYBQMEPAVLOZ-UHFFFAOYSA-N 417.447 -0.259 50 10 HBGE O=C(NNC(=O)C1(n2cc(Br)cn2)CC1)N[C@@H]1CCS(=O)(=O)C1 1292044511 IVGDKYYOMOADFG-SECBINFHSA-N 406.262 -0.348 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@@H]2COCC[C@@H]21)NNC(=O)c1cccc(Cl)c1 1460221553 KMJWBLDIRMZUNK-UONOGXRCSA-N 401.872 -0.011 50 10 HBGE Cc1[nH]nc(I)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 1472504417 BBXMYFMFKCJXML-YFKPBYRVSA-N 415.213 -0.979 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(=O)n(C)cn2)c1 1540250387 GTXAGZJZDOAJLB-UHFFFAOYSA-N 407.452 -0.114 50 10 HBGE O=C(NCC[S@@](=O)CC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1 1565056492 GMAWUIZBVPTHIW-HHHXNRCGSA-N 405.362 -0.083 50 10 HBGE CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)co1 1596922662 CLYWOEJMGVACMJ-CYBMUJFWSA-N 400.457 -0.456 50 10 HBGE C[C@H]1[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2267392538 YLRUDCMEIUHORZ-VHSXEESVSA-N 405.307 -0.360 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H]2COC[C@@H]12 2282068573 FKXLWVWFUIRBMV-TUAOUCFPSA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282074499 UUBCVFXBKFCKHO-UHFFFAOYSA-N 420.318 -0.674 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282356201 RAXVSNJTCDGXQB-WDEREUQCSA-N 402.253 -0.055 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 2283950177 IGKBPHDBVQAHKD-SCZZXKLOSA-N 400.266 -0.889 50 10 HBGE COC[C@]1(C(=O)Nc2ncc(B(O)O)s2)CN(C(=O)OC(C)(C)C)CCO1 2283979218 KXKVYLJJOFIDOC-HNNXBMFYSA-N 401.250 -0.586 50 10 HBGE COc1cc(NC(=O)NNC(=O)[C@@H]2COCCO2)ccc1S(=O)(=O)N(C)C 757777647 XMPOSAXFRSWOCO-LBPRGKRZSA-N 402.429 -0.486 50 10 HBGE Cc1cc(C)nc(N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)n1 782997765 BYBNZOJNCIKJCO-UHFFFAOYSA-N 401.427 -0.021 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 787858156 LPXWWGCSOFCLLE-LBPRGKRZSA-N 403.420 -0.157 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 1149617798 TXWNPEHVWJQHCE-NEPJUHHUSA-N 403.457 -0.840 50 10 HBGE O=C(NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 1159505006 QGBXEFIXBFVTSM-NJBDSQKTSA-N 405.432 -0.059 50 10 HBGE CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)C1 1456041405 ZCUODNQCCNZLIS-UKRRQHHQSA-N 402.517 -0.551 50 10 HBGE COc1cc(N2C[C@@H](C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2=O)cc(OC)c1OC 1530230272 BHXBJHTZYMLZIE-CMPLNLGQSA-N 420.422 -0.509 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2CCC(=O)N2)s1 1533745191 XKZJOQITHFDEGP-MNOVXSKESA-N 400.482 -0.364 50 10 HBGE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NNC(=O)c1ccc(Br)s1 1624166968 IMHGWBFQVYJGNP-ZCFIWIBFSA-N 402.234 -0.537 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1ccnc(B(O)O)c1 2029308082 MOVXWIYWVKWIQJ-UHFFFAOYSA-N 403.225 -0.421 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC(=O)N(Oc2ncc(Br)cc2B(O)O)C1 2224061443 KDNUEODBQGJEIF-VIFPVBQESA-N 416.037 -0.057 50 10 HBGE C[C@H]1CC[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282079906 CAPOCCFSTNCEOT-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](NC(=O)c2sccc2B(O)O)C1 2282206757 JHOJNEGHZLVOBT-MNOVXSKESA-N 418.302 -0.810 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)c1B(O)O 2282376967 LDVPSJKYXLRCTK-BDAKNGLRSA-N 412.220 -0.419 50 10 HBGE COc1ccc(S(=O)(=O)NCCCONC(=O)OC(C)(C)C)cc1B(O)O 2282731300 PCRCKNAPHNMLFO-UHFFFAOYSA-N 404.250 -0.500 50 10 HBGE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1csc(B(O)O)c1 2283954600 ACPUKEVIBYAXII-LBPRGKRZSA-N 400.262 -0.157 50 10 HBGE CCOC(=O)C(=O)/C(=N\Nc1[nH]cnc1C(=O)NC)C(=O)N/N=C/c1ccccc1 8385559 TWOXLUZVKUEXTO-IIZZXCEOSA-N 413.394 -0.180 50 10 HBGE CC(C)(C)OC(=O)NC1CCN(CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)CC1 816872166 CPEHODLUEZVCJV-CYBMUJFWSA-N 421.502 -0.023 50 10 HBGE CN1C(=O)N(CC(=O)NNC(=O)[C@H]2CCc3nncn3C2)C(=O)C12CCCCC2 816882684 KJIJHSLZMJOAGA-LBPRGKRZSA-N 403.443 -0.415 50 10 HBGE C#CC[C@H](COC)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1253780449 ZOTHCOILRDSPCR-CQSZACIVSA-N 410.500 -0.318 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3CC(=O)NC3=O)cc2)CC1 1446391805 ZASPLVARQZPUPA-GFCCVEGCSA-N 409.468 -0.881 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@H]1CCC(=O)N1)N1C(=O)c2ccc(Br)cc2C1=O 1530231282 YSNWVASNWZJIQX-RDDDGLTNSA-N 423.223 -0.140 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(I)cn1 1638300708 WKWCCFIHIPTMAT-LURJTMIESA-N 412.209 -0.615 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2267378644 QZIUPNBKSPVKTO-UWVGGRQHSA-N 405.307 -0.360 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N(C)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 2267433654 QHKXQUBHAHEFCB-OAHLLOKOSA-N 400.244 -0.109 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2S(=O)(=O)Cc1ccsc1B(O)O 2267626857 OYSKNWKINFJMNN-RYUDHWBXSA-N 402.303 -0.049 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2cc(B(O)O)c[nH]2)CC1 2281610812 KKCIMHZAMADYDK-HHHXNRCGSA-N 400.266 -0.600 50 10 HBGE Cn1ncc(CNS(=O)(=O)c2cc(B(O)O)cs2)c1NC(=O)OC(C)(C)C 2282073416 FGSWWSVTVGHJOC-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE C[C@@H]1CC[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282079903 CAPOCCFSTNCEOT-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282335611 RSUVAPYUNLXDDJ-NEPJUHHUSA-N 420.318 -0.518 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2CC[C@](C)(NC(=O)C(F)(F)F)C2)c1B(O)O 2282742000 WDSHZDCKOFNWDN-LBPRGKRZSA-N 414.236 -0.124 50 10 HBGE C[C@@H]1CN(C(=O)c2c(B(O)O)ncn2C)C[C@@H](C)N1C(=O)OCc1ccccc1 2337292363 PQHBESPRHLBAGA-ZIAGYGMSSA-N 400.244 -0.029 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 757874515 QAHPGKSIVIWYTP-GFCCVEGCSA-N 402.404 -0.166 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCOc3c(F)cccc32)n(C)c1=O 764815348 CQZHDXMFKDACBH-UHFFFAOYSA-N 400.370 -0.124 50 10 HBGE CN(C)S(=O)(=O)N1CCCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)CC1 811870272 GDVIZSMNOZCUNJ-OAHLLOKOSA-N 411.484 -0.455 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)c3cnn(C)c3)cc2)CC1 1545922189 XBTJICVCACKNOC-MRXNPFEDSA-N 408.484 -0.467 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)ccc1=O 1598526513 BXZDHAOOOINYEN-HOCLYGCPSA-N 416.409 -0.510 50 10 HBGE COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)CC(=O)N2C2CC2)c1 1641667207 MYCWAYIWOFUKGT-WMLDXEAASA-N 409.464 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2sccc2B(O)O)[C@@H](O)C1 2267200442 FTBICSTYLJQGKC-MNOVXSKESA-N 406.291 -0.924 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@@H]2CN(C(=O)OCc3ccccc3)CC23CCC3)n1 2281864830 OTMDGBIXXUHJHO-CQSZACIVSA-N 413.243 -0.584 50 10 HBGE CC(C)C[C@@H](CNS(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282069198 MTRPKVXGDORWCN-NSHDSACASA-N 404.298 -0.682 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282094826 VUGFNDLTACGKGU-STQMWFEESA-N 400.262 -0.673 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)Cc2ccsc2B(O)O)CC1)C(F)(F)F 2282333852 UEJGCZIPNUDKGA-UHFFFAOYSA-N 414.236 -0.352 50 10 HBGE COC[C@]1(NS(=O)(=O)c2cscc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282725176 XKPAMFSGUUHHEU-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CP(C)(C)=O)C(=O)NCc1cnc(B(O)O)s1 2335464936 ALKJOGGJAWKZEL-SNVBAGLBSA-N 405.222 -0.045 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H]2C(=O)NCCN2S(=O)(=O)N2CC(Cl)C2)C1 2351723069 AZJVWLWQVSORCN-LBPRGKRZSA-N 408.908 -0.179 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 742069161 NIIAUCNYODIYFI-VIFPVBQESA-N 400.486 -0.070 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(OC)c1 742643785 DDFMOOUNTWCISN-MPTQWLOMSA-N 403.391 -0.373 50 10 HBGE COc1ccc(C(=O)NNC(=O)NNC(=O)[C@@H]2COCCO2)cc1Br 745999329 UYUNGEFCPZMUQJ-NSHDSACASA-N 417.216 -0.152 50 10 HBGE C/C(=C\C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765725989 XOHCKAQHOOBQRJ-YRNVUSSQSA-N 414.397 -0.176 50 10 HBGE Cc1ccccc1SCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765729530 CQWXPKMWDAFBJN-UHFFFAOYSA-N 416.463 -0.318 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1COCCO1 810462395 OGDDWMSORVRDKN-NSHDSACASA-N 422.257 -0.710 50 10 HBGE CO[C@@H]1COC[C@H]1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1478878818 TWDPQKOWXCIVOM-ZIAGYGMSSA-N 400.457 -0.640 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3(N(C)C)CC3)CC2)cc1 1629792797 GOZZRELNHWGVLX-UHFFFAOYSA-N 423.539 -0.457 50 10 HBGE O=C(NNc1cc(Br)ncn1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 1644110879 SUSGRRDFURHRQL-IUCAKERBSA-N 418.273 -0.282 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1c(Cl)cccc1B(O)O 2282362351 FCGYQHLEFSDGFB-VXGBXAGGSA-N 420.680 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@](CO)(NS(=O)(=O)c2sccc2B(O)O)C1 2282699352 JKCIHHKUHYDDIT-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2282733296 SZCBPUJZKMSYCO-RYUDHWBXSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282853428 CSSQCBDZVYTDSO-LBPRGKRZSA-N 420.318 -0.517 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@H]1COCCO1 745638652 VNZOSPJVIUUDJC-OAHLLOKOSA-N 412.468 -0.283 50 10 HBGE C/C(=C/c1ccc(C)cc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 778687996 HNXNOQUXKSMSNP-LCYFTJDESA-N 410.434 -0.007 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CCCOC1 1463792402 MZURGSYUTJAMEK-PXAZEXFGSA-N 419.500 -0.110 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)NCCn1cc(Br)ccc1=O 1470351463 UXRXNKBCZNJIMT-SNVBAGLBSA-N 405.249 -0.007 50 10 HBGE CO[C@@H]1C[C@H](C(=O)NNC(=O)[C@H]2COCCO2)N(C(=O)OCc2ccccc2)C1 1514955080 YHLGNAHLMNJICO-BZUAXINKSA-N 407.423 -0.025 50 10 HBGE CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)ccc1F 1533744610 KYLTYUYPEPQSKL-LLVKDONJSA-N 400.432 -0.058 50 10 HBGE COc1cnc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nc1 1638390218 SHMZPCPEPAYXBQ-UHFFFAOYSA-N 407.456 -0.427 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ccsc2B(O)O)[C@@H](O)C1 2282345918 KDMLXNLXHPWVTJ-NEPJUHHUSA-N 420.318 -0.782 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282365098 UHHNNNOBIMXCCJ-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)C(=O)c1sncc1B(O)O 2282460082 GPWIFHOUHWNHDD-UHFFFAOYSA-N 400.310 -0.259 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](NS(=O)(=O)c3cc(B(O)O)cs3)[C@H]2C1 2282707439 YTJXSAUWGUIARP-UTUOFQBUSA-N 418.302 -0.660 50 10 HBGE Cc1ccc(S(=O)(=O)NCC2(F)CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1 2282728345 DQXACSMMCDEIDA-UHFFFAOYSA-N 402.253 -0.088 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)[C@H]3COCCO3)C2)cc1 915052344 QDUPQXREOYETAR-GOEBONIOSA-N 411.480 -0.041 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@@H]2COCC[C@H]21)NNC(=O)c1ccccc1Cl 1195002516 FVZXVZCGOGVRDY-ZIAGYGMSSA-N 401.872 -0.011 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)N1 1470496751 AGVLOMKPTBGZRD-OLZOCXBDSA-N 417.422 -0.120 50 10 HBGE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NNC(=O)c1n[nH]c2c1CCCC2 1629127170 ZGEJKHHAZROOSQ-HNNXBMFYSA-N 403.414 -0.092 50 10 HBGE C=C[C@](C)(O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1630996412 GHFSOQNQAFBVJQ-SFHVURJKSA-N 410.496 -0.614 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2ccc(B(O)O)s2)CC1 2267207973 VNBQSYITWXDHCN-UHFFFAOYSA-N 424.331 -0.165 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282337545 LTYRGVIIQFBQSI-LLVKDONJSA-N 419.334 -0.159 50 10 HBGE COc1ccc(S(=O)(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282356381 UNUFVQCDLOXAPW-NSHDSACASA-N 402.278 -0.091 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1cscc1B(O)O 2282363419 NQIFUKDAVLNHIC-NQBHXWOUSA-N 420.318 -0.223 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(C)CCOCCNC(=O)OC(C)(C)C 2282364299 NUGMFOBMXGEOKY-UHFFFAOYSA-N 422.334 -0.102 50 10 HBGE CN([C@]1(CNC(=O)OC(C)(C)C)CCOC1)S(=O)(=O)c1cc(B(O)O)cs1 2282700907 TWNPSZKVKUSULL-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)c1c(B(O)O)cnn1C 2282705557 ZPDKCKDEZVQQGC-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1sccc1B(O)O 704310235 NKJLVRYWSUFFJJ-UHFFFAOYSA-N 408.266 -0.466 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnn(-c2ccncc2)c1C(F)F 787886373 MHUDCWXQIHQUDD-MRVPVSSYSA-N 402.383 -0.096 50 10 HBGE 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Cn1nc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(B(O)O)c1Cl 2281651533 QWOQJKJBCXQIPB-ZCFIWIBFSA-N 414.577 -0.061 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H](C)C(C)(C)NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282347482 YSLFPYZUYGSFDX-SECBINFHSA-N 404.298 -0.622 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](OCCNS(=O)(=O)c2sccc2B(O)O)C1 2282719707 PKSLZAOKRWYJOP-NSHDSACASA-N 420.318 -0.268 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)[C@@H]2COCCO2)CCO1 760780293 LPHAOYBJHHVVLJ-XQQFMLRXSA-N 402.448 -0.243 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](O)Cc3cnn(C)c3)cc2)CC1 787134971 LMIKLQLQAFMELK-KRWDZBQOSA-N 422.511 -0.597 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)N1 1438034878 ICVKSARLLAMWEW-GFCCVEGCSA-N 400.844 -0.226 50 10 HBGE CC[C@@H](CO)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1545423886 FAMVTHJTHDXTHH-HNNXBMFYSA-N 412.512 -0.533 50 10 HBGE O=C(NNC(=O)c1nn2c(c1Br)CCC2)N[C@H]1CCS(=O)(=O)C1 1597432971 UVNAWJPJHRMLFI-ZETCQYMHSA-N 406.262 -0.277 50 10 HBGE Cc1csc(CN(C)S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)c1B(O)O 2039339978 RESBKAXXNQJETA-UHFFFAOYSA-N 422.293 -0.206 50 10 HBGE Cn1cc(C(=O)NCCSSCCNC(=O)OC(C)(C)C)nc1B(O)O 2267321521 JFDHFYGTYMCCGU-UHFFFAOYSA-N 404.323 -0.264 50 10 HBGE CCCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267713937 GEMUHBXNMKJBNG-UHFFFAOYSA-N 407.323 -0.111 50 10 HBGE CCn1cc(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)nc1B(O)O 2281649928 UATSDHDLAWKDBA-HNNXBMFYSA-N 416.243 -0.650 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1c(B(O)O)cnn1C 2282076496 IXWFIENBOSDRHX-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE CN(C[C@H](O)CN(C)S(=O)(=O)c1ccc(B(O)O)cc1)C(=O)OC(C)(C)C 2282084703 QXVHHFRGLUSROW-ZDUSSCGKSA-N 402.278 -0.785 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282729273 ZUQZQIJZFNTHJQ-GWCFXTLKSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282736524 RZDXCWAKDRLNEX-QWRGUYRKSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2284046879 FJSDVTWASYLCTQ-RWMBFGLXSA-N 400.624 -0.701 50 10 HBGE CCn1nc(C(=O)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc2c1=O 25954662 FCDWUJWKMWUMCZ-MDZDMXLPSA-N 424.417 -0.712 50 10 HBGE COCCCNC(=O)[C@H](C)N1CCN(C(=O)NNC(=O)Cc2ccccn2)CC1 729232112 DFCPBSJYLGWMTJ-HNNXBMFYSA-N 406.487 -0.476 50 10 HBGE Cc1cc(C)c(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c(C)c1NS(C)(=O)=O 745979165 IKXFDFTVZFMMLF-GFCCVEGCSA-N 421.497 -0.292 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C23CC(C(F)(F)F)(C2)C3)n(C)c1=O 787126509 POWANHFVWIBOQZ-UHFFFAOYSA-N 414.344 -0.686 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)C[C@H](C)O1 1160415994 HXWBPVFUFKXKMB-RYUDHWBXSA-N 413.500 -0.849 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)ccc1=O 1255498021 CHMBUGPPVOQBHH-UHFFFAOYSA-N 407.452 -0.551 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1303881012 GWTFUBSQCAWQKS-INIZCTEOSA-N 410.496 -0.049 50 10 HBGE O=C(Cn1nc(C(F)(F)F)c2c1CCOC2)NNC(=O)[C@H]1CCS(=O)(=O)C1 1440705271 QCMHLGDIFSLYQU-QMMMGPOBSA-N 410.374 -0.443 50 10 HBGE CN1CCC[C@](O)(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1 1622153504 IJMMWGHVYSOONB-NRFANRHFSA-N 417.510 -0.561 50 10 HBGE CCN1CC[C@H]1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1637958969 NMEJAFMUCFVOGT-AWEZNQCLSA-N 411.532 -0.262 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)NNC(=O)C2CCOCC2)C1 1650889351 QXIMQMACDLCCRA-CYBMUJFWSA-N 419.500 -0.015 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1sccc1B(O)O 2267207021 OENAKLMBBYQGNQ-JGVFFNPUSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NS(=O)(=O)c2cscc2B(O)O)s[nH]1 2267382660 OELYDTOVJWHUPP-UHFFFAOYSA-N 420.303 -0.473 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272655807 SBJYNKYBEBQZEJ-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282094824 VUGFNDLTACGKGU-OLZOCXBDSA-N 400.262 -0.673 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(S(=O)(=O)c2cccc(B(O)O)c2)C1 2282103253 OVWYMBHEWNDGDZ-STQMWFEESA-N 400.262 -0.985 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282425532 QVEYVUDULQVCHQ-LBPRGKRZSA-N 414.598 -0.149 50 10 HBGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282736808 WDEYJEKQXSAJJU-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)NCc1sccc1B(O)O 2283954439 FHIJBCUXTDEUJM-LLVKDONJSA-N 420.318 -0.628 50 10 HBGE C[C@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cscc1B(O)O 2284043012 WYCPPLFWNCEZDF-JOYOIKCWSA-N 402.253 -0.075 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2343828762 WAOXUKQPZOAUBQ-QMMMGPOBSA-N 405.669 -0.534 50 10 HBGE CN(Cc1sccc1B(O)O)C(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360531062 IYUTZDJMYYLWDB-NSHDSACASA-N 420.318 -0.676 50 10 HBGE O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)[C@@H]1COCCO1 745803304 RFEWKKYWFCHUNK-HNNXBMFYSA-N 407.475 -0.875 50 10 HBGE CCc1cccc(S(=O)(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 765122329 DYPYWVMAXVPJCW-UHFFFAOYSA-N 420.451 -0.994 50 10 HBGE CN(NC(=O)c1cnc(O)n(C)c1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 776211785 HDBHFBQVVXXILW-UHFFFAOYSA-N 410.431 -0.265 50 10 HBGE O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)[C@@H]1CCc2nncn2C1 814334339 FPTPBHBCDPSPLO-GFCCVEGCSA-N 411.422 -0.143 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 1163146936 YDMPNVQZSJCZJN-WCQYABFASA-N 417.509 -0.116 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)CS(C)(=O)=O)ccc1OC(F)F 1168868983 LSQMWDQNWTYJAZ-UHFFFAOYSA-N 409.367 -0.782 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1ccccc1Cl)C2 1176861487 ZPGIGIRIOBMXKG-AWEZNQCLSA-N 419.873 -0.026 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1c(Br)nc2n1CCOC2 1440706028 SMTKQRKDIDQMLY-ZETCQYMHSA-N 407.246 -0.629 50 10 HBGE CN(C)N(C(=O)c1nc(S(N)(=O)=O)c2ccccn12)[C@H]1CCS(=O)(=O)C1 1625795602 XENQGLSQKUYUEA-JTQLQIEISA-N 401.470 -0.912 50 10 HBGE C[C@@H](CO)N(C)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 1639064438 NBHRZFPSSHBUCO-HNNXBMFYSA-N 412.512 -0.357 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1cc(B(O)O)sn1)OCc1ccccc1 2255576084 ZYXHJDXURWCLSO-JSGCOSHPSA-N 405.241 -0.363 50 10 HBGE Cn1nc(C(=O)NC[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281647815 FAIHARYXKJDREC-SECBINFHSA-N 404.635 -0.312 50 10 HBGE Cn1nc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2F)c(B(O)O)c1Cl 2281651580 RJIXPSWHOZORRO-BDAKNGLRSA-N 404.635 -0.169 50 10 HBGE Cc1nn(C)c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2281847241 KLIGDDMBYPSUQC-CABCVRRESA-N 416.243 -0.778 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)NC1CC2(C1)C[C@H]2NC(=O)OCc1ccccc1 2281848041 VVZNSYCNUOYINJ-RDYUPDBUSA-N 412.255 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CCNC(=O)C2(B(O)O)CCC2)C1 2282290446 SBIWFHFIMZHMMA-GFCCVEGCSA-N 404.294 -0.076 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282327962 QEHWIPXYFAKAIM-VXGBXAGGSA-N 420.318 -0.613 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1sc(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282408045 FFMCTTMZDSRXPX-LLVKDONJSA-N 400.262 -0.077 50 10 HBGE COCC1(NC(=O)OC(C)(C)C)CC(NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282425479 QHUAKLYVFCYWDA-UHFFFAOYSA-N 420.318 -0.222 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C 2282699176 IIIZKQBEWXBQOB-ZYHUDNBSSA-N 402.282 -0.928 50 10 HBGE C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282699830 MGPPCKSQKKIPBX-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE C[C@@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2ccc(Cl)c(B(O)O)c2)C1 2282740130 UWXWWDVQKUJWPY-GFCCVEGCSA-N 414.598 -0.149 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](C(=O)N=c2nc(B(O)O)[nH]s2)(C(F)(F)F)C1 2283947081 WEXFFNAHHOTXSA-GFCCVEGCSA-N 410.183 -0.232 50 10 HBGE COC(=O)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2CN(C)C)cc1 254301823 HSUPVXQEPRVDHQ-UHFFFAOYSA-N 413.398 -0.155 50 10 HBGE COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)c1 746001765 HEWZVHSMWIOTPO-MRXNPFEDSA-N 406.439 -0.462 50 10 HBGE 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CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)Nc1cc(B(O)O)ccc1Cl 2284050516 ZXZPCKSZZVWNAH-RWMBFGLXSA-N 400.624 -0.701 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cc(B(O)O)cs1)[C@@H](O)C(F)(F)F 2284130785 VWQMYVWEDQQPPR-VHSXEESVSA-N 412.195 -0.139 50 10 HBGE C[C@H](NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cc(B(O)O)cs1 2360551051 KBOPFBJCLQJMOW-GXSJLCMTSA-N 420.318 -0.457 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCN(c3nccn(C)c3=O)CC2)n1 745990451 FLRXXFOGZXTLCE-UHFFFAOYSA-N 405.484 -0.943 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)N2CCOCC2)CC1 745992062 UJKNSDRKDSWQCE-UHFFFAOYSA-N 414.488 -0.500 50 10 HBGE O=C(O)c1cc(Br)c(S(=O)(=O)NNC(=O)[C@H]2COCCO2)s1 769632258 CNLHPFDHDRYRKZ-ZCFIWIBFSA-N 415.243 -0.066 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1csc(I)n1 1539402006 PJCDIVRDTATVJC-YFKPBYRVSA-N 415.234 -0.057 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)C[C@@H](O)CN1C(=O)OCc1ccccc1 1630431263 BWBRVIVJQIKWHT-PJIJBLCYSA-N 404.423 -0.426 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1C[C@@H]2CC[C@H]1O2 1685753572 DRDOPFDMLFUUTJ-NUEKZKHPSA-N 424.479 -0.029 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2247884916 BMGKWKPMLPUCMN-UHFFFAOYSA-N 411.270 -0.737 50 10 HBGE O=C(NC[C@H]1CCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1)C(F)(F)F 2267610781 JWZJWAOJMXTNNF-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@@H](O)C1 2267613417 BPUYTRWTXMEJAM-UWVGGRQHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(B(O)O)c2)[C@H]2C[C@@H]21 2282346178 UFZRZPZSTSCFPM-KBPBESRZSA-N 400.237 -0.112 50 10 HBGE Cc1c(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282441414 FMMLQKMNTMSGRH-JGFSIVIASA-N 400.266 -0.686 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282727134 WPDBQBKYVWREJJ-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNS(=O)(=O)Cc1ccsc1B(O)O 2282739534 KUMXIWLFRJWJJC-UHFFFAOYSA-N 416.290 -0.461 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccn1 731596056 REFMOIOCSYBOCY-HZSPNIEDSA-N 408.480 -0.048 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1116020756 VDDQDGPNJMMISU-HRCADAONSA-N 422.507 -0.119 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)N(C)C)cc1Br 1144050475 VEJGCYNGEKKCNJ-UHFFFAOYSA-N 423.289 -0.043 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1 1632923295 FGJLIKRZONSQCS-UHFFFAOYSA-N 404.471 -0.279 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1nnc2c(=O)[nH]ccn12 1659997859 XHACJHIJNUOOSS-UHFFFAOYSA-N 419.829 -0.027 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)nn1 1681130040 KALRAXRLGKNHTD-LSDHHAIUSA-N 412.454 -0.642 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCCS(=O)(=O)Nc1ncc(B(O)O)cn1 2102384469 UZEADRVBJOFUFH-UHFFFAOYSA-N 418.240 -0.635 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267207729 TZIOTRBVJBIJSM-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)N=c2nc(B(O)O)[nH]s2)OC(C)(C)C1 2284045462 NCMIGFBWJIEKJT-BDAKNGLRSA-N 400.266 -0.571 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2288268225 ZQTFGYWVZYOYBO-ZUZCIYMTSA-N 417.318 -0.501 50 10 HBGE CNC(=O)CCOC1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1 752009226 GQMUFCDXVAMUTG-UHFFFAOYSA-N 411.484 -0.164 50 10 HBGE O=C(Cn1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cn1)NC1CCCC1 1156184628 XKZDSIZTTVYBSU-QGZVFWFLSA-N 418.498 -0.044 50 10 HBGE C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1587661662 QSMUQRBBUWADFB-DFBGVHRSSA-N 411.422 -0.013 50 10 HBGE C=CC(=O)N(CC)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1622153713 QETQPWFHRJICKJ-UHFFFAOYSA-N 401.467 -0.374 50 10 HBGE CN(C)N(C(=O)CCOc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCS(=O)(=O)C1 1638428527 VEIPAQXRCAWIRY-GFCCVEGCSA-N 405.498 -0.405 50 10 HBGE COc1nn(C)cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1641317304 SNAYYIDUUCGANJ-UHFFFAOYSA-N 409.472 -0.483 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCc1nnc2c(=O)n(C)ccn12 1685241036 UTJSRHHORXOXRJ-NSHDSACASA-N 417.401 -0.093 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CNS(=O)(=O)c3ccc(B(O)O)s3)[C@@H]2C1 2267205049 MZNVHKHKAWHCLC-RTCCRHLQSA-N 402.303 -0.181 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1C(=O)c1cc(B(O)O)cs1 2267401808 PUQJAGIKIFVKKJ-UHFFFAOYSA-N 404.275 -0.549 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2267626406 HTYPSXSLDVZXDB-UWVGGRQHSA-N 405.307 -0.502 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282072226 BTVGWKQLWCXQGA-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCCCCNC(=O)OC(C)(C)C 2282086266 JUIVBVBIWBHANW-UHFFFAOYSA-N 404.298 -0.537 50 10 HBGE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282334001 VZQUZMXYYUJPSA-WPRPVWTQSA-N 414.236 -0.211 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)Cc2cccc(B(O)O)c2)COC1 2282335022 JLJWRHIWAHYOJQ-UHFFFAOYSA-N 400.262 -0.921 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cnsc1B(O)O 2315692364 YZAVHNJFWZGLQU-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE Cn1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(=O)n(C)c1=O 10936660 OVZCNXPBLIONPK-VMPITWQZSA-N 420.809 -0.245 50 10 HBGE CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@H]1COCCO1 744649029 RCYHJEHSIXFEBB-ZIAGYGMSSA-N 417.509 -0.351 50 10 HBGE COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)[C@@H]3COCCO3)C2=O)c1 747952915 DSJRAHMYGNPPCA-GJZGRUSLSA-N 408.411 -0.445 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2=Cc3ccccc3OC2)n(C)c1=O 765721491 BOBIKNFQVNLZKZ-UHFFFAOYSA-N 410.390 -0.943 50 10 HBGE CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)N1CCN(C)CC1 1139085392 UHGCVIJOCQCBLI-ZDUSSCGKSA-N 412.516 -0.032 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN(CCO)CCN2CCOCC2)cc1OC 1167587092 SYDGYWHVGYRFEF-UHFFFAOYSA-N 410.471 -0.909 50 10 HBGE CN1CCOC[C@@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1234558586 KQFYSRFJVSKIMI-SFHVURJKSA-N 404.515 -0.140 50 10 HBGE C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CS(C)(=O)=O 1454276612 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HBGE O=C(Cc1csc([C@@H]2CCS(=O)(=O)C2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1539401507 GOTMWRPXDLOSSC-NXEZZACHSA-N 421.522 -0.830 50 10 HBGE COCCOCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2cc(C)ccc2OC)C1=O 1557861056 YWSVVODUUPNJTM-LJQANCHMSA-N 422.438 -0.419 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cnsn1 1625811174 GQIYIRBNRZXZAZ-UHFFFAOYSA-N 411.465 -0.058 50 10 HBGE CC(C)Cc1c[nH]c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 1629792613 BYLLDNBJVWUYBL-UHFFFAOYSA-N 401.427 -0.579 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)s3)C[C@H]2C1 2267202353 BGLUGDXNKXMLIK-GHMZBOCLSA-N 402.303 -0.085 50 10 HBGE Cc1nn(C)c(C(=O)N[C@@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c1B(O)O 2281847243 KLIGDDMBYPSUQC-HUUCEWRRSA-N 416.243 -0.778 50 10 HBGE Cc1nc(S(=O)(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282352348 NMKGFBFLQHYMNC-JTQLQIEISA-N 404.298 -0.668 50 10 HBGE CON(CCCNS(=O)(=O)Cc1ccc(B(O)O)cc1)C(=O)OC(C)(C)C 2282379874 AIOBGORQNUWNRH-UHFFFAOYSA-N 402.278 -0.026 50 10 HBGE Cc1cc(B(O)O)c(CNC(=O)[C@@H](F)C2(O)CN(C(=O)OC(C)(C)C)C2)s1 2284032915 BJCWSMGPJYGRFE-GFCCVEGCSA-N 402.253 -0.328 50 10 HBGE CC[C@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)N(C)C1 616589978 UHQYIIRIOVIPLI-PDQBFQGNSA-N 410.964 -0.001 50 10 HBGE O=C(COc1ccc(CCNC(=O)NNC(=O)[C@@H]2COCCO2)cc1)NC1CC1 745679620 BUSBFHTWDZDGKD-INIZCTEOSA-N 406.439 -0.368 50 10 HBGE COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)c2ccc(B(O)O)cc2)cc1 1297640761 JWBRGMQSXAZPAT-CYBMUJFWSA-N 414.223 -0.073 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(F)cc1 1440420311 ZDXDJRQLAJDEPI-BBRMVZONSA-N 403.366 -0.096 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(N(C)C)ncc1Br 1648534312 ATLUUHGCOOUGCU-LURJTMIESA-N 409.266 -0.996 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@]1(C)CCCN(C(=O)OCc2ccccc2)C1 2266957627 NXJQPJGMUDQEMX-GOSISDBHSA-N 401.232 -0.584 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2267062257 QOEOLRRRMRYWME-KBPBESRZSA-N 419.268 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2sncc2B(O)O)CC1 2281910495 SCWFEKCLVKCCTJ-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@H](CO)C1 2282074487 MOHJPUNKVYMOEP-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282101350 CMOUHAQDLWXXCH-STQMWFEESA-N 402.253 -0.008 50 10 HBGE Cc1nc(S(=O)(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(B(O)O)n1C 2282344394 KSYXPHHZJCEWBH-KOLCDFICSA-N 402.282 -0.915 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCOC[C@@H]1CNC(=O)OC(C)(C)C 2282356075 PEUYXUUYQYNMTK-NSHDSACASA-N 420.318 -0.349 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 2282383947 GLZWJZPRJPRHMO-GJZGRUSLSA-N 407.326 -0.141 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(NS(=O)(=O)c3sccc3B(O)O)CO[C@H]1C2 2359281065 NDMFBGJOELNVRO-JRPNMDOOSA-N 418.302 -0.469 50 10 HBGE Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCc1cccs1)c(=O)n2C 732557639 NZDWFQVDRSTNMA-UHFFFAOYSA-N 404.452 -0.335 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1 745322509 WJDWALFIRDUJTR-HNNXBMFYSA-N 414.484 -0.037 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(C(=O)Nc2c(F)cccc2F)CC1 1182609268 HWLXRFSZBDXPJN-MRVPVSSYSA-N 404.395 -0.231 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1437641095 SDNOQNRXODZZNL-NQBHXWOUSA-N 408.484 -0.127 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1cccc(B(O)O)c1 1556326976 IISPHRWFLFNAJG-UHFFFAOYSA-N 400.624 -0.133 50 10 HBGE CN(C)N(C(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1F)[C@@H]1CCS(=O)(=O)C1 1629231104 WVYDHVKDBDHJEJ-BXUZGUMPSA-N 414.459 -0.708 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@@H](C(=O)NNC(=O)[C@@H]2COCCO2)C1=O 1634837878 KLCUJCDHXMKWRY-STQMWFEESA-N 414.459 -0.688 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](CS(N)(=O)=O)C1 1660446713 DMRDPKXXSRVFMN-JTQLQIEISA-N 404.876 -0.280 50 10 HBGE C[C@@H]1CN(C(=O)c2c(B(O)O)nnn2C)C[C@@H](C)N1C(=O)OCc1ccccc1 2267336941 JFIPSPXXOVYNIQ-CHWSQXEVSA-N 401.232 -0.634 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cscc2B(O)O)[C@H](O)C1 2267627934 FMJBQUSDDZMEQZ-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282080505 KMTSEXYNKPPHTK-MHNYQROPSA-N 418.302 -0.613 50 10 HBGE CC[C@](C)(CNC(=O)OC(C)(C)C)N(C)S(=O)(=O)c1c(B(O)O)cnn1C 2282082165 YJACQECVJVTDOA-OAHLLOKOSA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NS(=O)(=O)c1ccccc1B(O)O 2282717567 LIGBKBJWOYAUMR-WCQYABFASA-N 400.262 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@]2(NS(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]2C1 2282861183 LDDLVPDQAJUJKS-MEBBXXQBSA-N 417.318 -0.358 50 10 HBGE COc1cccc(C=NNC(=O)c2nnn(-c3nonc3N)c2CN(C)C)c1O 254520182 ADEURSIPLMBGKA-UHFFFAOYSA-N 401.387 -0.228 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)[C@@H]1COCCO1 744642363 JEIQYDPHBPVIBX-CVEARBPZSA-N 411.480 -0.209 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2COCCO2)cc1S(=O)(=O)NC(C)(C)C 744648037 NFJGWMFUXWNBLO-CYBMUJFWSA-N 415.468 -0.052 50 10 HBGE CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)[C@@H]2COCCO2)CC1 782078319 KLWQKADIBMWLJF-KRWDZBQOSA-N 405.455 -0.081 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@@H]4CC[C@H]3O4)nc2)CC1 1251675548 ZYHFMYPUXSDQOH-NWANDNLSSA-N 410.500 -0.036 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1CN([C@@H]2CCOC2)C1 1444713033 CSSNBHQHJDNSMS-OAHLLOKOSA-N 410.496 -0.129 50 10 HBGE Cc1nc(-c2ncccn2)nc(O)c1CC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 1637260979 CTGLBRCHGDQJOR-GFCCVEGCSA-N 406.468 -0.018 50 10 HBGE CC(C)(C)OC(=O)N1CC(Oc2ncc(Br)cc2B(O)O)(C(N)=O)C1 2223647894 DVVGNOPJDJTEAB-UHFFFAOYSA-N 416.037 -0.623 50 10 HBGE Cc1cc(S(=O)(=O)N(C)CCOCCNC(=O)OC(C)(C)C)sc1B(O)O 2282735366 ZKKNQHQXMNZNIR-UHFFFAOYSA-N 422.334 -0.102 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1(C)C 2282736600 SVVYJPUFQUMXKC-QWRGUYRKSA-N 419.334 -0.066 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C 2283963498 LXDJEBFWLWRRRT-PWSUYJOCSA-N 400.310 -0.203 50 10 HBGE COc1cc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3COCCO3)CC2=O)cc(OC)c1OC 744646911 SMIZKLBRTNGWEJ-NHYWBVRUSA-N 423.422 -0.372 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)CN2CCCN(S(=O)(=O)C3CC3)CC2)c1 801978202 BXKITSZIFCHZHI-UHFFFAOYSA-N 405.480 -0.181 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccn3nnnc3c2)cc1 1160385510 GOFYBKCLOWKPKV-UHFFFAOYSA-N 403.424 -0.486 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCCc2ccc(F)cc2)n(C)c1=O 1566278832 TUDJWFPZORSPKR-UHFFFAOYSA-N 416.413 -0.257 50 10 HBGE CC(=O)N[C@H]1[C@H](OCCCl)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 2081158764 DRVVQXMTZMNEAU-IBEHDNSVSA-N 409.819 -0.102 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2255751112 VFIALOGLSOCUPA-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE Cc1cc(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)COC2)sc1B(O)O 2267377820 KVDWSRQPBSDNDQ-UHFFFAOYSA-N 406.291 -0.692 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272653165 LICJYEPEAMBUEX-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1CCC(OCCC(=O)N=c2nc(B(O)O)[nH]s2)CC1 2283945799 GDUWTATXVSGWNV-UHFFFAOYSA-N 400.266 -0.616 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N=c2nc(B(O)O)[nH]s2)[C@H](C(F)(F)F)C1 2283946225 KUOARQQPJMMTKY-RNFRBKRXSA-N 410.183 -0.376 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)c1cnsc1B(O)O)C(=O)O 2362570525 ZNRJZARCNMPKKV-SNVBAGLBSA-N 401.250 -0.299 50 10 HBGE O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)[C@H]1COCCO1 744641526 CZQCWOCRUMHISE-GFCCVEGCSA-N 421.269 -0.073 50 10 HBGE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 750661649 GJEWTDFZBWAEHT-ZLDLUXBVSA-N 423.495 -0.110 50 10 HBGE Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1 816872160 CMGLBMKXTBEPLX-CYBMUJFWSA-N 406.468 -0.335 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=O)COc2ccccc2O)[C@H]1c1ccnn1C 1443608479 JXPKQQZQEUQYJV-MSOLQXFVSA-N 417.422 -0.360 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3C[C@H](C)CO3)CC2)cc1 1545424397 YVXWQDXCPRLHDG-RDJZCZTQSA-N 424.523 -0.126 50 10 HBGE COC(=O)c1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)n(C)n1 1566975753 YEBUZULZTMBFOU-UHFFFAOYSA-N 409.262 -0.353 50 10 HBGE CCCn1nc(C(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)c2ccccc2c1=O 1628358404 YKAKBSSECCDSCI-UHFFFAOYSA-N 407.452 -0.541 50 10 HBGE CSCCNC(=S)NNC(=O)[C@@H](CC(N)=O)NC(=O)Cc1cccc(F)c1 1631879435 GKTQOYLGIYQKBP-GFCCVEGCSA-N 415.516 -0.413 50 10 HBGE CCOC(=O)CS[C@@H](CNC(=O)NNC(=O)[C@@H]1COCCO1)C(F)(F)F 1684893563 OMBRIJFAJXHUMF-IUCAKERBSA-N 403.379 -0.041 50 10 HBGE COC1(CNC(=O)c2nn(C)c(Cl)c2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282250301 VIDMTSQZHFHNSC-UHFFFAOYSA-N 402.644 -0.881 50 10 HBGE CC[C@]1(NC(=O)c2c(B(O)O)nnn2C)CCCN(C(=O)OCc2ccccc2)C1 2282267828 MVRXXIPYTGZNDY-IBGZPJMESA-N 415.259 -0.194 50 10 HBGE Cc1ccc(S(=O)(=O)NCCOCCNC(=O)OC(C)(C)C)c(B(O)O)c1 2282356927 CDNWXNYHKYIJCX-UHFFFAOYSA-N 402.278 -0.506 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNS(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282736620 TWZKRLMEJVQAKW-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1sccc1B(O)O 2283969464 QANXDZKJNAIEOT-GFCCVEGCSA-N 400.262 -0.157 50 10 HBGE COC1(CCNC(=O)c2c(B(O)O)ncn2C)CN(C(=O)OCc2ccccc2)C1 2362458479 ZUJQWXKRAFVDNF-UHFFFAOYSA-N 416.243 -0.743 50 10 HBGE CN(C)Cc1c(C(=O)NN=Cc2ccccc2[N+](=O)[O-])nnn1-c1nonc1N 254311816 YREZGLMATCWINQ-UHFFFAOYSA-N 400.359 -0.034 50 10 HBGE COc1cc(B(O)O)ccc1NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O 712395619 XWJORHFYTISECY-UHFFFAOYSA-N 404.209 -0.587 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 744648655 HLMPLYZJCKCKBI-OAHLLOKOSA-N 409.420 -0.066 50 10 HBGE COc1ccc([C@@H](CNC(=O)NNC(=O)[C@H]2COCCO2)N2CCOCC2)cc1 745289659 OPCKTDPLNFQPRU-IAGOWNOFSA-N 408.455 -0.186 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3ncnn23)CC1 1182815254 BDAXXZAECBPQCZ-UHFFFAOYSA-N 416.467 -0.183 50 10 HBGE Cn1cc(I)c(C(=O)NNC(=O)c2nc[nH]c3ncnc2-3)n1 1303433091 CAIOUCSWNOUWSC-UHFFFAOYSA-N 412.151 -0.283 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)c1 1313165545 BLPICFRPXKISLM-LJQANCHMSA-N 406.439 -0.360 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@@H]1C(=O)NNC(=O)c1cn(C)nn1 1470083331 IXZKLHWBOGKPLI-JZSSXWJLSA-N 414.344 -0.438 50 10 HBGE C[C@]1(NNC(=O)NCc2ccc(CN3C(=O)CNC3=O)cc2)CCS(=O)(=O)C1 1471136798 ZUGNCDAIKHRBGC-KRWDZBQOSA-N 409.468 -0.381 50 10 HBGE NS(=O)(=O)CCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1478892102 RWZQEAQVPMYTPD-UHFFFAOYSA-N 412.516 -0.792 50 10 HBGE CCO[C@@H](C)c1noc(CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)n1 1566170378 SRISPWKEYDVYAW-LBPRGKRZSA-N 406.223 -0.056 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 1642897416 OFWXKDXUBQETKQ-UHFFFAOYSA-N 414.397 -0.071 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NS(=O)(=O)c3sccc3B(O)O)[C@H]2C1 2267611887 WQQXCIDJFZNJKE-NHCYSSNCSA-N 402.303 -0.038 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)s1 2267611894 DAPDHEXAPCZZPB-SNVBAGLBSA-N 406.291 -0.011 50 10 HBGE Cn1ncc(CNS(=O)(=O)c2ccc(B(O)O)s2)c1NC(=O)OC(C)(C)C 2282081027 QHPVJFBYULKQEQ-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@@H](CO)C1 2282081468 CNQQMUFVAOJJLR-MNOVXSKESA-N 420.318 -0.676 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282423658 RJJSEPPZSBGDBD-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE O=S(=O)(c1ccc(B(O)O)s1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2282716153 QBGNFBUWSJYABM-CABCVRRESA-N 408.310 -0.298 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282851696 FYSFHBPHPJSNPP-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE C[C@H](NC(=O)[C@](C)(NC(=O)C(F)(F)F)C(F)(F)F)c1nscc1B(O)O 2284015807 RYPNRXRJVVOCTL-IGJIYHIXSA-N 407.101 0.000 50 10 HBGE O=C(O)[C@]1(NS(=O)(=O)c2cc(B(O)O)cs2)CCN(Cc2ccccc2)C1 2284403312 RPYNYSHELMOJJI-INIZCTEOSA-N 410.282 -0.565 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1cccc(B(O)O)n1 704381509 YSQKGFKIMMQOHP-UHFFFAOYSA-N 417.252 -0.175 50 10 HBGE Cn1c(=O)c2c(ncn2CCC(=O)NNc2ccc(S(C)(=O)=O)cc2)n(C)c1=O 748156935 RSASEMDDUNDIGD-UHFFFAOYSA-N 420.451 -0.629 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC(=O)N2C)cc1 758029776 NZCJWWQLVOPALU-PSOPSSQASA-N 412.468 -0.700 50 10 HBGE O=C(CN1CCN(CC(=O)N2CCOCC2)CC1)NNC(=O)c1cccc(Cl)c1 781045958 XSTMPENKYIGETI-UHFFFAOYSA-N 423.901 -0.423 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1116020757 VDDQDGPNJMMISU-OWCLPIDISA-N 422.507 -0.119 50 10 HBGE CC(=O)N[C@@](C)(C(=O)NNC(=O)[C@H]1COCCO1)c1ccc(S(C)(=O)=O)cc1 1294209190 SEDSUTGYOCWFAO-RHSMWYFYSA-N 413.452 -0.996 50 10 HBGE CNS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)CC1 1456016006 FMFGBMLOFLVYKP-GFCCVEGCSA-N 419.504 -0.681 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c1 1514758850 VDOZVGOCPQZHST-LBPRGKRZSA-N 403.482 -0.477 50 10 HBGE COc1ccc(Cn2nnc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1 1539402281 VXUZPQZNDPWGNE-ZDUSSCGKSA-N 407.452 -0.161 50 10 HBGE C[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1587661665 QSMUQRBBUWADFB-TUKIKUTGSA-N 411.422 -0.013 50 10 HBGE O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@H]1CCC(=O)N1 1623367673 AJGCFOYRGPYCCF-GFCCVEGCSA-N 422.239 -0.025 50 10 HBGE C[C@]1(c2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2)NC(=O)NC1=O 1646045869 VSVGFLMKOMFIEX-FOIQADDNSA-N 415.450 -0.245 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1nscc1B(O)O)OCc1ccccc1 2255739931 RLGHTPUYEXSDKR-ZIAGYGMSSA-N 405.241 -0.363 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@H](CNC(=O)OCc1ccccc1)C(F)(F)F 2266959812 USYGUCVYUCVJQS-SNVBAGLBSA-N 415.137 -0.918 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1B(O)O 2282372203 VKTQEHIGAVIFGS-QWRGUYRKSA-N 420.318 -0.697 50 10 HBGE CN(C)CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2282703808 BBJVCGBZEQLMGR-UHFFFAOYSA-N 421.350 -0.495 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2ccc(Cl)c(B(O)O)c2)C1 2282740131 UWXWWDVQKUJWPY-LBPRGKRZSA-N 414.598 -0.149 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C 2362351900 LIVJKWIOQUUODE-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE Cc1cn([C@H]2C[C@H](O)[C@@H](CNC(=O)CI)O2)c(=O)[nH]c1=O 6069508 NWGXFMGORNLEMS-QXFUBDJGSA-N 409.180 -0.955 50 10 HBGE CN1CC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1565385505 JXHNERMOIIOBIA-CQSZACIVSA-N 411.484 -0.644 50 10 HBGE Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)[C@H]3CCCCO3)cnc21 1595465010 SRWYVIGRFIYOBZ-MRVPVSSYSA-N 413.232 -0.391 50 10 HBGE C[C@H]1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C(=O)O1 1638100806 JXTGBEGFLQQKAL-AAEUAGOBSA-N 412.472 -0.652 50 10 HBGE CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)[C@@H]2CCC(=O)N2)CC1 1668881483 VPANTHURAWRABP-INIZCTEOSA-N 402.455 -0.218 50 10 HBGE C[C@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1cc(B(O)O)nn1C 2282076032 BWZISYKZZPCFBN-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccccc2B(O)O)[C@@H](F)C1 2282101879 IGAJPHJPSCSBKL-STQMWFEESA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](OCCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282698298 ATXSZKRULODYCH-GFCCVEGCSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369896655 DGXQOSZHOMDQAF-UWJYBYFXSA-N 420.680 -0.961 50 10 HBGE CCc1c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cnc2c1c(=O)n(C)c(=O)n2C 754277973 WJTZVPGCVSQAGV-NSHDSACASA-N 423.495 -0.700 50 10 HBGE O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)[C@H]1CCc2nncn2C1 816879663 SVYSBSDURRBYOA-RNODOKPDSA-N 423.433 -0.619 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccnnc1 1299497663 DVTSMTIIRXCFPM-UHFFFAOYSA-N 414.241 -0.021 50 10 HBGE CCN1C(=O)C[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@H]1c1cccc(C)c1 1306514104 LRKDOJPAXZQXNN-DUVNUKRYSA-N 410.496 -0.010 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1 1470661018 IJSFVSUYDCLHNH-UHFFFAOYSA-N 403.482 -0.287 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCN(S(=O)(=O)c2cc(B(O)O)cs2)CC1 2282707518 ZSXGYULOHXJHSW-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](O)C[C@@H](NC(=O)OC(C)(C)C)C1 2282729335 LRVCSPSTLVYSOG-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)Nc1cc(B(O)O)ccc1Cl 2284050520 ZXZPCKSZZVWNAH-YNEHKIRRSA-N 400.624 -0.701 50 10 HBGE CC(C)(C)OC(=O)N1C[C@]2(C(=O)N=c3nc(B(O)O)[nH]s3)CCC[C@]2(F)C1 2284057630 BRVPMMNNOVOBBZ-GJZGRUSLSA-N 400.241 -0.292 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)NNC(=O)[C@@H]3CCC(=O)N3)O2)C1 1565094658 KCZTYZNIWAMPQB-RYUDHWBXSA-N 411.459 -0.236 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1 1608486719 IYVBGRZHAAOFFI-CHWSQXEVSA-N 413.519 -0.557 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)c1 1628649844 UNKSRPROPLRMLN-VHDGCEQUSA-N 424.479 -0.618 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CN(S(=O)(=O)N3CC(Cl)C3)CCN2C1=O 2265388062 VUPMDVMIWQWKIS-VXGBXAGGSA-N 408.908 -0.036 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2267203550 RONZHCHQOFNLIP-QWRGUYRKSA-N 406.291 -0.660 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C 2282356451 VLUUVAHEADLTIM-JQWIXIFHSA-N 400.262 -0.434 50 10 HBGE CN([C@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)c1cc(B(O)O)nn1C 2282709871 GKSOZPYZMVKEDJ-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@H](CCNC(=O)OC(C)(C)C)C1 2282716428 ULSXGLLGBHZTAO-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282849609 DPOONAIVBGJWTI-VXGBXAGGSA-N 420.318 -0.518 50 10 HBGE Cc1cc(S(=O)(=O)N(CCNC(=O)OC(C)(C)C)C[C@@H](C)O)sc1B(O)O 2285301596 PEPRYCDKAXSAAG-LLVKDONJSA-N 422.334 -0.367 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 746022354 BIUZATIFJJWHLQ-ZFWWWQNUSA-N 413.452 -0.680 50 10 HBGE O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)N1CCOCC1 746846760 GFJILBWKLBHJHT-MRXNPFEDSA-N 401.423 -0.465 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2csc(C3CC3)n2)n(C)c1=O 765721550 CRPZBNDTZWHOTM-UHFFFAOYSA-N 403.424 -0.771 50 10 HBGE C=CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)s1 1135989922 CUNCRFSMAYGZAJ-JTQLQIEISA-N 421.522 -0.663 50 10 HBGE Cc1ccc(S(=O)(=O)CCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 1464444051 MIRMTHLUDLMEOM-LBPRGKRZSA-N 403.482 -0.324 50 10 HBGE COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CN3CCCC3=O)CC2=O)c1 1632321260 UBVMVAMZJGRTQB-GFCCVEGCSA-N 404.423 -0.174 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CN1C(=O)COc2cc(Br)ccc21 1647996732 DGMDNAKRZWRBBE-UHFFFAOYSA-N 420.241 -0.634 50 10 HBGE COC(=O)C1CC2(C1)C[C@H](NC(=O)NNC(=O)[C@H]1CCCCO1)CCS2(=O)=O 1685597533 HNHRPPNQWTXPCO-SBUZTJRASA-N 417.484 -0.215 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(NS(=O)(=O)c3ccc(B(O)O)s3)CO[C@H]1C2 2282082790 LDZVKHSVFJJBKT-YHAQOWFVSA-N 418.302 -0.469 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)S(=O)(=O)c1cccc(B(O)O)c1 2282720267 XSKQSJGFTOOHBK-UHFFFAOYSA-N 402.278 -0.736 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NCC2(O)CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2282740114 URIPDNHHVIEVQL-UHFFFAOYSA-N 420.318 -0.695 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CP(C)(C)=O)C(=O)NCc1ncc(B(O)O)s1 2335466638 PYGHKTBABPVHNC-VIFPVBQESA-N 405.222 -0.045 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)c(OC)c1 1264957015 FYJJRYKEJPVDNJ-UHFFFAOYSA-N 408.436 -0.017 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@@H](NC(=O)c3cc(B(O)O)ccc3F)CC2=O)C1 1304620580 BSALJJBRQBTPAD-LBPRGKRZSA-N 421.234 -0.545 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)N1 1623368575 QYLSQKPWQAPIEW-BXUZGUMPSA-N 400.391 -0.499 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)CC2=O)cn1 1645964138 YBENEAKMXBAIRS-DGCLKSJQSA-N 406.443 -0.070 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CNS(=O)(=O)c1sccc1B(O)O 2267209373 WDZXRGMILVOLHH-NHCYSSNCSA-N 402.303 -0.038 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@H]3[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)sc1B(O)O 2267391107 NRRRCHXQYLEADH-IAZYJMLFSA-N 402.303 -0.120 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 2267472608 SPJSRPZCMNTUHK-CQSZACIVSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267717213 ZEMSRHWDIILWGQ-NHYWBVRUSA-N 402.303 -0.143 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282378018 ZOOUVKPHDNHTGI-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC1CCC(NC(=O)OC(C)(C)C)CC1 2282705869 DIXHJURHRCIUGS-UHFFFAOYSA-N 402.282 -0.786 50 10 HBGE CCON(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccccc1B(O)O 2282852362 OECXCZALANQRFN-UHFFFAOYSA-N 402.278 -0.026 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369896652 DGXQOSZHOMDQAF-GGZOMVNGSA-N 420.680 -0.961 50 10 HBGE Cn1cc(C[C@@H](O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1 786690449 UXPNNYFVCYKILQ-MRXNPFEDSA-N 421.479 -0.431 50 10 HBGE C[C@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCC(=O)NC1 798980184 GQCCEWXULKFPRH-FQEVSTJZSA-N 401.467 -0.492 50 10 HBGE COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)c2ccc(B(O)O)cc2)cc1 1297640763 JWBRGMQSXAZPAT-ZDUSSCGKSA-N 414.223 -0.073 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2cc(Br)cn2C)C1=O 1352560313 LTQMQEQISOFYLD-SNVBAGLBSA-N 415.244 -0.040 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2=O)cc1OC 1530230578 IWDIEBVTADPDHL-KBPBESRZSA-N 418.450 -0.479 50 10 HBGE CN1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)NC1=O 1538393612 YUTNRMAXSJVMIK-CQSZACIVSA-N 409.468 -0.354 50 10 HBGE Cn1ncc(I)c1C(=O)NNC(=O)c1ccc(=O)n(C)c1 1618154121 SMHSQONFLOVDPO-UHFFFAOYSA-N 401.164 -0.202 50 10 HBGE Cn1nc(C(=O)NNC(=O)NCCN2CCC3(C2)OCCO3)c2ccccc2c1=O 1684273934 KXUAAWPAKJCMIF-UHFFFAOYSA-N 416.438 -0.674 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)CC1 2282082768 KZQIOBREOAIDMI-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](CNS(=O)(=O)c2cscc2B(O)O)CO1 2282364819 YNQBLZBIMNLPCV-WDEREUQCSA-N 420.318 -0.364 50 10 HBGE COC1(CCNC(=O)OC(C)(C)C)CN(S(=O)(=O)c2cscc2B(O)O)C1 2282369201 CILMGEVNZKWXAN-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE C=C(CS(=O)(=O)N1CCC2(CC1)CN(C(=O)OC(C)(C)C)CCO2)B(O)O 2282381763 WJUABXSESVIXAV-UHFFFAOYSA-N 404.294 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2Cl)[C@H](O)C1 2282740864 GRZBYFMRZSVYBW-NWDGAFQWSA-N 420.680 -0.722 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(B(O)O)n1C 2282865768 YPWNXEJUTJTSIR-ONGXEEELSA-N 402.282 -0.915 50 10 HBGE O=C(O)C[C@H](COCc1ccccc1)NS(=O)(=O)Cc1ccsc1B(O)O 2284412036 RJCYXDDJGFPLDX-CQSZACIVSA-N 413.282 -0.093 50 10 HBGE CC(=O)c1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(F)c1 777418697 BKEWINWVNPSOIJ-UHFFFAOYSA-N 416.369 -0.763 50 10 HBGE CN(CCNC(=O)NNC(=O)c1cnsn1)S(=O)(=O)c1ccc(F)cc1 1227261902 KTDJMJPFRTYDEN-UHFFFAOYSA-N 402.433 -0.058 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@H]1CCC(=O)N1)C1=NS(=O)(=O)c2ccccc21 1587113662 HQQDKTXJTGHOBY-GFCCVEGCSA-N 407.452 -0.727 50 10 HBGE O=C(Cn1nc(Br)c(Br)n1)NNC(=O)[C@@H]1COCCO1 1630358244 MZTFDEFGCYGBCS-YFKPBYRVSA-N 413.026 -0.634 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NCCSS(C)(=O)=O 1643367458 OCBZPKMFZMVWTQ-UHFFFAOYSA-N 411.527 -0.531 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(CS(=O)(=O)N(C)C)cc1 1684015346 VWIJFVRILHSOIH-CYBMUJFWSA-N 416.500 -0.040 50 10 HBGE Cn1cc(C(=O)NCC2(F)CCN(C(=O)OCc3ccccc3)CC2)c(B(O)O)n1 2281902065 DGALZNAWMFEEDJ-UHFFFAOYSA-N 418.234 -0.029 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282327243 FDRRIHYJGOKUTL-WPRPVWTQSA-N 414.236 -0.353 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ccc(B(O)O)cc2)CCO1 2282375226 MHMAWFIUFZNHNQ-CQSZACIVSA-N 400.262 -0.273 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1 2282719138 HWKDKLCNCCOPPI-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2F)C1 2282721858 YGGMLKQMRYNLPZ-LBPRGKRZSA-N 400.237 -0.041 50 10 HBGE CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)ccc1OC 2282724246 LPJDLPYRBBTSJI-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE CC(C)(C)OC(=O)NC1[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)c(F)c3)C[C@@H]12 2282730928 JRKDCMMNOQQORA-GHMZBOCLSA-N 400.237 -0.351 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCN1C(=O)CCc2cc(F)ccc21 1306513767 CZNCCYXIRQCDAK-JTQLQIEISA-N 400.432 -0.420 50 10 HBGE O=C(Cc1csc([C@H]2CCS(=O)(=O)C2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1539401510 GOTMWRPXDLOSSC-ZJUUUORDSA-N 421.522 -0.830 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)CC1 1556362291 XVVABDANTTZOJE-UHFFFAOYSA-N 411.484 -0.691 50 10 HBGE CC(C)N1C(=O)CC[C@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1558940138 GSUJJTMVFMYCCO-AWEZNQCLSA-N 424.527 -0.140 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2267628149 ILCWPJQQYLCMPP-DOFRTFSJSA-N 403.291 -0.892 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1nscc1B(O)O)C(=O)O 2289794887 AMJAMGYHEUXBPH-JTQLQIEISA-N 401.250 -0.299 50 10 HBGE COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)[C@H]2COCCO2)C1=O 746781556 RYKIRFLTHFZCGN-GHMZBOCLSA-N 412.424 -0.614 50 10 HBGE COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cnn(C)c2)C1=O 771268880 PQGOOTBYMAHBAV-IBGZPJMESA-N 414.422 -0.035 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc(F)c1F 793452476 ZOUCYUDWULTUIR-MRVPVSSYSA-N 415.378 -0.085 50 10 HBGE COCC#CC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1465789991 DDUVAYHUJFNZAK-UHFFFAOYSA-N 408.480 -0.901 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCc2nnc(O)n2C1 1623945575 LAODTOYNHGYUSL-HNNXBMFYSA-N 413.482 -0.094 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)CC1=O 1652302524 ZHHPTBOOEKQKLP-NXHRZFHOSA-N 421.542 -0.280 50 10 HBGE O=C(NC[C@H]1CCCS(=O)(=O)C1)NNC(=O)c1csc(N2CCOCC2)n1 1683029746 MUSNXGPZQGMVHJ-LLVKDONJSA-N 417.513 -0.252 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(F)(F)F 2267322770 IFBBUVSRRZEPKE-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1ccc(B(O)O)s1 2267613154 UJKKEEIKFJHAMB-MXWKQRLJSA-N 402.303 -0.038 50 10 HBGE CN([C@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1cncc(B(O)O)c1 2267616243 PZJNYNNUFKHOMB-IRXDYDNUSA-N 419.268 -0.161 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)c2cscc2B(O)O)C1 2267622233 OCKVNFHODQDDNU-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1ncc(B(O)O)cc1F 2268362854 JRTINDYLYKMMBP-UHFFFAOYSA-N 421.215 -0.281 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282067290 YBYWUEHWAKKRKN-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE Cn1nc(C(=O)NC[C@@H]2COCCN2C(=O)OC(C)(C)C)c(B(O)O)c1Cl 2282246852 XPCCZEWLIOJBQG-SECBINFHSA-N 402.644 -0.881 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)n1 2282377229 OITGDUZRRDCUFE-PWSUYJOCSA-N 402.282 -0.928 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282711402 BUWVSRTZULNGKJ-NSHDSACASA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CF)(NS(=O)(=O)c2ccccc2B(O)O)C1 2282713186 AXFZYTJMIKKPDU-INIZCTEOSA-N 402.253 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282741801 SSYVRCDGDJUCQK-QWRGUYRKSA-N 400.237 -0.112 50 10 HBGE O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)[C@@H]1COCCO1 745999477 YRCZLTFIGRJVDQ-HNNXBMFYSA-N 412.468 -0.710 50 10 HBGE CCc1c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cnc2c1c(=O)n(C)c(=O)n2C 754277969 WJTZVPGCVSQAGV-LLVKDONJSA-N 423.495 -0.700 50 10 HBGE COc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1 1135524299 WYKIFNMSQKXQOW-UHFFFAOYSA-N 404.253 -0.478 50 10 HBGE Cn1nc(C(=O)NNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)c2ccccc2c1=O 1290067905 WASRXMHOIYRCGD-CJNGLKHVSA-N 415.450 -0.426 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NN(C)C[C@H](C)O)o1 1450939075 CTOFRRJJNGHRAY-NWDGAFQWSA-N 403.457 -0.047 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@]2(C)CCc3ccccc32)n(C)c1=O 1629793536 VLHIXCDTNLAXLP-FQEVSTJZSA-N 410.434 -0.515 50 10 HBGE Cc1cnc2nc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)nn2c1 1635505288 RAJPCCJTIBTZQY-UHFFFAOYSA-N 422.449 -0.348 50 10 HBGE CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)NCCN3CCOCC3)ccc21 1857990834 ALUCTNUVQZNOES-UHFFFAOYSA-N 411.484 -0.580 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1cscc1B(O)O)NC(=O)OC(C)(C)C 2267392054 VJIAQVROEJINNC-JTQLQIEISA-N 408.307 -0.364 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCC=CCNC(=O)OC(C)(C)C 2282361961 YXQHJMKEISZIDP-UHFFFAOYSA-N 400.262 -0.266 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282363202 MSESTKUMCQWHJO-LLVKDONJSA-N 420.318 -0.410 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(S(=O)(=O)c3ccc(B(O)O)c(F)c3)C[C@@H]21 2282366143 JRKDCMMNOQQORA-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282377419 QJGRZDFJGXDPEU-NSHDSACASA-N 419.334 -0.016 50 10 HBGE O=C(N1CCC[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1)C(F)(F)F 2282380968 QBZFOBHLKHSFCA-QMMMGPOBSA-N 415.224 -0.957 50 10 HBGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)C(=O)c1csnc1B(O)O 2282459314 UTNKVIUPEKUJOC-UHFFFAOYSA-N 400.310 -0.259 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H]1CS(N)(=O)=O 733998419 VHJJSBXJOKMEQH-NSHDSACASA-N 404.876 -0.138 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)Nc1cnn(CC(=O)N2CCOCC2)c1 756836063 SCLJKYVSBRNTFK-INIZCTEOSA-N 414.422 -0.102 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)[C@H]1COCCO1 815736220 REEDQIVDDVUEIJ-FOIQADDNSA-N 416.434 -0.062 50 10 HBGE O=C(NNC(=O)c1cccc(Cl)n1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 1147396969 WCBCQPITZRVQNW-SECBINFHSA-N 413.843 -0.339 50 10 HBGE Cn1cc(C(=O)NNC(=O)N2CCOCC2)c(CN2C(=O)c3ccccc3C2=O)n1 1442475069 NMJBXOMJTVICIW-UHFFFAOYSA-N 412.406 -0.097 50 10 HBGE O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)[C@@H]1CCN1C1CCOCC1 1471976594 PEWUOLPLTDCJNM-AWEZNQCLSA-N 414.459 -0.495 50 10 HBGE NC(=O)C1CCN(Cc2ccc(CNC(=O)NNC(=O)[C@H]3COCCO3)cc2)CC1 1478822110 UTRDZENTILYRSF-QGZVFWFLSA-N 419.482 -0.370 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)C(F)F)c1)N[C@H]1CCS(=O)(=O)C1 1542285355 LSTJLOWOWUOVMB-VIFPVBQESA-N 411.408 -0.186 50 10 HBGE CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1596923729 SNCQWMVFHQVRPZ-KRWDZBQOSA-N 424.523 -0.120 50 10 HBGE NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2COCCO2)c1 1630358785 XBYJWZYZWVRXLH-SNVBAGLBSA-N 408.230 -0.727 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1Cl 1634355684 POOLKXDQDOKPGS-UHFFFAOYSA-N 413.861 -0.673 50 10 HBGE Cn1cc([C@H]2[C@H](C(=O)NNC(=O)CN3CCCC3=O)CC(=O)N2C(C)(C)C)cn1 1648934543 ALUYUKCSPIOQQV-DYVFJYSZSA-N 404.471 -0.122 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1sncc1B(O)O 2255784396 DOYIBVOFEBGGPG-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267608616 XFWSGYYNKYWJPC-MWLCHTKSSA-N 406.291 -0.754 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)Cc1ccsc1B(O)O 2267711309 JLVQMPZRQNAXOL-CQSZACIVSA-N 408.307 -0.877 50 10 HBGE C=C(CS(=O)(=O)N1CCO[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)B(O)O 2282362946 KJPMNBIGDFGIKV-MRXNPFEDSA-N 404.294 -0.014 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)cc1B(O)O 2282382266 IXYJFUVNGXNIOK-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)c1c(B(O)O)cnn1C 2282705558 ZPDKCKDEZVQQGC-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1CNS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282723575 GJPNVTAACVIMQY-JTQLQIEISA-N 406.216 -0.068 50 10 HBGE O=C(C=Cc1cccs1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 2297563066 CKXZRVZGZAZWSZ-UHFFFAOYSA-N 422.496 -0.694 50 10 HBGE CCc1nc2ccccc2n1CC(=O)NNC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 810468224 FVXCPRWIVYAQDO-KTKRTIGZSA-N 410.434 -0.143 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)n1 856546381 MIKZUFLGWIYILO-LSDHHAIUSA-N 416.507 -0.008 50 10 HBGE CCN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1 1160954099 GKLPRCQXFMBJQO-MAUKXSAKSA-N 410.434 -0.037 50 10 HBGE CC[C@H](NC(C)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1182148737 DWHJGBJJVGBBEB-HNNXBMFYSA-N 412.468 -0.617 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC(=O)NCCN2C(=O)c2cc(B(O)O)ccc2F)C1 1301716989 JJOQFCYENMMZLR-UHFFFAOYSA-N 421.234 -0.543 50 10 HBGE CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)[C@@H]1COCCO1 1354837545 XZSXEBYIZJFQRE-AAEUAGOBSA-N 400.457 -0.458 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)nn1 1531950011 JDQWAGCEAFFMLD-MRXNPFEDSA-N 423.792 -0.164 50 10 HBGE CN1CCN(C)CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 1628159774 NEEOGIRWHRKSND-UHFFFAOYSA-N 423.539 -0.275 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(B(O)O)ccc2F)C1 1635244301 CMYDLOWPAIODNS-LLVKDONJSA-N 409.223 -0.086 50 10 HBGE O=C(CCN1CCCS1(=O)=O)N1CCN(S(=O)(=O)CBr)CC1 1637456041 LNZRBVBIMQFDTO-UHFFFAOYSA-N 418.335 -0.762 50 10 HBGE Cc1nc(S(=O)(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282352349 NMKGFBFLQHYMNC-SNVBAGLBSA-N 404.298 -0.668 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2282353714 XLMWOOCBZLTNOT-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@@H](CNC(=O)C(F)(F)F)C2)sc1B(O)O 2282362782 JQCLXLNYFWAVMO-VIFPVBQESA-N 414.236 -0.184 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCC2CC(NC(=O)OC(C)(C)C)C2)n1 2282370827 BBJUEQUKFDCDAX-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N[C@H]1CCON(C(=O)OC(C)(C)C)C1 2282731427 QIRNLBZZUFTPQY-ZDUSSCGKSA-N 400.262 -0.106 50 10 HBGE COc1ccc([C@H](CNC(=O)NNC(=O)[C@H]2COCCO2)N2CCOCC2)cc1 745289658 OPCKTDPLNFQPRU-DLBZAZTESA-N 408.455 -0.186 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cccc(S(=O)(=O)NCc2ccco2)c1 746022443 IXGSLUPXSZZZNC-HNNXBMFYSA-N 409.420 -0.066 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)NNC(=O)[C@H]1COCCO1 776056983 RGRNQTLYTKXEEW-GVDBMIGSSA-N 417.466 -0.669 50 10 HBGE C=CC[C@@H](C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 778997429 CPICEBYYELBSDA-CQSZACIVSA-N 410.434 -0.059 50 10 HBGE COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)c2ccc(B(O)O)cc2)cc1 1595815432 SUMVYCRDLCXABU-UHFFFAOYSA-N 405.237 -0.616 50 10 HBGE CCOC(=O)C[C@@H](O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1634402853 FKTUYPCSSXFTOV-CYBMUJFWSA-N 401.441 -0.535 50 10 HBGE O=C(NNc1cc(Br)ncn1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 1644110881 SUSGRRDFURHRQL-RKDXNWHRSA-N 418.273 -0.282 50 10 HBGE COC1(CCNS(=O)(=O)c2sccc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282071275 PEOHWDKWQSWKIQ-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1C[C@@H](CNS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 2282372611 ZFERHTPEYJCRGT-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CN(C)CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 2282701377 WZNAARVYABXZHN-UHFFFAOYSA-N 421.350 -0.495 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncc(B(O)O)s1)[C@@H](O)C(C)(C)C 2284063381 QLEXHKCNHAWOJM-VXGBXAGGSA-N 401.294 -0.261 50 10 HBGE Cc1cc(CNC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)sc1B(O)O 2360534145 WZYSJXGLKFMWKJ-NSHDSACASA-N 420.318 -0.710 50 10 HBGE O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)c1cnn[nH]1 729457165 AKFZDQPNUCWJTQ-UHFFFAOYSA-N 402.230 -0.057 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@H]1COCCO1)N1C(=O)c2ccccc2C1=O 744649077 RSOSIWIXWDBVLB-ZIAGYGMSSA-N 407.448 -0.033 50 10 HBGE COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN(C)C)ccc1Br 764204574 VQRKLJIMPSZSRF-UHFFFAOYSA-N 401.217 -0.117 50 10 HBGE O=C(C[C@@H]1NC(=O)NC1=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1 764752795 OPVQARBQHWTJMO-AWEZNQCLSA-N 422.873 -0.797 50 10 HBGE O=C(NNC(=O)C12CCC(C(=O)NNC(=O)[C@H]3CCCO3)(CC1)CC2)[C@H]1CCCO1 817215701 NWOODZHFSXQVIN-RCRDTURJSA-N 422.482 -0.020 50 10 HBGE C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CS(C)(=O)=O 1454276611 BKCGOUULSWLEJH-LURJTMIESA-N 412.287 -0.179 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 1470661043 JPRAIGARSBSMGL-UHFFFAOYSA-N 403.482 -0.721 50 10 HBGE CCC(=O)NNC(=O)[C@@H](C)N1CCC(NS(=O)(=O)NCC(F)(F)F)CC1 1473401228 RIUHSEBHYDSNDR-SECBINFHSA-N 403.427 -0.617 50 10 HBGE CCCn1nc(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)c2ccccc2c1=O 1586950605 NKQGZFJBRBYIFW-UHFFFAOYSA-N 422.463 -0.371 50 10 HBGE CN(CC(=O)NNC(=O)c1ccccc1Cl)Cc1nnc2c(=O)n(C)ccn12 1644469441 AAKQOCTUTFORTC-UHFFFAOYSA-N 403.830 -0.026 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N(C)[C@@H]1CC[C@H]1NC(=O)OCc1ccccc1 2267425222 NCLLTFCIYLXZAI-HUUCEWRRSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccccc1B(O)O 2267621887 XRPMDQBJYWBCFZ-VWLOTQADSA-N 406.291 -0.322 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2282068458 DEOHGUUMNPPQRU-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C[C@@H](F)C1 2282336696 AYGBZFIRLLEKNR-ZJUUUORDSA-N 423.297 -0.410 50 10 HBGE CON(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282355489 HCIHJPRMNLYLIQ-UHFFFAOYSA-N 410.204 -0.279 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)c1ccc(B(O)O)cc1F 2282724700 OVAPGWDNEJJSJI-UHFFFAOYSA-N 404.225 -0.322 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282728029 NUFOGPLNJTVDCN-TXEJJXNPSA-N 400.237 -0.112 50 10 HBGE CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1cscc1B(O)O 2282734662 OOWAMJPNMCBEMV-KRWDZBQOSA-N 410.326 -0.315 50 10 HBGE Cc1cc(S(=O)(=O)Nc2n[nH]c(CNC(=O)OC(C)(C)C)n2)sc1B(O)O 2282738729 YRSJEMWIOQSDID-UHFFFAOYSA-N 417.278 -0.320 50 10 HBGE C[C@@H](OC(C)(C)C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N=c1nc(B(O)O)[nH]s1 2284060542 OPJDJFBVNDBPAN-RKDXNWHRSA-N 402.282 -0.325 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H](O)C1CCOCC1 766649733 JPGYPDMSYLJSMQ-GOSISDBHSA-N 404.467 -0.621 50 10 HBGE Cn1cc(C(=O)NNC(=O)COc2ccccc2Br)c(=O)n(C)c1=O 1462495704 XVPNVKNRUWVMNW-UHFFFAOYSA-N 411.212 -0.314 50 10 HBGE O=C(CN1Cc2c(cnn2-c2ccccc2)C1=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1463792958 RAZABBURZBLBAO-GFCCVEGCSA-N 417.447 -0.590 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1 1565219853 KBESYAQWHHJMMY-OAHLLOKOSA-N 404.514 -0.482 50 10 HBGE CN1C(=O)CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1641081107 KJDNWGZVLHZZTR-OAHLLOKOSA-N 424.479 -0.521 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccncc3)CCO2)ccc1=O 1684349366 FCAFWTWHWKUZIK-MRXNPFEDSA-N 400.439 -0.375 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282336655 APMGLHQHMWGUKV-UHFFFAOYSA-N 406.241 -0.675 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2282355437 GLZFGDVAGROWDO-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE C[C@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1nn(C)cc1B(O)O 2282373083 IAQQSXMHKDEZKI-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282719317 KESPKPMEYIDLKI-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@H](NC(=O)C(F)(F)F)[C@@H](C)C2)sc1B(O)O 2282738639 XPUWYCHLMBYVQW-IUCAKERBSA-N 414.236 -0.186 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@@H](C)N1C(=O)OC(C)(C)C 2282741202 KSQHLUKNTMAOAM-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H]1CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282859045 HGJDAZPWPXTFSV-LLVKDONJSA-N 400.237 -0.041 50 10 HBGE C[C@@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cscc1B(O)O 2284043007 WYCPPLFWNCEZDF-BXKDBHETSA-N 402.253 -0.075 50 10 HBGE Cn1nc(C(=O)N2C[C@@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)c(B(O)O)c1Cl 2334266753 RYELMUZWADKRHG-SGMGOOAPSA-N 418.646 -0.107 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Cc3ccon3)CC2)cc1 766635909 IPJUUYBAFOQQJK-UHFFFAOYSA-N 421.479 -0.321 50 10 HBGE Cc1nc(-c2ccn(C)n2)sc1CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1292038452 GFXVMVICZPICLX-JTQLQIEISA-N 412.497 -0.088 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 1540362978 DKJFHCNSTNUJQB-CQSZACIVSA-N 406.439 -0.217 50 10 HBGE O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1625003416 IUVSLDRLMDHSAT-ZANVPECISA-N 411.461 -0.495 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2cccn3c(I)cnc23)N1 1642269814 BZKIQOOJXOWZHC-QMMMGPOBSA-N 413.175 -0.022 50 10 HBGE Cc1nn(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(=O)n1C 1649390215 NQUQZOFWFFRZPR-UHFFFAOYSA-N 422.467 -0.864 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282383108 UVBJBBINXXRNBG-JGFSIVIASA-N 400.266 -0.273 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@H]1CCOC[C@@H]1OCc1ccccc1 2282384447 MTEZZSDYKLNMPG-ZFWWWQNUSA-N 412.298 -0.383 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282415074 BNAVKQKPHSJQIM-MEBBXXQBSA-N 417.318 -0.358 50 10 HBGE CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cncc(B(O)O)c1 2282708932 UECXBXLHGGOCRE-MRXNPFEDSA-N 401.294 -0.021 50 10 HBGE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713935 LJSIKLMNIAWESR-OPQQBVKSSA-N 420.318 -0.223 50 10 HBGE CO[C@](C)(CNS(=O)(=O)Cc1ncsc1B(O)O)COCc1ccccc1 2282737420 FECLAFKTRATIAM-MRXNPFEDSA-N 414.314 -0.136 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)cc2F)[C@H]2C[C@@H]21 2282739110 DHCIOZMUUCHFHE-STQMWFEESA-N 400.237 -0.112 50 10 HBGE CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1596922852 FQMIJBAQSQIWTL-MRXNPFEDSA-N 410.496 -0.462 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(F)cc2)C[C@H](C)O1 1608487196 REWQPDXAZSZPFO-STQMWFEESA-N 416.475 -0.249 50 10 HBGE Cc1ccc(OCC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1C 1683459654 FZRBONOQIKCTIJ-IBGZPJMESA-N 406.439 -0.360 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C)c(B(O)O)c1 2282354217 NRNKDEPUFKVLAP-LBPRGKRZSA-N 402.278 -0.819 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282704170 HFAYZSLBDVQGLD-KGLIPLIRSA-N 400.262 -0.985 50 10 HBGE CC[C@@]1(NS(=O)(=O)c2cc(B(O)O)nn2C)CCN(C(=O)OC(C)(C)C)C1 2282707789 CYIRDJJNHIFMOP-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)n1C 2337404848 JDZGAQBTBIFKLL-HUUCEWRRSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1ccc(Cl)cc1B(O)O 2359390699 OWRPLJVVUGBRJS-JHJVBQTASA-N 400.624 -0.701 50 10 HBGE NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)[C@H]3COCCO3)c2)C1 745809986 VXBHBJXMFOGCCL-DLBZAZTESA-N 419.482 -0.370 50 10 HBGE CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1OC 795326627 PIIHJBBGKWLAKQ-JTQLQIEISA-N 407.832 -0.567 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)[C@@H]3COCCO3)C2)cc1 915052346 QDUPQXREOYETAR-ZBFHGGJFSA-N 411.480 -0.041 50 10 HBGE CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 921056772 XEXRXAKDEFBQIE-CYBMUJFWSA-N 400.482 -0.381 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1cccnc1 1141727546 MIYSENVISLRCQV-UHFFFAOYSA-N 413.481 -0.247 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C 1147663485 XGOFFFQFVPMXEI-UHFFFAOYSA-N 423.536 -0.043 50 10 HBGE O=C1CC[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CN1 1160403724 QBOJKSAHFGHVFG-CYBMUJFWSA-N 424.479 -0.615 50 10 HBGE COc1cc(Cl)ccc1C(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1313099878 WCICDKFTLFAVPO-UHFFFAOYSA-N 405.864 -0.217 50 10 HBGE CS(=O)(=O)NC[C@@H]1COCCN1CC(=O)NNC(=O)c1ccccc1Cl 1473691806 XHNLXRXNEDPSFL-LLVKDONJSA-N 404.876 -0.649 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)c1 1540291365 SWWBNTJICCDCOM-HBMTUGDUSA-N 406.464 -0.387 50 10 HBGE CN1CC[C@](C)(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1629793100 LSYREGQDBIFWMA-HXUWFJFHSA-N 401.467 -0.540 50 10 HBGE COc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnn1C 1638390110 NCVRLYHZGCBQDZ-UHFFFAOYSA-N 409.472 -0.483 50 10 HBGE NC(=O)C[C@H](NC(=O)Cc1cccc(F)c1)C(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 1640905694 MOSUGBQCPIIYNR-CBBWQLFWSA-N 406.414 -0.557 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1674898206 WSEUOISORIUIJJ-UHFFFAOYSA-N 417.513 -0.392 50 10 HBGE COCCN(CCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2282355236 CMFNGXZTSVHTGE-UHFFFAOYSA-N 423.322 -0.874 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1sccc1S(=O)(=O)N1CCSCC1 744647600 MALOTYANYNWICB-JTQLQIEISA-N 421.522 -0.338 50 10 HBGE CCn1nc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c2ccccc21 769792313 HKVJGAPQTQFCEW-UHFFFAOYSA-N 408.422 -0.046 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)cn1 776055582 WGSFZVWTCQXMPR-DLBZAZTESA-N 411.466 -0.037 50 10 HBGE O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)[C@H]1COCCO1 814211690 MKURVIBLSZKEKD-CQSZACIVSA-N 411.436 -0.571 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)NNC(=O)N2CCOCC2)C1 1136453238 YVYXQVRVZIRAOP-GFCCVEGCSA-N 420.488 -0.516 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cn(C)nn2)cc1S(=O)(=O)N1CCCC1 1437641232 VOVJDELXZBWAQI-UHFFFAOYSA-N 408.440 -0.317 50 10 HBGE Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNC(=O)C(C)(C)O 1616527858 YCMZKEYYFIETFC-UHFFFAOYSA-N 400.501 -0.243 50 10 HBGE C[C@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1cccc(B(O)O)n1 2108229311 SURZMIHDRIWOBX-KRWDZBQOSA-N 421.215 -0.473 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)[C@@H]2C[C@@H]21 2267365824 WENVUNLLKCKQMT-NWDGAFQWSA-N 402.303 -0.049 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2c(Cl)cccc2B(O)O)CO1 2267386158 QUKSPBXBWVAQLY-SECBINFHSA-N 406.653 -0.151 50 10 HBGE CN(C(=O)OC(C)(C)C)C(C)(C)CNS(=O)(=O)Cc1ncsc1B(O)O 2267714321 WQWSZMFYMABRLE-UHFFFAOYSA-N 407.323 -0.112 50 10 HBGE COc1ccc(S(=O)(=O)NCCCN(C)C(=O)OC(C)(C)C)cc1B(O)O 2282367038 WVZSTWGVYCSVGP-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE CCc1nn(C)c(C(=O)N=[S@@](C)(=O)CCNC(=O)OC(C)(C)C)c1B(O)O 2282393385 KCQPWCTVEBQMBL-MHZLTWQESA-N 402.282 -0.575 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2sccc2B(O)O)[C@@H](CO)C1 2282708742 QRCUQWKDOWUXFU-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2(CCc3ccccc3)CC2)n(C)c1=O 1149621550 BWUCJANOBQOOHR-UHFFFAOYSA-N 424.461 -0.006 50 10 HBGE Cn1nccc1CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 1198730891 AFNYGNGGWMHUAU-UHFFFAOYSA-N 401.427 -0.093 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1 1351126605 QRJMHWYJDCWLLU-MRVPVSSYSA-N 412.204 -0.438 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1558926940 BVCRSGLEBCXKIA-HBNTYKKESA-N 410.468 -0.333 50 10 HBGE Cc1cccc(Cl)c1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1630996603 NKGGZYRGYAUMSU-UHFFFAOYSA-N 404.814 -0.143 50 10 HBGE CNC(=O)NC[C@@H]1COCCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1 1644263696 ZECKUADJRZUQJQ-CYBMUJFWSA-N 409.443 -0.905 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2ncsc2B(O)O)C1 2267313863 QYMKCBUZXXRVFB-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@@H](O)CNC(=O)OC(C)(C)C)c1B(O)O 2267412418 MQJWBVNAKDUZHM-JTQLQIEISA-N 408.307 -0.791 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@@]2(C)CCCN(C(=O)OCc3ccccc3)C2)n1 2267448231 VPZCRIQPLSNHDM-SFHVURJKSA-N 401.232 -0.584 50 10 HBGE CCC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ncsc1B(O)O 2267626958 QRYBHYICCGZWHM-SNVBAGLBSA-N 407.323 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282702163 DOMOCVICCRYDKI-NSHDSACASA-N 420.318 -0.410 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](C)[C@H]1NC(=O)C(F)(F)F 2282725221 YCKGVAUASTXSQA-XLDPMVHQSA-N 414.236 -0.106 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](CNS(=O)(=O)Cc3ncsc3B(O)O)[C@@H]2C1 2282735897 HUCXGHIWKRZAAR-JGPRNRPPSA-N 417.318 -0.645 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CNS(=O)(=O)c1cncc(B(O)O)c1)C(C)(C)C 2362080462 LKZWPKKRTUFUKL-ZDUSSCGKSA-N 401.294 -0.021 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2369893256 WARTXVYXPYOBRV-SECBINFHSA-N 419.696 -0.144 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1Cc2cccc(B(O)O)c2C1 713204634 KWUUVKHCTKQFFI-UHFFFAOYSA-N 400.221 -0.692 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)CN1CCOCC1=O 790890166 FZIJPHAKOJVLIO-UHFFFAOYSA-N 423.901 -0.536 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 1152015002 IEQAQHKVUGRBDT-KBPBESRZSA-N 408.455 -0.262 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC2=O)cn1 1264889806 VQSMLSZNNYSMCF-NSHDSACASA-N 404.452 -0.198 50 10 HBGE CC(C)(C)OC(=O)CN1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1=O 1628913128 XAJPHBPORIZYOQ-VXGBXAGGSA-N 417.484 -0.851 50 10 HBGE CN(C)c1noc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)n1 1632905174 XFQRHUXSQNONGD-UHFFFAOYSA-N 410.294 -0.105 50 10 HBGE CN(c1cccc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1)S(C)(=O)=O 1638939651 JZVOYGCLVYSVAG-HNNXBMFYSA-N 404.514 -0.037 50 10 HBGE CCOCc1nc(C)cc(NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)n1 1644393978 XSGSZCUGAWJPTA-OAHLLOKOSA-N 406.487 -0.055 50 10 HBGE COC(=O)[C@@]1(N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)CCOC1 1655121901 YNVKZEGOQQQRCO-HXUWFJFHSA-N 404.467 -0.294 50 10 HBGE Cc1cc(CNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)ccc1B(O)O 2273855874 MTBANWCNXBKGSF-UHFFFAOYSA-N 416.264 -0.219 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)n1 2281900873 RIRMRUQRRXFLNC-HHHXNRCGSA-N 400.266 -0.560 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282248159 PEHVSRPBMJNRJS-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE COC(C)(C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 766636736 TWSJVCWPQYLSKA-UHFFFAOYSA-N 412.512 -0.126 50 10 HBGE C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1 1160776484 OCAKLEKGLSPZBT-JSGCOSHPSA-N 419.525 -0.548 50 10 HBGE CN(C)C(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 1464538142 GHRAPPJGPAEELP-UTUOFQBUSA-N 404.489 -0.041 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)c3cc(B(O)O)ccc3F)C2)cc1 1466549508 OCSQIOVGFAJYOB-UHFFFAOYSA-N 408.216 -0.683 50 10 HBGE O=C(C1=CS(=O)(=O)CCC1)N1CCN(S(=O)(=O)CBr)CC1 1546252315 YSGGXWFYTGVZLZ-UHFFFAOYSA-N 401.304 -0.095 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1 1684434913 MVEZXGXPBOZSNB-UHFFFAOYSA-N 407.456 -0.693 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1cc(B(O)O)sn1)OCc1ccccc1 2255576085 ZYXHJDXURWCLSO-OCCSQVGLSA-N 405.241 -0.363 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267614067 ITGSJDZSEJJDLY-JGVFFNPUSA-N 400.209 -0.352 50 10 HBGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)C(=O)c1nscc1B(O)O 2281606390 CJCAQUGHRRGMFY-UHFFFAOYSA-N 400.310 -0.259 50 10 HBGE CC(C)(C)OC(=O)NC1CC(C[S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2281837321 YXTQYLKUGISCCN-YKBSNTEPSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccccc2B(O)O)[C@@H](F)C1 2282101878 IGAJPHJPSCSBKL-QWHCGFSZSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282364314 NXLSFCYBYAQWPX-CHWSQXEVSA-N 404.225 -0.924 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CN(C(=O)OC(C)(C)C)C1 2282705927 FENXVYWSJXZKSD-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cc(B(O)O)sc2C)C[C@@H]1NC(=O)OC(C)(C)C 2282726102 MTKWBDPRGVZIAV-QWRGUYRKSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2ncsc2B(O)O)C1 2288540098 QECCCNJWRMPNQE-UHFFFAOYSA-N 407.204 -0.830 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1cc(Cl)ccc1B(O)O 2360549249 NDFRODQBGBNDAG-GFCCVEGCSA-N 420.680 -0.104 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(N3CCOCC3)CCC2)c1 770551435 WOANPWOWQYQALK-UHFFFAOYSA-N 410.496 -0.047 50 10 HBGE CC[C@@H](C)n1ncc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 790785199 YKMZCWZNSXMFHP-SNVBAGLBSA-N 416.442 -0.629 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)NNC(=O)COc3ccccc3O)CC2=O)cn1 1144657269 RLXPTPHXFVANSM-ZDUSSCGKSA-N 417.422 -0.186 50 10 HBGE C[C@@H]1Cn2nc(C(=O)NNC(=O)CS(C)(=O)=O)cc2CN1C(=O)OC(C)(C)C 1470661422 SBKLORHKZBIRRC-SNVBAGLBSA-N 415.472 -0.172 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2CCON(C(=O)OC(C)(C)C)C2)sc1B(O)O 2267393128 TXXLUMOZMKFPDJ-SNVBAGLBSA-N 406.291 -0.044 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccccc2B(O)O)[C@H](F)C1 2282101877 IGAJPHJPSCSBKL-OLZOCXBDSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282743690 SBIKEEMLZXONPV-MEBBXXQBSA-N 417.318 -0.501 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1cc(F)c(B(O)O)c(F)c1 2318665500 NDCQTVGRZMBNJJ-UHFFFAOYSA-N 410.163 -0.318 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)Cc1ncsc1B(O)O 2369652108 IVFWTIUELOFABT-MWLCHTKSSA-N 423.297 -0.458 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1OC 28078252 VXTXHJRQLIRHSI-VQHVLOKHSA-N 402.407 -0.034 50 10 HBGE Nc1nonc1-n1nnc(C(=O)NN=Cc2ccccc2F)c1CN1CCOCC1 254406487 MJXABYHIOCWBSS-UHFFFAOYSA-N 415.389 -0.032 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)N[C@@H]1CCN(CCN2CCOCC2)C1 734685483 FJENIQGUDIIBKA-AEFFLSMTSA-N 403.483 -0.273 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 744640992 HDDNDURTVPCDKX-UKRRQHHQSA-N 413.452 -0.680 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl 748722516 VRGFBYVCCNCDTO-ZDUSSCGKSA-N 403.844 -0.089 50 10 HBGE COc1cccc(C=NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c1OC 1082732878 KIQCXUMNNODAFY-UHFFFAOYSA-N 414.422 -0.009 50 10 HBGE biogenic CN(C)[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cncn1C 1152745840 MWCVNHQXQPBWBV-GFCCVEGCSA-N 408.322 -0.151 50 10 HBGE O=C(NNS(=O)(=O)c1cccnc1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 1324054558 WXWPUHAOMSVAQU-SSDOTTSWSA-N 402.376 -0.220 50 10 HBGE CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@@]3(C)C[C@H]3Br)CC2)CC1 1624389121 ZYJJCRLCENEEHV-OCCSQVGLSA-N 409.350 -0.204 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@]3(C)CCOC3=O)nc2)CC1 1639048101 RMRDBXTUOWSBNO-INIZCTEOSA-N 412.472 -0.651 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@H]3[C@@H]2CCCN3CCO)cc1OC 1655019999 NLSQTAFGSZGGMA-HOTGVXAUSA-N 406.483 -0.004 50 10 HBGE Cn1cc([C@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1 1658523842 FVCHJQAVIFZLTL-MHTXLSKPSA-N 420.451 -0.105 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2Cl)C1 2130056494 WJXQHCFIMCANJN-WDEREUQCSA-N 411.908 -0.922 50 10 HBGE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1cc(B(O)O)cs1 2267205193 OYPMIGSGGAFBBL-VXNVDRBHSA-N 400.209 -0.352 50 10 HBGE O=C(N[C@@H]1CC[C@H]1NC(=O)c1cc(B(O)O)c(O)cc1O)OCc1ccccc1 2267811287 XWLDAPHLFBHHAC-HUUCEWRRSA-N 400.196 -0.035 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@@H](NC(=O)OCc2ccccc2)C1 2278564513 MQOCZGYKWXGXHS-CQSZACIVSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282373383 LUVGXVMGKAOEQB-RYUDHWBXSA-N 400.237 -0.112 50 10 HBGE C=C(CS(=O)(=O)NC[C@]1(O)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)B(O)O 2282373848 SFBVOZUMUASNTM-YWVIFJGQSA-N 404.294 -0.233 50 10 HBGE CN(CC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282739566 LHIBHTUEWNHBBQ-UHFFFAOYSA-N 402.253 -0.007 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3CCCN3C)nc2)CC1 139328533 BKJYCJIDRUCILJ-AWEZNQCLSA-N 411.532 -0.262 50 10 HBGE COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)CCNc1n[nH]c(=O)[nH]c1=O 169892850 SNYNWSXOGWGGSY-REZTVBANSA-N 407.343 -0.664 50 10 HBGE O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)[C@@H]1Cc2ccccc2O1 730580987 QWRKKBKHAZTCCB-AWEZNQCLSA-N 414.509 -0.301 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC(=O)N2C)cc1 758029824 NZCJWWQLVOPALU-RIEGTJTDSA-N 412.468 -0.700 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ncc[nH]1 1135610833 CFHCFYWXVLBUAT-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)N1 1252844849 RTTINLSCFBUHIP-AWEZNQCLSA-N 409.468 -0.970 50 10 HBGE O=C(NCCCN1CCCC1)C1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1464893912 MHRQYWTYGKNJPD-UHFFFAOYSA-N 405.279 -0.040 50 10 HBGE O=C1COc2ncc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2N1 1466475513 VAGQYQMOPPLMCL-UHFFFAOYSA-N 419.257 -0.148 50 10 HBGE CO[C@@]1(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCS(=O)(=O)C1 1523602891 ALCDGWLZVRTSQF-IBGZPJMESA-N 424.523 -0.450 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CN3CCN2C[C@H]3C)c1 1540250306 CIVAAXLWIVLPEZ-RHSMWYFYSA-N 423.539 -0.134 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1557185459 MSTWCHQQNABDNP-TVYUQYBPSA-N 405.860 -0.448 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCCSS(C)(=O)=O)[C@@H](C)O)cc1 1650843677 PVSBPTRNTHWPNK-DGCLKSJQSA-N 410.539 -0.168 50 10 HBGE C[C@H]1CN(C(=O)c2c(B(O)O)cnn2C)C[C@@H](C)N1C(=O)OCc1ccccc1 2267323571 NZTMVWQNIWMHRB-OKILXGFUSA-N 400.244 -0.029 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC1(C)CN(C(=O)OC(C)(C)C)C1 2282355657 JJITULGNTRATDM-UHFFFAOYSA-N 400.262 -0.337 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)cc1B(O)O 2282359920 UWAHGOYZPZAYEP-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H](C)CN1C(=O)OC(C)(C)C 2282380832 OQNRUYKTCWHITR-GHMZBOCLSA-N 419.334 -0.018 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@@H]1NC(=O)C(F)(F)F 2282851932 JFKPMULUGUDPEW-YUMQZZPRSA-N 415.224 -0.958 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H](C)CCN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282857496 JAGGIVDKBJEUPW-JTQLQIEISA-N 404.298 -0.668 50 10 HBGE CO[C@@H](C(=O)N=c1nc(B(O)O)[nH]s1)C1CCN(C(=O)OC(C)(C)C)CC1 2284059846 JCKUFWRHAAWCIT-SNVBAGLBSA-N 400.266 -0.760 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2ccccn2)cc1 739679149 PTHNGZUPBBCCTE-UHFFFAOYSA-N 419.463 -0.412 50 10 HBGE Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(F)(F)Oc1ccccc1)c(=O)n2C 741595800 CMHNXLSZEGSQGY-UHFFFAOYSA-N 422.348 -0.747 50 10 HBGE CS(=O)(=O)c1ccc(NC(=O)NNC(=S)NCCN2CCOCC2)cc1 741856398 OAZXWUUOPNWUED-UHFFFAOYSA-N 401.514 -0.077 50 10 HBGE CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 765408531 GZZYRRXTXSCNEP-UHFFFAOYSA-N 413.456 -0.662 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)NC[C@@H](C)O)cc1 1624409582 BHNQEUUMKQZWRW-GFCCVEGCSA-N 418.541 -0.167 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H]1CC(=O)N(c2cnn(CCOC)c2)C1 1628717918 JMYCBONQZREODL-ZDUSSCGKSA-N 412.516 -0.244 50 10 HBGE CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1 1629346819 WWBZSUDVGXAFFC-UHFFFAOYSA-N 416.264 -0.284 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)NNC(=O)CNC(=O)c2cccnc2)C1 1638452583 CTJNVOBAIRSUSU-IBGZPJMESA-N 421.454 -0.015 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nnn1-c1ccc(F)c(F)c1 1654294591 BPNRKQYQUUSGCQ-SSDOTTSWSA-N 402.383 -0.447 50 10 HBGE CCS(=O)(=O)C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 1684200287 DEVRDLGTKSGPRG-UHFFFAOYSA-N 417.513 -0.109 50 10 HBGE O=C(N[C@H]1CC[C@@H]1NS(=O)(=O)c1cncc(B(O)O)c1)OCc1ccccc1 2255678165 AKGMLDXBIMWUAJ-HOTGVXAUSA-N 405.241 -0.503 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1cc(B(O)O)sc1C)NC(=O)OC(C)(C)C 2281906409 NPRJCPYRRRZZRX-NSHDSACASA-N 400.262 -0.077 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)C[C@H](C)N1C(=O)OC(C)(C)C 2282077942 BMRUOZVHIJCTIV-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282084463 WBTITBWXPFHLPG-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE COC1(CCNC(=O)c2nn(C)cc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2282232566 ZVTRNPYCNGLYFD-UHFFFAOYSA-N 416.243 -0.743 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1CNC(=O)OC(C)(C)C 2282739512 KNDAMJIBXDEDRW-MNOVXSKESA-N 419.334 -0.255 50 10 HBGE CCC[C@@H](CNS(=O)(=O)c1nc(C)n(C)c1B(O)O)NC(=O)OC(C)(C)C 2282851274 ZSAWHFFPIDCWTJ-NSHDSACASA-N 404.298 -0.620 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1cnsc1B(O)O)OCc1ccccc1 2315645455 ORWMGWJEJBGGEB-KGLIPLIRSA-N 405.241 -0.363 50 10 HBGE Cc1cc(NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)ccc1B(O)O 2360551224 MHULLGUZRBHUFV-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE CN(C)CCN(/C=C(/C#N)C(=O)N(C)C1CCN(C)CC1)[C@H]1CCS(=O)(=O)C1 216905843 GWQYIGDCMXCHDM-BROZXCPCSA-N 411.572 -0.003 50 10 HBGE CC(=O)NNC(=O)C[S@@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 586304744 XKBKIVLSZNDZFT-FZWUBBAYSA-N 414.509 -0.174 50 10 HBGE CCCn1nc(C)c(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 755787467 DULQYRMJUHHPBT-UHFFFAOYSA-N 400.443 -0.193 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=S)Nc2ccc(F)cc2F)n(C)c1=O 913445637 DCUOXWBFJZPRHO-UHFFFAOYSA-N 423.405 -0.270 50 10 HBGE CCOCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 920273772 AXXZMHZNKYIGGL-UHFFFAOYSA-N 415.468 -0.478 50 10 HBGE CN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cncn1C 1135502778 SEFVPIZXHMRTOH-OAHLLOKOSA-N 408.484 -0.266 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N(Cc2ccccc2)C2CN(C(=O)OC(C)(C)C)C2)n1 2243414342 YUFFYKQHGQWUCV-UHFFFAOYSA-N 415.259 -0.243 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(CNS(=O)(=O)c3sccc3B(O)O)[C@@H]2C1 2267470641 AFKUUDKYVUWLND-QWRGUYRKSA-N 402.303 -0.181 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1Oc1cc(B(O)O)c(Cl)cn1 2277609368 DXQCJIDKAZAYHV-MNOVXSKESA-N 406.653 -0.516 50 10 HBGE Cn1cc(C(=O)N=[S@@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)nc1B(O)O 2282245662 FQIYMKFMCFBHHM-FLESLCNUSA-N 400.266 -0.747 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2282350592 PEFDVHXMIRDQBY-WPRPVWTQSA-N 414.236 -0.353 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C 2282371499 KIDZISYMHMZHHL-ZDUSSCGKSA-N 402.278 -0.819 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282716565 VYTQFZGYJIMXEE-AWEZNQCLSA-N 402.253 -0.150 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282735419 ZYWKTCMUDZWCMN-IIMNLJJBSA-N 400.237 -0.208 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2282741877 UIFYYFMGUNHNBP-OUAUKWLOSA-N 417.318 -0.360 50 10 HBGE CN(Cc1sccc1B(O)O)C(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284062434 KSUQMYWWXQKALE-GFCCVEGCSA-N 402.253 -0.294 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(Cl)c(B(O)O)c1 2360549479 PLBWZUXVRCCLHB-GFCCVEGCSA-N 420.680 -0.104 50 10 HBGE Cc1ccc(OCC(=O)NCC(=O)NN=C2C(=O)N(CC(N)=O)c3ccccc32)cc1 254696602 VYTLEODBYUCREL-UHFFFAOYSA-N 423.429 -0.158 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccco3)c2)CCN1 748265024 FPXQUHFWRPMZOH-UHFFFAOYSA-N 420.447 -0.206 50 10 HBGE NS(=O)(=O)CCN1CCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)CC1 799921304 PYHHSMFXXLYVKX-UHFFFAOYSA-N 423.417 -0.034 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1 1149617768 SFKSDQXNYPUBEC-JTQLQIEISA-N 409.511 -0.517 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CS(C)(=O)=O)s1 1470661398 ORXXHTQKZVHWEP-SNVBAGLBSA-N 409.511 -0.598 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)CC1 1556362147 UHZXNINNEWTJHN-GOEBONIOSA-N 407.446 -0.682 50 10 HBGE CCOC(=O)[C@H]1CCCN(CC(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)C1 1556767446 ONPDFXLIWWTYTH-LRDDRELGSA-N 416.434 -0.140 50 10 HBGE CN1C[C@H](O)C[C@]1(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1586780042 GEUKQMWPJVPADO-RDTXWAMCSA-N 410.496 -0.313 50 10 HBGE Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1C 1635371299 AKJFWUPZOPPXOV-INIZCTEOSA-N 410.496 -0.035 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1 1642897135 LRINJAZNGXESDO-NSHDSACASA-N 400.482 -0.329 50 10 HBGE O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)CN1CCCC1=O 1642898199 WXJHIDLEKLTBLL-UHFFFAOYSA-N 402.455 -0.720 50 10 HBGE COC(=O)[C@@]1(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)CCOC1 1654284568 GDDJUTFWZKQVNE-LJQANCHMSA-N 408.430 -0.464 50 10 HBGE COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1 1681351229 KGKPDXHDAMIHRB-AWEZNQCLSA-N 401.441 -0.648 50 10 HBGE CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC)cc1 1682617515 DVXJJWYCXSDTPQ-DFBGVHRSSA-N 415.468 -0.005 50 10 HBGE N#C/C(=C\c1cccc(Br)c1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1866131083 XLHZEAYLLWABSI-JUEMRBKASA-N 413.224 -0.728 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267392499 LPYURRHRYVMJDY-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282364687 QCVIYZBFIDFZLJ-AOOOYVTPSA-N 406.216 -0.021 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 2282703086 RLEXPGTXHZMUDD-PHIMTYICSA-N 402.282 -0.928 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC(CNC(=O)OC(C)(C)C)C1 2282736413 PSSBWAZCYGPNAL-UHFFFAOYSA-N 400.262 -0.480 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)Cc1ccccc1B(O)O 2282736428 PYKNKWKKTYCWSY-MRXNPFEDSA-N 402.278 -0.939 50 10 HBGE Cn1c(=O)c2c(ncn2CCC(=O)NNc2c(F)c(F)nc(F)c2F)n(C)c1=O 16205224 UYWVBIXDWKKTRN-UHFFFAOYSA-N 415.307 -0.082 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccnc(Cl)c2F)n(C)c1=O 764751680 DZWSQRZQRRMIEI-UHFFFAOYSA-N 409.765 -0.918 50 10 HBGE O=C(NNC(=O)c1ccn2nnnc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1 1531049241 QYBHPDIAIOFYEA-UHFFFAOYSA-N 415.435 -0.016 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 1639935625 ZWCJNFVDJHILSY-MNOVXSKESA-N 403.482 -0.045 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCCc1ccccc1B(O)O 2131211239 IXPQTDZWRBOMFI-UHFFFAOYSA-N 416.264 -0.485 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267626987 QZFXVKJETXGGSK-JTQLQIEISA-N 405.307 -0.358 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)c2cc(B(O)O)cs2)CC1)C(F)(F)F 2270595119 KMLIBZHEJFLKHZ-VIFPVBQESA-N 400.209 -0.350 50 10 HBGE CC1(C[S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)CN(C(=O)OC(C)(C)C)C1 2281847455 MZIIIDWLYBSOBB-HHHXNRCGSA-N 400.266 -0.416 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)[C@@H]2COC[C@H]12 2282373181 JDAYJGVZBXICGX-YUSALJHKSA-N 418.302 -0.660 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1 2282706637 OKLAIUSKASJUGD-NSHDSACASA-N 402.282 -0.975 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCC1CC(NC(=O)OC(C)(C)C)C1 2282708686 PYTIOOHIIQDBRS-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE Cc1cc(S(=O)(=O)NC2(CCO)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282730830 IGDFWYIOJPRMCF-UHFFFAOYSA-N 420.318 -0.613 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)cc1 1437079421 UZWZJGCDSJGFAC-IAQYHMDHSA-N 412.468 -0.162 50 10 HBGE CS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)cc1Br 1623368895 ZHCHXULMIKWOMQ-SECBINFHSA-N 404.242 -0.108 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CN1CCCC1=O 1632321386 YDJZKBYZOAOTJT-UHFFFAOYSA-N 422.385 -0.247 50 10 HBGE Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2nnc3n2CCNC3=O)c1C 1638034297 VSBGLNKJLLPPOF-GFCCVEGCSA-N 401.427 -0.064 50 10 HBGE Cn1cc(S(=O)(=O)N2CC(NC(=O)OC(C)(C)C)(C(N)=O)C2)c(CCl)n1 2123401477 GILBPDMHCHJNAC-UHFFFAOYSA-N 407.880 -0.088 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267392496 LPYURRHRYVMJDY-SECBINFHSA-N 408.669 -0.816 50 10 HBGE O=C(N1CCC[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1)C(F)(F)F 2267611995 XEPMUAFGRYGSND-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)c2cscc2B(O)O)CC1)C(F)(F)F 2270594532 HYSACURXDSRGRK-MRVPVSSYSA-N 400.209 -0.350 50 10 HBGE Cc1sc(C(=O)NC(CO)(CO)CNC(=O)OC(C)(C)C)c(C)c1B(O)O 2282137030 ZIGOYONGKWLWRP-UHFFFAOYSA-N 402.278 -0.977 50 10 HBGE Cn1cc(C(=O)NCC2(F)CCN(C(=O)OCc3ccccc3)CC2)nc1B(O)O 2282247354 FEDBYFSHNRURMJ-UHFFFAOYSA-N 418.234 -0.029 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282334000 VZQUZMXYYUJPSA-WCBMZHEXSA-N 414.236 -0.211 50 10 HBGE COc1ccc(S(=O)(=O)NCC2CN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282360724 GVPOGGRQEGSPKR-UHFFFAOYSA-N 400.262 -0.480 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(S(=O)(=O)c2sccc2B(O)O)C1 2282707426 YRAMJJVPXPYHGF-AWEZNQCLSA-N 420.274 -0.830 50 10 HBGE COc1ccc(S(=O)(=O)NC2CC(NC(=O)OC(C)(C)C)C2)cc1B(O)O 2282730331 ADRKHXDMBZHKFJ-UHFFFAOYSA-N 400.262 -0.291 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N(Cc2ccccc2)CC2(O)CNC2)c1B(O)O 2282732345 FKHONOQJOIBZRH-UHFFFAOYSA-N 410.326 -0.430 50 10 HBGE CN1CCN(Cc2ccccc2)[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282736470 QVORHMUBBUYMDP-OAHLLOKOSA-N 409.342 -0.478 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)nn3)c2)C[C@H](C)O1 1131111245 BLGFSUFSTANVJR-RYUDHWBXSA-N 422.467 -0.312 50 10 HBGE CS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1 1160960411 FJSPDBWNYLRBMM-UHFFFAOYSA-N 404.448 -0.005 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1 1182609060 FNIZTTVGBKPPRV-SSDOTTSWSA-N 417.387 -0.321 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(N3CCOCC3)n2)c1 1354635293 VGCWGZMFOQWGOK-UHFFFAOYSA-N 405.436 -0.209 50 10 HBGE CN1CCN(CC(=O)N(C)c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CC1 1443308572 DZQZEFZRGVAMFF-UHFFFAOYSA-N 410.283 -0.171 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CC[C@@H]3[C@@H](C2)C3(F)F)n(C)c1=O 1445556185 YJRXREJBOKBKQF-OPRDCNLKSA-N 410.381 -0.738 50 10 HBGE C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)[C@H]1CCC(=O)N1 1623404481 KNINBWNCBLLPFX-CZUORRHYSA-N 409.512 -0.020 50 10 HBGE Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1635371706 HUMUGPUHRNHGAM-CQSZACIVSA-N 414.484 -0.147 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272655808 SBJYNKYBEBQZEJ-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282081100 AHFWFPLRSNDDEP-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282373718 QMHAMDYLENMETO-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@@H]1CO 2282374919 HYPONOIKLQACFG-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(O)CCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282708812 ROVLFAYZXNUAGY-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CN(C[C@@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cscc1B(O)O 2282734152 HXNORGVDEYUJJD-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1sccc1B(O)O)[C@@H](O)C(F)(F)F 2284060826 RXXPPNZBZRSOGA-NXEZZACHSA-N 412.195 -0.139 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2c(B(O)O)cccc21 712218307 NNUVOAHRLCZQCU-UHFFFAOYSA-N 400.221 -0.645 50 10 HBGE CN(CCN1CCCS1(=O)=O)C(=O)NNC(=O)CNC(=O)c1cccs1 752010636 STQDFWDKYKWLBQ-UHFFFAOYSA-N 403.486 -0.814 50 10 HBGE CCn1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 1160403788 SQMZLTSKTIRBLC-UHFFFAOYSA-N 421.479 -0.072 50 10 HBGE COC(=O)C1CC2(C1)C[C@H](NC(=O)NNC(=O)[C@H]1CCO[C@@H]1C)CCS2(=O)=O 1251485371 VKCYMEUMCQGZEW-AIOKKLSASA-N 417.484 -0.359 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc2n(n1)CCN(C)S2(=O)=O 1264054735 AKMVQHJWAIRLEU-JTQLQIEISA-N 411.415 -0.115 50 10 HBGE CO[C@@H]1C[C@@H](C(=O)NNC(=O)[C@@H]2COCCO2)N(C(=O)OCc2ccccc2)C1 1265592313 YHLGNAHLMNJICO-PMPSAXMXSA-N 407.423 -0.025 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)ccc1=O 1598521099 LQZBPBJRIMOCDK-UHFFFAOYSA-N 420.447 -0.050 50 10 HBGE C[C@@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCCS1(=O)=O 1622153520 IYOYWMKTVMSRIZ-IBGZPJMESA-N 422.507 -0.441 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NCCSS(C)(=O)=O)cc2S1(=O)=O 1636470432 MMQNYAQTQWGXPW-UHFFFAOYSA-N 422.506 -0.100 50 10 HBGE COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NN(C)C[C@H](C)O)c1OC 1638568227 QEGVGTBRLBCJKB-LBPRGKRZSA-N 417.484 -0.318 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](CO)NS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2255884924 HELKNCIKWKELBS-ZETCQYMHSA-N 414.698 -0.755 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2267203551 RONZHCHQOFNLIP-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](CNS(=O)(=O)c3ccc(B(O)O)s3)[C@@H]2C1 2267205048 MZNVHKHKAWHCLC-JGPRNRPPSA-N 402.303 -0.181 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CCCN1C(=O)OC(C)(C)C 2282710565 PUAFTISVJWQNCD-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1 745978029 BCVQGQMROVMJRK-AWEZNQCLSA-N 421.497 -0.047 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCN1 815826865 DDAGNGBKBOWTMY-OAHLLOKOSA-N 401.467 -0.492 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNC(=O)CN3CCCc4ccccc43)n(C)c2n(C)c1=O 919689862 GAIQVALJIJPNJZ-UHFFFAOYSA-N 424.461 -0.211 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=C4CCCN=C4NN3)cc2)CC1 1151459382 MEEIRDHRYPPWDF-UHFFFAOYSA-N 419.511 -0.380 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)COB3O)c1 1290040100 BVYCUERSFNLXOQ-UHFFFAOYSA-N 403.225 -0.771 50 10 HBGE Cc1[nH]nc(I)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 1472504416 BBXMYFMFKCJXML-RXMQYKEDSA-N 415.213 -0.979 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)NC[C@@H](NS(=O)(=O)N(C)C)C1CCCC1 1478899150 BDIIXZPKTAJKLA-IACUBPJLSA-N 405.521 -0.303 50 10 HBGE CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2)c1 1538656010 AGPFWRZVUHSQIG-UHFFFAOYSA-N 411.461 -0.170 50 10 HBGE Cc1nc(CS(C)(=O)=O)sc1CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1540554930 RWNSVCAQMOVULM-SECBINFHSA-N 409.511 -0.879 50 10 HBGE CN(C)C(=O)Cn1nc2n(c1=O)CCN(C(=O)NC[C@@]1(C)C[C@@H]1Br)C2 1565124592 BMZHNWFIDGUOCQ-ZUZCIYMTSA-N 415.292 -0.168 50 10 HBGE CN1C(=O)CCC[C@@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278434 COJDMACTLXOTRU-MRXNPFEDSA-N 401.467 -0.397 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@]2(CC(=O)NN2C(=O)c2cc(B(O)O)ccc2F)C1 1645106902 WVESINVZSLCJOD-SFHVURJKSA-N 407.207 -0.238 50 10 HBGE CON(C)C(=O)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1682116147 BFRIDYPPPNQTOX-UHFFFAOYSA-N 413.456 -0.565 50 10 HBGE Cc1c(C(=O)N2CC3(CC(NC(=O)OCc4ccccc4)C3)C2)nn(C)c1B(O)O 2281609980 ZHAWMCCAJRCMLL-UHFFFAOYSA-N 412.255 -0.061 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C 2282143963 REFFUSRPAFOJOO-GFVXYOJSSA-N 402.282 -0.266 50 10 HBGE CCC1(NS(=O)(=O)c2nc(C)n(C)c2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282339264 SVVDAYYMZOFOAK-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE CN(CC(C)(C)CNS(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282362092 AQSHHNZYNKAXHM-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@@H]1COCCO1 744649026 RCYHJEHSIXFEBB-KGLIPLIRSA-N 417.509 -0.351 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Cc2ccccn2)[C@H](C)O)cc1 779513647 WIFWSJUCGMOZLE-SUMWQHHRSA-N 406.464 -0.192 50 10 HBGE CS(=O)(=O)c1ccc(NCC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1156184401 RRFUUNVKGWRGEK-INIZCTEOSA-N 410.496 -0.097 50 10 HBGE COC(=O)C[C@@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)Cc1ccccc1C 1175228640 ILJKQXHYCFOGAX-OAHLLOKOSA-N 411.480 -0.653 50 10 HBGE Cn1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1-n1cnnc1 1446967541 ZZYDJWSUJMPIOP-UHFFFAOYSA-N 418.277 -0.559 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2ccc3ncc(I)n3c2)N1 1461835918 IVRLXAQAIDNRGS-MRVPVSSYSA-N 413.175 -0.022 50 10 HBGE C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCC(=O)N1 1465791348 CXXYDACEJYZPMK-HOCLYGCPSA-N 401.467 -0.494 50 10 HBGE O=C(NNC(=O)c1c[nH]c2c(F)cc(F)cc2c1=O)N[C@H]1CCS(=O)(=O)C1 1543753842 ZCHZERCHHARNAI-QMMMGPOBSA-N 400.363 -0.063 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1624585808 RQMQWTDQXGUTQE-WOPDTQHZSA-N 405.473 -0.502 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1 1630862552 MFVAEBYYDOHUCG-VIFPVBQESA-N 418.269 -0.006 50 10 HBGE C[C@H]1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CS1(=O)=O 1636726114 SEVHZDUHBAXGKQ-QWRGUYRKSA-N 407.452 -0.157 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCCS(=O)(=O)Nc1ccnc(B(O)O)c1 2089786241 HZNMTJBSKUZWIU-UHFFFAOYSA-N 417.252 -0.030 50 10 HBGE NS(=O)(=O)c1nnc(NS(=O)(=O)N2CCC(Br)CC2)s1 2162201063 FPAQRSUFUQGECD-UHFFFAOYSA-N 406.309 -0.299 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1O 2282079070 RCHDKACTMHKKBX-WCQGTBRESA-N 420.318 -0.630 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)Cc2ccsc2B(O)O)CC1)C(F)(F)F 2286119205 CIPMOYUABXFMNK-SNVBAGLBSA-N 414.236 -0.209 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)c(OC)c1 729969039 JRFDZQCNEIINFN-AWEZNQCLSA-N 420.466 -0.355 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)N1CCN(S(=O)(=O)Cc2ccon2)CC1 743594566 IFPJNYFOMWAGOX-UHFFFAOYSA-N 414.469 -0.058 50 10 HBGE COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2COCCO2)c1 744646905 SKIIEIXJGVTJGL-ZDUSSCGKSA-N 421.859 -0.559 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Cl 749756593 WZKXRPFMTKULIY-MRVPVSSYSA-N 410.857 -0.129 50 10 HBGE COC(=O)C(C)(C)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 778187675 CPDURBNTLWGKFW-UHFFFAOYSA-N 407.427 -0.075 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=S)NCCN2CCOCC2)ccc1Cl 913444401 HWASWYXFXZCBTJ-UHFFFAOYSA-N 421.932 -0.572 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)C 1628171381 QMBRCGWDBFQPNF-LLVKDONJSA-N 419.529 -0.377 50 10 HBGE COC(=O)[C@H]1CC[C@H](C(=O)OC)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1 1659462711 UUSFHPNKHHTEON-LSDHHAIUSA-N 402.407 -0.254 50 10 HBGE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)CCOCCCl)C1 1877123057 GWGMTYNFXDDKEK-BDAKNGLRSA-N 409.814 -0.574 50 10 HBGE CN([C@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2282081485 CSMQOSUYPNNDRN-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(B(O)O)n1C 2282327719 MLDZCEJLJKZSQJ-JTQLQIEISA-N 402.282 -0.962 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)CCO1 2282418349 IALOUDCNRVNGCV-NSHDSACASA-N 420.318 -0.349 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)n1 2282743575 QTHOTJLBKYTMNX-UHFFFAOYSA-N 402.282 -0.786 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282849695 FRDZNWSCHBVSGA-YUMQZZPRSA-N 415.224 -0.958 50 10 HBGE CN(C)S(=O)(=O)N1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1 810091413 TXGTWWRQNBAQLV-UHFFFAOYSA-N 408.484 -0.867 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CCCC[C@H]2C2CC2)n(C)c1=O 1137298877 FREJOSQRNPWERQ-QWHCGFSZSA-N 402.455 -0.203 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1 1434880117 DGFDBOOBPSQYGW-UHFFFAOYSA-N 407.452 -0.080 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NN(C)[C@H](C)CO 1452346362 DQHKRWXXLYNKSA-OCCSQVGLSA-N 401.485 -0.428 50 10 HBGE CNC(=O)C[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1478654747 DYFBXIXDIOZMQK-GFCCVEGCSA-N 413.504 -0.832 50 10 HBGE CCN1C(=O)C[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)[C@H]1c1cccnc1 1597426055 MNBNPYWXZDXTNK-KCQAQPDRSA-N 409.468 -0.491 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)C[C@H]1NC(=O)C(F)(F)F 2195883746 QRBFEBPCSKSBRM-GWOFURMSSA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCCO1 2282070004 XPVZYEHLAHSJGD-GFCCVEGCSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1CO 2282083189 NFUMEMOHZZLQFW-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE Cn1nc(C(=O)N=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C)cc1B(O)O 2282382265 IXYJFUVNGXNIOK-HHHXNRCGSA-N 402.282 -0.357 50 10 HBGE CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)c1c(B(O)O)cnn1C 2282708300 KEJMVLZMKHBSDI-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282849607 DPOONAIVBGJWTI-NWDGAFQWSA-N 420.318 -0.518 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2365477146 KUIOYBNCHKBNOX-JTQLQIEISA-N 422.696 -0.162 50 10 HBGE COC(=O)[C@@H](CS(=O)(=O)NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1 793449829 FWOJWFRRXDNJQM-KGLIPLIRSA-N 407.452 -0.252 50 10 HBGE Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC3)c1 1160733134 MWDRFAZWQDFFNF-OCCSQVGLSA-N 420.495 -0.099 50 10 HBGE CN(C)CC#CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1256579689 NXZDKTCBPRADGL-UHFFFAOYSA-N 407.496 -0.020 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1454058500 FAYLOHSYJKHZBH-RNODOKPDSA-N 413.434 -0.199 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccnnc1 1557069026 XUWUXSWKBIKXCN-UHFFFAOYSA-N 414.241 -0.021 50 10 HBGE COc1ccc(NC(=S)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cn1 1644013227 LLWLUQMHEABNCV-UHFFFAOYSA-N 408.465 -0.095 50 10 HBGE CS(=O)(=O)N1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 1683743928 HIQWBQQKZZXCGK-ZDUSSCGKSA-N 411.488 -0.943 50 10 HBGE N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 1866128246 FJTFOJVKPWVKDQ-RHVSQNAWSA-N 413.224 -0.728 50 10 HBGE COc1ccc(/C=C(\C#N)C(=O)N(CC(=O)O)[C@@H]2CS(=O)(=O)C[C@@H]2O)cc1OC 1866366011 FUILCWGUOLEYLP-KYYFYTAESA-N 424.431 -0.318 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@H]1NC(=O)C(F)(F)F 2267206921 NAIMLKRZVZABAB-JGVFFNPUSA-N 400.209 -0.495 50 10 HBGE Cn1cc(C(=O)N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nc1B(O)O 2267359095 IJRUGFBABRJYEM-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c(B(O)O)n1C 2267370654 OSDROEZFZHPCNW-CQSZACIVSA-N 422.272 -0.902 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281868990 ORYFGQCLUUBDLZ-BLBHWQHRSA-N 400.266 -0.273 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)n1 2281879475 JHHISYNECURMNH-BLBHWQHRSA-N 402.282 -0.266 50 10 HBGE CC[C@]1(NC(=O)c2nn(C)nc2B(O)O)CCCN(C(=O)OCc2ccccc2)C1 2282144335 WJXCWYVYICDQMI-IBGZPJMESA-N 415.259 -0.194 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1ccccc1B(O)O 704308356 AYJYXBQJZTWOLY-UHFFFAOYSA-N 402.237 -0.528 50 10 HBGE Cc1ccc(CCCC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 765728394 PFSXSRGXLPUECU-UHFFFAOYSA-N 412.450 -0.088 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn2c(=O)cc[nH]c12 1321858816 LSOHXLNTFDCNTN-UHFFFAOYSA-N 403.424 -0.301 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NN(C)C[C@@H](C)O)o1 1450939141 CTOFRRJJNGHRAY-VXGBXAGGSA-N 403.457 -0.047 50 10 HBGE Cn1cc(C(=O)N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c(B(O)O)n1 2267400736 XCFZSOZSNSNTCS-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282071937 XXTFRUFCFPIGBS-NWDGAFQWSA-N 420.318 -0.269 50 10 HBGE O=C(NCCCN1CCN(Cc2ccccc2)CC1)NNC(=O)[C@H]1COCCO1 745502844 FLDVRXFNXPGOIK-GOSISDBHSA-N 405.499 -0.060 50 10 HBGE CN(C)S(=O)(=O)N1CCCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)CC1 811870266 GDVIZSMNOZCUNJ-HNNXBMFYSA-N 411.484 -0.455 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCN1CCNC1=O 1255498467 JARUDRWOSYUGLW-UHFFFAOYSA-N 403.487 -0.446 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1584300979 WSQSVKWXWDSQCZ-JGVFFNPUSA-N 413.399 -0.152 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cscc1B(O)O 2267389474 PBRLYINFPOOMHH-GHMZBOCLSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C[C@H]2NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613659 DZQSAACLGIALDY-HBNTYKKESA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1cscc1B(O)O 2267622550 SSBRXKLKJKEXNT-SCVCMEIPSA-N 402.303 -0.038 50 10 HBGE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1cscc1B(O)O 2267625098 JWORKVFDVAXXJI-APPZFPTMSA-N 400.209 -0.352 50 10 HBGE Cn1nc(C(=O)N=[S@@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1B(O)O 2281915476 ZMOOCJDRNKPYHJ-FLESLCNUSA-N 400.266 -0.747 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c1B(O)O 2282418158 MNWJEGXNFNUYOU-QWRGUYRKSA-N 420.318 -0.385 50 10 HBGE C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CN1C(=O)OC(C)(C)C 2282712310 OANIPRMKZGIWML-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282718609 ZYDZIPNRCUKICF-MZHQLVBMSA-N 418.302 -0.180 50 10 HBGE C[C@@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1nn(C)cc1B(O)O 2284034833 FBHXAXQZIFQDRN-NSHDSACASA-N 404.298 -0.681 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2cc(B(O)O)c(F)cn2)[C@@H](S(C)(=O)=O)C1 2370019604 MCQNWLCQILYSPY-RYUDHWBXSA-N 403.241 -0.655 50 10 HBGE Cn1ccnc1CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 733310782 WOXLCXKAFJPYGW-UHFFFAOYSA-N 401.427 -0.093 50 10 HBGE CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)[C@H]2CCC(=O)N2)c1 1287238154 KPTLYEWDZVCTNK-CQSZACIVSA-N 423.495 -0.423 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2Cl)N1 1520970444 YPGITYHJLILGFI-VIFPVBQESA-N 424.660 -0.223 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNC(=O)c2cc(F)ccc2Br)N1 1565566770 GSTOVKSZMSETHY-VIFPVBQESA-N 408.205 -0.738 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@@]23CCCC[C@@H]2C3(F)F)n(C)c1=O 1629793448 RTCMQAPYVKEEIQ-BTDLBPIBSA-N 424.408 -0.203 50 10 HBGE CN(C)N(C(=O)CCOc1ccc(S(N)(=O)=O)cc1)[C@H]1CCS(=O)(=O)C1 1638428528 VEIPAQXRCAWIRY-LBPRGKRZSA-N 405.498 -0.405 50 10 HBGE O=C(NCCCCN1C(=O)c2ccccc2C1=O)C(=O)NNC(=O)C(F)(F)F 1923848404 UTHIGMLKMHIZKG-UHFFFAOYSA-N 400.313 -0.111 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(CC(=O)N[C@H]2CS(=O)(=O)C[C@H]2Cl)C1 2130056492 WJXQHCFIMCANJN-MNOVXSKESA-N 411.908 -0.922 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccsc1B(O)O 2267370647 OQONERSFJHIHSL-NSHDSACASA-N 408.307 -0.925 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2267624606 BIPIEZPSDWSKJG-APPZFPTMSA-N 400.209 -0.495 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)c1nc(NS(=O)(=O)c2cc(B(O)O)cs2)n[nH]1 2282069214 MWYVGMMCRSNPIS-SSDOTTSWSA-N 417.278 -0.068 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282074210 KBWSGKOQKJSNAU-ZBAXXZLZSA-N 418.302 -0.613 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2cc(B(O)O)cs2)[C@H](S(C)(=O)=O)C1 2282388047 LUZPWMUQEGOOFT-ZYHUDNBSSA-N 418.302 -0.810 50 10 HBGE COC(=O)[C@@H](CC(=O)N(C)Cc1cc(B(O)O)cs1)NC(=O)OC(C)(C)C 2283943508 AJRGIOZDSYHAAB-GFCCVEGCSA-N 400.262 -0.157 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ncccc2C(F)(F)F)n(C)c1=O 765582300 COAONKYIHJVVNX-UHFFFAOYSA-N 409.328 -0.002 50 10 HBGE COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]2COCCO2)C1=O 771263827 JDEWETAKBDFHLI-LIRRHRJNSA-N 420.422 -0.667 50 10 HBGE O=C(NCCNS(=O)(=O)c1cccnc1)NNC(=O)[C@@H]1Cc2ccccc2O1 772996725 HBDGVFXAPSXGFK-HNNXBMFYSA-N 405.436 -0.306 50 10 HBGE O=C(COC(=O)[C@@]12[C@@H]3[C@H]4C(=O)[C@H]1[C@@H]1[C@@H]4C[C@@H]3[C@H]12)NNC(=O)[C@H]1COc2ccccc2O1 800250239 FAHYMFFFBSBBKE-BFVDJEAESA-N 424.409 -0.156 50 10 HBGE CC(C)(C)OC(=O)NC1CCN(CC(=O)NNC(=O)[C@H]2CCc3nncn3C2)CC1 816872167 CPEHODLUEZVCJV-ZDUSSCGKSA-N 421.502 -0.023 50 10 HBGE CS(=O)(=O)C[C@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1 1292038207 CNPDNFOADYQFJI-STQMWFEESA-N 403.482 -0.668 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c(OC)c1 1313099106 QLQCNRYPQKWAMD-UHFFFAOYSA-N 401.445 -0.862 50 10 HBGE C=CCNC(=S)NNC(=O)[C@@]12CN(C(=O)OC(C)(C)C)C[C@@H]1CS(=O)(=O)C2 1618600593 DXMLMNFKQQSJOT-BDJLRTHQSA-N 418.541 -0.051 50 10 HBGE COCCNS(=O)(=O)c1cc(NC(=O)c2cccc(B(O)O)c2)ccc1OC 1626631950 NGZGDVPWAUUDBM-UHFFFAOYSA-N 408.241 -0.448 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ccc(B(O)O)cn1 2102376791 KJSUXHCWKCPOAB-UHFFFAOYSA-N 417.252 -0.175 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2267203549 RONZHCHQOFNLIP-MNOVXSKESA-N 406.291 -0.660 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CCC1 2282699904 MZPOULHPRYGQJZ-NSHDSACASA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282707123 VDIWLQVVQUFDMF-KGLIPLIRSA-N 400.262 -0.673 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713086 ZTMMHYHVLRSREM-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(F)cc1B(O)O 2282727415 YRFJSRHAITZWJU-SANMLTNESA-N 424.281 -0.183 50 10 HBGE CN(Cc1csc(B(O)O)c1)C(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360548876 IYHHQRGECLVUPO-LLVKDONJSA-N 420.318 -0.676 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@@H]1COCCO1)C1=NS(=O)(=O)c2ccccc21 744643469 VSCAFBZLFBUWGT-ZDUSSCGKSA-N 410.452 -0.590 50 10 HBGE CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@H]1COCCO1 744649028 RCYHJEHSIXFEBB-UONOGXRCSA-N 417.509 -0.351 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1303881015 GWTFUBSQCAWQKS-MRXNPFEDSA-N 410.496 -0.049 50 10 HBGE NS(=O)(=O)CCCCCC(=O)N1CCN(S(=O)(=O)CBr)CC1 1446963756 RCVOGSRSMKDVFP-UHFFFAOYSA-N 420.351 -0.338 50 10 HBGE Cc1ccc(C(=O)NNC(=O)c2cn(C)nn2)cc1S(=O)(=O)N1CCOCC1 1528541325 AJDYIQUPEGJJHY-UHFFFAOYSA-N 408.440 -0.781 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)sc2n(C)c1=O 1539748005 QOFAAFKEWXFACA-UHFFFAOYSA-N 402.436 -0.025 50 10 HBGE COCCOCC(=O)NNC(=O)[C@H]1CCCN(CCNC(=O)OC(C)(C)C)C1=O 1642243179 RMESQNAMARHALH-CYBMUJFWSA-N 416.475 -0.440 50 10 HBGE COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 1681351231 KGKPDXHDAMIHRB-CQSZACIVSA-N 401.441 -0.648 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2ncsc2B(O)O)CC1 2281645182 HIEZQQFKAPBOMN-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)Cc1ccccc1B(O)O 2282348851 QDBQLXJQEFMRKU-UHFFFAOYSA-N 402.278 -0.673 50 10 HBGE O=S(=O)(c1c(Cl)cccc1B(O)O)N(Cc1ccccc1)CC1(O)CNC1 2282421467 OENZPXAHBLTICL-UHFFFAOYSA-N 410.688 -0.455 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C1 2282715704 KCIFJZVXIQDZOM-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE COc1ccc(S(=O)(=O)N(C)C2CN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282735325 YXYKUXKQJCBLHI-UHFFFAOYSA-N 400.262 -0.385 50 10 HBGE C[C@@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286910031 ZHDUTLSPOGMMNJ-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE CN(CCCNC(=O)OC(C)(C)C)CCCNC(=O)c1cnsc1B(O)O 2362572312 YUNXJZDKTWKEFF-UHFFFAOYSA-N 400.310 -0.211 50 10 HBGE COc1cc(OC)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(OC)c1 777599051 GWFAUMDWUCVBGY-VIFPVBQESA-N 408.454 -0.543 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2F)CCNC3=O)n1 793021582 FSTDQNBPFFEOOY-UHFFFAOYSA-N 402.386 -0.289 50 10 HBGE O=C(CS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919888980 JIAHWRNUVOABAU-JTQLQIEISA-N 409.873 -0.369 50 10 HBGE COc1cc(OC)nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1 1135501965 AJMGPSUVLCQKOT-UHFFFAOYSA-N 409.424 -0.181 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1254316561 WLZCRBTYHACMNE-SFHVURJKSA-N 408.411 -0.968 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCN1 1326426297 LRDWGZBXEVLQIZ-ZDUSSCGKSA-N 424.479 -0.615 50 10 HBGE O=C(NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 1625003945 QLQPLUSOUGGZNX-PRHODGIISA-N 412.324 -0.004 50 10 HBGE CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1638870748 GYKIOAGTWIYYIO-QGZVFWFLSA-N 424.523 -0.072 50 10 HBGE COc1ccc(/C=C(\C#N)C(=O)N(CC(=O)O)[C@H]2CS(=O)(=O)C[C@@H]2O)cc1OC 1866366012 FUILCWGUOLEYLP-NUIMBWKGSA-N 424.431 -0.318 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)c2cncc(B(O)O)c2)C1)OCc1ccccc1 2278541143 ZKHMMNZUQZKDFW-MRXNPFEDSA-N 419.268 -0.159 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282072806 JFSMRUPMLDTBDF-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2nscc2B(O)O)CC1 2282314948 HKRASXVEWGFDPT-HHHXNRCGSA-N 418.306 -0.471 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C)c(B(O)O)n1C 2282328216 UOMHCJBBFJPRHT-ONGXEEELSA-N 402.282 -0.915 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NCCc1cnn(Cc2ccccc2)c1 2282358186 VRMBZSLERLFOCW-UHFFFAOYSA-N 406.298 -0.270 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1Cl 2282373008 GXEPLZDMZKJVIN-LLVKDONJSA-N 422.696 -0.474 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCN(C(=O)OC(C)(C)C)C1CC1 2282713216 BGVIVGSEHQILOV-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](CCNC(=O)OC(C)(C)C)C1 2282719139 HWMMXYPIJOFAAA-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282721878 YNNNCNUZBZTPDE-UHFFFAOYSA-N 412.195 -0.056 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)OCCN2S(=O)(=O)c1cscc1B(O)O 2282733295 SZCBPUJZKMSYCO-NWDGAFQWSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NC(=O)c1cc(B(O)O)c(O)cc1O 2282982008 AYCYNLSRQVPGKB-MHZLTWQESA-N 402.234 -0.460 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccncc3)CCO2)ccc1=O 1684349365 FCAFWTWHWKUZIK-INIZCTEOSA-N 400.439 -0.375 50 10 HBGE Cn1cc(C(=O)N[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c(B(O)O)n1 2267398930 ZXQNRCIZOMSWPE-GFCCVEGCSA-N 414.149 -0.313 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@](F)(CNC(=O)c2nscc2B(O)O)C1 2281606650 GYDQCCVHIPCWML-OAHLLOKOSA-N 403.241 -0.472 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282065134 JRCQNSIPHQWCDC-UONOGXRCSA-N 400.262 -0.673 50 10 HBGE CC(C)(C)OC(=O)NCC[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282700332 PYGRJWCJDIWAOC-GFCCVEGCSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)CC[C@@H]1NC(=O)C(F)(F)F 2282857284 GDZALVRDDRHPEG-SCZZXKLOSA-N 414.236 -0.353 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ccc(S(C)(=O)=O)cc1 748131520 OCZBHFPIJZIGBU-SNVBAGLBSA-N 401.470 -0.366 50 10 HBGE C[C@H]1C(=O)CC[C@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1(C)C 780925374 DEQRCRLULBNXHW-WDEREUQCSA-N 418.454 -0.778 50 10 HBGE CC(=O)Nc1ccc(C(C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 781594454 GJUBZNDIEWNCSC-UHFFFAOYSA-N 411.422 -0.068 50 10 HBGE CN1CCO[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1=O 1135409725 HQXOEECMHFXEBW-AWEZNQCLSA-N 410.452 -0.911 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@@H]1CCCCO1 1523624424 AQYLIFGOISAIGX-ZDUSSCGKSA-N 418.493 -0.165 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)nn1 1538899107 BGNHRKCEWNYGKS-UHFFFAOYSA-N 412.403 -0.950 50 10 HBGE O=C(C[C@@H]1CS(=O)(=O)c2ccccc2O1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1539402438 YVJSZWHFGOTPKN-GHMZBOCLSA-N 402.450 -0.807 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NN(C)C(=S)NCCCOC)[C@H]1c1nccn1C 1540497076 UXBHBVJKXIMQKS-KBPBESRZSA-N 412.516 -0.418 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1 1558447482 OLZATBPMGDGFEE-CQSZACIVSA-N 418.454 -0.212 50 10 HBGE CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)CS(C)(=O)=O)c1 1586191223 PEKFGGJVRCESKT-UHFFFAOYSA-N 405.498 -0.290 50 10 HBGE CCN(CC)c1nc(NNC(=O)CS(=O)(=O)N(C)C)nc(N(CC)CC)n1 1626526793 PLNSPDMDYVSEER-UHFFFAOYSA-N 402.525 -0.102 50 10 HBGE Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1635372306 RIJQQRDAOOFZHK-OAHLLOKOSA-N 402.455 -0.005 50 10 HBGE CC(C)(C)CC(=O)NNC(=O)CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1 1638292399 RFBDGOGMJIXZOF-UHFFFAOYSA-N 405.498 -0.048 50 10 HBGE Cn1nc(C(=O)N[C@H]2CCN(C(=O)OCc3ccccc3)C2)c(B(O)O)c1Cl 2255486493 BEYJPBCXGKCRDV-LBPRGKRZSA-N 406.635 -0.106 50 10 HBGE O=C(NC[C@H](NC(=O)c1n[nH]cc1B(O)O)C(F)(F)F)OCc1ccccc1 2255552846 QGROHBXCGBGKNJ-NSHDSACASA-N 400.122 -0.323 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 2266950440 GEPHBTNTGXJNCP-AWEZNQCLSA-N 401.232 -0.727 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267389476 PBRLYINFPOOMHH-QWRGUYRKSA-N 406.291 -0.660 50 10 HBGE Cc1c(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2281604479 ROWDXBGSUIBITO-LSDHHAIUSA-N 416.243 -0.778 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2282079642 YXBVRRNLVCRCEM-JQWIXIFHSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1ccc(B(O)O)cc1 2282083649 KBJYBAYJHPSSCL-UHFFFAOYSA-N 402.278 -0.424 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2282168275 ROCCECXIDUVXPD-HHHXNRCGSA-N 400.266 -0.734 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)NCC1(F)CCN(C(=O)OCc2ccccc2)CC1 2282277349 QFELLEUDVQMEGO-UHFFFAOYSA-N 419.222 -0.634 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282336948 IARVRCACQKGXQA-NWDGAFQWSA-N 420.318 -0.782 50 10 HBGE C=C(CS(=O)(=O)NCC1(O)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)B(O)O 2282729815 SFBVOZUMUASNTM-OCZCAGDBSA-N 404.294 -0.233 50 10 HBGE C[C@H](CC(=O)NNC(=O)[C@H]1COCCO1)NS(=O)(=O)c1cccnc1Cl 760694682 CKTRXDTYYYXLOJ-NXEZZACHSA-N 406.848 -0.645 50 10 HBGE Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=O)CS(C)(=O)=O 1470662133 XHHQVKZWSNOBLC-UHFFFAOYSA-N 422.389 -0.115 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)N1 1543096962 YFZUBLGAJXOMAZ-YPMHNXCESA-N 408.842 -0.007 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@H]2C[C@@H](O)CN2C(=O)Cc2ccccc2F)CC1 1556362146 UHZXNINNEWTJHN-GDBMZVCRSA-N 407.446 -0.682 50 10 HBGE COCC(COC)N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 1653880546 MGVLBROQVUKMLD-UHFFFAOYSA-N 409.443 -0.365 50 10 HBGE O=C(NC[C@H]1CN(C2CC2)C(=O)O1)NNC(=O)c1csc(N2CCOCC2)n1 1686893386 OVZBYAPUEUZKAA-NSHDSACASA-N 410.456 -0.093 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1ncccc1B(O)O 2180984027 SRICJSBGOFQKRZ-LLVKDONJSA-N 401.250 -0.972 50 10 HBGE Cc1c(C(=O)N2CCC(NC(=O)OCc3ccccc3)CC2)c(B(O)O)nn1C 2267016991 KYJKRQZGKZHASF-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE CC[C@@H](CN(CC)S(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282069236 NIWSRJKCTDBJTI-NSHDSACASA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CCN(S(=O)(=O)c2sccc2B(O)O)CC1 2282085550 ZRQXUUOATDPUGL-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNC(=O)c1nn(C)c(Cl)c1B(O)O 2282247737 JXBDBPFTWOTYLX-VHSXEESVSA-N 400.672 -0.014 50 10 HBGE Cc1nc(S(=O)(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282336976 CVMRRWDBPHQYCP-OAHLLOKOSA-N 402.282 -0.914 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1CO 2282378057 ACSIXAPKEQGEQD-NSHDSACASA-N 420.318 -0.661 50 10 HBGE CC(C)(C)OC(=O)N1CCSC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282414248 QAEWEZMGSBIQFC-ZDUSSCGKSA-N 416.330 -0.003 50 10 HBGE C[C@@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282704651 MTIOQXJHOBPKOL-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](NS(=O)(=O)c3cc(B(O)O)cs3)[C@H]2C1 2282707440 YTJXSAUWGUIARP-WOPDTQHZSA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)c3cscc3B(O)O)CO[C@H]2C1 2282736284 NVBDJTWFXXYJPG-WCQGTBRESA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N=c2nc(B(O)O)[nH]s2)OC(C)(C)C1 2284045463 NCMIGFBWJIEKJT-DTWKUNHWSA-N 400.266 -0.571 50 10 HBGE CN(CC(C)(C)N(C)S(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2288921326 FAJOIMIYDQFVAX-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE CN(Cc1cc(B(O)O)cs1)C(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360637756 SSUGPOUCTXPWFJ-GFCCVEGCSA-N 420.318 -0.676 50 10 HBGE CN(NC(=O)[C@@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)S(=O)(=O)C1CCC1 2365267557 FMQFPZQDSZRTMD-AVGNSLFASA-N 407.489 -0.437 50 10 HBGE COc1cc(/C=N/NC(=O)CCNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OC 169892738 HDOMVWPGDIOOLQ-REZTVBANSA-N 407.343 -0.664 50 10 HBGE CCn1cnc2c1c(=O)n(CC(=O)NNC1=NCC(O)=C1)c(=O)n2Cc1ccccc1 747627055 AQABOOSYOCIGHE-UHFFFAOYSA-N 423.433 -0.097 50 10 HBGE Cc1cc(N2CCC[C@@H](N3CCN(CC(=O)NNC(=O)C4CC4)CC3)C2=O)n(C)n1 780564626 COCFILIHBVLLGL-MRXNPFEDSA-N 417.514 -0.601 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nnn(C(C)(C)C)n2)cc1 1160386000 XKRUZWQDKAPXES-UHFFFAOYSA-N 409.472 -0.182 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCS(=O)(=O)CC2)C1 1297754434 UMMCEDAFXOETTC-CYBMUJFWSA-N 418.516 -0.489 50 10 HBGE NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c(F)c1 1558458486 HMFNNKXYXCZRCP-CQSZACIVSA-N 400.432 -0.513 50 10 HBGE O=C(NNC(=O)c1cnc2n1CCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393470 OWPJRABIXZWOAG-UHFFFAOYSA-N 419.463 -0.075 50 10 HBGE CNC(=O)COc1cccc(CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1652301987 SJWHYHFMGLJQSK-KRWDZBQOSA-N 404.467 -0.245 50 10 HBGE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)c1ncc(Br)cc1B(O)O 2259121748 AMJOMOBJRBRTHO-UHFFFAOYSA-N 416.081 -0.058 50 10 HBGE C[C@@H]1CN(C(=O)c2nn(C)cc2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2266887928 LXMWVCAIOPCGOP-ZIAGYGMSSA-N 400.244 -0.029 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NS(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2267613657 DZQSAACLGIALDY-DCAQKATOSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(S(=O)(=O)c2ccc(B(O)O)cc2)C1 2282085412 YEHSLENSRJQWGS-STQMWFEESA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282739148 FBTLOWZAZHOUAS-SNVBAGLBSA-N 423.297 -0.553 50 10 HBGE C[C@@H](NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cc(B(O)O)cs1 2360531300 KBOPFBJCLQJMOW-KOLCDFICSA-N 420.318 -0.457 50 10 HBGE Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2cn(C)c3ccccc23)n(C)c1=O 16235596 SHBYEVWZETWFLL-UHFFFAOYSA-N 423.433 -0.223 50 10 HBGE COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)c1 746001747 HAJBFVAOIOJWNS-MRXNPFEDSA-N 422.438 -0.382 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=C(CO)c2ccc(F)cc2F)n(C)c1=O 749625829 HQYBECUGIKTNJU-UHFFFAOYSA-N 406.349 -0.775 50 10 HBGE Cc1cc(C(=O)NNC(=O)[C@H]2CCCO2)cc(C(=O)NNC(=O)[C@H]2CCCO2)c1 817213743 BRSMCQCNYGXLSK-HUUCEWRRSA-N 404.423 -0.125 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CC2(C1)CS(=O)(=O)C2 1289975753 GKBTYSUQPJZALN-UHFFFAOYSA-N 414.509 -0.126 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1290349520 SULXODPHUIEFSP-NWDGAFQWSA-N 404.489 -0.880 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCO[C@H]2C)CC1 1452257609 KAKGIBSEBFKLOL-GXTWGEPZSA-N 413.500 0.000 50 10 HBGE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c(OC)c1 1623368230 KJKCRPVCRXJPTI-UONOGXRCSA-N 404.423 -0.266 50 10 HBGE CON1CCC(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1 1638390026 IALYWRNTVLTAJW-UHFFFAOYSA-N 412.516 -0.266 50 10 HBGE C[C@@H](CC(=O)NNC(=O)c1ccc(=O)n(C)c1)/N=C1/NS(=O)(=O)c2ccccc21 1639797818 SDXCWNLYULZCEE-NSHDSACASA-N 417.447 -0.336 50 10 HBGE CN1C(=O)CN(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1=O 1648432368 DWFRDXJNRWJIEI-UHFFFAOYSA-N 417.451 -0.238 50 10 HBGE CN1CCN(Cc2ccccc2)[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282074074 JUNMANWFXHNCFR-INIZCTEOSA-N 409.342 -0.478 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)[C@@H](CO)C1 2282853368 BXFWCBRCTJLNEF-GFCCVEGCSA-N 420.318 -0.829 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(B(O)O)n1C 2282865766 YPWNXEJUTJTSIR-KOLCDFICSA-N 402.282 -0.915 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)NCc2ccc(B(O)O)s2)C1 2284124071 DAGUFKGUMWIXIJ-LLVKDONJSA-N 418.302 -0.922 50 10 HBGE O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCc2nncn2C1 814284339 URUATYHYEPQSDE-MRXNPFEDSA-N 412.498 -0.007 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)N1 1131722425 DZEYETAQXFUQGU-GJZGRUSLSA-N 408.480 -0.346 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 1149617802 TXWNPEHVWJQHCE-RYUDHWBXSA-N 403.457 -0.840 50 10 HBGE O=C(NNC(=O)[C@H]1CCN1C1CCOCC1)[C@@H]1Nc2ccccc2S(=O)(=O)N1 1303881529 MURZOIZBUOGKIM-UKRRQHHQSA-N 409.468 -0.883 50 10 HBGE CN1C(=O)CO[C@H](C(=O)NNC(=O)COc2ccccc2O)[C@H]1c1cccnc1 1443611069 SJFYZSZNPNQJHJ-MSOLQXFVSA-N 400.391 -0.088 50 10 HBGE CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCC(=O)N1)C2=O 1470497689 ISOIHQJPJBTQPX-WZEQGRABSA-N 407.471 -0.061 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(=O)c2cnn(C)c21 1624376968 YJRVYJUTQUIKJI-UHFFFAOYSA-N 403.420 -0.250 50 10 HBGE COC(=O)[C@H]1C[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1 1630996546 LTGALVQELYBPTI-IYBDPMFKSA-N 402.451 -0.209 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNS(=O)(=O)c2sccc2B(O)O)C1 2267201259 LUEWPEJIXURQJN-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@H]2CN1S(=O)(=O)c1ccc(B(O)O)s1 2267207633 DHCRKKQRBBJLFX-GARJFASQSA-N 402.303 -0.038 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267610886 LEWMPXQVUKCGPN-QGZVFWFLSA-N 422.272 -0.821 50 10 HBGE CCc1nc(C(=O)NCCN(C[C@@H](C)O)C(=O)OC(C)(C)C)c(B(O)O)s1 2282450903 ILLOHDBWVXODFQ-SNVBAGLBSA-N 401.294 -0.267 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(S(=O)(=O)c2sccc2B(O)O)C1 2282707427 YRAMJJVPXPYHGF-CQSZACIVSA-N 420.274 -0.830 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ncc(B(O)O)s1)[C@H](O)C(F)(F)F 2284060643 PSYZFGCAYIRLGO-IUCAKERBSA-N 413.183 -0.744 50 10 HBGE Cn1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)cc1C(=O)NCC(F)(F)F 775675685 IIEWGBRMDUNTTA-SNVBAGLBSA-N 414.362 -0.958 50 10 HBGE C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1457480968 TVGJILAPYDXZLW-ABAIWWIYSA-N 405.432 -0.332 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cn[nH]c3)CC2)c1 1530259672 OSOBALMZHNGYSM-UHFFFAOYSA-N 406.468 -0.369 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccn2nnnc2c1 1545424420 ZKQQAAPYEIHXND-UHFFFAOYSA-N 408.422 -0.657 50 10 HBGE COc1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1OCC(=O)NC(C)C 1557735080 SEGMXEDGFNKASX-UHFFFAOYSA-N 401.441 -0.596 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2S1(=O)=O 1586892255 CCOYIJPAUWVVKS-ZDUSSCGKSA-N 407.408 -0.882 50 10 HBGE CCN1CCN(C(=O)[C@H](Cc2ccccc2)NC(=O)c2cccc(B(O)O)c2)CC1 1607436665 KNHGBDIKKBZWAL-FQEVSTJZSA-N 409.295 -0.128 50 10 HBGE COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NN(C)C[C@@H](C)O)c1OC 1638568226 QEGVGTBRLBCJKB-GFCCVEGCSA-N 417.484 -0.318 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1sccc1B(O)O 2267208667 LUVVIKQGDSORJL-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE O=S(=O)(NCC[C@@H]1CN(Cc2ccccc2)CCO1)c1cc(B(O)O)cs1 2282071077 NADKFCQIISQHBM-MRXNPFEDSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1ccccc1B(O)O 2282102238 JWUBINOSRGGFOJ-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE O=C(OCc1ccccc1)N1CC2(CC=CCN2C(=O)c2ncncc2B(O)O)C1 2282216858 NRRPDWNUOOZZOP-UHFFFAOYSA-N 408.223 -0.050 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)n1 2282728664 GRPUVGLUGFAMOK-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1cnsc1B(O)O)OCc1ccccc1 2315645457 ORWMGWJEJBGGEB-UONOGXRCSA-N 405.241 -0.363 50 10 HBGE N#C/C(=C/N1CCN(S(=O)(=O)c2ccccc2)CC1)C(=O)N(CCO)CCO 217122056 VCPWWJUOIXOJKR-NXVVXOECSA-N 408.480 -0.786 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)Cc2ccccc2F)C1 806037690 QTMJOADKTLWZCC-CYBMUJFWSA-N 401.464 -0.031 50 10 HBGE Cn1ncc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 807567259 POEMTEFJEDSPEI-UHFFFAOYSA-N 407.456 -0.256 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(=O)n(C)c2)CC1 1160865510 OUKAIEHNUOJWKE-UHFFFAOYSA-N 406.468 -0.527 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 1293967188 OZXAKSIOIWUCIM-UHFFFAOYSA-N 420.513 -0.568 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCC(=O)N(c3cnn(C)c3)C2)C[C@@H](C)O1 1457496817 JLRISBXLVTVIGS-QLFBSQMISA-N 406.487 -0.190 50 10 HBGE Cc1ccc(C)c(OCC(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1 1540451855 JOYDLQGRJVZMBR-UHFFFAOYSA-N 407.452 -0.026 50 10 HBGE C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(=O)n(C)c1)C2=O 1616316987 WZVLZECOIIWRAB-SLAYPKMVSA-N 403.439 -0.107 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c(F)c2)C1 1654294863 LWNJBJGCWLMZBM-IUCAKERBSA-N 404.395 -0.597 50 10 HBGE CCO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN(C)C 1683987385 VWXDWKJDPIPGSC-AWEZNQCLSA-N 415.516 -0.152 50 10 HBGE Cc1cc(CNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)sc1B(O)O 2082337703 JSFRETDNHQHBLM-UHFFFAOYSA-N 422.293 -0.158 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3sccc3B(O)O)C[C@H]2C1 2267201533 PYJVWNDMOXUABV-PHIMTYICSA-N 402.303 -0.085 50 10 HBGE Cn1ncc(C(=O)N2CCC(CNC(=O)OCc3ccccc3)CC2)c1B(O)O 2267303823 DQCMLFZAFMMKOZ-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE COCC1(NS(=O)(=O)c2ccc(B(O)O)cc2)CN(C(=O)OC(C)(C)C)C1 2282080153 GJTHFKPPGGBNKV-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE CC[C@](C)(CNC(=O)OC(C)(C)C)N(C)S(=O)(=O)c1cc(B(O)O)nn1C 2282086837 QULWYVQQOGQRJJ-OAHLLOKOSA-N 404.298 -0.586 50 10 HBGE C[C@@H]1C[C@H](CNS(=O)(=O)c2cc(B(O)O)nn2C)CN1C(=O)OC(C)(C)C 2282087222 UAGMUKVFOBUQLJ-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE Cn1cc(C(=O)N=[S@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282262916 UTBPPAWHCXFGHG-HHHXNRCGSA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](CNS(=O)(=O)c2cscc2B(O)O)CO1 2282364818 YNQBLZBIMNLPCV-QWRGUYRKSA-N 420.318 -0.364 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1[C@@H](OC)[C@@H](OC)CN1C(=O)OC(C)(C)C)B(O)O 2282376434 DONMTRMNQRZKQQ-FRRDWIJNSA-N 408.282 -0.877 50 10 HBGE O=S(=O)(c1sccc1B(O)O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2282701459 APHYCQMBPKOBPQ-CVEARBPZSA-N 408.310 -0.298 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@H](C(=O)O)C1 2282715630 JBYHYGPZPGLUTE-JTQLQIEISA-N 420.274 -0.878 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1sc(C)cc1B(O)O 2283971153 XFSPHHFHKXOYDF-GFCCVEGCSA-N 400.262 -0.191 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(Cl)cc1B(O)O 2284048585 OWRPLJVVUGBRJS-RWMBFGLXSA-N 400.624 -0.701 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[C@@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2366863845 UIFYYFMGUNHNBP-DCAQKATOSA-N 417.318 -0.360 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[C@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2366863846 UIFYYFMGUNHNBP-GARJFASQSA-N 417.318 -0.360 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)[C@H]1CC(=O)N(CCN2CCOCC2)C1 748357744 GHHDAVRQTVOVOQ-RDJZCZTQSA-N 402.451 -0.682 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2c(F)ccc(F)c2F)n(C)c1=O 773388399 DAGFQTBKDVAMMT-UHFFFAOYSA-N 410.312 -0.688 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1Cc2ccc(Br)cc2C(=O)O1 1454277252 KAQVBALAJBCEAA-SNVBAGLBSA-N 405.226 -0.277 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1 1586190967 CTOKMYIGZGVOAS-UHFFFAOYSA-N 403.482 -0.333 50 10 HBGE CC(C)(C)C(=O)N1CCO[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1 1629043017 OTBTXZSQEOPSEZ-CQSZACIVSA-N 401.427 -0.303 50 10 HBGE NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@@H]2COCCO2)c1 1630358784 XBYJWZYZWVRXLH-JTQLQIEISA-N 408.230 -0.727 50 10 HBGE CCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)C2CC2)c2ccccc2c1=O 1673648929 QIUUXPWIXOGYHY-UHFFFAOYSA-N 407.452 -0.062 50 10 HBGE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267614069 ITGSJDZSEJJDLY-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNS(=O)(=O)c2ccc(B(O)O)s2)CC1 2282080735 NAUFHDDVZRBNEQ-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@](O)(CNS(=O)(=O)c2sccc2B(O)O)C1 2282084601 WXJLNGWHOVIZQQ-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC(C)(NC(=O)OC(C)(C)C)C1 2282362635 IJQKLMYOPKUUNP-UHFFFAOYSA-N 400.262 -0.337 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282710238 LTRACJSKUAOLMO-KGLIPLIRSA-N 400.262 -0.721 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@H](F)C1 2282736483 RHLUIXQXKIFHPG-NXEZZACHSA-N 423.297 -0.410 50 10 HBGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282857500 JCNJTRDCUCDLFH-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCOC1CN(C(=O)OC(C)(C)C)C1 2362284571 IGIACUSZSLJJSG-UHFFFAOYSA-N 420.318 -0.349 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1COCCO1 744644944 MSDPTJPRVOYKKH-NSHDSACASA-N 411.358 -0.454 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccnn2C)CC1 776149946 ZLNIURNTJCLDTQ-UHFFFAOYSA-N 407.500 -0.173 50 10 HBGE CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H]2CCC(=O)N2)c1 1131508448 PWEWBRWDMNVRSO-CYBMUJFWSA-N 400.432 -0.106 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3cn(C)nn3)CC2)cc1 1557479565 UPJUNYMSZBWFRF-FPLPWBNLSA-N 413.438 -0.510 50 10 HBGE C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1687213147 YQOWUTNXHIMVIP-JTQLQIEISA-N 419.891 -0.072 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2cccc(B(O)O)c2)C1 2282103245 OVWYMBHEWNDGDZ-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCCN(OC)C(=O)OC(C)(C)C 2282735532 BWTFHTXCHBVGGT-UHFFFAOYSA-N 404.250 -0.548 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2C[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282741827 SYWBQLLBMNROKM-KOLCDFICSA-N 402.282 -0.915 50 10 HBGE O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 731620659 DWQDHEZHSZCCCN-MGPQQGTHSA-N 416.500 -0.831 50 10 HBGE CN(C)c1c(C=NNC(=O)CNC(=O)OCc2ccccc2)c(=O)n(C)c(=O)n1C 807986772 UJOBSOJRFSFJFF-UHFFFAOYSA-N 416.438 -0.474 50 10 HBGE O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@H]1CCc2nncn2C1 816882536 HOKIEIXROBWVCB-LBPRGKRZSA-N 424.458 -0.114 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)COB2O 1135416607 JENNOGYMSHYNDH-UHFFFAOYSA-N 402.241 -0.419 50 10 HBGE COc1nc(N2CCN(C(=O)c3cccc(B(O)O)c3)CC2)ncc1Br 1137153465 DSDHYABYXOHTMJ-UHFFFAOYSA-N 421.060 -0.110 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)[C@@H]2CCCCO2)c1 1141463051 CXBJJZFSRCECBB-AWEZNQCLSA-N 412.468 -0.617 50 10 HBGE COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)CC1=O 1149616765 AHPJUJBPEPODPL-VIFPVBQESA-N 403.844 -0.107 50 10 HBGE CS(=O)(=O)N1CC(C(=O)NNC(=O)COc2ccc(Br)cc2)C1 1440754762 ZVNVTFRENJOHNV-UHFFFAOYSA-N 406.258 -0.133 50 10 HBGE CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1456039822 UVINPGBJVBAPLG-JKSUJKDBSA-N 416.544 -0.019 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)CN1CCCC1=O 1557979144 YPCJOCDIRIEXII-UHFFFAOYSA-N 411.436 -0.609 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCC(=O)O3)CC2)cc1 1566278873 UUDNHPOHLQKIKM-OAHLLOKOSA-N 424.479 -0.846 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CS1(=O)=O 1636726113 SEVHZDUHBAXGKQ-MNOVXSKESA-N 407.452 -0.157 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2ncc(Br)cc2B(O)O)[C@H](O)C1 2217204230 GYEKZPFISAPWOK-WDEREUQCSA-N 402.054 -0.084 50 10 HBGE CCc1nn(C)c(C(=O)N[C@H]2CCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267021932 AJYOGUWNRDDCNB-AWEZNQCLSA-N 400.244 -0.197 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@](CO)(NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282077544 XDWJWIZIXSYLSH-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CON(CCCNS(=O)(=O)c1ccc(B(O)O)cc1F)C(=O)OC(C)(C)C 2282364803 YMHUVVWWRMOAPX-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE C[C@@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282704652 MTIOQXJHOBPKOL-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)Nc1cc(Cl)ccc1B(O)O 2284131172 SPXLEWFEXTZICL-RWMBFGLXSA-N 400.624 -0.701 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2365477147 KUIOYBNCHKBNOX-SNVBAGLBSA-N 422.696 -0.162 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)N2CC[C@@](C)(B(O)O)C2)C1 2368342583 IPCGZXHSQCSGLN-MLGOLLRUSA-N 404.294 -0.124 50 10 HBGE O=C(NCC1CC1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 731617449 KXKMUUIUWKADSY-MELADBBJSA-N 400.501 -0.164 50 10 HBGE CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)[C@H]2COCCO2)cc1 744649160 FSQCUJPBGALWSW-CQSZACIVSA-N 401.441 -0.222 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cc3ccccc3o2)n(C)c1=O 766642883 HKFGZYBQUOWMBR-UHFFFAOYSA-N 410.390 -0.430 50 10 HBGE CN(C)S(=O)(=O)c1ccc(NNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1 794716856 GJALZFIOMFESGD-YHYXMXQVSA-N 407.452 -0.509 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnn2cc(Br)cnc12 1319715653 NWFAJGJFTAPZMV-ZETCQYMHSA-N 402.230 -0.313 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CS(=O)(=O)C[C@H]1OC 1470765224 XBRQXXONGCWTLD-SMDDNHRTSA-N 401.441 -0.394 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)c1c[nH]nc1I 1626422854 UELFZWRZPQFJRH-UHFFFAOYSA-N 403.136 -0.202 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267609051 KSHNQGLCCAQNQZ-DLOVCJGASA-N 402.303 -0.038 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(C)c(B(O)O)s1 2267619271 PEWOMUXHDPTSMT-UHFFFAOYSA-N 406.291 -0.092 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 2269794051 RYXAWSQFYQYUSE-SNVBAGLBSA-N 408.307 -0.676 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c(B(O)O)n1C 2282332059 VUVKFPCDEFKBID-SNVBAGLBSA-N 402.282 -0.962 50 10 HBGE Cc1cn([C@@H]2C[C@H](O)[C@H](CNC(=O)CI)O2)c(=O)[nH]c1=O 40368807 NWGXFMGORNLEMS-NRPADANISA-N 409.180 -0.955 50 10 HBGE Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 766635327 HQMMCRVYYIZSIM-LBPRGKRZSA-N 414.422 -0.643 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 1149617415 LUASNYJVSHFADM-UHFFFAOYSA-N 421.472 -0.194 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCCCO2)cc1OC 1637662967 KSFYNRSHLMJZEB-ZDUSSCGKSA-N 401.441 -0.301 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)C(OC)OC)CC2)cc1OC 1647549061 LXBUESLJYWWUGH-UHFFFAOYSA-N 424.454 -0.772 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(Br)c2ccccn12 1648534791 UGHVFQQAJNYWRN-SSDOTTSWSA-N 404.246 -0.205 50 10 HBGE COC1(CNS(=O)(=O)c2sccc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2267211481 PJZYVACTAQPZET-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE COC1(CCNC(=O)c2csnc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2267444064 RDGXKJZZYOZYEO-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2268721856 RCUHFXITHMVCPY-SJCJKPOMSA-N 420.256 -0.606 50 10 HBGE CC(=O)N1CCN(C(=O)C(C#N)=CN(CCN(C)C)[C@@H]2CCS(=O)(=O)C2)CC1 2324851735 IDXVHIJSBZLHJX-QGZVFWFLSA-N 411.528 -0.865 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)N3CCOCC3)CC2)c1 728953922 ZLUQTUZNDRETBH-UHFFFAOYSA-N 422.467 -0.893 50 10 HBGE CCc1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)oc1CC 768290604 KWRBWTAMMXEJPM-UHFFFAOYSA-N 402.411 -0.387 50 10 HBGE O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)[C@H]1CCc2nncn2C1 816876080 OFEMMKGQKDOPPL-QMMMGPOBSA-N 411.216 -0.227 50 10 HBGE CN1CCO[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1=O 1149649786 PUQQZGXNDUKWCN-KRWDZBQOSA-N 423.901 -0.538 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)C(F)(F)Oc2ccccc2)[C@H]1c1cnn(C)c1 1293939047 VTLHYCXCAXNCPS-MGPQQGTHSA-N 423.376 -0.271 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2S1(=O)=O 1361061950 ARFTZDUODSMJFZ-UHFFFAOYSA-N 415.378 -0.050 50 10 HBGE O=C1N[C@@]2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)C[C@H]3C[C@@H]1[C@H]2C3 1446963909 RQCQPDMYWJWHPS-OXIWPEFWSA-N 406.302 -0.273 50 10 HBGE O=C(N[C@H](CO)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)OCc1ccccc1 1596923970 ZCBVBWMCHKZXAW-IAGOWNOFSA-N 420.466 -0.326 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@@](C)(NC(=O)C(F)(F)F)C2)sc1B(O)O 2267625173 LFBTURQLDCSAIJ-LLVKDONJSA-N 400.209 -0.432 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282337243 KCKZEKQONISTLI-LLVKDONJSA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282419006 SEWQJMGDLGOWFI-UHFFFAOYSA-N 420.318 -0.781 50 10 HBGE Cc1c(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282431843 ZAYWQCGFMDAQKO-LSDHHAIUSA-N 416.243 -0.778 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1cscc1B(O)O 2282725218 YCKGVAUASTXSQA-FYBVGQRMSA-N 414.236 -0.106 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282855129 ZSEHVUPXVMHSCT-UHFFFAOYSA-N 420.318 -0.781 50 10 HBGE CN(C)[S@@](=O)(=NC(=O)[C@@H]1C[C@@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2359275995 MOOIJANQYHKNCX-NZYNRKLISA-N 404.298 -0.212 50 10 HBGE O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNC(=O)[C@H]1COCCO1 745781802 VZCZWMHCVCTSHV-HZPDHXFCSA-N 406.439 -0.159 50 10 HBGE O=C(COC(=O)C1(N2CCOCC2)CCC1)NNC(=O)[C@@H]1COc2ccccc2O1 769815317 IGGPTCRASDYDAJ-INIZCTEOSA-N 419.434 -0.228 50 10 HBGE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 1319998558 XQNFEFFQYVZKQW-SNVBAGLBSA-N 423.900 -0.214 50 10 HBGE COCCn1cc(N2C[C@H](C(=O)NNC(=O)Cc3ccccc3O)CC2=O)cn1 1557705840 LCGYMFMWWLXRDE-CQSZACIVSA-N 401.423 -0.022 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267368054 CVSPELOLHCVGLO-RYUDHWBXSA-N 402.303 -0.049 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CN(S(=O)(=O)c3cscc3B(O)O)C[C@H]2C1 2267386930 BDBVFBQQGDAQGO-GHMZBOCLSA-N 402.303 -0.085 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267614026 IEMXXCLUKKBJTF-GHMZBOCLSA-N 406.291 -0.660 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 2282082566 KHUXSOIEUMDSTM-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2282430330 CXCQDGQXXJOLNL-CABCVRRESA-N 416.243 -0.778 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2337136424 DLQMULOTTJDQCU-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@@](C)(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2362456403 OBIDAAFWTZOSFL-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE CCN1CCN(CC(=O)NNC(=O)c2cc(Br)cn2C)C(=O)C1=O 45876647 MVUTVWISVUIKOH-UHFFFAOYSA-N 400.233 -0.761 50 10 HBGE C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)[C@@H]1COCCO1 745981777 ZNNNQPYWOANSMA-LIRRHRJNSA-N 402.407 -0.452 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@](C)(O)Cn1ccccc1=O 790483803 SLWSOYVYQQOMBG-GOSISDBHSA-N 421.479 -0.338 50 10 HBGE C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)[C@@H]1COCCO1 801756880 YICMJKZTTBCFDG-JSGCOSHPSA-N 400.457 -0.511 50 10 HBGE O=C(NNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCS(=O)(=O)C1 1136389823 LBDOXIIUBLOONX-NSHDSACASA-N 418.422 -0.068 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCO[C@H]3C)CC2)cn1C 1526606312 VDAZROMLZVKLBX-FZMZJTMJSA-N 413.500 -0.298 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3C[C@@H](C)CO3)CC2)cc1 1545424396 YVXWQDXCPRLHDG-NVXWUHKLSA-N 424.523 -0.126 50 10 HBGE CN(CC(=O)NNC(=O)c1ccc(=O)n(C)c1)C1=NS(=O)(=O)c2ccccc21 1558637044 IEUPAQMGOWIOET-UHFFFAOYSA-N 403.420 -0.773 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F 1635877715 HZUDCOTUDBKLKV-ZFWWWQNUSA-N 406.414 -0.900 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2cccnc2)C[C@H](C)O1 1638063375 QZJLPUKOFFETNP-QAMTZSDWSA-N 419.482 -0.373 50 10 HBGE COCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(Br)ccc1O 1641335428 WYPXLPNOHWGNMA-UHFFFAOYSA-N 424.273 -0.128 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)CC2=O)cn1 1645964140 YBENEAKMXBAIRS-YPMHNXCESA-N 406.443 -0.070 50 10 HBGE CCS(=O)(=O)CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 1681990419 OIGWSQNINPGJNY-UHFFFAOYSA-N 405.502 -0.252 50 10 HBGE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1sccc1B(O)O 2282069738 URJNFQHSJAQROG-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CC[C@H]1[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282091280 FMPMBXXLDFEZQH-RYUDHWBXSA-N 402.282 -0.834 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2ccccc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282105378 KAKONWCFIVBLGH-STQMWFEESA-N 400.262 -0.721 50 10 HBGE Cn1cc(C(=O)N=[S@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)nc1B(O)O 2282245664 FQIYMKFMCFBHHM-JGFSIVIASA-N 400.266 -0.747 50 10 HBGE C[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282717659 MPXFOUVPIODYGX-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CN(C(=O)OC(C)(C)C)C1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)CC1 2282741733 RWUHYAVCPLINGT-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE O=C(O)C1(COCc2ccccc2)CN(S(=O)(=O)c2cscc2B(O)O)C1 2284395755 PCPJYWQSVXHMRN-UHFFFAOYSA-N 411.266 -0.280 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734772355 YHPJXLMLPQYNTJ-XNRPHZJLSA-N 409.464 -0.203 50 10 HBGE CS(=O)(=O)N1CCN(CC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)CC1 790323422 WWZSGSPABQXKCA-RDJZCZTQSA-N 410.496 -0.716 50 10 HBGE CS(=O)(=O)C[C@@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1 1292038201 CNPDNFOADYQFJI-CHWSQXEVSA-N 403.482 -0.668 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN[C@H]2C(=O)NCC23CCOCC3)cc1OC 1308108258 FFOKZFBJLYFRRV-INIZCTEOSA-N 406.439 -0.650 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NCCSC)cc1OC 1566434188 JCMMNJMKDAZARW-UHFFFAOYSA-N 422.554 -0.160 50 10 HBGE CN(NC(=O)[C@H]1CCS(=O)(=O)N1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1638030108 GHDBYTXDAVCSEQ-LLVKDONJSA-N 405.477 -0.686 50 10 HBGE O=S(=O)(NC[C@]1(O)CCCN(Cc2ccccc2)C1)c1cc(B(O)O)cs1 2282065612 NMVGYQBBNXHKPZ-QGZVFWFLSA-N 410.326 -0.267 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(B(O)O)s2)CCOCC1 2282071513 SHJWNTSESHDJSY-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE CN(C[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1)C(=O)OC(C)(C)C 2282079320 UTXDUTUDGLSOFF-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1C[C@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2282341423 RWUVHHHWUMIKHA-FOGDFJRCSA-N 417.318 -0.360 50 10 HBGE Cn1cc(C(=O)N=S2(=O)CCC(NC(=O)OC(C)(C)C)CC2)c(B(O)O)n1 2282390876 PKIONAIVKSMBQE-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE O=C(NNC(=O)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1)[C@H]1COCCO1 746003270 OVLJTVSSQFDIGH-DLBZAZTESA-N 417.466 -0.434 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1456035933 FLURCGZECPQDJE-ZDUSSCGKSA-N 413.475 -0.972 50 10 HBGE CN(NC(=O)c1cc(B(O)O)ccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1466673346 GDPQIIDKCXROLB-UHFFFAOYSA-N 424.238 -0.245 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 1471221888 FKUUHIZZSSLSLR-INIZCTEOSA-N 422.507 -0.002 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1539175368 XENRISDOMGEDDL-GVAFMPQTSA-N 404.467 -0.117 50 10 HBGE CNC(=O)C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1564770984 OITKMEFHQBKRKG-GFCCVEGCSA-N 411.484 -0.060 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2S1(=O)=O 1586892254 CCOYIJPAUWVVKS-CYBMUJFWSA-N 407.408 -0.882 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2ccc(F)c(Cl)c2)n(C)c1=O 1622153619 MNIPFNGLJPFUBS-UHFFFAOYSA-N 422.804 -0.384 50 10 HBGE Cc1nn(C)c(C(=O)N(C)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267399303 FZBVQQMAUGNEPK-HNNXBMFYSA-N 400.244 -0.109 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2267614125 JUTNTDHCAMDDSV-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cc1c(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)c(B(O)O)nn1C 2281837620 IQSJPTOMKHMOOG-UHFFFAOYSA-N 400.266 -0.733 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2281914464 VEICXFFBSRNWPT-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNS(=O)(=O)c2sccc2B(O)O)C[C@@H]1O 2282074129 RUBOYFLKYLYFJJ-WCQGTBRESA-N 420.318 -0.630 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282081097 AHFWFPLRSNDDEP-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O 2282362665 AJFUTZQUCHGOAK-WDEREUQCSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2cscc2B(O)O)CCOCC1 2282375518 QJJFCOOTVHITPC-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282738121 PTUKJLNISIEGDL-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE COc1ccc(C(=O)N/N=C(\c2nc3ccccc3[nH]c2=O)[C@@H](O)[C@H](O)CO)cc1 5285633 UTIQURRKVVUIES-QCTGNACTSA-N 412.402 -0.220 50 10 HBGE CN1CCC[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 748552657 IKVXYBNUOZTMNC-KRWDZBQOSA-N 424.523 -0.118 50 10 HBGE CCc1c(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cnc2c1c(=O)n(C)c(=O)n2C 753988608 YEDPGRVQPPWXLJ-OAHLLOKOSA-N 423.429 -0.041 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1cnc(I)c(O)c1 1302583103 PECNFXIETRBUKK-UHFFFAOYSA-N 404.164 -0.225 50 10 HBGE O=C(c1cn(C[C@@H]2CCOC2)nn1)N1CCN(S(=O)(=O)CBr)CC1 1466474930 CLBNAMOYACMBNR-NSHDSACASA-N 422.305 -0.245 50 10 HBGE CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cn2)CC1 1585526056 WCZQDNMCLURYJS-UHFFFAOYSA-N 404.257 -0.905 50 10 HBGE CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1596923197 LCAQBKHGUOLVMH-AWEZNQCLSA-N 412.468 -0.222 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2nn(C)cc2I)cn1 1635211678 NWYBGUOHJDVQPM-UHFFFAOYSA-N 403.184 -0.098 50 10 HBGE CC(C)(C)C(=O)NNC(=O)CN1CCC(NS(=O)(=O)NCC(F)(F)F)CC1 1642781579 BTODFEJDDNRPEF-UHFFFAOYSA-N 417.454 -0.369 50 10 HBGE Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1645053763 KNJHNXVDNZBVET-INIZCTEOSA-N 424.523 -0.018 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNc2ncc(Br)cc2B(O)O)C1 2217196254 DMJXDJRFCNKRIV-UHFFFAOYSA-N 402.054 -0.082 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2sccc2B(O)O)C1 2267202885 JIUJTABVOYRGOP-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE C[C@@H]1CN(C(=O)c2cnn(C)c2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267321707 LZEDKMVBOYIITN-ZIAGYGMSSA-N 400.244 -0.029 50 10 HBGE Cn1nc(C(=O)NC[C@]2(NC(=O)OC(C)(C)C)CCOC2)c(B(O)O)c1Cl 2281652007 YJWUJNBCXVZCSL-OAHLLOKOSA-N 402.644 -0.833 50 10 HBGE CN(C[C@@H](O)CN(C)C(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2281653746 XBNAHMPKUJQKET-VIFPVBQESA-N 404.660 -0.947 50 10 HBGE O=C(OCc1ccccc1)N1CC2(CC=CCN2C(=O)c2ncc(B(O)O)cn2)C1 2281916311 OTRWMVMBDULVNB-UHFFFAOYSA-N 408.223 -0.050 50 10 HBGE COC(=O)[C@@H](CCNS(=O)(=O)c1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2282080497 KMAYEBBJIXPBRS-SECBINFHSA-N 422.290 -0.837 50 10 HBGE CCN(CCNS(=O)(=O)c1ccc(OC)c(B(O)O)c1)C(=O)OC(C)(C)C 2282366021 HZPZIAGOVOHXAG-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@H]21 2282384872 RXCJOENZENURSA-ZYHUDNBSSA-N 417.318 -0.406 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282706120 HYYJKUULQWWCDE-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CCCN(C(=O)OC(C)(C)C)[C@@H]1COC[C@@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2283945618 CZLNJYYOMFSHGR-VHSXEESVSA-N 400.266 -0.760 50 10 HBGE CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1 746002925 NUARVSVAKBIPLW-QGZVFWFLSA-N 419.482 -0.039 50 10 HBGE CCN1CCN(c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2F)CC1 758045603 DHAGPUSFOYTVEA-GFCCVEGCSA-N 415.491 -0.334 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C\C=C(Cl)Cl)n(C)c1=O 1137299505 UAPMTQMUWXOJIL-HYXAFXHYSA-N 401.210 -0.544 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)c(OC)c1 1292881517 HEZZIEQOAYGUSF-ZDUSSCGKSA-N 406.370 -0.210 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]3OCCNC(=O)[C@H]32)cc1OC 1308023755 NOLKZFNFPJCDBW-YOEHRIQHSA-N 406.439 -0.556 50 10 HBGE C[C@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(F)n1 1454096892 CLKRTBNYYMGHIQ-QPUJVOFHSA-N 402.429 -0.229 50 10 HBGE COC(=O)[C@@H]1O[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C[C@H]1C 1546252097 QSMSXTJPYMLYCN-GMTAPVOTSA-N 413.290 -0.221 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1cccc(B(O)O)c1 2267212908 VXITXABBUSBRLL-RUZDIDTESA-N 406.291 -0.322 50 10 HBGE CCc1nc(C(=O)NCCN(CCOC)C(=O)OC(C)(C)C)c(B(O)O)s1 2281647251 IUFXYQUTMHIYTN-UHFFFAOYSA-N 401.294 -0.001 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2ccc(B(O)O)cc2F)COC1 2282356289 SLICRQLQLYKXTO-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cc(C)c(B(O)O)s2)C[C@@H]1NC(=O)OC(C)(C)C 2282371505 KKDDHXCREVUMKC-QWRGUYRKSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2cccc(B(O)O)c2)CC1 2282723226 OTMVZNVBOQQYJP-UHFFFAOYSA-N 418.302 -0.226 50 10 HBGE COC(=O)[C@@H](CC(=O)Nc1nc(B(O)O)ccc1Cl)NC(=O)OC(C)(C)C 2284011974 ROOIYSGWTURXSP-SECBINFHSA-N 401.612 -0.190 50 10 HBGE Cc1cc(B(O)O)ccc1NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360571636 JUUCOYRLUHXPLO-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2ccccc2B(O)O)C1 2362309400 PCZJCLVSERBMGY-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE CCS(=O)(=O)NCCS(=O)(=O)NNC(=O)c1ccc(Br)cc1 79047705 MRCHUYGWDRELJS-UHFFFAOYSA-N 414.303 -0.047 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1cnc[nH]1 1440620465 ABGZMFBMGVQYLX-UHFFFAOYSA-N 421.479 -0.247 50 10 HBGE CCOC(=O)CON=C(C(=O)NN(C)C(=S)NCCCOC)c1cc[nH]n1 1540420368 OFJJNHKTIJFAAQ-UHFFFAOYSA-N 400.461 -0.433 50 10 HBGE CSCCNC(=S)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 1623164752 PNWNQAQCJWOUEL-UHFFFAOYSA-N 419.554 -0.218 50 10 HBGE CCOC(=O)CS[C@H](CNC(=O)NNC(=O)[C@@H]1COCCO1)C(F)(F)F 1684893561 OMBRIJFAJXHUMF-DTWKUNHWSA-N 403.379 -0.041 50 10 HBGE COCCN1C(=O)C(=CNNC(=O)C(=O)Nc2ccc(C)cc2)C(=O)NC1=S 2040480096 HSTWBIPBPCKVFQ-UHFFFAOYSA-N 405.436 -0.672 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282262917 UTBPPAWHCXFGHG-MHZLTWQESA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)Cc1cccc(B(O)O)c1 2282330118 VMJPPCSEAGDLKG-UONOGXRCSA-N 400.262 -0.922 50 10 HBGE Cc1nc(S(=O)(=O)NCCN(C(=O)OC(C)(C)C)C(C)C)c(B(O)O)n1C 2282335694 SUYJSSSIUFIRAJ-UHFFFAOYSA-N 404.298 -0.668 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC[C@]2(C)CNC(=O)OC(C)(C)C)n1 2282362425 GBYDMRDBZSLBMH-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CN(NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O)S(=O)(=O)C1CCC1 2365320985 NPTABMKMMBNXGO-MLGOLLRUSA-N 407.489 -0.436 50 10 HBGE C[C@H](C(=O)N(C)CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)n1cccn1 794071195 GPSNMTKEHLSKJM-CQSZACIVSA-N 416.438 -0.024 50 10 HBGE COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NNC(=O)[C@@H]2CCC(=O)N2)cc1OC 1131723239 NXKGVLHCWOLVDH-ORAYPTAESA-N 406.439 -0.433 50 10 HBGE CN1CCN(S(=O)(=O)c2cccc(NC(=O)c3cc(B(O)O)ccc3F)c2)CC1 1142160329 QNDOHVOAIKRDQV-UHFFFAOYSA-N 421.259 -0.306 50 10 HBGE O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)[C@H]1CCC(=O)N1 1168010897 ZFIDVEITEJMVNI-OAHLLOKOSA-N 403.439 -0.633 50 10 HBGE CC(C)(C)OC(=O)C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1 1170990278 KIAARZRKPADENF-UHFFFAOYSA-N 415.450 -0.195 50 10 HBGE Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)C3CCOCC3)cnc21 1288226384 OEYNURRNFHIIBY-UHFFFAOYSA-N 413.232 -0.534 50 10 HBGE COC1(C(=O)NNC(=O)COc2ccc(Br)cc2)CS(=O)(=O)C1 1351659980 GISSIVONLAMQGB-UHFFFAOYSA-N 407.242 -0.211 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)N1 1543096959 YFZUBLGAJXOMAZ-AAEUAGOBSA-N 408.842 -0.007 50 10 HBGE COCCCn1c(S)nc2cc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)ccc2c1=O 1633925849 RQVXUSHRBPYOCZ-GFCCVEGCSA-N 419.463 -0.239 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1641071950 TUJYLIFRTKPSAO-UHFFFAOYSA-N 420.513 -0.956 50 10 HBGE C#CC[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1674887482 GUIQYPLIDNOQAJ-HNNXBMFYSA-N 424.479 -0.310 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CCOc2ncccc2B(O)O)C1 2240280461 JOUMYNPGOWEOCI-GFCCVEGCSA-N 400.262 -0.436 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)cc1 2267616620 WRKOYNJJFNWNRC-RUZDIDTESA-N 406.291 -0.322 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](OCCNS(=O)(=O)c2cscc2B(O)O)C1 2282378817 LEJUBFAFCDYCEO-NSHDSACASA-N 420.318 -0.268 50 10 HBGE Cc1nn(C)c(C(=O)NC2CC3(C2)C[C@H]3NC(=O)OCc2ccccc2)c1B(O)O 2282391240 RUJZRXNQEFOVEX-RDYUPDBUSA-N 412.255 -0.014 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)n1 2282739786 PNIVIXMTFJTEFV-VXGBXAGGSA-N 402.282 -0.786 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCN(CC(=O)O)Cc1ccccc1 2284412646 WRXDAXPYOTXGDJ-UHFFFAOYSA-N 412.298 -0.399 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@](C)(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2362456402 OBIDAAFWTZOSFL-GFVXYOJSSA-N 400.266 -0.653 50 10 HBGE CC(C)(C)OC(=O)N1CC(C(=O)NCc2cc(B(O)O)cs2)(S(C)(=O)=O)C1 2379803900 YEOKFKCIWFKKTD-UHFFFAOYSA-N 418.302 -0.922 50 10 HBGE Cn1cccc1C(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 731598750 XIBGRLAQAJYJGA-MELADBBJSA-N 410.496 -0.104 50 10 HBGE COCCNC(=O)Cn1cc(NC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cn1 756838470 MVGQBUIXWTVJOU-OAHLLOKOSA-N 402.411 -0.198 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(CNC(=O)NNC(=O)[C@@H]2COCCO2)C1 1248485622 RAJXXFRGNNDWND-SJCJKPOMSA-N 402.448 -0.242 50 10 HBGE CN1CCCN(S(=O)(=O)c2cccc(NC(=O)c3cccc(B(O)O)c3)c2)CC1 1292791216 AVYGXIMFZOGENH-UHFFFAOYSA-N 417.296 -0.055 50 10 HBGE CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1301441892 QQMPBDULNQCNIZ-KGLIPLIRSA-N 408.480 -0.271 50 10 HBGE COC(OC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1465790580 QWIJHIIHGIFIFF-UHFFFAOYSA-N 414.484 -0.932 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)ccc1Cl 1530230383 FMBRHTMRWCYYTC-SNVBAGLBSA-N 404.832 -0.439 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C 1652258388 PHYYNBJOMATKAK-OLZOCXBDSA-N 411.459 -0.730 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@H](B(O)O)C2)[C@@H]2CS(=O)(=O)C[C@H]21 2281876781 IBVQGCNLECIJII-FDYHWXHSSA-N 402.278 -0.516 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282064798 FLIYTMATXJKXBZ-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCc1nc(NS(=O)(=O)c2sccc2B(O)O)n[nH]1 2282064872 GDGKVESJWMRWFG-UHFFFAOYSA-N 417.278 -0.586 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)n1 2282256134 ZLJPHTDDJQKGMP-DLBZAZTESA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282359265 LNYLTHYKQCDGFO-UHFFFAOYSA-N 400.237 -0.253 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282727137 WPDBQBKYVWREJJ-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2365478123 SYUGDRUEOXAQCW-SNVBAGLBSA-N 406.241 -0.677 50 10 HBGE CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)CNC(=O)c1cccs1 726276811 CNCADHMWWJSVNW-CYBMUJFWSA-N 424.527 -0.249 50 10 HBGE COc1cc(C(=O)NNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc(OC)c1OC 809723438 WMOMMZYIVBMEDQ-SREVYHEPSA-N 418.406 -0.416 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 817213842 IQGYSJZTKAMWTL-KWCYVHTRSA-N 401.416 -0.724 50 10 HBGE CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CC1 1290349556 UMRWCUYYUIJBKT-YPMHNXCESA-N 405.542 -0.194 50 10 HBGE O=C(Cn1cnc(-c2ccccc2)cc1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1292046087 ZLGDJSSOYQTFSN-CYBMUJFWSA-N 405.436 -0.572 50 10 HBGE CN1CCN(Cc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)s2)CC1 1442179464 CKYYSEQIVRHXLQ-LBPRGKRZSA-N 415.541 -0.373 50 10 HBGE CN1C[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)NC1=O 1545432946 SVMNZNMMMLOIIS-HNNXBMFYSA-N 408.890 -0.371 50 10 HBGE CNC(=S)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 1629332127 VSVFCWBRQXRFEY-UHFFFAOYSA-N 402.498 -0.203 50 10 HBGE O=C(Cc1csc([C@H]2CCS(=O)(=O)C2)n1)NNC(=O)CN1CCCC1=O 1635878052 PFWMWMQXSKQXOG-JTQLQIEISA-N 400.482 -0.643 50 10 HBGE O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(B(O)O)ccc1F 1636580184 ZVPKBPVLSCDIGI-IRXDYDNUSA-N 411.242 -0.166 50 10 HBGE CC(C)(C)OC(=O)NCCOCCCNS(=O)(=O)c1ccc(B(O)O)s1 2267615391 BUZDMXSWWYUVIZ-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282071938 XXTFRUFCFPIGBS-RYUDHWBXSA-N 420.318 -0.269 50 10 HBGE C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282711063 WXPVJMQKDQUWNR-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N=S1(=O)CC2(CN(C(=O)c3cnsc3B(O)O)C2)C1 2337342340 FFROHMKVKQJDGW-UHFFFAOYSA-N 401.275 -0.318 50 10 HBGE Cc1ccc(C(=O)NNC(=O)COC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1 10936684 UCFARYCUETYWCB-CMDGGOBGSA-N 400.391 -0.590 50 10 HBGE COc1ccc([C@@H](CNC(=O)NNC(=O)[C@@H]2COCCO2)N2CCOCC2)cc1 745289703 OPCKTDPLNFQPRU-SJORKVTESA-N 408.455 -0.186 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc(-n3cccc3)ccn2)n(C)c1=O 805191981 VVTRWMSZDFFSAU-UHFFFAOYSA-N 422.405 -0.919 50 10 HBGE C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816877836 DJXWGBIIOOLUOI-FTLABTOESA-N 403.443 -0.511 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1 1290182173 YDPMQLSLRLPIDZ-LBPRGKRZSA-N 406.370 -0.454 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1437641094 SDNOQNRXODZZNL-LOWVWBTDSA-N 408.484 -0.127 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)N1 1470496824 ATPJRYIBUHFHRP-SECBINFHSA-N 402.379 -0.555 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cn(C)nn2)nc1I 1538899634 QTEUTQUWSJFDRC-UHFFFAOYSA-N 402.152 -0.102 50 10 HBGE C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1558458811 LQRZQWSZBJAJBF-DYESRHJHSA-N 416.478 -0.206 50 10 HBGE CSCCNC(=S)NNC(=O)[C@@H]1CN(C)C(=O)CN1C(=O)OC(C)(C)C 1623164743 PJUZPPPFRAINQA-JTQLQIEISA-N 405.546 -0.078 50 10 HBGE C[C@@]1(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCS(=O)(=O)N1 1623873109 XRGIOAQLMNRHPZ-AWEZNQCLSA-N 403.486 -0.787 50 10 HBGE O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H]2CO)cc1)c1cccc(B(O)O)c1 1627186341 NMVCUHLUHHYHLW-INIZCTEOSA-N 404.253 -0.236 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1639934469 JJTBHMZMQVSHMD-XPABHHOTSA-N 415.512 -0.332 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)C1CCCC1 1683688855 JFRJSMWOWMCFKO-APIJFGDWSA-N 417.532 -0.161 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCCc2ccc(B(O)O)cc21 2088910679 YCMKOQIGYCRDQE-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE C[P@]1(=O)C[C@@H](Br)[C@H](NS(=O)(=O)N2CCS(=O)(=O)CC2)C1 2177839453 OTFVTRCBUODGCL-OOSSNNJISA-N 409.264 -0.310 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083494 JCQICGUJDQZVEV-QWHCGFSZSA-N 402.253 -0.008 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCC(C)(C)NC(=O)OC(C)(C)C 2282358839 FQGMXFRMHFQHAB-UHFFFAOYSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282719574 OAFGCUAZFCWYOV-CHWSQXEVSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2S(=O)(=O)c1ccc(F)cc1B(O)O 2282721087 KXTQZDYNXCIRFW-RYUDHWBXSA-N 400.237 -0.112 50 10 HBGE N#CC(=CN1CCN(Cc2ccc3c(c2)OCO3)CC1)C(=O)N(CCO)CCO 2318468216 KUHLQOQTYBIBTL-UHFFFAOYSA-N 402.451 -0.246 50 10 HBGE CN(CC(=O)NNC(=O)c1cnn[nH]1)S(=O)(=O)c1ccc(Br)cc1 729457829 RKOSYKZCABCWTE-UHFFFAOYSA-N 417.245 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)[C@H]1CCC(=O)N1)=NO2 1301442848 ZCNMCWXKJUPZIN-LLVKDONJSA-N 409.443 -0.042 50 10 HBGE CCN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)[C@@H]1c1cccc(C)c1 1306514105 LRKDOJPAXZQXNN-INWMFGNUSA-N 410.496 -0.010 50 10 HBGE CCN1CC[C@H]1C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1629793269 PEWQPDUQXFEYPM-KRWDZBQOSA-N 423.539 -0.457 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1ccnnc1 1630210695 XOQCLLBNORZXRO-UHFFFAOYSA-N 411.465 -0.437 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNc1ncc(Br)cn1 1683460118 PSBUBVIEVHJZST-ZDUSSCGKSA-N 401.221 -0.507 50 10 HBGE CC(C)(C)OC(=O)N1CC(Oc2ncc(Br)cc2B(O)O)(C(=O)O)C1 2223653312 PSXDHXVQMNVKDV-UHFFFAOYSA-N 417.021 -0.023 50 10 HBGE CC(C)(C)OC(=O)N1CC(NC(=O)c2scc(B(O)O)c2Cl)(C(N)=O)C1 2267446821 ZLVSBTKUUOBLDF-UHFFFAOYSA-N 403.653 -0.714 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282718055 RKFCCYUNZFOTCU-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCC1(C)CN(C(=O)OC(C)(C)C)C1 2282719428 MGWSNTCOOMGDPB-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CO[C@H](C(=O)N=c1nc(B(O)O)[nH]s1)C1CCN(C(=O)OC(C)(C)C)CC1 2284059845 JCKUFWRHAAWCIT-JTQLQIEISA-N 400.266 -0.760 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2ccsc2B(O)O)C1 2288539228 HIBYNDDKYQCCSC-UHFFFAOYSA-N 406.216 -0.225 50 10 HBGE Cc1ccc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)cc1F 773262803 QCYMVIROCJEGND-UHFFFAOYSA-N 401.464 -0.345 50 10 HBGE COc1ccccc1CC(=O)NNC(=O)N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1 806037192 HMCQWNUEHWRWEL-CQSZACIVSA-N 413.500 -0.161 50 10 HBGE CCC[C@H](O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1540406720 PSQVFMIMURXVLN-INIZCTEOSA-N 413.496 -0.052 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@@H](C(=O)NNC(=O)[C@H]2COCCO2)C1=O 1634837876 KLCUJCDHXMKWRY-QWHCGFSZSA-N 414.459 -0.688 50 10 HBGE O=S1(=O)CCC(S(=O)(=O)N[C@H]2CS(=O)(=O)C[C@H]2Br)CC1 2177849669 OVJUCBYACUXSNW-BDAKNGLRSA-N 410.333 -0.957 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2cscc2B(O)O)CCOC1 2267419917 UDNFERJVMNKDIA-CQSZACIVSA-N 406.291 -0.610 50 10 HBGE Cn1cc(C(=O)N=[S@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1 2281905527 BSQIUMRQMXGZKQ-FLESLCNUSA-N 400.266 -0.653 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@]1(C)CCCN1C(=O)OC(C)(C)C 2282069384 PFYTUUUXMFAGTP-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2OCCN(S(=O)(=O)c3ccc(B(O)O)s3)[C@@H]2C1 2282075072 QKXFZILUMPQJMG-GHMZBOCLSA-N 418.302 -0.563 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2282363421 NQIFUKDAVLNHIC-WZRBSPASSA-N 420.318 -0.223 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)c(B(O)O)nn1C 2282439283 ZJVABEWYXKTRFT-RWXBIINUSA-N 402.282 -0.440 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282722548 IHVZZMXPOZUPNW-QWHCGFSZSA-N 400.262 -0.721 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCC1CCN(S(C)(=O)=O)CC1 1225603386 ZPXPMBSMUFMRPU-UHFFFAOYSA-N 419.548 -0.069 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)nn1 1531950010 JDQWAGCEAFFMLD-INIZCTEOSA-N 423.792 -0.164 50 10 HBGE O=C(NNC(=O)c1ncccn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 1585301770 LGIAORCHUOAKIQ-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)C1 1625566965 AKFNYKGVCHWOFQ-XMZIXOGTSA-N 402.473 -0.239 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2C[C@]2(F)c2ccccc2)n(C)c1=O 1635500607 KSPJALSJILBXNH-BUXKBTBVSA-N 414.397 -0.534 50 10 HBGE CC(=O)NCC(=O)NCC(=O)NNC(=O)COc1ccccc1Br 1644567848 TVUOHTLPKDNWQU-UHFFFAOYSA-N 401.217 -0.772 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267201590 QMVHKCPIRGNKBR-SFYZADRCSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267206593 IRNZHVGJVSJXRW-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CNS(=O)(=O)c1cncc(B(O)O)c1)C(F)(F)F 2282102907 OECAVBHWVVHNKP-JTQLQIEISA-N 413.183 -0.505 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282334375 AJINFKTUNPUIBL-WDEREUQCSA-N 402.282 -0.868 50 10 HBGE COCC1(CNS(=O)(=O)c2ccc(B(O)O)s2)CN(C(=O)OC(C)(C)C)C1 2282410167 VNKDHIDFPFCVMK-UHFFFAOYSA-N 420.318 -0.410 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccccc2B(O)O)CCO1 2282713474 FRDYXRQSGAQWLQ-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)n1 2282732407 GGXQDTSGMFAUIU-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@@H](C)N1C(=O)OC(C)(C)C 2282732728 KSQHLUKNTMAOAM-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282734774 QAXBKICXHOSAIN-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282738120 PTUKJLNISIEGDL-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE COCCn1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)C)n[nH]2)cn1 59887355 YGXINSOLWLEHRK-OMCISZLKSA-N 409.476 -0.011 50 10 HBGE CO[C@@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)n1 750287063 IEPOTMFGIHELOA-QWHCGFSZSA-N 412.447 -0.559 50 10 HBGE COC/C=C\C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1149621489 ADILBMKIQXXQNP-ARJAWSKDSA-N 410.496 -0.349 50 10 HBGE C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc2)C1 1301698237 XTRPZVXLTZSIQL-GFCCVEGCSA-N 417.509 -0.087 50 10 HBGE CC(C)[C@@H](NS(C)(=O)=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1 1597885337 FWDYXHBDJMGNND-SNVBAGLBSA-N 420.351 -0.613 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2Cc3ccc(Cl)cc32)n(C)c1=O 1635500642 METBTDMKBNWPHV-GFCCVEGCSA-N 416.825 -0.426 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1 1638300425 PMDPNJOLIGXIPW-LBPRGKRZSA-N 405.498 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN2S(=O)(=O)Cc2ncsc2B(O)O)C1 2267393319 XDEURQWARFBYHS-UHFFFAOYSA-N 403.291 -0.652 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCCO1 2282070005 XPVZYEHLAHSJGD-LBPRGKRZSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(F)cc1B(O)O 2282360418 CGTZAKWWGDEPHE-LJWDBELGSA-N 400.237 -0.208 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COCC[C@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2282375422 PCRGJTCEABRMFN-MNOVXSKESA-N 420.318 -0.303 50 10 HBGE CC(C)(C)OC(=O)N1CCC(COCC(=O)N=c2nc(B(O)O)[nH]s2)CC1 2284038523 IRMHQEVCOROIAV-UHFFFAOYSA-N 400.266 -0.758 50 10 HBGE CC(=O)NNC(=O)C[S@](=O)CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 586355040 ZMBDBOVDKXOCIO-MUUNZHRXSA-N 407.452 -0.661 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1cccc(B(O)O)c1F 704309371 DKVRNNIJGPBMRR-UHFFFAOYSA-N 406.200 -0.067 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@@H]1CCCCN1S(=O)(=O)c1cccs1 744642813 FIIOMWWJGKCGMP-NWDGAFQWSA-N 403.482 -0.146 50 10 HBGE COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)CCOC(C)C)c(OC)c1 747907849 OCMOGFWVPIGKOV-UHFFFAOYSA-N 403.457 -0.191 50 10 HBGE Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1 756100811 OOGUXSIDGRQHNS-UHFFFAOYSA-N 403.367 -0.482 50 10 HBGE CN(C)CCn1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1 763578187 MSBOLLMCEMPALJ-OAHLLOKOSA-N 402.411 -0.629 50 10 HBGE Cn1ccn2c(CCNC(=O)NNC(=O)COc3ccccc3F)nnc2c1=O 1255504944 VPZOZEVJUBWPEB-UHFFFAOYSA-N 403.374 -0.481 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 1442186046 USPFZJILBFFUIU-GFCCVEGCSA-N 419.504 -0.943 50 10 HBGE CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1449162942 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CN([C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)c1ccc(B(O)O)s1 2267208376 YHVNJHKWRWTZOP-DDFAGTSDSA-N 402.303 -0.086 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267209905 CHPVYVNQGNBJTR-NXEZZACHSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2267471962 LUWMZISBFOZJOA-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)n1 2282377230 OITGDUZRRDCUFE-ZYHUDNBSSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282709067 VBRXHZOQYZGPKR-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282717657 MPXFOUVPIODYGX-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)CC1 731682355 WVPXTXIFIJZJJI-MRXNPFEDSA-N 410.496 -0.171 50 10 HBGE CCn1nc2c(cc1=O)CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC2 742428437 NIBZDWOVOIWJIL-UHFFFAOYSA-N 400.395 -0.009 50 10 HBGE Cc1cccc(C(=O)NNC(=O)COC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 744626202 QEZYZPXFLZSOGY-FPLPWBNLSA-N 400.391 -0.590 50 10 HBGE CCn1nc(C(=O)NNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc2c1=O 809749305 FCDWUJWKMWUMCZ-KTKRTIGZSA-N 424.417 -0.712 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)nc1I 1131722436 FLGNJJAMHPMYEX-LURJTMIESA-N 404.164 -0.266 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1156083029 CEZJFPIHUDXIEJ-QPKSUZNQSA-N 422.438 -0.694 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)N[C@@H]1CCN(S(C)(=O)=O)C1 1312954680 RSSOHNJQOBNXFF-SECBINFHSA-N 408.278 -0.235 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1558459449 UVFQWMQYRBAVBR-KGLIPLIRSA-N 400.476 -0.337 50 10 HBGE CC[C@@H](CC(F)(F)F)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1566278778 QZHXBWOYKKIRSI-QMMMGPOBSA-N 404.349 -0.440 50 10 HBGE C=CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(=O)n(C)c2)s1 1598526175 ABUJSLOUHYADLF-UHFFFAOYSA-N 410.477 -0.085 50 10 HBGE COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)c2cccc(B(O)O)c2)cc1 1630379166 QYQNUNWNZACQQB-UHFFFAOYSA-N 405.237 -0.616 50 10 HBGE O=C(NNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)[C@@H]1C(=O)Nc2ccccc2C1=O 1637585407 ZMBIBDUNVOUEMM-WCQGTBRESA-N 401.297 -0.069 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1cc(B(O)O)ccn1 2029312073 OIVVESYQQBCQDK-UHFFFAOYSA-N 403.225 -0.421 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2267366650 IXYHAGZAFHEWML-XHDPSFHLSA-N 402.303 -0.143 50 10 HBGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282073331 MQVODINIJQPCDF-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H](C(=O)O)C1 2282074198 JZSAUJVIUNFZDJ-VIFPVBQESA-N 420.274 -0.878 50 10 HBGE C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1nn(C)cc1B(O)O 2282373082 IAQQSXMHKDEZKI-JTQLQIEISA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)Cc1ccc(B(O)O)cc1 2282735886 HRLHIRIBCRVLAI-MRXNPFEDSA-N 402.278 -0.939 50 10 HBGE 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O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2cc(B(O)O)ccc2C1 2093517683 YMPDFWWYMKTQOO-UHFFFAOYSA-N 414.248 -0.650 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cscc1B(O)O 2267625347 NYKSWMUWWGSMRM-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE Cn1ncc(C(=O)N=[S@]2(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1B(O)O 2282249737 MOSCGYDQFVOMED-JGFSIVIASA-N 400.266 -0.747 50 10 HBGE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NC(=O)c1cc(B(O)O)c(Cl)s1 2282391939 SRJJFRWMGVVCPU-UHFFFAOYSA-N 415.668 -0.091 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)c1ncsc1B(O)O)C(=O)O 2289798459 WZPACBCLJAWMMC-SECBINFHSA-N 401.250 -0.299 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)N(C)C1 575232478 UHQYIIRIOVIPLI-AGSLPUCNSA-N 410.964 -0.001 50 10 HBGE O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)[C@H]1Cc2ccccc2O1 732066177 JRPLIIDHKAERMO-QZTJIDSGSA-N 416.478 -0.149 50 10 HBGE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2 758030948 UHGABNLQOMFUFZ-IONNQARKSA-N 423.417 -0.006 50 10 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COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1cn(C)nn1)CC2 1470083272 IQFMALQFWBSDDE-UHFFFAOYSA-N 416.438 -0.042 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N[C@H](C)CO)cc1 1628717490 BBWOABCKSOHTHO-GFCCVEGCSA-N 418.541 -0.167 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)cc1OC 1685317612 PJOIANQXFLWIIW-INIZCTEOSA-N 401.441 -0.149 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267393126 TXVPWMKAVZDKAB-SNVBAGLBSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@@H](CO)C1 2282074489 MOHJPUNKVYMOEP-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1C(=O)c1ccc(B(O)O)s1 2282211036 NXMDNQBGJMBRTN-MRXNPFEDSA-N 400.262 -0.844 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282851697 FYSFHBPHPJSNPP-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816881900 RWAMQKPGMFOODA-RJAOAUJVSA-N 417.470 -0.265 50 10 HBGE 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Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@H](NC(=O)C(F)(F)F)[C@@H](C)C1 2282383693 CJRJIFNDVQBQCS-CBAPKCEASA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCCO1 2282508334 VAKBTWIBYGDXLH-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@@H](NS(=O)(=O)c1ccccc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2282718395 XBERLEDVJVVBKS-LLVKDONJSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N(CCCO)CCC(=O)N=c1ccc(Cl)c(B(O)O)[nH]1 2368596193 FCHZZGMKIMDZSV-UHFFFAOYSA-N 401.656 -0.215 50 10 HBGE CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816879423 OHGDXIBANIGNTR-BUXKBTBVSA-N 417.470 -0.121 50 10 HBGE CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(Cl)c1 1135771373 JIYUYWIUORMAGK-MRVPVSSYSA-N 409.873 -0.093 50 10 HBGE CO[C@]1(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CCS(=O)(=O)C1 1297752534 FWAGZUKRJFIGKP-SJKOYZFVSA-N 419.500 -0.015 50 10 HBGE COCCOCC(=O)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 1643166517 QDQDOAODEPFTRT-UHFFFAOYSA-N 407.395 -0.171 50 10 HBGE CCS(=O)(=O)c1cnc(O)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1 1648397466 XDIMHAJYCACRND-TXEJJXNPSA-N 414.484 -0.159 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NCC2(S(=O)(=O)N(C)C)CC2)cc1 1685217951 IIABQCZDOSPFOQ-UHFFFAOYSA-N 400.457 -0.172 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282099011 BDUXERPXMAHGDV-NWDGAFQWSA-N 403.241 -0.613 50 10 HBGE CN([C@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2282363004 LBABULNAZAVLQW-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282380381 IGOOHMFWVVQGRJ-WDEREUQCSA-N 402.282 -0.786 50 10 HBGE O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)[C@@H]1COCCO1 744642114 PACUPYQPIVBYNS-LBPRGKRZSA-N 421.269 -0.073 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 748284299 MAORWHNAQKWMDQ-DOMZBBRYSA-N 420.447 -0.697 50 10 HBGE CC1(C)CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCS1(=O)=O 756932607 IISREPXKEUYGRX-UHFFFAOYSA-N 410.500 -0.057 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN3CCOCC3=O)CC2)cc1 790890908 LALUEGRWRSVRII-UHFFFAOYSA-N 403.483 -0.881 50 10 HBGE COc1cnccc1N1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1 792882289 LIXKZMPQNFESGU-UHFFFAOYSA-N 402.411 -0.024 50 10 HBGE O=C(COC(=O)[C@]12[C@H]3C(=O)[C@H]4[C@H]5C[C@@H]([C@@H]41)[C@@H]2[C@H]53)NNC(=O)[C@@H]1COc2ccccc2O1 800250240 FAHYMFFFBSBBKE-FMXMXLBHSA-N 424.409 -0.156 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)n(C)c1 816876109 OPRVMCSDZSQODF-LBPRGKRZSA-N 423.499 -0.329 50 10 HBGE CNC(=O)CN1CCCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1 1176304632 IVIRJEOBSKFFEE-UHFFFAOYSA-N 407.471 -0.782 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(S(=O)(=O)NCc2ccccc2)CC1 1300385686 KSYCGQLHAFOSKY-UHFFFAOYSA-N 421.259 -0.702 50 10 HBGE CCOC(=O)CS[C@@H](CNC(=O)NNC(=O)[C@H]1CCC(=O)N1)C(F)(F)F 1479166505 PZHYEQOKRZFCTR-SFYZADRCSA-N 400.379 -0.177 50 10 HBGE CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)cc1OC 1618468519 JPXINLYEKAAZKN-LBPRGKRZSA-N 413.452 -0.452 50 10 HBGE COc1ccc(NC(=S)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cn1 1644017192 WKEYHMCYZPBXDL-UHFFFAOYSA-N 411.469 -0.448 50 10 HBGE Cc1cc(O)nc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)n1 1648342684 WPDMVTWNZZMGGB-UHFFFAOYSA-N 405.484 -0.232 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1csnc1B(O)O)OCc1ccccc1 2255581723 QRFRILDXLOLPPU-KGLIPLIRSA-N 405.241 -0.363 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@H]1NC(=O)C(F)(F)F 2267387986 QVLROGCHIGKSDM-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE Cc1nc(S(=O)(=O)NCC2(N(C)C(=O)OC(C)(C)C)CC2)c(B(O)O)n1C 2282850337 NTBPKNAMHDPCIZ-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)c1cc(B(O)O)sn1)C(=O)O 2289803934 WRMNUWSZDRNHDL-SECBINFHSA-N 401.250 -0.299 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C/c2ccc3[nH]ccc3c2)n(C)c1=O 765800798 BNEHLLBJGZXRCW-GQCTYLIASA-N 421.417 -0.224 50 10 HBGE Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2CCOCC2=O)cc1 790515937 VOLXQTPCIVZECY-UHFFFAOYSA-N 404.452 -0.273 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cn(C)cn3)nc2)CC1 1313404075 IUNPHCGCDONBCU-UHFFFAOYSA-N 408.488 -0.423 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)ccc1=O 1463154627 ALAOWWPJYYKZJL-OAHLLOKOSA-N 404.448 0.000 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CCCOC1 1463792403 MZURGSYUTJAMEK-SJCJKPOMSA-N 419.500 -0.110 50 10 HBGE CCn1nc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CN(C)CCN2C)c2ccccc2c1=O 1471601612 MIBQZMZBWUSWMZ-CJNGLKHVSA-N 415.498 -0.005 50 10 HBGE Cn1ncc(I)c1CNC(=O)c1cc(B(O)O)ccc1F 1644212931 ANBMNBYKVPFMDF-UHFFFAOYSA-N 402.960 -0.226 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1 1648450082 AZWCKXPBCNGSQS-UHFFFAOYSA-N 416.275 -0.418 50 10 HBGE CN(C(C)(C)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267393130 UBENUDYCWRJISM-UHFFFAOYSA-N 407.323 -0.112 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC1(CNC(=O)OC(C)(C)C)CCC1 2282076400 HQLDTHMPZADFME-UHFFFAOYSA-N 402.282 -0.927 50 10 HBGE COc1cc(C(=O)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc(OC)c1OC 11776252 WMOMMZYIVBMEDQ-VOTSOKGWSA-N 418.406 -0.416 50 10 HBGE Cc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(Cl)n1 766641666 BCKIFSIGJQWBST-UHFFFAOYSA-N 405.802 -0.748 50 10 HBGE CN(CCNC(=O)NNC(=O)[C@@H]1COCCO1)S(=O)(=O)c1ccc(F)cc1 798066904 KDIITKGWZDOVBH-ZDUSSCGKSA-N 404.420 -0.808 50 10 HBGE CS(=O)(=O)CC1(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)COC1 1135291733 IFUCZISOPGAXED-UHFFFAOYSA-N 424.523 -0.593 50 10 HBGE CN1CC(=O)Nc2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cnc21 1350198160 HISUFYKAGWGGNI-UHFFFAOYSA-N 403.420 -0.052 50 10 HBGE CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)ccc1F 1533744611 KYLTYUYPEPQSKL-NSHDSACASA-N 400.432 -0.058 50 10 HBGE Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc(=O)n(C)c1 1536984836 PGTGVXYYHHOMKC-UHFFFAOYSA-N 421.479 -0.027 50 10 HBGE CN(C)c1ncc(Br)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)n1 1597431282 AHJCWOGJFZNKCX-ZETCQYMHSA-N 421.277 -0.564 50 10 HBGE COC1(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CS(=O)(=O)C1 1636371100 ZIMWSMHYCKVUIR-LLVKDONJSA-N 405.473 -0.406 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1ncc(B(O)O)s1 2268642390 SCHSNVBPCWBWGE-QMMMGPOBSA-N 407.279 -0.911 50 10 HBGE Cn1nc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2F)c(B(O)O)c1Cl 2281651582 RJIXPSWHOZORRO-IUCAKERBSA-N 404.635 -0.169 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282334471 BSEFHXIIGMZLSD-JTQLQIEISA-N 404.298 -0.810 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)COC1 2282344855 XKDVQJDJFUXDBL-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)n1 2282377228 OITGDUZRRDCUFE-JQWIXIFHSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1F 2282720880 HREKTXQEHGPVOT-NWDGAFQWSA-N 404.225 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)Cc1ncsc1B(O)O 2334266894 ITMUPWYNCRQQBR-LSJOCFKGSA-N 403.291 -0.750 50 10 HBGE CS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794069436 GTZOZCDIQBVMPJ-AWEZNQCLSA-N 412.468 -0.126 50 10 HBGE CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)C1 1456041400 ZCUODNQCCNZLIS-HIFRSBDPSA-N 402.517 -0.551 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2cnn(C)c2)c1 1540327730 PYKADMVSQPUNIV-OAHLLOKOSA-N 409.468 -0.055 50 10 HBGE C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@@H](C)S(C)(=O)=O 1624128183 SWYKYKMQSNDZCB-NXEZZACHSA-N 405.336 -0.118 50 10 HBGE CCN1CCN(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)CC1 1631773420 VZJXXFCGEWBGPI-UHFFFAOYSA-N 411.366 -0.160 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@@](F)(C(=O)NNC(=O)[C@@H]2COCCO2)C1 1634838629 UZRCLWNIYYWYDE-GTNSWQLSSA-N 403.407 -0.475 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c1 1685318419 XNCDULLQCUOIDV-MRXNPFEDSA-N 401.441 -0.149 50 10 HBGE N#CC1=C(C(=O)NCC2(O)CCN(C(=O)Cc3cc(O)nc(O)n3)CC2)CCC1 2087917972 LPTPYJLLLTXYBT-UHFFFAOYSA-N 401.423 -0.096 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267606779 CRWYCCJVVYVPII-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267614027 IEMXXCLUKKBJTF-MNOVXSKESA-N 406.291 -0.660 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2267626614 LEZUJEJNNRDCJT-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](F)CN1S(=O)(=O)c1cncc(B(O)O)c1 2282097355 DRPNHIXFWVDSCQ-NWDGAFQWSA-N 403.241 -0.613 50 10 HBGE CN([C@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)c1nn(C)cc1B(O)O 2282372385 APOWHJYHZSJSKG-GFCCVEGCSA-N 402.282 -0.976 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2COCCN2C(=O)OC(C)(C)C)sc1B(O)O 2282728749 HFUWICVIKAJORE-NSHDSACASA-N 420.318 -0.349 50 10 HBGE Cc1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(=O)[nH]c1C 764752789 OLPFYFNJDLXRDS-UHFFFAOYSA-N 412.450 -0.394 50 10 HBGE Cc1ccc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 774062325 IUBOTFUJNOKZLX-UHFFFAOYSA-N 402.386 -0.267 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccccc2C(F)F)n(C)c1=O 1137299370 POSJTRVNLRDKEA-UHFFFAOYSA-N 406.349 -0.168 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)[C@H]1CCCN(S(C)(=O)=O)C1 1456006079 QRMZRIDEBRDKIB-NWDGAFQWSA-N 404.489 -0.185 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)CC1 1556361805 IPAGGAKRAFMHTG-CYBMUJFWSA-N 410.862 -0.698 50 10 HBGE C[C@@H](O)[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1565676299 DAKQFOAHBJNUQW-CJNGLKHVSA-N 418.498 -0.104 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccsc1B(O)O 2267370646 OQONERSFJHIHSL-LLVKDONJSA-N 408.307 -0.925 50 10 HBGE Cc1c(C(=O)N2CCC[C@@H](NC(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2278565691 QJLZRSAHXHGQDF-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE Cn1nc(C(=O)N2CCOC[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281656076 FZZMPJYYTPAWBN-SECBINFHSA-N 402.644 -0.881 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282380630 LYSOHGMNIKWJAB-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@H](NC(=O)C(F)(F)F)[C@H](C)C2)sc1B(O)O 2282738637 XPUWYCHLMBYVQW-BDAKNGLRSA-N 414.236 -0.186 50 10 HBGE Cn1ncc(CNS(=O)(=O)c2cscc2B(O)O)c1NC(=O)OC(C)(C)C 2282740506 ANUYESUKDUEPIW-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE COC(=O)[C@@H](CC(=O)N(C)Cc1sccc1B(O)O)NC(=O)OC(C)(C)C 2283937204 TZOLLTJPMNWXTD-LLVKDONJSA-N 400.262 -0.157 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@H](B(O)O)C2)S(=O)(=O)C(C)(C)C1 2368347305 BKRWNBSMFHLWQU-NWDGAFQWSA-N 404.294 -0.126 50 10 HBGE Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)C(F)(F)Oc2ccccc2)cn1C 741709415 KCIDNSIMBVFNKX-UHFFFAOYSA-N 417.394 -0.174 50 10 HBGE O=C(NNS(=O)(=O)c1cc2c(cc1Br)OCCO2)[C@@H]1COCCO1 745979543 VJEUIKHUJVHKAV-NSHDSACASA-N 423.241 -0.055 50 10 HBGE O=C(COc1ccc(Br)cc1)NNC(=O)NNC(=O)[C@@H]1COCCO1 746002278 JORURBUWGXSIIY-NSHDSACASA-N 417.216 -0.395 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)c1cn(CCO)nc1C1CCOCC1 1156184481 UEVCVOBRYSEVKA-KRWDZBQOSA-N 421.498 -0.216 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCN1C(=O)CCc2cc(F)ccc21 1306513768 CZNCCYXIRQCDAK-SNVBAGLBSA-N 400.432 -0.420 50 10 HBGE O=C(CN1CCCC2(CC2)S1(=O)=O)NNC(=O)C1CCN(c2ncccn2)CC1 1528896746 APMVRIWFEGLGSA-UHFFFAOYSA-N 422.511 -0.201 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CS1(=O)=O 1565030593 DJSHZFLNDOVZJD-TZMCWYRMSA-N 410.500 -0.011 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@@H]2COCCN2C(=O)OC(C)(C)C)ccc1=O 1637557878 MDBYJNFDMGIAPR-CYBMUJFWSA-N 409.443 -0.035 50 10 HBGE Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)c1C 1682730216 FUHBUFMPURBORC-CYBMUJFWSA-N 401.489 -0.203 50 10 HBGE O=C(N[C@H]1CC[C@H]1NS(=O)(=O)c1cncc(B(O)O)c1)OCc1ccccc1 2255678170 AKGMLDXBIMWUAJ-JKSUJKDBSA-N 405.241 -0.503 50 10 HBGE Cc1c(C(=O)N[C@H]2CCCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2267349977 BTQIQPZBZZUWDU-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)CCO1 2267379495 YUEUENHPCWNFCY-VIFPVBQESA-N 407.279 -0.817 50 10 HBGE Cn1nc(C(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c(B(O)O)c1Cl 2281651859 WHJTUYYIJBAXRV-VIFPVBQESA-N 402.644 -0.881 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNS(=O)(=O)c2sccc2B(O)O)CC1 2282065095 JBGSLTWSXAPQOE-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE CC(C)(C)OC(=O)NCCc1nc(NS(=O)(=O)c2cc(B(O)O)cs2)n[nH]1 2282070636 HKNZGGLCZPLNKV-UHFFFAOYSA-N 417.278 -0.586 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282072225 BTVGWKQLWCXQGA-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2(B(O)O)CCC2)[C@H]2CS(=O)(=O)C[C@H]21 2282165205 AOKQJDAZLURWAB-NWDGAFQWSA-N 402.278 -0.372 50 10 HBGE Cn1cc(C(=O)N=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C)nc1B(O)O 2282252242 XLUANFNQQUDFMG-HHHXNRCGSA-N 402.282 -0.357 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](NC(=O)C(F)(F)F)C1 2282730013 WAKOVOZJEQHKAE-VXNVDRBHSA-N 414.236 -0.186 50 10 HBGE CCOCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 731280244 PSNUCDWFAHJIAM-UHFFFAOYSA-N 406.486 -0.364 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(S(C)(=O)=O)CC2)c(OC)c1 759412934 JSQBPVBTARZRMQ-UHFFFAOYSA-N 400.457 -0.958 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)CC2 1152745672 MEXCEWQBOHLUEL-NSHDSACASA-N 406.306 -0.025 50 10 HBGE CCn1cc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1 1160865820 ZYCFRYUWSOSUQI-UHFFFAOYSA-N 408.488 -0.685 50 10 HBGE CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c(C)o1 1471977013 DTROZXQIFVNDAS-CYBMUJFWSA-N 400.457 -0.490 50 10 HBGE C=C[C@@](C)(O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1540405341 FIXIYJPLQPRIPJ-GOSISDBHSA-N 411.480 -0.276 50 10 HBGE CC(=O)NCC(C)(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1629793010 KPQVRKQZZMVGKN-UHFFFAOYSA-N 403.483 -0.246 50 10 HBGE COCCOCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2OC)C1=O 1635056476 CHLSDWBFVZWSOI-SFHVURJKSA-N 408.411 -0.727 50 10 HBGE C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CS(=O)(=O)C[C@H]2C(F)(F)F)C[C@@H](C)O1 1638062695 CODVVRWULFEAPH-DDHJBXDOSA-N 415.434 -0.144 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)NCCc1ccc(B(O)O)cc1 2058046124 JVODINSGSIHNNV-UHFFFAOYSA-N 402.237 -0.876 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)cs1 2267200651 HFDDIPXFFVAZPM-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE CN([C@@H]1CC[C@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1nn(C)cc1B(O)O 2267390581 GIDMFIWGBZRZQP-HUUCEWRRSA-N 422.272 -0.822 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267614456 NXJVFCZFWMYZCU-KRWDZBQOSA-N 422.272 -0.821 50 10 HBGE Cc1c(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2281609055 MYIWQRKBGWDMQD-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282065133 JRCQNSIPHQWCDC-KGLIPLIRSA-N 400.262 -0.673 50 10 HBGE CC(C)(C)OC(=O)NCC12CC(CN1S(=O)(=O)Cc1ncsc1B(O)O)C2 2282337316 GMQTUQYJFZYXJG-UHFFFAOYSA-N 417.318 -0.358 50 10 HBGE Cc1c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282431840 ZAYWQCGFMDAQKO-CABCVRRESA-N 416.243 -0.778 50 10 HBGE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282706495 MINWMOBLOFOTHN-NSHDSACASA-N 404.298 -0.682 50 10 HBGE CC(C)(C)OC(=O)NCc1nnc(NS(=O)(=O)Cc2ncsc2B(O)O)o1 2282850843 UEIIUXBWIFLXOA-UHFFFAOYSA-N 419.250 -0.828 50 10 HBGE C[C@@H](NC(=O)NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 745681063 OQLKPNQLPZPNOR-BXUZGUMPSA-N 400.457 -0.256 50 10 HBGE CN(NC(=O)CS(=O)(=O)CC(=O)Nc1cccc(Br)c1)C(N)=O 778416850 JMAJZDPWEOWKAV-UHFFFAOYSA-N 407.246 -0.156 50 10 HBGE Cn1c(=O)c2cc(NC(=O)C(=O)NNc3cccc(F)c3F)cnc2n(C)c1=O 785012189 BARCMPRFOHCBEP-UHFFFAOYSA-N 404.333 -0.008 50 10 HBGE O=C(NNC(=O)[C@H]1CCCCO1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 1450276215 SNLNYXTUGDJAPS-VHDGCEQUSA-N 415.443 -0.334 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@]1(OC)CCS(=O)(=O)C1 1479381329 JPTLIHGDJSARTE-KRWDZBQOSA-N 415.468 -0.002 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cn2nc(Br)c(Br)n2)cn1 1544185937 MKYJRLDMSDVQKP-UHFFFAOYSA-N 407.026 -0.002 50 10 HBGE CO[C@@]1(CNC(=O)NNC(=O)c2cc(Br)cn2C)CCS(=O)(=O)C1 1565379806 SKKYEMKJXULYQI-CYBMUJFWSA-N 423.289 -0.065 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCO[C@@H]2C)cc1OC 1570690721 ZYUBUGJHUMVGNW-PWSUYJOCSA-N 401.441 -0.446 50 10 HBGE CN1CCC(CNC(=O)NNC(=O)CNC(=O)c2ccco2)(N2CCOCC2)CC1 1636146899 HUCRXEJLLGWLML-UHFFFAOYSA-N 422.486 -0.864 50 10 HBGE C[C@@H](NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1nscc1B(O)O 2066556395 JJZXILTTYHTLCZ-SNVBAGLBSA-N 423.281 -0.510 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CCOc2ccc(B(O)O)cn2)C1 2240324594 CHCDPWWGCFWFFS-CYBMUJFWSA-N 400.262 -0.436 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C)sc1B(O)O 2267626534 JYFQDPDWCYNHIY-AWEZNQCLSA-N 408.307 -0.710 50 10 HBGE CN(C)[S@](=O)(=NC(=O)[C@@H]1C[C@@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2281868766 MOOIJANQYHKNCX-JHCVWZRZSA-N 404.298 -0.212 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282166360 NWUAXMACTYEUCE-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2sccc2B(O)O)[C@@H](S(C)(=O)=O)C1 2282206758 JHOJNEGHZLVOBT-QWRGUYRKSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)c3ccc(F)cc3B(O)O)C[C@@H]21 2282360676 GFYZPIXKMRDGNA-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCCN2S(=O)(=O)Cc2ncsc2B(O)O)C1 2282424601 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Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 2267388467 YVAJXOGCVBDLRC-NXEZZACHSA-N 406.291 -0.693 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282736325 OJHXQQOTMDYVLW-JTQLQIEISA-N 406.216 -0.068 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3cscc3B(O)O)CO[C@@H]1C2 2359273908 LXZDTHMXXZVKBB-HFAKWTLXSA-N 418.302 -0.469 50 10 HBGE O=C(NCC(F)(F)F)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1 745979393 OGVAOWHQWZQUET-NSHDSACASA-N 411.358 -0.296 50 10 HBGE O=C(NNC(=O)[C@]1(O)CCCN(Cc2ccccc2)C1)N[C@@H]1CCS(=O)(=O)C1 1442179450 CEYOGDQZKWYGKW-QAPCUYQASA-N 410.496 -0.469 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NC[C@@]1(OC)CCS(=O)(=O)C1 1479382703 WODHCHYWPRIJPV-INIZCTEOSA-N 401.441 -0.392 50 10 HBGE C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)n(C)c2)C1 1530230944 QIWGTSVIUOSXSC-DGCLKSJQSA-N 411.484 -0.515 50 10 HBGE CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3ccc(=O)n(C)c3)C2)nc1 1564548087 CBYYTWXVBQDWPN-UHFFFAOYSA-N 414.422 -0.210 50 10 HBGE O=C(c1cnn2c(=O)cc[nH]c12)N1CCN(S(=O)(=O)CBr)CC1 1637456283 QVHWECBMBMNYGO-UHFFFAOYSA-N 404.246 -0.537 50 10 HBGE Cn1c(CC(=O)NNC(=O)NCCCN2CCC[C@H]2C(N)=O)nc2ccccc21 1683841791 YLOLYHSEOSPEQJ-HNNXBMFYSA-N 401.471 -0.214 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)NCCc1cccc(B(O)O)c1 2058067052 OOYKRZKQFIAJIB-UHFFFAOYSA-N 402.237 -0.876 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CO)CCCN(S(=O)(=O)c2sccc2B(O)O)C1 2282069167 MMSKGZDQTKMPMS-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C1 2282079223 TXWMUDBPAMUKBY-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE CCN(C(=O)OC(C)(C)C)C1CN(S(=O)(=O)c2nc(C)n(C)c2B(O)O)C1 2282338857 QDHJBICZOLBGCT-UHFFFAOYSA-N 402.282 -0.962 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C(C)(C)C1 2282732840 MFRJVMPIINTJAK-LLVKDONJSA-N 419.334 -0.112 50 10 HBGE CCN(CCCNS(=O)(=O)c1nc(C)n(C)c1B(O)O)C(=O)OC(C)(C)C 2282861615 QGKMYZPVKHSJJA-UHFFFAOYSA-N 404.298 -0.666 50 10 HBGE C[C@@H](NC(=O)CN(CCN(C)C)C(=O)OC(C)(C)C)c1nscc1B(O)O 2283948730 QFVXQZQRHHTGLN-LLVKDONJSA-N 400.310 -0.201 50 10 HBGE O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)c1cnn[nH]1 729456020 MQDATNGWGSFPMD-UHFFFAOYSA-N 414.394 -0.055 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)C1CCN(S(=O)(=O)c2ccccc2F)CC1 744644660 MDTISSYNUCKQSV-CQSZACIVSA-N 415.443 -0.211 50 10 HBGE CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 745776020 JQLZUZZFSBKVKO-OAHLLOKOSA-N 414.484 -0.240 50 10 HBGE CC[C@H](C)n1ncc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 790785198 YKMZCWZNSXMFHP-JTQLQIEISA-N 416.442 -0.629 50 10 HBGE COCCN1C(=O)/C(=C/NNC(=O)CN2CCCc3ccccc32)C(=O)NC1=S 920978092 UMJCGNNGWZTQCX-SDNWHVSQSA-N 417.491 -0.166 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)c2nccn2c1 1610347252 JRNUTAWMFNPMFH-SSDOTTSWSA-N 404.246 -0.205 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 1639935624 ZWCJNFVDJHILSY-GHMZBOCLSA-N 403.482 -0.045 50 10 HBGE COCC[C@@H](CNS(=O)(=O)Cc1ccsc1B(O)O)NC(=O)OC(C)(C)C 2282328147 SZAWYADKAORVNU-LBPRGKRZSA-N 422.334 -0.223 50 10 HBGE COc1ccc(S(=O)(=O)N2CC[C@@H]2CNC(=O)OC(C)(C)C)cc1B(O)O 2282732187 CHOFRSKYTNDVTG-LLVKDONJSA-N 400.262 -0.337 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@H]1CCCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741104 JQUAPQWMVHAZOM-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 730310653 NVQNAFWFNHUSNX-FZMZJTMJSA-N 409.420 -0.562 50 10 HBGE O=C(NCCNC(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COCCO1 745793396 PPMUJLYMZXXFCR-GFCCVEGCSA-N 415.244 -0.075 50 10 HBGE Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 747974960 IBBLLUMCJXTCDC-MNOVXSKESA-N 416.463 -0.245 50 10 HBGE COC1(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CS(=O)(=O)C1 1138053335 DUGNWRQQIBKYSL-UHFFFAOYSA-N 420.488 -0.564 50 10 HBGE O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NC1CCN([C@H]2CCOC2)CC1 1479004674 JYUOEULCKXVFFG-INIZCTEOSA-N 400.443 -0.140 50 10 HBGE CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2C[C@H](O)CN2c2ccncn2)cc1 1569520517 VCHUUAZLPWIJSC-DZGCQCFKSA-N 406.468 -0.190 50 10 HBGE C[C@H]1CN(C(=O)c2c(B(O)O)cnn2C)C[C@H](C)N1C(=O)OCc1ccccc1 2267323570 NZTMVWQNIWMHRB-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C 2282720941 IQESCFURCWZQOP-LLVKDONJSA-N 402.278 -0.043 50 10 HBGE Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 766635326 HQMMCRVYYIZSIM-GFCCVEGCSA-N 414.422 -0.643 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCO1 817215419 XVAKIPZLFLBVJL-AAVRWANBSA-N 401.485 -0.578 50 10 HBGE COc1ccc(S(=O)(=O)N2CCCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1 1137735894 PSXNEEIVUBYVQW-UHFFFAOYSA-N 418.280 -0.088 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)S(=O)(=O)C1CCOCC1 1156183676 FONYUJNLAMRFET-DOMZBBRYSA-N 403.501 -0.631 50 10 HBGE N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)cc1 1290635768 BHORXPVMVKRBGX-UHFFFAOYSA-N 417.227 -0.476 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc2c1CC(=O)N2 1465791332 CMCQIHQXMUAIRU-UHFFFAOYSA-N 422.445 -0.205 50 10 HBGE COc1ccc(Cn2nnc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 1539402280 VXUZPQZNDPWGNE-CYBMUJFWSA-N 407.452 -0.161 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1 1642598714 CDBQQUGDZSYXIC-DLBZAZTESA-N 420.491 -0.013 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1csnc1B(O)O 2255579931 WQIACONXZDVPDG-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NS(=O)(=O)c2cc(B(O)O)cs2)s[nH]1 2267202139 YHZRPFSRUPCFIA-UHFFFAOYSA-N 420.303 -0.473 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267609054 KSHNQGLCCAQNQZ-ZMLRMANQSA-N 402.303 -0.038 50 10 HBGE Cn1cc(C(=O)N=[S@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282248161 PEHVSRPBMJNRJS-GFVXYOJSSA-N 400.266 -0.653 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1nn(C)cc1B(O)O 2282367768 HBRMGAPABPQSCK-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE Cc1cc(S(=O)(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)sc1B(O)O 2282419049 MGXOWWFDASKQIM-UHFFFAOYSA-N 414.236 -0.184 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2282712761 VPEYFZSNHADKMV-NSHDSACASA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](CCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282736878 WXKISQFKXUDZPL-XYPYZODXSA-N 419.334 -0.064 50 10 HBGE CCC[C@H](CNS(=O)(=O)c1nc(C)n(C)c1B(O)O)NC(=O)OC(C)(C)C 2282851273 ZSAWHFFPIDCWTJ-LLVKDONJSA-N 404.298 -0.620 50 10 HBGE CN(Cc1ccc(B(O)O)s1)C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284054789 JDKNKWXQJGRAHN-LBPRGKRZSA-N 402.253 -0.294 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)n1C 2362568605 JGBNSMNAQOWCSW-MHZLTWQESA-N 400.266 -0.734 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)[C@H]3COCCO3)CC2=O)cc1OC 744642490 QAVPJIQULIQYAQ-WMLDXEAASA-N 421.450 -0.342 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1sccc1S(=O)(=O)N1CCSCC1 744647602 MALOTYANYNWICB-SNVBAGLBSA-N 421.522 -0.338 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC(=O)N2C)cc1 758029825 NZCJWWQLVOPALU-VZJVUDMVSA-N 412.468 -0.700 50 10 HBGE Cc1nn(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)o1 1149649707 NEKRVDFJPGFOTA-UHFFFAOYSA-N 422.873 -0.237 50 10 HBGE CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1456039813 UVINPGBJVBAPLG-HOTGVXAUSA-N 416.544 -0.019 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCC(=O)N(c3cnn(C)c3)C2)C[C@@H](C)O1 1457496838 JLRISBXLVTVIGS-ZNMIVQPWSA-N 406.487 -0.190 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)CNC(=O)c1cccnc1 1457685515 MDQLNVUPRFGCOO-UHFFFAOYSA-N 419.463 -0.169 50 10 HBGE CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CSCC(=O)N2)CC1 1543380056 CAUYYJOKHXIMIR-NSHDSACASA-N 401.489 -0.052 50 10 HBGE CC(C)(C)OC(=O)N1CC(NC(=O)c2scc(B(O)O)c2Cl)(C(=O)O)C1 2267241140 KBRGCFLCJZKWEW-UHFFFAOYSA-N 404.637 -0.115 50 10 HBGE COCC1(NS(=O)(=O)c2ccc(B(O)O)s2)CN(C(=O)OC(C)(C)C)C1 2267612614 LUKFEVOJBJFESX-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE C[C@@H](NS(=O)(=O)c1ccc(B(O)O)s1)C1(O)CN(C(=O)OC(C)(C)C)C1 2267615767 IRUYXBLEHSEDPH-SECBINFHSA-N 406.291 -0.924 50 10 HBGE CN(CCCN(C)S(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267623142 ZTIJFIODMWKUBO-UHFFFAOYSA-N 407.323 -0.159 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=S1(=O)CCN(C(=O)OC(C)(C)C)CC1 2281911354 AXQKQDREZLKDDY-UHFFFAOYSA-N 400.266 -0.558 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2CC[C@@H]21 2282345758 QZWRINVOZITSDW-NWDGAFQWSA-N 417.318 -0.264 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1 2282444015 OOWOXOZENBBKKF-HNNXBMFYSA-N 416.243 -0.650 50 10 HBGE Nc1nonc1-n1nnc(C(=O)NN=Cc2cccc(F)c2)c1CN1CCOCC1 254612586 SBQUOYSBKHHSKY-UHFFFAOYSA-N 415.389 -0.032 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2COCCO2)cc1S(=O)(=O)N1CCCC1 744641802 MPYBTAMWLZFDNF-CQSZACIVSA-N 413.452 -0.344 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CSc1n[nH]c(O)n1 1135291656 FFZOYWLFXQXRET-UHFFFAOYSA-N 405.484 -0.038 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CCOC(=O)CNC(=O)C(C)(C)C)C[C@H](C)O1 1182158128 OXWIWZBIKGQMGV-KBPBESRZSA-N 414.503 -0.271 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1 1182609061 FNIZTTVGBKPPRV-ZETCQYMHSA-N 417.387 -0.321 50 10 HBGE COc1ccc(Br)c(C(=O)NNC(=O)CN(C)S(=O)(=O)N(C)C)c1 1632440122 GJUQAKXFJFLESX-UHFFFAOYSA-N 423.289 -0.043 50 10 HBGE COCCOCC(=O)NNC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C 1635056990 JJZVMQLMISXTJG-LBPRGKRZSA-N 402.473 -0.210 50 10 HBGE C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CN1CCCC1=O 1635878046 OVPIRMOLFPEVIL-OAHLLOKOSA-N 404.345 -0.612 50 10 HBGE O=C(CN(Cc1ccccc1)CC1(O)CNC1)N[C@H]1CS(=O)(=O)C[C@H]1Cl 1915486377 QATKHEQYXSLYJT-CABCVRRESA-N 401.916 -0.657 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1cscc1B(O)O 2267625099 JWORKVFDVAXXJI-CBAPKCEASA-N 400.209 -0.352 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCC[C@@H](NC(=O)OC(C)(C)C)C1 2282082831 LLVJGLGTFKAPOL-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1C(=O)c1csc(B(O)O)c1 2282221861 CXJBVKCZAGDGPT-INIZCTEOSA-N 400.262 -0.844 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2282737223 BLTMUNJPKLQMJE-STQMWFEESA-N 400.262 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CCc1ccc(C(=O)NNC(=O)c2cn(C)nn2)cc1S(=O)(=O)N1CCOCC1 1587243979 JCTDEDOXWJFWJC-UHFFFAOYSA-N 422.467 -0.527 50 10 HBGE O=C(NCC[C@@H]1CCCS1(=O)=O)NNC(=O)C1CCN(c2ncccn2)CC1 1675617720 LKNKXYJURIQYKU-AWEZNQCLSA-N 410.500 -0.009 50 10 HBGE CC(=O)N1CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1 1687165775 JBLMQMJCDWAQND-CQSZACIVSA-N 411.484 -0.433 50 10 HBGE O=C(NC[C@H](NC(=O)c1nccnc1B(O)O)C(F)(F)F)OCc1ccccc1 2267857824 HJJLMFGXNAUMJL-NSHDSACASA-N 412.133 -0.257 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 2282071752 WBGXNIXPSXTOBG-NEPJUHHUSA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(S(=O)(=O)c2ccc(B(O)O)cc2)C1 2282085411 YEHSLENSRJQWGS-QWHCGFSZSA-N 400.262 -0.985 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1 2282710582 PYTIOOHIIQDBRS-XYPYZODXSA-N 402.282 -0.928 50 10 HBGE COC[C@@]1(NS(=O)(=O)c2cscc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282725177 XKPAMFSGUUHHEU-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE 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O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1141422374 ODWDJVNETMCJSK-SFHVURJKSA-N 422.445 -0.198 50 10 HBGE CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CC1 1290349554 UMRWCUYYUIJBKT-DGCLKSJQSA-N 405.542 -0.194 50 10 HBGE CN(C)C(=O)N1CCC(C(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)CC1 1641450907 JPNZTLWZACVZSR-CQSZACIVSA-N 401.423 -0.021 50 10 HBGE CS(=O)(=O)N1CC[C@H](O[C@@H]2CS(=O)(=O)C[C@@H]2I)C1 2257832368 OWCRLRXQJXNUSC-XHNCKOQMSA-N 409.267 -0.363 50 10 HBGE Cc1c(C(=O)NC2CCN(C(=O)OCc3ccccc3)CC2)nn(C)c1B(O)O 2267350463 JHKMIFPFTZAXCD-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267368194 FOSAPGXUKVCRMX-NXEZZACHSA-N 405.307 -0.502 50 10 HBGE CN(C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)S(=O)(=O)c1sccc1B(O)O 2267611328 RMEIUEZTPBSAKH-UWVGGRQHSA-N 402.303 -0.086 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282363302 GDUAFCZWUZLODH-NEPJUHHUSA-N 420.680 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](C)(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282377247 OMMPKMKWRCGCOW-OAHLLOKOSA-N 419.334 -0.111 50 10 HBGE CN([C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)Cc1ncsc1B(O)O 2282377367 PRHNHYSZVDHUDR-IAZYJMLFSA-N 417.318 -0.550 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282743688 SBIKEEMLZXONPV-BMIGLBTASA-N 417.318 -0.501 50 10 HBGE C[C@H](c1cscc1B(O)O)N(C)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2370319277 DCGRPQLVYRQNME-SNVBAGLBSA-N 402.278 -0.805 50 10 HBGE CNC(=O)C1=c2s/c(=C/C(=O)OC)c(=O)n2C(N)=C(C#N)[C@@H]1c1cccs1 33853434 ZFWGRHSEKUIMIB-GCZGVDRJSA-N 402.457 -0.730 50 10 HBGE COc1cc2ncn(CCCC(=O)NNC(=O)[C@@H]3COCCO3)c(=O)c2cc1OC 744646376 XSOBFCKCKAOMKK-INIZCTEOSA-N 420.422 -0.243 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1)Nc1ccc(F)cc1 746000107 ZOIZGOPWJCWBFW-OAHLLOKOSA-N 409.418 -0.462 50 10 HBGE O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)[C@@H]3COCCO3)nn2)c(Cl)c1 763435183 QKKZHQTXVQMLGE-HNNXBMFYSA-N 423.813 -0.001 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N(C)OC)c1 1470565565 QDLAHIFMNKFNRL-UHFFFAOYSA-N 415.472 -0.319 50 10 HBGE CC(C)[C@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)N1CCCS1(=O)=O 1558459169 PXWCBBVWBZILNV-LSDHHAIUSA-N 402.517 -0.553 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC2=O)cn1 1623716476 AZJQWACNIAPSNK-LBPRGKRZSA-N 415.454 -0.055 50 10 HBGE CN(C)N(C(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1F)[C@@H]1CCS(=O)(=O)C1 1629231106 WVYDHVKDBDHJEJ-RISCZKNCSA-N 414.459 -0.708 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)c1ccc(F)cc1 1652305047 XDZOFRLKMRXEQV-HOTGVXAUSA-N 408.430 -0.683 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267205796 WVRZWDZHBQVRNN-FORDYWAESA-N 424.331 -0.118 50 10 HBGE Cn1nc(C(=O)NC[C@]2(F)C[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281650329 ZNOWQZRUNXZHGF-APXWNHPRSA-N 404.635 -0.122 50 10 HBGE CN1CCN(C(=O)c2scc(B(O)O)c2Cl)[C@H](CNC(=O)C(F)(F)F)C1 2281756730 ACMQZJFYXDSCQJ-SSDOTTSWSA-N 413.614 -0.484 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282085592 AHGYGZVFDJQFHE-KGLIPLIRSA-N 416.330 -0.004 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(C)CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282346549 WRTQYCBJUMMBHR-OAHLLOKOSA-N 419.334 -0.111 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2COCCN2C(=O)OC(C)(C)C)sc1B(O)O 2282728746 HFUWICVIKAJORE-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N=[S@@](C)(=O)CCNC(=O)OC(C)(C)C 2282737070 APRGCSUJFZLHLV-SANMLTNESA-N 420.318 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)Nc1ncc(B(O)O)s1 2283965002 QOTGYDRMHKOUIB-VIFPVBQESA-N 419.290 -0.814 50 10 HBGE CC(=O)N1CCN(C(=O)C(C#N)=CN(CCN(C)C)[C@H]2CCS(=O)(=O)C2)CC1 2324851732 IDXVHIJSBZLHJX-KRWDZBQOSA-N 411.528 -0.865 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1ccc(B(O)O)cc1 2365421006 CHULXYFEEDFDEU-CQSZACIVSA-N 402.278 -0.675 50 10 HBGE CNC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(N)=C(C#N)[C@@H]1c1ccc(F)cc1 254399304 RCFRPJXGXCDSOF-AWEZNQCLSA-N 414.418 -0.653 50 10 HBGE C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)C1 746000882 BHIHWZMGEHQFIU-OWCLPIDISA-N 411.503 -0.735 50 10 HBGE O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@@H]1CCC(=O)N1 1623367775 BMOUZQQOXFBHMY-JTQLQIEISA-N 409.196 -0.529 50 10 HBGE COC(=O)[C@@H]1C[C@@H]1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1685247254 NVZSMJZHXPCGGU-TZMCWYRMSA-N 412.468 -0.245 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)s1 2255882972 YFEMGUMPCHANIO-DEOSSOPVSA-N 412.320 -0.261 50 10 HBGE Cn1cc(B(O)O)c(C(=O)NCCSSCCNC(=O)OC(C)(C)C)n1 2267304941 WCMDOXZULAMKGA-UHFFFAOYSA-N 404.323 -0.264 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2267372140 JXVDQFPUMBZOPK-QWRGUYRKSA-N 406.291 -0.861 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)c1B(O)O 2281833791 HTLMDHCYFBZJAA-JGFSIVIASA-N 400.266 -0.686 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282337546 LTYRGVIIQFBQSI-NSHDSACASA-N 419.334 -0.159 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)CC1 2282355777 KSSDBNPUMPJDHK-UHFFFAOYSA-N 400.262 -0.289 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282371921 QZEZATCZWKBEBS-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)n1 2282741593 PQTUZOHIHLLEMR-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE O=C(N[C@@H]1[C@H]2C[C@@H]1N(C(=O)c1cc(B(O)O)c(O)cc1O)C2)OCc1ccccc1 2359285998 BFBZYKPTLYBVNT-XLWVJDPXSA-N 412.207 -0.083 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)[C@@H]2COCCO2)c1 744648326 FOSBHGWDSFMJOW-HNNXBMFYSA-N 415.468 -0.098 50 10 HBGE COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 746004912 YOAKCQRGXSKQKS-KRWDZBQOSA-N 420.466 -0.072 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 748284349 MAORWHNAQKWMDQ-SWLSCSKDSA-N 420.447 -0.697 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccc3ncsc3c2)n(C)c1=O 765726598 CIZSZVBCALPJNI-UHFFFAOYSA-N 413.419 -0.495 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)Cc2cnn(C)c2)c1 786688909 PSLYBFSQOSPNLP-MRXNPFEDSA-N 423.495 -0.185 50 10 HBGE O=C(N1CCC[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1)C(F)(F)F 2267620543 KQRZTFJCRGXORH-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC(NS(=O)(=O)Cc3ncsc3B(O)O)C2)C1 2282340563 HNGKHVSIUWHQFT-UHFFFAOYSA-N 417.318 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@@H](O)C1 2282740354 YOYALQIJGIPUTH-LBPRGKRZSA-N 420.318 -0.829 50 10 HBGE C=CCOC(=O)c1sc(NC(=O)C[S@@](=O)CC(=O)NNC(C)=O)nc1C 586348182 JNKYXYIXJRPNAZ-AREMUKBSSA-N 402.454 -0.351 50 10 HBGE CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)[C@@H]1COCCO1 755432806 UAJIZPGMWCWJQI-IHRRRGAJSA-N 414.503 -0.225 50 10 HBGE Cc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnn1-c1ccc(F)c(F)c1 1631028625 ARYXGJPULLKACZ-VIFPVBQESA-N 414.394 -0.015 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)N1C(=O)NC2(CCCC2)C1=O 1645053531 ICXDJFFPEGOTJY-JSGCOSHPSA-N 407.471 -0.360 50 10 HBGE 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COc1ccc(S(=O)(=O)NC[C@H]2CCN2C(=O)OC(C)(C)C)cc1B(O)O 2282361324 PDNLNBOSZKVLOG-LLVKDONJSA-N 400.262 -0.337 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)c3ccc(F)cc3B(O)O)C[C@@H]21 2282363310 GFYZPIXKMRDGNA-YABSGUDNSA-N 400.237 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)C[C@H]2C1 2282380352 HYBUCCAAKPNOAB-AXFHLTTASA-N 417.318 -0.502 50 10 HBGE CCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nc(C)n(C)c1B(O)O 2282420580 BHDVBTPTJYTSAS-UHFFFAOYSA-N 402.282 -0.962 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)cc2)C[C@H]1NC(=O)OC(C)(C)C 2282711048 WTJSMLNABCYSKI-KGLIPLIRSA-N 400.262 -0.721 50 10 HBGE C[C@@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1nn(C)cc1B(O)O 2282738380 UGAQIDMSPOCYAA-NSHDSACASA-N 404.298 -0.634 50 10 HBGE COC(=O)[C@@H](CC(=O)N=c1ccc(Cl)c(B(O)O)[nH]1)NC(=O)OC(C)(C)C 2283926244 KWEUWRSUIHIYTH-SECBINFHSA-N 401.612 -0.768 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCc2sc(Cl)cc2B(O)O)C1 2343815497 XVFGYRGCLDZSNJ-UHFFFAOYSA-N 404.681 -0.073 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2(C)C)n1 2380428781 VHEMTRTZMVFWCU-LLVKDONJSA-N 402.282 -0.834 50 10 HBGE CS(=O)(=O)N1CCN(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)O)c2)CC1 216962473 UMFHDTDFBSYNDJ-QXMHVHEDSA-N 414.465 -0.144 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNc2ccc(-n3ccnc3)nn2)C1 806037083 OFOZNWYTZSAYNB-GFCCVEGCSA-N 409.476 -0.441 50 10 HBGE C[C@]1(NNC(=O)N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)CCS(=O)(=O)C1 807609276 LLILBFGZWONPBV-BBRMVZONSA-N 416.525 -0.169 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1cnn(-c2ccccc2)c1 1479131989 LVSZJJNRPISVJK-IBGZPJMESA-N 414.422 -0.556 50 10 HBGE CN(C)c1noc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1 1540367720 BVEJSJYXYGGRPF-UHFFFAOYSA-N 410.456 -0.220 50 10 HBGE CN(CC(C)(C)NC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267420513 VYQTVVWPDKDANA-UHFFFAOYSA-N 407.323 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282342358 GKUSBWMTDWDTCZ-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)n1 2282363538 OKBUDTRQCMCFOT-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)[C@H]2COC[C@H]12 2282373178 JDAYJGVZBXICGX-JLLWLGSASA-N 418.302 -0.660 50 10 HBGE O=S(=O)(c1cc(B(O)O)cs1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2282707104 VAPWAZMFTOAUAR-HOTGVXAUSA-N 408.310 -0.298 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H](CN(C)Cc2ccccc2)C(=O)O)sc1B(O)O 2284411247 HYPHENLPRZSDSI-CYBMUJFWSA-N 412.298 -0.400 50 10 HBGE CN(C)CCN(C=C(C#N)C(=O)N1CCC(C(=O)O)CC1)[C@@H]1CCS(=O)(=O)C1 2324591679 ZSCXVMONXFCNLS-MRXNPFEDSA-N 412.512 -0.232 50 10 HBGE COC(=O)/C=C\c1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 747602497 SRIUACPNHJMGEN-KMSCOEIWSA-N 402.450 -0.383 50 10 HBGE COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)[C@H]3COCCO3)cc2)CC1 756391922 FGBOBPUOJJGFAK-MRXNPFEDSA-N 421.454 -0.450 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@]3(C)C[C@@H](O)CN3C)cc2)CC1 1151459753 XMLSGBUKJHMPCM-QAPCUYQASA-N 411.528 -0.479 50 10 HBGE CN1C[C@H](C(=O)NNC(=O)c2ccc(=O)n(C)c2)N(C(=O)OC(C)(C)C)CC1=O 1304258848 PEOBHRFFYNOJHF-GFCCVEGCSA-N 407.427 -0.776 50 10 HBGE COc1cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc(OC)c1OCC(N)=O 1351202701 XLFMXJGOVHPCSJ-LBPRGKRZSA-N 415.468 -0.326 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1CN([C@H]2CCOC2)C1 1444713027 CSSNBHQHJDNSMS-HNNXBMFYSA-N 410.496 -0.129 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)N1 1461838126 PBYIMSMQCVRZJX-IUCAKERBSA-N 420.900 -0.019 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(C[C@H](O)CO)c1 1463573841 RIGXEQLWMUNYAP-SFHVURJKSA-N 416.482 -0.790 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCS(=O)(=O)C1CC1 1478819591 MOZUSSRMFAFXPD-UHFFFAOYSA-N 417.513 -0.191 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)c2ccccc2C1=O 1534064304 GHVQTEDKCFGBSQ-STQMWFEESA-N 404.448 -0.170 50 10 HBGE CN(C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)S(=O)(=O)c1cc(B(O)O)cs1 2267611530 AREINIYSNGEVAM-QWRGUYRKSA-N 402.303 -0.086 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282423657 RJJSEPPZSBGDBD-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2ccccc2B(O)O)C1 2282718266 UZCGIKJHCIVRBK-ZDUSSCGKSA-N 402.253 -0.150 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@@H](O)C2)sc1B(O)O 2282726200 OJEMQQOTUKGJKY-WDEREUQCSA-N 420.318 -0.615 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@@H](C)CNS(=O)(=O)c1nc(C)n(C)c1B(O)O 2282867874 FMPWUZDZFVEOOA-JTQLQIEISA-N 404.298 -0.668 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C 2362351899 LIVJKWIOQUUODE-HHHXNRCGSA-N 402.282 -0.357 50 10 HBGE Cn1nc(Br)c(Br)c1CNC(=O)c1cc(B(O)O)c[nH]1 2364437982 ZPRCYLGBYLOGEO-UHFFFAOYSA-N 405.843 -0.117 50 10 HBGE CCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 730316515 IEPIOAJXKTVKQH-FZMZJTMJSA-N 423.447 -0.172 50 10 HBGE COc1ccc(OC)c(CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)c1 746003314 PJSXYDZMZBSJER-QGZVFWFLSA-N 408.455 -0.022 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)n(C)c1=O 802762876 OXTAYZMCFUKYHS-DTWKUNHWSA-N 416.360 -0.440 50 10 HBGE CS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 1125955388 SICPDIXCSZQJQG-AWEZNQCLSA-N 410.500 -0.488 50 10 HBGE CN1C[C@H](C(=O)NNC(=O)COc2ccccc2O)N(C(=O)OC(C)(C)C)CC1=O 1136693689 SGVGAHGXZZAGOY-GFCCVEGCSA-N 422.438 -0.004 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)nc1)N[C@H]1CCS(=O)(=O)C1 1323661798 KUWGUPYUGXUXPR-ZETCQYMHSA-N 402.376 -0.220 50 10 HBGE C[C@]1(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)CCS(=O)(=O)N1 1597885577 IOZHTABYKYOHRD-LLVKDONJSA-N 418.335 -0.715 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)C)c2ccccc2c1=O 1628355845 XJLPJLGVJZIRTE-CYBMUJFWSA-N 409.468 -0.249 50 10 HBGE O=C(CN1CCCC2(CC2)S1(=O)=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1645054037 OGIDHTDDNCOGGQ-AWEZNQCLSA-N 400.501 -0.655 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267379552 RZLCMIUKJTXADQ-UHFFFAOYSA-N 402.303 -0.047 50 10 HBGE CN(CC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2267393118 SZAPCEDQZDOZAH-UHFFFAOYSA-N 405.307 -0.549 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267615538 FGBIGZFHEHBBPI-UHFFFAOYSA-N 406.291 -0.876 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCc2csc(NC(=O)OC(C)(C)C)n2)n1 2282729269 ZTYQZFLMJQNCPC-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2282738482 VMEQJKGXEXXMNT-GHMZBOCLSA-N 420.318 -0.758 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1 2285302356 YDHPTDSEBILTGT-LBPRGKRZSA-N 402.278 -0.737 50 10 HBGE CCC(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1 59888262 FACUTNCLDTWIRC-FRKPEAEDSA-N 409.476 -0.294 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)NCc1cc(B(O)O)ccc1F 704375017 YRSROXAXIYPFST-UHFFFAOYSA-N 406.200 -0.779 50 10 HBGE CN1C(=O)CS/C1=C\C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1445563468 FFSFFPAGXBBKQZ-WQRHYEAKSA-N 417.491 -0.362 50 10 HBGE CNS(=O)(=O)c1ccc(NCCOC)c(NC(=O)c2cccc(B(O)O)c2)c1 1466059792 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Cc1sc(B(O)O)cc1S(=O)(=O)NC1(CCO)CN(C(=O)OC(C)(C)C)C1 2282741159 KECBTXJBCAKSAE-UHFFFAOYSA-N 420.318 -0.613 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282847599 BCSQDAGDCFVCOA-VXGBXAGGSA-N 420.318 -0.925 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2cnsc2B(O)O)CC1 2362501422 RXSKCSMXXZOCOZ-HHHXNRCGSA-N 418.306 -0.471 50 10 HBGE CCN1CCN(c2ccccc2NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC1 755473804 BNHWLWSZMJSSBA-CYBMUJFWSA-N 412.516 -0.081 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)[C@H]1CCc2nncn2C1 793452434 YUDIACWVAUDIQP-LBPRGKRZSA-N 404.452 -0.023 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cccc(F)n1 1131532862 GNVZKGMAUBQVHR-UHFFFAOYSA-N 411.415 -0.345 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)NCCN2CCNC2=O)c2ccccc2c1=O 1255499466 ZAMUDDKNKHAULO-UHFFFAOYSA-N 401.427 -0.053 50 10 HBGE COCC(COC)N1CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1 1307838996 JYCGFDMAXGHIEY-UHFFFAOYSA-N 424.498 -0.256 50 10 HBGE O=C(NNC(=O)[C@H](O)[C@@](O)(c1ccccc1)C(F)(F)F)[C@@H]1CCS(=O)(=O)C1 1440705214 PJMUFNMWAVQTQL-PUYPPJJSSA-N 410.370 -0.621 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC[C@H]2CC2(Cl)Cl)n(C)c1=O 1630996789 UCPFUNFKNPZVCT-QMMMGPOBSA-N 417.253 -0.445 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNc2ccc(S(C)(=O)=O)cc2)[C@H]1c1cnn(C)c1 1632210988 NWOBBEGBSGWVCL-RBSFLKMASA-N 407.452 -0.543 50 10 HBGE CN(C[C@@H](O)CN(C)S(=O)(=O)c1sccc1B(O)O)C(=O)OC(C)(C)C 2267616549 VNUWAYCQBDTLQV-SNVBAGLBSA-N 408.307 -0.724 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272655145 LICJYEPEAMBUEX-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1CCC(O)(CNS(=O)(=O)c2sccc2B(O)O)CC1 2282082118 HPUCNUVXROZSPQ-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COCCN2S(=O)(=O)c2sccc2B(O)O)C1 2282082380 ZWVYTIFGRDMUFP-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H]1CNS(=O)(=O)c1ccccc1B(O)O 2282097126 AWURAPKDKJJXFI-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](CNS(=O)(=O)c2sccc2B(O)O)CO1 2282702625 LIVSKMXDJCKOHU-MNOVXSKESA-N 420.318 -0.364 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)CO1 2282703365 VMWUVHUFESVTRL-ZYHUDNBSSA-N 420.318 -0.364 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1(C)C 2282736601 SVVYJPUFQUMXKC-WDEREUQCSA-N 419.334 -0.066 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)ccc1B(O)O 2282736970 YAJMOLQTUCDNPB-ZIAGYGMSSA-N 400.262 -0.755 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)c(C)c1 2365476711 HNHQSHWKWKYXIR-LBPRGKRZSA-N 402.278 -0.507 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(Br)cn1C 728463196 WQVYDOUDVGFGOM-NSHDSACASA-N 414.260 -0.324 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 744650190 PEQCGFQJLMXFAJ-AWEZNQCLSA-N 417.415 -0.977 50 10 HBGE Cc1nn(C(C)(C)C)cc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 784683534 FXATVGSFYCJOQV-UHFFFAOYSA-N 416.442 -0.845 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CN2CCCC3(CC3)S2(=O)=O)C[C@H](C)O1 1306209832 OHXTWQVVTFETFF-KBPBESRZSA-N 402.517 -0.409 50 10 HBGE Cc1cccc(C(=O)NNC(=O)CN2CCN(C[C@@H]3CCCS3(=O)=O)CC2)c1 1620502087 VIKAMPCYTWOUCB-KRWDZBQOSA-N 408.524 -0.049 50 10 HBGE O=C(NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1)OCC(F)(F)F 1634094630 OUFHJLMZFSXREU-ZETCQYMHSA-N 400.335 -0.528 50 10 HBGE CCOc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)[nH]n1 1654359872 TYEHWEFDCONQHN-UHFFFAOYSA-N 409.472 -0.104 50 10 HBGE CC(C)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CS(C)(=O)=O 1684005997 KRCXLRWJLMZCSM-UHFFFAOYSA-N 419.529 -0.006 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)sn1 2255686369 QLDPVXXWVXATLV-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1ccc(B(O)O)s1 2267207731 UAWGVDIEPPNQDC-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282076434 IBTMOZQATVRJPQ-NSHDSACASA-N 420.318 -0.268 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@]1(C)CCCN1C(=O)OC(C)(C)C 2282507815 MNHDMURYTSFYNL-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CN(C(=O)OC(C)(C)C)C1 2282705926 FENXVYWSJXZKSD-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CCC(CC)(CNS(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282707229 WIXCKKBWDSYRHO-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CF)(NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282719019 GBUFJTNLEITQOP-OAHLLOKOSA-N 403.241 -0.611 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NC1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2282743151 MAPAAICZHDVSDG-KBPBESRZSA-N 407.326 -0.237 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282847597 BCSQDAGDCFVCOA-NWDGAFQWSA-N 420.318 -0.925 50 10 HBGE O=C(CO)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1 753439246 LKUZRLRCIKJVFR-LLVKDONJSA-N 406.258 -0.258 50 10 HBGE Cc1ccc(-n2nnc(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)cc1 920293165 LJWYNHMAXQIFPX-ZDUSSCGKSA-N 406.468 -0.056 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(I)cn1 1135771333 JHWBRCKTHIDHPL-SSDOTTSWSA-N 409.205 -0.118 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CCC2=O)cn1 1290067694 RECYCSCEFBMFHW-LBPRGKRZSA-N 423.433 -0.129 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3C[C@H](C)CO3)CC2)cc1 1545424395 YVXWQDXCPRLHDG-DOTOQJQBSA-N 424.523 -0.126 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 1632321006 LVKQUIHOIFIREA-CABCVRRESA-N 404.423 -0.472 50 10 HBGE CN1CC[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1638057524 HYEKDPJUDKFVPU-AWEZNQCLSA-N 410.496 -0.190 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2CN(S(=O)(=O)c3ccc(B(O)O)s3)C2)C1 2267212547 SROKZIJHLQUXPU-UHFFFAOYSA-N 402.303 -0.085 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCON(C(=O)OC(C)(C)C)C1 2267387929 QDHUHXMRFTYXAW-SNVBAGLBSA-N 406.291 -0.044 50 10 HBGE CN(C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)S(=O)(=O)c1cscc1B(O)O 2267387949 QIISNWGONSHNCN-UWVGGRQHSA-N 402.303 -0.086 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2CNS(=O)(=O)Cc1ncsc1B(O)O 2282335419 PLSILWQIGXDQLJ-FOGDFJRCSA-N 417.318 -0.502 50 10 HBGE COCC[C@@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2282338580 OJZTVQAEJUSGNI-JTQLQIEISA-N 423.322 -0.828 50 10 HBGE C=C(CS(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)Cc2nccn2C1)B(O)O 2282730079 WVLSUHRTAZFCFJ-LBPRGKRZSA-N 400.266 -0.510 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c(B(O)O)n1C 2282860670 DYTPWFUKGYZZGM-LLVKDONJSA-N 402.282 -0.914 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C 2283950178 IGKBPHDBVQAHKD-WCBMZHEXSA-N 400.266 -0.889 50 10 HBGE O=C(/C=C\c1ccccc1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 12368442 XRJZDZLQWAVFHA-SREVYHEPSA-N 416.467 -0.755 50 10 HBGE O=C(CCOc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 729350077 VPEKIPOHWVYCCU-MRXNPFEDSA-N 404.467 -0.216 50 10 HBGE COC(=O)C(C)(C)N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 778188859 JTJZASMTOXFXPE-UHFFFAOYSA-N 407.427 -0.075 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)[C@@H]1CCc2nncn2C1 816875051 PWKKXTFSMXSOLZ-MRVPVSSYSA-N 418.888 -0.319 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1 1290256202 RLIWVZVRTWYADJ-AWEZNQCLSA-N 400.476 -0.281 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCS(C)(=O)=O 1585951947 KOJXAFRMOYMNLO-NWDGAFQWSA-N 418.493 -0.309 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)[C@@H]2CCC(=O)N2)ccc1OC(F)F 1633925901 SWVAMTGLLZPQJC-VIFPVBQESA-N 400.338 -0.548 50 10 HBGE CN1CC[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1638057525 HYEKDPJUDKFVPU-CQSZACIVSA-N 410.496 -0.190 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 1684002434 QIGNNNOPKULKIJ-OWCLPIDISA-N 417.466 -0.341 50 10 HBGE O=C(N1CCC(CNS(=O)(=O)c2ccc(B(O)O)s2)CC1)C(F)(F)F 2267203498 QXANRPXYFIUKRV-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1ccc(B(O)O)s1 2267207734 UAWGVDIEPPNQDC-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2267393327 XFZPCYJFOGEIDO-SNVBAGLBSA-N 405.307 -0.358 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)nn(C)c1B(O)O 2281609484 SPPKSIUJLGKSAC-JNVGHINZSA-N 402.282 -0.440 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CS(=O)(=O)CCN2C(=O)[C@H]1C[C@H](B(O)O)C1 2281872904 VEZOWWUKPFEIBQ-HAQNSBGRSA-N 402.278 -0.514 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1CO 2282086622 OHZIQMFWNLUDFE-QWRGUYRKSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282425214 MVJAXEFSJCCIJX-HNNXBMFYSA-N 406.241 -0.941 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 2282507852 NBGBVVZMHAUZNR-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1 2282708803 RLEXPGTXHZMUDD-XYPYZODXSA-N 402.282 -0.928 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728062 BYGQTTIZPBVIMZ-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282736056 KHEXKAPMYNHWFU-UHFFFAOYSA-N 400.237 -0.253 50 10 HBGE CCN([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282743855 UUBBASQBVMHXHT-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cc(C)c(B(O)O)s1 2283970947 WNHHYKPIERCYIR-LLVKDONJSA-N 400.262 -0.191 50 10 HBGE COc1ccc(NS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)cc1B(O)O 2339749487 UAPZDCTZCSGVEB-UHFFFAOYSA-N 418.236 -0.197 50 10 HBGE Cn1nccc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 771843895 DBGPOCUXKRMPGJ-UHFFFAOYSA-N 421.479 -0.165 50 10 HBGE CN(C)S(=O)(=O)CCCS(=O)(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 811700631 NDUKVTWVKRSKSQ-GJZGRUSLSA-N 419.525 -0.209 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=S)NCCc1cccs1 1623681563 LNNFCUIAWITROD-SNVBAGLBSA-N 416.554 -0.114 50 10 HBGE CCNC(=O)N(C)NC(=O)[C@@]12CN(C(=O)OC(C)(C)C)C[C@@H]1CS(=O)(=O)C2 1631362440 PAAHBTWRXIVMSS-BDJLRTHQSA-N 404.489 -0.039 50 10 HBGE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1646044612 KMCSIPWREJYBNY-DLBZAZTESA-N 422.457 -0.754 50 10 HBGE COC(=O)[C@]1(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)CCOC1 1654284567 GDDJUTFWZKQVNE-IBGZPJMESA-N 408.430 -0.464 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2OC)cc1OC 1682618214 LSGCEKZSHCQJMC-FZMZJTMJSA-N 401.441 -0.150 50 10 HBGE CC(C)(C)OC(=O)NCC1(Oc2cc(B(O)O)c(Cl)cn2)CS(=O)(=O)C1 2277606270 NKKJKANPWVLTSU-UHFFFAOYSA-N 406.653 -0.515 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O 2282378140 BCSGCXUADYGVPL-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NCc1cc(B(O)O)cs1 2283954213 CAVANKBRCLYDBM-LBPRGKRZSA-N 420.318 -0.628 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 744653802 KMKZDQPNNMDYGN-BBRMVZONSA-N 401.423 -0.022 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCCc3sccc32)n(C)c1=O 771647871 FLAXQMVCGMUQCT-NSHDSACASA-N 416.463 -0.237 50 10 HBGE Cc1nc(O)nc(O)c1CC(=O)N1CCN(S(=O)(=O)CBr)CC1 1152745199 FTCYUNQRKBGZDQ-UHFFFAOYSA-N 409.262 -0.435 50 10 HBGE O=C1N[C@]2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)C[C@H]3C[C@H]1[C@H]2C3 1446963896 RQCQPDMYWJWHPS-KZWBYHQPSA-N 406.302 -0.273 50 10 HBGE O=C(CN1CC[C@@H](c2ccccc2)NC1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1583281157 OMNNZGJVGQGEPT-KGLIPLIRSA-N 409.468 -0.340 50 10 HBGE Cc1cc(COCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)no1 1641317404 ZXHFUEPNJVVZBP-UHFFFAOYSA-N 424.483 -0.026 50 10 HBGE O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2)C(=O)N1 1646045797 STJPXXXRHRIQRZ-NVXWUHKLSA-N 414.462 -0.094 50 10 HBGE Cn1cc([C@@H]2[C@@H](C(=O)NNC(=O)CN3CCCC3=O)CC(=O)N2C(C)(C)C)cn1 1648934545 ALUYUKCSPIOQQV-SUMWQHHRSA-N 404.471 -0.122 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1ncc(B(O)O)s1 2029308103 MXWAVIKVWLPOEL-UHFFFAOYSA-N 423.281 -0.681 50 10 HBGE O=C(N1CCCC[C@H]1CNS(=O)(=O)c1ccc(B(O)O)s1)C(F)(F)F 2267610739 JLXWPTOPSQAITQ-QMMMGPOBSA-N 400.209 -0.350 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1S(=O)(=O)c1cc(B(O)O)nn1C 2282078969 PMMFGGKKUXOXBU-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE CCN([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2282079285 ULIBPJRCZSRIHV-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1CC[C@H]1NC(=O)OC(C)(C)C 2282361701 VJCZLHDVWIVAPC-VXGBXAGGSA-N 400.262 -0.291 50 10 HBGE Cc1ccc(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)COC2)c(B(O)O)c1 2282730857 INPKCGDAFJXMFH-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282741750 SAAUUQTWVBZBJN-GHMZBOCLSA-N 402.278 -0.045 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1cc(B(O)O)ccc1O)OCc1ccccc1 2282976639 WATJNKLRRBFNQU-DLBZAZTESA-N 414.223 -0.114 50 10 HBGE C[C@@H](OCc1ccccc1)[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(=O)O 2284411977 QRRVDVRTNIYVMW-ZWNOBZJWSA-N 414.270 -0.699 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@H]1COCCO1 744640855 DUELRGNWWJNHAT-MRXNPFEDSA-N 411.480 -0.034 50 10 HBGE NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)c2)C1 745810006 VXBHBJXMFOGCCL-SJORKVTESA-N 419.482 -0.370 50 10 HBGE CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)[C@@H]1COCCO1 755432808 UAJIZPGMWCWJQI-RDBSUJKOSA-N 414.503 -0.225 50 10 HBGE O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCN(C(=O)COc2ccccc2)C1 802467592 AVLBDNBBUOKGTR-CQSZACIVSA-N 403.439 -0.381 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCS(=O)(=O)C1 914444914 HIQGXLWZILRRLF-TZMCWYRMSA-N 415.493 -0.578 50 10 HBGE COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCO[C@H]2C)cc1OC 1299885117 LRNNQZHCEXLJIG-WCQYABFASA-N 415.468 -0.055 50 10 HBGE COc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cnn1C 1472475303 UKNWAQLNQDLOJH-UHFFFAOYSA-N 423.451 -0.476 50 10 HBGE CCc1c(C(=O)NNC(=O)Cc2ccccc2O)cnc2c1c(=O)n(C)c(=O)n2C 1557701640 SHKPSKHEMOSUBV-UHFFFAOYSA-N 411.418 -0.096 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 1623324799 FJYSLPRKLJBJEU-AWEZNQCLSA-N 401.533 -0.959 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)n1 2267029738 CIVISANZYYXYGP-SNVBAGLBSA-N 415.137 -0.918 50 10 HBGE C[C@H]1CN(C(=O)c2nn(C)nc2B(O)O)C[C@H](C)N1C(=O)OCc1ccccc1 2267040710 YWPUBURSUOYZRC-STQMWFEESA-N 401.232 -0.634 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282067302 YDSHIGKYCSGBDA-IELRGYKMSA-N 418.302 -0.613 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282092402 PIKLJXRBFBVAMI-CHWSQXEVSA-N 400.262 -0.985 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1cccc(B(O)O)c1 2282344944 XZLSJZZQYBCKSR-CQSZACIVSA-N 402.278 -0.986 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1[C@H](OC)[C@H](OC)CN1C(=O)OC(C)(C)C)B(O)O 2282376436 DONMTRMNQRZKQQ-UPJWGTAASA-N 408.282 -0.877 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 2282715057 AIJKPMBZKBFXMB-LLVKDONJSA-N 402.282 -0.834 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)cc1F 2282732019 ZOGFHXFXPWYOAU-UHFFFAOYSA-N 404.225 -0.323 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CN(S(=O)(=O)c1cscc1B(O)O)CCO2 2288439684 HVNFFHGLCWXCSC-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE CCc1ccc(NC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 757755307 TXYQOUGOOCTLBA-UHFFFAOYSA-N 417.401 -0.012 50 10 HBGE NS(=O)(=O)CCN1CCN(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)CC1 799933254 IVURQPHYKUKQGZ-UHFFFAOYSA-N 421.426 -0.695 50 10 HBGE Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@](C)(O)Cn2ccccc2=O)n1 1116863893 RPEMNGREUTXNIK-KRWDZBQOSA-N 408.436 -0.702 50 10 HBGE O=C(NNC(=O)c1cc(Br)cn2ncnc12)N[C@H]1CCS(=O)(=O)C1 1142193186 JPHZOPRLWAGPGG-QMMMGPOBSA-N 417.245 -0.377 50 10 HBGE Cc1cc(C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c2ccccc2n1 1479062961 JVHGZKYPXAIXKT-UHFFFAOYSA-N 406.468 -0.022 50 10 HBGE O=C(NNC(=O)C1(CC(=O)N2CCOCC2)CCCC1)N[C@H]1CCS(=O)(=O)C1 1626649863 IDLOGWBDIVQMSQ-ZDUSSCGKSA-N 416.500 -0.687 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@]2(C)CCC(=O)N2)cc1 1673428260 UMLIPIRQIAGAKW-KRWDZBQOSA-N 411.484 -0.385 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 2066517828 GSJNKCYKRNAPKA-JTQLQIEISA-N 423.281 -0.558 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N[C@@H](CB(O)O)C(=O)O)C1 2124535778 YHMYIBNSIMFGHE-SUNYJGFJSA-N 408.216 -0.155 50 10 HBGE Cc1cc(B(O)O)c(CN(C)S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)s1 2221849920 GGLNNLWJSQWUIE-UHFFFAOYSA-N 422.293 -0.206 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(CNS(=O)(=O)c3ccc(B(O)O)s3)[C@@H]2C1 2267203175 MZNVHKHKAWHCLC-QWRGUYRKSA-N 402.303 -0.181 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728053 BYGQTTIZPBVIMZ-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282848327 MGZYTPAJPJWENV-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@@H]2COCCO2)cc(Br)cc1S(N)(=O)=O 747413260 LJIAYJIQSVPILS-JTQLQIEISA-N 422.257 -0.419 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCOCC2=O)c1 790472074 LHLDXYRUCRWDRO-UHFFFAOYSA-N 412.468 -0.663 50 10 HBGE Cc1ccccc1NC(=S)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 913434520 NQZFMQUTUANNLG-UHFFFAOYSA-N 401.452 -0.240 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)NNC(=O)[C@H]3COCCO3)O2)C1 1313031967 DYSHZCLOCPVYFY-CHWSQXEVSA-N 414.459 -0.099 50 10 HBGE Cn1cc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 1457485677 BXOJOXFUEQXZJS-UHFFFAOYSA-N 422.467 -0.770 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1623534495 QFNDVYJTVSYULN-PWSUYJOCSA-N 409.244 -0.022 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)N1CCN(S(=O)(=O)CBr)CC1 1631771995 JELRRUFKKMTBBD-UHFFFAOYSA-N 406.324 -0.906 50 10 HBGE CC(C)NS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1 1654437294 NVVNXCCFKWZPIN-UHFFFAOYSA-N 408.484 -0.820 50 10 HBGE COC(=O)[C@H]1C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1 1686809698 YFSLUTDQTNUYKS-BETUJISGSA-N 412.468 -0.102 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CCNS(=O)(=O)c2cscc2B(O)O)C1 2282359227 KXNLQNPAJBAHPW-NSHDSACASA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)Cc1ccc(B(O)O)cc1 2282377039 LWPYHDNSDCGNEU-UHFFFAOYSA-N 408.232 -0.054 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)ccc1C 2282729591 PENVMZIVNKFDQU-UHFFFAOYSA-N 400.262 -0.154 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)ccc1O 2282978737 QPIHKNWGJFOSDB-INIZCTEOSA-N 414.223 -0.161 50 10 HBGE Cc1cc(C(F)(F)F)n2nc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2n1 1472505285 SVKWLHXOVURAEF-ZETCQYMHSA-N 408.362 -0.245 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cnn(CCOC)c2)C1 1636211785 ZFOSJHPUNGGREM-ZDUSSCGKSA-N 411.459 -0.181 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2267199026 GKZZOXNLCDZOQJ-UWVGGRQHSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613020 RXLHVEUZIMZOTB-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE C=CC1(NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2267626597 KYUHQFIQDDORBD-UHFFFAOYSA-N 403.291 -0.582 50 10 HBGE CCn1cc(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)nc1B(O)O 2281632773 VMMXDOIUOHSFSG-JGFSIVIASA-N 400.266 -0.512 50 10 HBGE C[C@H]1C[C@@H](CNS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 2282372612 ZFERHTPEYJCRGT-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)CCO1 2282420080 ZZQYNKAXVQESPE-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282425783 UHHNNNOBIMXCCJ-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE CN(C[C@H](O)CN(C)S(=O)(=O)c1ccccc1B(O)O)C(=O)OC(C)(C)C 2282720017 UJFOZEDJOOGKTN-LBPRGKRZSA-N 402.278 -0.785 50 10 HBGE CC[C@H](C#N)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1149621877 DZQUOTITVQTHMX-OAHLLOKOSA-N 407.496 -0.002 50 10 HBGE CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1287238502 OUELGVNOTIMTLS-BPUTZDHNSA-N 404.467 -0.045 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1 1290254886 DYPLTBBEYPHGGZ-UHFFFAOYSA-N 402.498 -0.567 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCO[C@@H]2C)CC1 1452257639 KAKGIBSEBFKLOL-OCCSQVGLSA-N 413.500 0.000 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1 1540551582 FYTLYUVUQGXRBJ-LBPRGKRZSA-N 400.370 -0.271 50 10 HBGE CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COCCOC)c1 1635058080 ZHGPXSYGUAZGFI-UHFFFAOYSA-N 424.273 -0.219 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)NNC(=O)[C@H]3CCO[C@H]3C)C2)cc1 1635069383 VTOIVCUPHOHPSW-NHYWBVRUSA-N 412.468 -0.177 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)C(=O)c2cc(S(N)(=O)=O)cn2C)cc1 1644013424 ORHGMACLSXLLAB-UHFFFAOYSA-N 424.508 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@H](F)C1 2282091780 ISJKDBVIEANUMS-KGLIPLIRSA-N 402.253 -0.008 50 10 HBGE COC1(CNS(=O)(=O)Cc2ccsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282335623 RVSBGCJAODRUFI-UHFFFAOYSA-N 420.318 -0.517 50 10 HBGE C[C@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286908551 WTPDBLICDNAYRW-JQWIXIFHSA-N 402.282 -0.834 50 10 HBGE COc1cccc(C(=O)NCC(=O)NN=C2C(=O)N(CC(N)=O)c3ccccc32)c1 254632283 SXENHXFNTJMLEK-UHFFFAOYSA-N 409.402 -0.223 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1 764559510 SEMINFJYFXGJKB-UHFFFAOYSA-N 404.452 -0.126 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1OC 1351252726 ZNNJBEXFWVPSFT-UHFFFAOYSA-N 409.424 -0.391 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@@H]2COCC[C@H]21)NNC(=O)c1cccc(Cl)c1 1460221555 KMJWBLDIRMZUNK-ZIAGYGMSSA-N 401.872 -0.011 50 10 HBGE CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@@H]2COCCO2)c1 1566168619 LWNOHWLSCPOGRN-NSHDSACASA-N 422.257 -0.466 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)[C@@H]1C[C@H](O)CN1c1ccncn1 1645963018 ABACKWXYRTWNEE-XQQFMLRXSA-N 406.443 -0.427 50 10 HBGE CN(CC(=O)NNC(=O)c1cccc(Cl)c1)Cc1nnc2c(=O)n(C)ccn12 1648293163 RYPFWHDPHPAHRH-UHFFFAOYSA-N 403.830 -0.026 50 10 HBGE Cn1cc([C@@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1 1658523843 FVCHJQAVIFZLTL-PEGYKEAPSA-N 420.451 -0.105 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2sncc2B(O)O)C1 2267439866 XSLKROKHZKKHSF-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282357447 JYMWJFIDWLQZPL-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 2282369592 IUANYSGXRDQDKY-OLZOCXBDSA-N 400.262 -0.755 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2csnc2B(O)O)CC1 2282456484 IVMWPCLVAWVULL-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NS(=O)(=O)c2sccc2B(O)O)CCO1 2282699453 KFCOVCNFAMVQRE-WDEREUQCSA-N 420.318 -0.222 50 10 HBGE O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)[C@H]3COCCO3)nn2)c(Cl)c1 763435185 QKKZHQTXVQMLGE-OAHLLOKOSA-N 423.813 -0.001 50 10 HBGE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 800055658 LTDLMGMNHLKQNF-ZOWXZIJZSA-N 412.468 -0.125 50 10 HBGE CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816885130 RBCINKCRKKVUQP-LBPRGKRZSA-N 406.468 -0.092 50 10 HBGE CC1(C)NC(=O)N(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 856534502 RFKUNQHBFYUQMC-UHFFFAOYSA-N 416.482 -0.324 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2S1(=O)=O 1126909476 AOHMZAXGBOBUJG-UHFFFAOYSA-N 403.424 -0.831 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@@H]1CCC(=O)N1)S(=O)(=O)c1ccc(F)cc1 1131508552 SNWOSOYKPREUIO-ZDUSSCGKSA-N 400.432 -0.348 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1318349379 MSFXDMOMBBOKIO-ARFHVFGLSA-N 422.507 -0.119 50 10 HBGE CCS(=O)(=O)N(C)CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 1585920603 LENOAMJVKCIANL-UHFFFAOYSA-N 421.520 -0.002 50 10 HBGE COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)c1 1627991356 DWUXUXXGQZBHRS-JTQLQIEISA-N 420.241 -0.868 50 10 HBGE Cc1c(C(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2266860947 SXYBUZLZSQYKMX-LJQANCHMSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2cscc2B(O)O)C1 2267625377 OMMHGMBIAQMTJZ-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@]1(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C1 2282259809 VHFYLWGNXROJAF-JGFSIVIASA-N 400.266 -0.747 50 10 HBGE C=CC1(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)CN(C(=O)OC(C)(C)C)C1 2282415808 MNZHCXLWHWUBBZ-UHFFFAOYSA-N 400.237 -0.041 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282719575 OAFGCUAZFCWYOV-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE Cc1nc(S(=O)(=O)NC2CC(C)(NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282857037 BRQJYJULSRKMPK-UHFFFAOYSA-N 402.282 -0.868 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 744646018 VONHSPWXJALSEB-JTQLQIEISA-N 405.379 -0.418 50 10 HBGE CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 812732990 XCVNFYZISINYDN-UHFFFAOYSA-N 405.440 -0.476 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCCCO3)cc2S1(=O)=O 1129265095 BWXHSIHLJUERLK-CYBMUJFWSA-N 411.436 -0.192 50 10 HBGE COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)CC2 1290349067 LJXDJLIJPJZAKR-CYBMUJFWSA-N 411.480 -0.356 50 10 HBGE CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CC1 1290349555 UMRWCUYYUIJBKT-WCQYABFASA-N 405.542 -0.194 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1472504776 IISKFWNWPHCZRP-USZNOCQGSA-N 404.489 -0.141 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)c3cncn3-c3ccccc3)c2S1(=O)=O 1618783056 UTJGLMMEYNNKKJ-UHFFFAOYSA-N 415.435 -0.222 50 10 HBGE COc1ccccc1-c1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)N(C)C)n[nH]1 1637726626 ZZBUJXIJRQBQLN-UHFFFAOYSA-N 410.456 -0.416 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)Nc1nc(CNC(=O)OC(C)(C)C)cs1 2282069867 WFZZGNHBFNVUMO-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282071939 XXTFRUFCFPIGBS-VXGBXAGGSA-N 420.318 -0.269 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282072800 JFSMRUPMLDTBDF-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE Cc1cc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C#N)sc1B(O)O 2282362655 AHDXDBDIHBYEIU-NSHDSACASA-N 415.302 -0.130 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC(C)(NC(=O)OC(C)(C)C)CC2)n1 2282364828 QVQZYZOXKYDLJC-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H]1CNS(=O)(=O)c1cccc(B(O)O)c1 2282429822 XBHFWILVFXXOQF-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](F)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282714924 YPTHNTBYXJKFRJ-CHWSQXEVSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)NCc1c[nH]nc1NS(=O)(=O)c1sccc1B(O)O 2352327734 UIAOCKJMDSKODJ-UHFFFAOYSA-N 402.263 -0.024 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)NNC(=O)C(F)(F)Oc1ccccc1 814305131 DZEKTGDBDNVCGB-SNVBAGLBSA-N 409.353 -0.126 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC(N3CC[C@@H](O)C3)CC2)cc1OC 1174742366 KWZZJBOOQITNKL-MRXNPFEDSA-N 406.483 -0.004 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CN(C)CCN1C 1479597494 PUUHJHGPQGZYFM-DOMZBBRYSA-N 401.471 -0.488 50 10 HBGE CCOc1ccc(C(=O)N2CSC[C@H]2C(=O)NNC(=O)CS(C)(=O)=O)cc1 1557734322 KOFBJMLXOQSFJU-ZDUSSCGKSA-N 415.493 -0.208 50 10 HBGE O=C(NCC[S@](=O)CC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1 1565056493 GMAWUIZBVPTHIW-MHZLTWQESA-N 405.362 -0.083 50 10 HBGE O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)c1ccc(B(O)O)cc1 1568628297 ASWKPMQKNJLXEF-QGZVFWFLSA-N 414.242 -0.047 50 10 HBGE CN1C[C@@H](O)C[C@@]1(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1586780041 GEUKQMWPJVPADO-KSSFIOAISA-N 410.496 -0.313 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc2nccn2c1 1629793510 ULPVAJOAHAYSIB-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC1CS(=O)(=O)C1 1634326905 PLYCFXHGIROGNO-UHFFFAOYSA-N 417.513 -0.333 50 10 HBGE COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCOCC2)cc1OC 1643425013 WUOWRCBWAYEWTR-UHFFFAOYSA-N 415.468 -0.054 50 10 HBGE COC(=O)CN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC(=O)OC 1652822395 SNIFXOXXXVSZGQ-UHFFFAOYSA-N 401.803 -0.242 50 10 HBGE O=C(N[C@@H]1CC[C@@H]1NS(=O)(=O)c1cncc(B(O)O)c1)OCc1ccccc1 2255678164 AKGMLDXBIMWUAJ-CVEARBPZSA-N 405.241 -0.503 50 10 HBGE Cc1c(C(=O)N(C)[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2267357537 ARDKDORBPOQBOI-GJZGRUSLSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)c2cscc2B(O)O)C1 2267382673 OHGKAWCPHNVZSE-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2COCCN2Cc2ccccc2)sc1B(O)O 2282376952 LAFPFPDVHXXENN-HNNXBMFYSA-N 410.326 -0.084 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282380380 IGOOHMFWVVQGRJ-QWRGUYRKSA-N 402.282 -0.786 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C 2282381908 XWPPBNOYZGNZPL-MRXNPFEDSA-N 402.278 -0.771 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282506101 NIEVIGPEWKGVKR-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282508580 YCPRYRQKILROEL-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2282708735 QMCDXAPLBLBQNQ-UTUOFQBUSA-N 420.318 -0.223 50 10 HBGE CN(CCOCCNS(=O)(=O)c1ccccc1B(O)O)C(=O)OC(C)(C)C 2282718907 DROJGOSRGWTNOM-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)NCC1(CC(=O)N=c2nc(B(O)O)[nH]s2)CCOCC1 2284059612 HRXNZXNELMQLOV-UHFFFAOYSA-N 400.266 -0.710 50 10 HBGE O=C(NNC(=O)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1)[C@H]1COCCO1 746003273 OVLJTVSSQFDIGH-IAGOWNOFSA-N 417.466 -0.434 50 10 HBGE Cc1c(C(=O)NNC(=O)CN2CCCC2=O)nnn1-c1ccc2c(c1)OCCO2 1152015512 WZTNGSXIRTUVKH-UHFFFAOYSA-N 400.395 -0.270 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NCC1(N2CCOCC2)CCN(C)CC1 1251864697 CAHMXYJFEOGYRI-HNNXBMFYSA-N 401.508 -0.835 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)cc1OC 1351252145 QTBTVPCVDDAHGP-UHFFFAOYSA-N 408.436 -0.017 50 10 HBGE CC(C)(C)OC(=O)NCCOCC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1456035780 DRCFSGKPHBBCCM-AWEZNQCLSA-N 400.476 -0.072 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1539401651 HPBAHULEFRFNLV-KGLIPLIRSA-N 411.455 -0.201 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)c2)C[C@@H](C)O1 1543093505 GJKSYGFXSQLSFZ-TYNCELHUSA-N 424.479 -0.476 50 10 HBGE O=C([C@H]1CCc2nnnn2CC1)N1CCN(S(=O)(=O)CBr)CC1 1546251633 FZEDAVNIQCLRTN-JTQLQIEISA-N 407.294 -0.548 50 10 HBGE CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cn(C)nn1 1557479755 YHHJWPJFKUAVCX-CYBMUJFWSA-N 406.468 -0.107 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 1557734000 DQLIDMDKRHDTCM-CYBMUJFWSA-N 403.482 -0.578 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1 1632321352 XFYVJNPSIRFKFT-UHFFFAOYSA-N 409.464 -0.221 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1sccc1B(O)O 2267207022 OENAKLMBBYQGNQ-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)[C@H]2C[C@@H]21 2267365825 WENVUNLLKCKQMT-RYUDHWBXSA-N 402.303 -0.049 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NC(=O)c2ncc(B(O)O)cc2F)C1 2282292862 BDXWZTOPAFBWAP-JGFSIVIASA-N 401.225 -0.194 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NC[C@H]1CN(Cc2ccccc2)CCO1 2282377355 POBKDUUQMLUYHG-AWEZNQCLSA-N 411.314 -0.857 50 10 HBGE C=C(CS(=O)(=O)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1)B(O)O 2282729048 JPWLGLBXISEBTE-AWEZNQCLSA-N 403.310 -0.489 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(B(O)O)cc2F)COC1 2282740164 VPOMUFYQJJIYJQ-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE 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1587158996 GSJVNKKFYQXBPQ-UHFFFAOYSA-N 405.523 -0.200 50 10 HBGE CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1596923730 SNCQWMVFHQVRPZ-QGZVFWFLSA-N 424.523 -0.120 50 10 HBGE O=C(c1cccc(B(O)O)c1)N1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1 1628755321 RPMQEEUYPTYDKM-UHFFFAOYSA-N 410.207 -0.209 50 10 HBGE COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)CN2CCCC2=O)C1=O 1648934911 OKCVYCSKFKXWDR-LJQANCHMSA-N 417.422 -0.768 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 1670983876 HYBAWKOJUXKEDI-SCLBCKFNSA-N 421.479 -0.057 50 10 HBGE CN(Cc1sccc1B(O)O)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 1950891416 RRNQIIQDSFJQEB-UHFFFAOYSA-N 408.266 -0.514 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)n1C 2267711711 OXHSERJNEQLWKQ-ZIAGYGMSSA-N 422.272 -0.856 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 2282078313 GYVKZQZFJWWWEY-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NCC1(F)CC(NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282102465 JOTISCCQVYDISV-UHFFFAOYSA-N 403.241 -0.565 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282104702 ZMVLBLCAADYSAU-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282364317 NXLSFCYBYAQWPX-STQMWFEESA-N 404.225 -0.924 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2O)sc1B(O)O 2282368984 YUBIYGXDYWLYBM-QWRGUYRKSA-N 420.318 -0.615 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC(C)(NC(=O)OC(C)(C)C)CC1 2282719817 RDLHOBHLHZRWFR-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C[C@@H](O)C1 2282729337 LRVCSPSTLVYSOG-WDEREUQCSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282861689 RENKWGSNJGWCQL-UHFFFAOYSA-N 404.225 -0.322 50 10 HBGE C[C@H](OC(C)(C)C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N=c1nc(B(O)O)[nH]s1 2284060540 OPJDJFBVNDBPAN-DTWKUNHWSA-N 402.282 -0.325 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1cc(B(O)O)ccc1Cl 2359391448 ZXZPCKSZZVWNAH-JHJVBQTASA-N 400.624 -0.701 50 10 HBGE Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816881115 ZHCAUAPGAYZSIX-ZFWWWQNUSA-N 413.417 -0.094 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl 1470660590 CDSSZWVZFSQMCO-UHFFFAOYSA-N 409.873 -0.315 50 10 HBGE O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)[C@@H]1CCC(=O)N1 1587114624 ODKFRVYDKRBXNW-NWDGAFQWSA-N 407.814 -0.029 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1 1608486718 IYVBGRZHAAOFFI-BETUJISGSA-N 413.519 -0.557 50 10 HBGE C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N(C)C 1618795325 KAELNTMWRHURJD-CQSZACIVSA-N 412.512 -0.262 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1NC(=O)OC(C)(C)C 2267211855 RNZYJCBKNAWVJR-NXEZZACHSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C1 2282380683 MUNOVRJHHVMPIK-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@@H](C#N)C1 2282381395 UEJDRAYTBDJOBB-JTQLQIEISA-N 416.290 -0.902 50 10 HBGE CN(C1(CNC(=O)OC(C)(C)C)CCC1)S(=O)(=O)c1nn(C)cc1B(O)O 2282730044 WLJYGVJUCZEOOJ-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(CCO)CCCNC(=O)OC(C)(C)C 2282733339 UMMKXWMOSMJJDI-UHFFFAOYSA-N 422.334 -0.366 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)CC1)C(F)(F)F 2286110671 BDQCUNCTUXEWQF-MRVPVSSYSA-N 415.224 -0.814 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1 1301698232 XPXDSSWLVRGUIV-INIZCTEOSA-N 401.416 -0.071 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 1456016689 GZNSMQDAZUXLCH-BBATYDOGSA-N 409.443 -0.136 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(F)n3)c2)CCN1 1530274745 ZDXQUGBOMZAVOA-UHFFFAOYSA-N 421.410 -0.584 50 10 HBGE CN(C)CCSc1nc(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cs1 1628912454 RIAWPZVXQXAPCK-JTQLQIEISA-N 406.555 -0.079 50 10 HBGE CC(C)C(=O)NNC(=O)CN1CCN(CCNS(=O)(=O)c2ccccc2)CC1 1655172677 MWHPRZRTKWHTLL-UHFFFAOYSA-N 411.528 -0.614 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)C1CCOCC1)C1CCCC1 1682374851 IMJFIHIBPUFCOB-AWEZNQCLSA-N 405.521 -0.302 50 10 HBGE O=C(NC[C@H](NC(=O)c1c[nH]nc1B(O)O)C(F)(F)F)OCc1ccccc1 2255788490 QCGADRCVJJGGQX-NSHDSACASA-N 400.122 -0.323 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2sccc2B(O)O)C1 2267205697 VURYHZFTNAGVJR-UHFFFAOYSA-N 406.291 -0.876 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)OCc3ccccc3)C2)cc1B(O)O 2267420132 VQAKZAKZPCDYBM-UHFFFAOYSA-N 420.252 -0.326 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1CO 2282071461 RNKJAQQDRNLVBZ-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE Cc1nc(S(=O)(=O)NCC(C)(C)CNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282338876 QKDWAXBOHZAAKZ-UHFFFAOYSA-N 404.298 -0.762 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)Cc2ccc(B(O)O)cc2)COC1 2282733095 QDBYWFLVPJOOFU-UHFFFAOYSA-N 400.262 -0.921 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C[C@H]1O 2282734159 HZYAQONLKGKSCX-YUSALJHKSA-N 420.318 -0.630 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(F)c(B(O)O)cc2Cl)C1 2282972949 WEHCYKQBBTXDTG-CHWSQXEVSA-N 402.615 -0.131 50 10 HBGE CC1=C(C#N)C(=O)NC(=O)/C1=C/N1CCN(/C=C2/C(=O)NC(=O)C(C#N)=C2C)CC1 110213215 GYJHNGYKDJZELB-KAVGSWPWSA-N 406.402 -0.635 50 10 HBGE O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)[C@@H]1COCCO1 744642812 FIIOMWWJGKCGMP-NEPJUHHUSA-N 403.482 -0.146 50 10 HBGE CC(C)C[C@H](C)OCCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765723927 FYXGQRGMOHDMPU-LBPRGKRZSA-N 408.459 -0.578 50 10 HBGE O=C(c1ccc(B(O)O)cc1)N1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1 1539122547 XFNDJYISWFROCG-UHFFFAOYSA-N 410.207 -0.209 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)N2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1 1617856949 ZMRVQAYYDYKUIW-UHFFFAOYSA-N 416.264 -0.632 50 10 HBGE C[C@H](CO)N(C)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 1639064439 NBHRZFPSSHBUCO-OAHLLOKOSA-N 412.512 -0.357 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)s1 2267611893 DAPDHEXAPCZZPB-JTQLQIEISA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613244 ALNPAYXWRWPXLP-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE COC(=O)[C@H](CBr)NS(=O)(=O)c1c(Br)nnn1C 2320335922 XVRJLDOYSCTIFC-BYPYZUCNSA-N 406.056 -0.208 50 10 HBGE CN([C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)c1ccccc1B(O)O 2369652521 NUIGOEFBLXIYNQ-OLZOCXBDSA-N 402.253 -0.056 50 10 HBGE CCCOc1c(OC)cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc1OC 169893048 GFAJQTVGFOEASS-UFWORHAWSA-N 406.399 -0.174 50 10 HBGE CC[C@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)N(C)C1 616589997 UHQYIIRIOVIPLI-RFIHHVCESA-N 410.964 -0.001 50 10 HBGE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2COCCO2)c(OC)c1 744650206 WHMIOZHQLDRUIO-GOEBONIOSA-N 407.423 -0.129 50 10 HBGE COc1cc(C=NNC(=O)[C@H]2COCCO2)ccc1OCC(=O)N1CCOCC1 745206697 AUFHAGJDVXXLIJ-QGZVFWFLSA-N 407.423 -0.202 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@@H]2CCCO[C@@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 779713799 RTUCJRYMBAESGJ-XHSDSOJGSA-N 409.464 -0.107 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@@](C)(O)Cn2ccccc2=O)c2ccccc2c1=O 790463728 XDUGAERRSYLWEH-FQEVSTJZSA-N 411.418 -0.210 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC3(CC2)C[C@H](O)CNC3=O)cc1OC 1460876678 GOXFBZVHMWZRRS-AWEZNQCLSA-N 420.466 -0.572 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)COCC(=O)NCc1cccnc1 1538856671 YDGLUWAGESBTJN-UHFFFAOYSA-N 402.407 -0.051 50 10 HBGE CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c1 1540483724 XGFIPJYPNCIVRV-BZUAXINKSA-N 400.439 -0.563 50 10 HBGE CN(C(=O)OCc1ccccc1)C1CN(S(=O)(=O)c2cncc(B(O)O)c2)C1 2255884023 QMMPKVNUPMUQHZ-UHFFFAOYSA-N 405.241 -0.597 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H]1CNS(=O)(=O)c1sccc1B(O)O 2267200280 UNDMXEBQGMKLLE-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@H](CO)NC(=O)OC(C)(C)C)c1B(O)O 2267411389 YLWUFSYHOCFLQC-SNVBAGLBSA-N 408.307 -0.791 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@](F)(CNC(=O)c2sncc2B(O)O)C1 2281919383 DPCZRSYRQRBNEA-OAHLLOKOSA-N 403.241 -0.472 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cn(C(F)(F)CO)nn1 1290023140 SPJNGTLWKPJMBF-UHFFFAOYSA-N 423.424 -0.207 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CSCC(=O)N1CCOCC1 1645449394 RAGLPELYBOMDBN-UHFFFAOYSA-N 402.517 -0.332 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]2CS(=O)(=O)C[C@@H]21 1648201345 GDKHUNZBCSJXGM-CABCVRRESA-N 424.284 -0.775 50 10 HBGE O=C(NCc1nnc2n1CCNC2=O)NNC(=O)c1cccc(Br)c1 1684992168 ZNEKSXKCHKVPMU-UHFFFAOYSA-N 408.216 -0.072 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282083312 OAAYJNNSMXFZAL-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1ncc(B(O)O)cc1F 2282290866 BJYGHARACIJXLM-OAHLLOKOSA-N 417.202 -0.332 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)c1ccc(F)c(B(O)O)c1)C2 2282342356 GKUSBWMTDWDTCZ-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N[C@@H]1CCOC[C@@H]1OCc1ccccc1 2282384445 MTEZZSDYKLNMPG-HIFRSBDPSA-N 412.298 -0.383 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282708152 IQQDYPJIQVGPQU-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282719319 KESPKPMEYIDLKI-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2cc(B(O)O)c(Cl)cn2)[C@H](S(C)(=O)=O)C1 2294913126 ASBQZSBZZSWEFG-NWDGAFQWSA-N 419.696 -0.141 50 10 HBGE CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 812881178 MMJZUCJSEIWPOB-HIFRSBDPSA-N 424.479 -0.644 50 10 HBGE O=C1N[C@@]2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)C[C@H]3C[C@H]1[C@H]2C3 1446963872 RQCQPDMYWJWHPS-DYNIEEOBSA-N 406.302 -0.273 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c(OC)c1 1542889037 MGWXOFNQLSTNAH-UHFFFAOYSA-N 409.424 -0.391 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@H]3CS(=O)(=O)C[C@]3(C#N)C2)cc1OC 1644636603 HLVJVBLMKFIKKP-UGSOOPFHSA-N 422.463 -0.665 50 10 HBGE Cc1c(C(=O)N2CCC(NC(=O)OCc3ccccc3)CC2)nn(C)c1B(O)O 2266866021 ULOGXOMEEQEFIV-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@@H]1NC(=O)C(F)(F)F 2267206908 MSSXRNDVCGLSCB-CBAPKCEASA-N 400.209 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Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)nc1 764406963 HCVSWOFCSGFDDX-UHFFFAOYSA-N 410.434 -0.345 50 10 HBGE C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1nnc2c(=O)n(C)ccn12 1254666013 IKZAQKGZDHVNCB-JTQLQIEISA-N 403.374 -0.135 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)C1 1469404236 ZTMKJMYCENMLLN-HZSPNIEDSA-N 413.500 0.000 50 10 HBGE CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCC1 1558898910 LFCMVJBQYVRKKF-UHFFFAOYSA-N 410.496 -0.047 50 10 HBGE COC(=O)[C@@H]1CN(C(=O)c2ccc(B(O)O)cc2)CC12CN(C(=O)OC(C)(C)C)C2 1639348089 PBPFAARKPZTGIM-HNNXBMFYSA-N 418.255 -0.152 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2267607650 PUFJVSVBJLDBQJ-UWVGGRQHSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)CC1 2281850455 VWVBMLXGQKEETN-MHZLTWQESA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2ccccc2B(O)O)C1 2282102709 KZSDBBCPVAJWCM-AREMUKBSSA-N 418.302 -0.228 50 10 HBGE 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CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1C 2365421787 MOLNIVHAHLUIJO-CYBMUJFWSA-N 402.278 -0.507 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 744642368 JEIQYDPHBPVIBX-HOTGVXAUSA-N 411.480 -0.209 50 10 HBGE CO[C@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)n1 750287062 IEPOTMFGIHELOA-OLZOCXBDSA-N 412.447 -0.559 50 10 HBGE Cc1cccc(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1Cl 792605090 FSCLTCHSFNGWHK-UHFFFAOYSA-N 418.841 -0.214 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NN(C)C[C@@H](C)O 1141853664 WUZWRDBRDMCCAE-TZMCWYRMSA-N 401.485 -0.428 50 10 HBGE CNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2 1468751151 PFSZSXGUKYDRAH-UHFFFAOYSA-N 402.498 -0.016 50 10 HBGE COCCOCC(=O)NNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 1470923444 ICZBNUAKQPUODH-BQYQJAHWSA-N 420.466 -0.290 50 10 HBGE Cn1cc(I)c(CNC(=O)NNC(=O)c2ncccn2)n1 1564746923 LYBZZQOOKNIIIP-UHFFFAOYSA-N 401.168 -0.041 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccn(C)n2)CC1 1648592927 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420.495 -0.183 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCCC[C@@H]2C2CC2)n(C)c1=O 1137298876 FREJOSQRNPWERQ-OLZOCXBDSA-N 402.455 -0.203 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CN2CCCC3(CC3)S2(=O)=O)C[C@@H](C)O1 1306209833 OHXTWQVVTFETFF-OKILXGFUSA-N 402.517 -0.409 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)NNC(=O)[C@H]3COCCO3)O2)C1 1313031969 DYSHZCLOCPVYFY-QWHCGFSZSA-N 414.459 -0.099 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)N[C@H]1CCS(=O)(=O)C1 1464442697 IKYGKZVCNZIICB-CMPLNLGQSA-N 401.466 -0.535 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NN(C)C(=S)NCCCOC)[C@H]1c1ccnn1C 1540420402 PALAMEKSIQOLIA-CABCVRRESA-N 412.516 -0.418 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCO[C@H]2CCOC2)cc1 1687698739 VWYCGBXRNLYQCW-AWEZNQCLSA-N 414.484 -0.249 50 10 HBGE Cc1nc(S(=O)(=O)N(C)CCN(C)C(=O)OCc2ccccc2)c(B(O)O)n1C 2267714285 IQIRRSCLVRMOKM-UHFFFAOYSA-N 424.288 -0.703 50 10 HBGE O=C(N[C@H]1CCCN(S(=O)(=O)c2ccc(B(O)O)s2)CC1)C(F)(F)F 2270594857 JCCYKHORNJTWQW-QMMMGPOBSA-N 400.209 -0.350 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2282073498 NMDNDKJHURTSHP-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282102371 JDLPQDRAQJIOIR-NWDGAFQWSA-N 402.253 -0.008 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2283958453 ZTLLCVLAMOLDHN-SNVBAGLBSA-N 401.612 -0.190 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](NS(C)(=O)=O)C1 735078935 XKSWKKKLUOCAGK-LLVKDONJSA-N 404.876 -0.267 50 10 HBGE C[C@@H](Sc1ccccn1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766635410 CHINZGHGKOQVRL-SNVBAGLBSA-N 417.451 -0.843 50 10 HBGE CC[C@@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)C(=O)N1CCOCC1 792989779 MMIWNILZJHLFMU-OAHLLOKOSA-N 421.454 -0.119 50 10 HBGE O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCCO1 817215422 XVAKIPZLFLBVJL-XJFOESAGSA-N 401.485 -0.578 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1(S(C)(=O)=O)CC1 1117467954 MLLNUURONQQBNQ-SNVBAGLBSA-N 407.452 -0.157 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCC(C(N)=O)(N3CCCCC3)CC2)n1 1197360259 XMQFHQKYBKKWTN-UHFFFAOYSA-N 422.555 -0.053 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2nnn(C(C)(C)C)n2)cc1 1472473171 KUTCCMLBUOGUOV-UHFFFAOYSA-N 423.499 -0.253 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)c1cnn2c1S(=O)(=O)N(C)CC2 1540473895 VYFCVFYYPBNMLL-UHFFFAOYSA-N 403.424 -0.452 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)N1C(=O)NC2(CCCC2)C1=O 1645053532 ICXDJFFPEGOTJY-OCCSQVGLSA-N 407.471 -0.360 50 10 HBGE CCN(OC)C(=O)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1683562938 IVGWIOVZNAKKBW-UHFFFAOYSA-N 415.472 -0.644 50 10 HBGE COC(=O)[C@H](Br)CN1C[C@@H](NC(=O)C(F)(F)F)C[C@H](C(N)=O)C1 1999244670 WNFOHTPIKMDHFD-BIIVOSGPSA-N 404.183 -0.223 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)NCCSSCCNC(=O)OC(C)(C)C 2266949809 WRZLAKDYVXSJDY-UHFFFAOYSA-N 405.311 -0.869 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1sccc1B(O)O 2267202545 DOSYHZSRTICFJT-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2267208385 JKUADVQWQKATIG-UWVGGRQHSA-N 402.303 -0.038 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1cscc1B(O)O)NC(=O)OC(C)(C)C 2267392055 VJIAQVROEJINNC-SNVBAGLBSA-N 408.307 -0.364 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@H]1CN(Cc2ccccc2)CCO1 2282408631 JKKOISPDWLJANE-INIZCTEOSA-N 410.326 -0.252 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)Cc1ccc(B(O)O)cc1 2282735885 HRLHIRIBCRVLAI-INIZCTEOSA-N 402.278 -0.939 50 10 HBGE COc1cc(C(=O)NNC(=O)Cn2cnc3c(cnn3C)c2=O)cc(OC)c1OC 14074829 WGTNANQNNJATAN-UHFFFAOYSA-N 416.394 -0.383 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2c[nH]c3cc(F)ccc23)n(C)c1=O 765872198 UEKGFTGDLXOCSQ-UHFFFAOYSA-N 413.369 -0.485 50 10 HBGE CCc1ccc(F)cc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1149621828 CTIVPTVFOAFPPX-UHFFFAOYSA-N 402.386 -0.404 50 10 HBGE O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1156183614 DBSSPWKOMIRPGB-HNNXBMFYSA-N 402.517 -0.407 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H](O)C1CC1 1440626640 QSQPMVJHJIKNSA-KRWDZBQOSA-N 411.480 -0.442 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)CC1 1558458513 IIRFRPVAHQTFMV-HNNXBMFYSA-N 402.517 -0.551 50 10 HBGE O=C(NCCCCN1CCN(c2ncccn2)CC1)c1cc(B(O)O)ccc1F 1627374045 JCWIPILRXFKKOP-UHFFFAOYSA-N 401.251 -0.372 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1ccc(B(O)O)cn1 2040764208 ZPSRGXREZQPBFF-UHFFFAOYSA-N 403.225 -0.421 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2255752905 NKJXXAIMAYXHLF-ZETCQYMHSA-N 414.698 -0.755 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 2267024357 KUVVJXSYWIKGSV-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1sccc1B(O)O 2267201923 VNZARNSMAXNYPZ-WDEREUQCSA-N 406.291 -0.612 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@H]12 2267377051 FGMXKMMXLTWKNY-IUCAKERBSA-N 403.291 -0.892 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282100800 YXIDWXWBFZEPBL-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282337827 NPXXZXXBIKCZSM-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282422341 ZWHMXWCOEUHJAD-YUMQZZPRSA-N 415.224 -0.816 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)S(=O)(=O)c1ccccc1B(O)O 2282710203 LJWGZDDQYYEAOK-UHFFFAOYSA-N 402.278 -0.736 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2ccc(B(O)O)cc2Cl)COC1 2282737625 IPZVRVGNCXOYKE-UHFFFAOYSA-N 420.680 -0.408 50 10 HBGE C[C@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(B(O)O)cs1 2284041959 UOQBDZQBVVVYHV-JOYOIKCWSA-N 402.253 -0.075 50 10 HBGE COCC[C@@]1(C(=O)N=c2nc(B(O)O)[nH]s2)CCN(C(=O)OC(C)(C)C)C1 2284124043 CVXYJOJKAYYLPV-HNNXBMFYSA-N 400.266 -0.758 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@@H](COCc2ccccc2)C(=O)O)c1B(O)O 2284396826 YYFKAOVLVAJQMD-ZDUSSCGKSA-N 413.282 -0.007 50 10 HBGE COc1ccc(C=NNC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)cc1OC 27527414 PHIRYWIAVJWOPN-UHFFFAOYSA-N 400.395 -0.399 50 10 HBGE O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)[C@H]1COCCO1 746001927 IOPOKJGXMTUEAI-QGZVFWFLSA-N 417.466 -0.651 50 10 HBGE C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)C1=O 816882066 WMHVBJZBRCCJGM-CWTRNNRKSA-N 411.422 -0.545 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@]3(C)C[C@H](O)CN3C)CC2)cc1 1137300266 LHOMRJHCHXCITR-GHTZIAJQSA-N 403.527 -0.285 50 10 HBGE CC(C)[C@H](NS(C)(=O)=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1 1546249341 FWDYXHBDJMGNND-JTQLQIEISA-N 420.351 -0.613 50 10 HBGE CN(C)S(=O)(=O)NCC(=O)NNC(=O)COc1ccccc1Br 1558131581 YTRGIAFCDLUJMB-UHFFFAOYSA-N 409.262 -0.629 50 10 HBGE CN(C)CCn1nccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1 1597886867 YFEPHNPZGQANMX-UHFFFAOYSA-N 408.322 -0.115 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2C[C@@H](O)CN2C(=O)Cc2ccccc2F)ccc1=O 1598526507 BXZDHAOOOINYEN-GDBMZVCRSA-N 416.409 -0.510 50 10 HBGE CN(C)N(C(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1F)[C@H]1CCS(=O)(=O)C1 1629231105 WVYDHVKDBDHJEJ-FZMZJTMJSA-N 414.459 -0.708 50 10 HBGE CNS(=O)(=O)c1ccc(NCCOC)c(NC(=O)c2ccc(B(O)O)cc2)c1 1636260703 BHSBDCOVUWSEEE-UHFFFAOYSA-N 407.257 -0.415 50 10 HBGE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)c2cc(B(O)O)c(Cl)s2)C1 2267424125 VOWSRBLDOXRVFP-UHFFFAOYSA-N 403.653 -0.714 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N2CC=CCC23CN(C(=O)OCc2ccccc2)C3)n1 2281646842 CNOAMFYVMIVWAI-UHFFFAOYSA-N 410.239 -0.107 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282357849 PMTOKOKQJRAPJT-GHMZBOCLSA-N 402.253 -0.055 50 10 HBGE CC(C)(C)OC(=O)N[C@]12CC[C@@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282739667 NEISFDRNLAPDJL-BMIGLBTASA-N 417.318 -0.358 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cnn(C)c3)C2)c2ccccc2c1=O 1135359601 MUAORRUVDBNOIZ-LBPRGKRZSA-N 423.433 -0.036 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)Cc1ccccn1 1255224696 LPWFSDANZOATAU-UHFFFAOYSA-N 412.450 -0.271 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)OC2)NNC(=O)c1cc(Br)c[nH]1 1313178990 GIYHLBVXHGOEEE-CYBMUJFWSA-N 402.205 -0.058 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2CCC(=O)N2)s1 1533745193 XKZJOQITHFDEGP-WDEREUQCSA-N 400.482 -0.364 50 10 HBGE CO[C@]1(CNC(=O)NNC(=O)c2cc(Br)cn2C)CCS(=O)(=O)C1 1565379807 SKKYEMKJXULYQI-ZDUSSCGKSA-N 423.289 -0.065 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2cnc(I)c(O)c2)CC1 1635083872 HXBMFXASUQUYTJ-UHFFFAOYSA-N 405.196 -0.006 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)cc1OC 1639948346 XXQDITRBJHHDIO-KGYLQXTDSA-N 413.452 -0.303 50 10 HBGE CN(C)CC(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12 1641243212 MGBSYQAPOBMGBU-AGIUHOORSA-N 418.516 -0.634 50 10 HBGE O=C(NCc1nnc2n1CCNC2=O)NNC(=O)c1ccc(Br)s1 1684898243 VLOPRSAUGCPNMV-UHFFFAOYSA-N 414.245 -0.010 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1ncsc1B(O)O)OCc1ccccc1 2255470775 JSBIDABSQAYENN-STQMWFEESA-N 405.241 -0.363 50 10 HBGE CS(=O)(=O)N1CC[C@H](O[C@H]2CS(=O)(=O)C[C@@H]2I)C1 2257832366 OWCRLRXQJXNUSC-CIUDSAMLSA-N 409.267 -0.363 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2267624607 BIPIEZPSDWSKJG-CBAPKCEASA-N 400.209 -0.495 50 10 HBGE C[C@@H]1[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCCN1C(=O)OC(C)(C)C 2282719270 JMPVKZJMWCNPFK-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)COC1 2282737347 DHCIKWZLAUEFFT-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1sc(B(O)O)cc1C)NC(=O)OC(C)(C)C 2284012302 UYQHTNPJLZCUSN-SNVBAGLBSA-N 400.262 -0.191 50 10 HBGE C=C(CS(=O)(=O)NC[C@H]1[C@H](OC)[C@H](OC)CN1C(=O)OC(C)(C)C)B(O)O 2359273841 DONMTRMNQRZKQQ-XQQFMLRXSA-N 408.282 -0.877 50 10 HBGE COc1ccc(OC)c(C=NNC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)c1 12318694 DXFSHKORIBMLFW-UHFFFAOYSA-N 400.395 -0.399 50 10 HBGE CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)CNC(=O)c1cccs1 726276814 CNCADHMWWJSVNW-ZDUSSCGKSA-N 424.527 -0.249 50 10 HBGE O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@H]1COCCO1 744647206 UGSJOVVLTUXPSZ-LLVKDONJSA-N 412.196 -0.392 50 10 HBGE O=C(NNC(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1)[C@H]1COCCO1 776893120 SPWBJZKRUNJCFG-MRVPVSSYSA-N 410.378 -0.165 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1COCCO1 810462041 KLLARTDROWFQDK-NSHDSACASA-N 422.257 -0.710 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1=O 1124933542 SLVBJWLJOBMRIJ-ZDUSSCGKSA-N 411.436 -0.737 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3nc(C)oc3=O)CC2)cc1 1566279149 FRDVLXQEXKOKNN-UHFFFAOYSA-N 402.455 -0.582 50 10 HBGE COCCCn1c(S)nc2cc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)ccc2c1=O 1633925850 RQVXUSHRBPYOCZ-LBPRGKRZSA-N 419.463 -0.239 50 10 HBGE C[C@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCCSS(C)(=O)=O 1636470373 LFKUUJHSIQQCFZ-WCBMZHEXSA-N 402.541 -0.415 50 10 HBGE COC(=O)Cc1ccc(NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 1644566884 VDYMPPAXYDFQBK-UKRRQHHQSA-N 409.464 -0.119 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2CN(S(=O)(=O)N3CC(Cl)C3)CCN2C1=O 2265388059 VUPMDVMIWQWKIS-NEPJUHHUSA-N 408.908 -0.036 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@H]1NC(=O)C(F)(F)F 2267206910 MSSXRNDVCGLSCB-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE CCC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nc(C)n(C)c1B(O)O 2282335547 QWAFOIUTSZFDDG-LLVKDONJSA-N 404.298 -0.620 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2282350590 PEFDVHXMIRDQBY-SCZZXKLOSA-N 414.236 -0.353 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1 2282364352 VBKIUBFZJKSODI-KRWDZBQOSA-N 410.326 -0.348 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC2(C)CCN(C(=O)OC(C)(C)C)CC2)n1 2282731234 ODBSXRAZLIXPSZ-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282736028 JVZLBCLXJBDTQJ-UHFFFAOYSA-N 406.216 -0.257 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1 758037315 ZQLDVWCRHHVQBV-PWSUYJOCSA-N 402.498 -0.633 50 10 HBGE CN1CCN(C(=O)CCNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1 792828900 YAZGKDZDPZSFHF-UHFFFAOYSA-N 420.470 -0.593 50 10 HBGE CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794069438 GTZOZCDIQBVMPJ-CQSZACIVSA-N 412.468 -0.126 50 10 HBGE NS(=O)(=O)CCOCCNC(=O)NNC(=O)c1cccc(Br)c1 1312832818 GKRGAVAFTRZPNB-UHFFFAOYSA-N 409.262 -0.302 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)[C@@H]1CCC(=O)N1 1438034954 IZVPBLCMMRUVAS-HNNXBMFYSA-N 408.480 -0.170 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@H]2CCO[C@@H]2C)c1 1461147804 IPKMFUSWINDPJL-OCCSQVGLSA-N 414.484 -0.549 50 10 HBGE NC(=O)C1CCN(c2ncccc2CNC(=O)c2cc(B(O)O)ccc2F)CC1 1464953474 LLMKUGLFXVRYGT-UHFFFAOYSA-N 400.219 -0.468 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)c1cn(C)nn1 1470084253 RYYVYEQXERKFCF-IBGZPJMESA-N 411.422 -0.035 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 1611087347 OXXROXXTRLUNNA-HTQZYQBOSA-N 413.232 -0.535 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CNS(=O)(=O)c3sccc3B(O)O)[C@@H]2C1 2267209699 AFKUUDKYVUWLND-RTCCRHLQSA-N 402.303 -0.181 50 10 HBGE CC(C)(C)OC(=O)N1CCC2(C1)CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282376857 JJYKRCSQUZAAHS-UHFFFAOYSA-N 417.318 -0.405 50 10 HBGE CC(C)(C)OC(=O)NCC[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282700334 PYGRJWCJDIWAOC-LBPRGKRZSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]2C1 2282707437 YTJXSAUWGUIARP-SRVKXCTJSA-N 418.302 -0.660 50 10 HBGE COC(=O)[C@@H](CC(=O)Nc1nc(B(O)O)ccc1Cl)NC(=O)OC(C)(C)C 2283989729 ROOIYSGWTURXSP-SECBINFHSA-N 401.612 -0.190 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1 742060748 RKJKNXUJCFWBQL-XHDPSFHLSA-N 421.479 -0.145 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CNC(=O)c1cc2c(s1)CCCC2 758051845 GMGCOKWDVIATEX-VIFPVBQESA-N 402.498 -0.558 50 10 HBGE O=C(CN1CCOCC1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 790486873 GGMIWTHEBBDYCL-UHFFFAOYSA-N 410.452 -0.909 50 10 HBGE CCn1nc(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)c2ccccc2c1=O 1135359448 JHHPXVIUZLMQNJ-UHFFFAOYSA-N 408.436 -0.761 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl 1168868663 GNQMINOMNKZYCH-UHFFFAOYSA-N 423.900 -0.070 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)c3cc(Br)c[nH]3)c2S1(=O)=O 1290349574 VDJOHCCVYDKPKG-UHFFFAOYSA-N 417.245 -0.317 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)C1 1449368601 SFBDMJYIPVIIJH-NSHDSACASA-N 404.489 -0.328 50 10 HBGE CC(=O)N1CCN(C(=O)CCNC(=O)NNc2ncc(Br)cn2)CC1 1468946924 PXGPWONVXBUBKA-UHFFFAOYSA-N 414.264 -0.054 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCS(=O)(=O)N(C)C 1586790264 CJGNGBUTVWQJBM-UHFFFAOYSA-N 405.502 -0.669 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1cc(B(O)O)cs1 2029310158 BXIFJHWNJCKKKE-UHFFFAOYSA-N 422.293 -0.076 50 10 HBGE O=C(OCc1ccccc1)N1CC(CNS(=O)(=O)c2sccc2B(O)O)C1 2247936355 ZNZFGCWMRMAOQS-UHFFFAOYSA-N 410.282 -0.025 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1C#N 2282360300 AWQIIMZROSHBRC-NSHDSACASA-N 415.302 -0.130 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]2C1 2282381638 WAOFIMUZVVPRHS-QWRGUYRKSA-N 417.318 -0.549 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@H]2COC[C@H]21 2282703600 YOOSZAUVXYJULX-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE C[C@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(S(=O)(=O)N(C)C)c1 745799597 ILGDYNUXGQQYAZ-FZMZJTMJSA-N 400.457 -0.256 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1OC 810479847 VXTXHJRQLIRHSI-CLFYSBASSA-N 402.407 -0.034 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)cn1 1471692018 BTWFYHXNOWPQIN-NSHDSACASA-N 408.415 -0.267 50 10 HBGE CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)N2CCN(C)CC2)cc1F 1617831764 QRCRZSWSFYNHLC-UHFFFAOYSA-N 400.432 -0.210 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1CCC(=O)N1 1630431316 DINMPNYQRNVATB-JTQLQIEISA-N 419.257 -0.847 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNS(=O)(=O)N1CCC(Cl)CC1 2231892137 ABVHATQEUAHWCL-AVGNSLFASA-N 413.924 -0.135 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@@H](O)C1 2267202253 ZYQLAOMRDCQTGL-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE CCn1cc(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)nc1B(O)O 2281632772 VMMXDOIUOHSFSG-GFVXYOJSSA-N 400.266 -0.512 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2ccccc2B(O)O)C1 2282102710 KZSDBBCPVAJWCM-SANMLTNESA-N 418.302 -0.228 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282343265 DAHRZIIHVOWREN-QWRGUYRKSA-N 402.282 -0.868 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)[C@H](O)C1 2282370069 PGJZFMFVIDBMAP-QWHCGFSZSA-N 420.680 -0.722 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282732450 GUTRNOHTDKKNHG-NSHDSACASA-N 400.262 -0.337 50 10 HBGE O=C(NC1CCN(S(=O)(=O)c2ccc(B(O)O)cc2Cl)CC1)C(F)(F)F 2286121305 QOHPLEOQXOLCRX-UHFFFAOYSA-N 414.598 -0.149 50 10 HBGE Cc1ccc(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)cc1B(O)O 2360571590 JFTLIBWNEPZSAL-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE COCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@]12C(=O)N(CC(N)=O)c1ccccc12 2211976 VDUBAVCTKCVDIC-FQEVSTJZSA-N 412.402 -0.056 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 744642371 JEIQYDPHBPVIBX-HZPDHXFCSA-N 411.480 -0.209 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@]2(C1)NC(=O)NC2=O 789379972 UKHKIVYWWGOQNU-KRWDZBQOSA-N 409.830 -0.216 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(F)cc2)C1 807578189 ZHKOREMEEAPRCF-CYBMUJFWSA-N 417.463 -0.194 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)c1ccc3c(c1)OCCO3)CS(=O)(=O)CC2 1351228507 DDDVTNQWROFDTN-UHFFFAOYSA-N 406.420 -0.263 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 1456016700 GZNSMQDAZUXLCH-ZMZPIMSZSA-N 409.443 -0.136 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)[C@H]3CCC(=O)N3)C2)s1 1461838057 PAGHNNZDWDSKLE-NWDGAFQWSA-N 414.509 -0.117 50 10 HBGE COCCCn1nc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1=O 1514755477 ANCLDOBLHFZYFK-UHFFFAOYSA-N 408.436 -0.242 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCC3(CC3)S2(=O)=O)c1 1514772238 OXSWNNRCORJJKT-UHFFFAOYSA-N 415.493 -0.191 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNc1ccccc1S(=O)(=O)N(C)C 1556881577 SWERPRZMIISANC-UHFFFAOYSA-N 401.470 -0.085 50 10 HBGE CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N[C@@H](C)CO)cc1 1596323510 UMWHDPPFXVACJZ-JTQLQIEISA-N 406.555 -0.182 50 10 HBGE O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1628908234 HMZQSSFKMPAJTR-MPPDQPJWSA-N 404.514 -0.706 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)CSc3ccccc3O)cc2S1(=O)=O 1636493842 ZFNJOCUBRHRIDR-UHFFFAOYSA-N 411.465 -0.224 50 10 HBGE CC(C)(C)OC(=O)NCc1cn(C2CN(C(=O)c3ccc(B(O)O)cc3)C2)nn1 1643512728 LOQHPTPIDJRERR-UHFFFAOYSA-N 401.232 -0.320 50 10 HBGE Cc1c(C(=O)N(C)[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2267022752 LBVOISWRUAWAFC-HUUCEWRRSA-N 400.244 -0.062 50 10 HBGE Cn1nc(C(=O)N[C@@H]2C[C@H](F)CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281660817 RVMMNCNJYDUSAO-DTWKUNHWSA-N 404.635 -0.169 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1CO 2282071459 RNKJAQQDRNLVBZ-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE C[C@H](O)CN(CCNC(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2282246264 OLZMGHJKONBYSG-VIFPVBQESA-N 404.660 -0.899 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282334081 WYPFWWPNKMQQET-WDEREUQCSA-N 419.334 -0.255 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282371922 QZEZATCZWKBEBS-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)N(CCN(C)C(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282719828 RIHFGFJSGHYPSR-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE Cc1nc(B(O)O)c(C(=O)NC2CC3(C2)C[C@@H]3NC(=O)OCc2ccccc2)n1C 2362562651 SAPYUGSZGXNSBF-CHWWFWEZSA-N 412.255 -0.014 50 10 HBGE C[C@@H](CO)NS(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 1141786349 DPFZRJKRJSBNAW-GXTWGEPZSA-N 419.525 -0.548 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)ccc1=O 1289430852 KPCKWVGYFOYKDL-UHFFFAOYSA-N 416.415 -0.233 50 10 HBGE O=C(Cn1nc(C(F)(F)F)c2c1CCOC2)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1440705270 QCMHLGDIFSLYQU-MRVPVSSYSA-N 410.374 -0.443 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1533743951 ARWKXGOVZSZGAO-QNWHQSFQSA-N 410.496 -0.291 50 10 HBGE CCS(=O)(=O)N[C@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1538484612 RZRMUCXVHLBOSS-OAHLLOKOSA-N 411.528 -0.326 50 10 HBGE O=C(NNC(=O)c1c[nH]nc1I)N[C@@H]1CCS(=O)(=O)C1 1631029241 KLBFAVBYTVEKPV-RXMQYKEDSA-N 413.197 -0.855 50 10 HBGE CN(C)S(=O)(=O)N[C@@H](CNC(=O)NNC(=O)Cc1ccncc1)C1CCCC1 1674042739 ZCDXRUKOOWOAJI-HNNXBMFYSA-N 412.516 -0.091 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(S(=O)(=O)Cc3ccsc3B(O)O)C[C@@H]21 2267409862 AFIXMSVPBXGKLU-ZSBIGDGJSA-N 402.303 -0.287 50 10 HBGE CC(C)(C)OC(=O)N=S1(=O)CC2(CN(C(=O)c3sncc3B(O)O)C2)C1 2267432289 GGYYBFMIZBGHSQ-UHFFFAOYSA-N 401.275 -0.318 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2267614573 PVMQRKDQBWYTAP-CBAPKCEASA-N 400.209 -0.495 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)n1 2282364164 SUDHFRMHADDVCX-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](CCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282379596 WXKISQFKXUDZPL-PHIMTYICSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(Oc2ccc(B(O)O)cn2)CCCS(=O)(=O)C1 2368395198 TYKYRRUPHOSZDQ-INIZCTEOSA-N 400.262 -0.388 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1 729511061 PXXRAKIJJFAICT-UHFFFAOYSA-N 418.501 -0.999 50 10 HBGE O=C(O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)cc1Br 747618498 WMYBREZKNLDFHS-SNVBAGLBSA-N 409.214 -0.128 50 10 HBGE Cc1cccnc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 752235679 OJYRGNBKZWKUAY-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1 812881179 MMJZUCJSEIWPOB-UKRRQHHQSA-N 424.479 -0.644 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1 816876040 NLFKKXDMYSYQAU-QWHCGFSZSA-N 406.468 -0.337 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O 1136529051 JWNVZCPMEBTRTO-HNNXBMFYSA-N 424.479 -0.018 50 10 HBGE O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1464441701 FFDOPINSVSQQBG-ZDUSSCGKSA-N 405.436 -0.572 50 10 HBGE CNC(=S)N(C)NC(=O)[C@@]12CN(C(=O)OC(C)(C)C)C[C@@H]1CS(=O)(=O)C2 1570105947 UQANSMHOMFBUHR-MEBBXXQBSA-N 406.530 -0.265 50 10 HBGE COCCOCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2OC)C1=O 1635056475 CHLSDWBFVZWSOI-GOSISDBHSA-N 408.411 -0.727 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1639934468 JJTBHMZMQVSHMD-BTFPBAQTSA-N 415.512 -0.332 50 10 HBGE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cscc1B(O)O 2271704296 WWKWYTIERHDDDP-UHFFFAOYSA-N 406.291 -0.970 50 10 HBGE CN(C[C@@H](O)CN(C)C(=O)c1ncc(B(O)O)cc1Cl)C(=O)OC(C)(C)C 2281898012 CUSZOFHCSBZXOD-NSHDSACASA-N 401.656 -0.285 50 10 HBGE CN1CCN(Cc2ccccc2)[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282079625 YTDGIPWMZGBLFS-OAHLLOKOSA-N 409.342 -0.478 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 2282080429 JMKPAKBHGNAIPS-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1cccc(B(O)O)c1 2282092118 LRTUUPGHRVJHKY-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](F)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282108023 SILQVILGSVCRCB-QWHCGFSZSA-N 402.253 -0.008 50 10 HBGE CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1nc2ccccc2n1C 764815608 AGVZVNINIAIVGO-UHFFFAOYSA-N 408.422 -0.139 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cn(C)nn3)cc2)CC1 1151459779 XUUQGKUONOSNBC-UHFFFAOYSA-N 407.500 -0.173 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl 1168868634 GEKRXGMBHACLLQ-UHFFFAOYSA-N 418.280 -0.536 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1=O 1457466823 VEVUDNVFOUTNQM-GFCCVEGCSA-N 401.423 -0.325 50 10 HBGE C[C@H]1Cn2nc(C(=O)NNC(=O)CS(C)(=O)=O)cc2CN1C(=O)OC(C)(C)C 1470661421 SBKLORHKZBIRRC-JTQLQIEISA-N 415.472 -0.172 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@H]3CS(=O)(=O)C[C@@]3(C#N)C2)cc1OC 1473850059 HLVJVBLMKFIKKP-SCLBCKFNSA-N 422.463 -0.665 50 10 HBGE CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2268721857 RCUHFXITHMVCPY-SJKOYZFVSA-N 420.256 -0.606 50 10 HBGE Cn1cc(S(=O)(=O)NCC(CO)(CO)NC(=O)OC(C)(C)C)c(CCl)n1 2270669736 OVGGQEPNCLIJEL-UHFFFAOYSA-N 412.896 -0.315 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282065103 JGASWTQGVSUOKR-LBPRGKRZSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1ccccc1B(O)O 2282097127 AWURAPKDKJJXFI-LBPRGKRZSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1C(=O)c1ccc(B(O)O)s1 2282211035 NXMDNQBGJMBRTN-INIZCTEOSA-N 400.262 -0.844 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(NS(=O)(=O)c3ccc(B(O)O)c(F)c3)[C@H]2C1 2282365389 YAZWADIGHPUSRJ-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H](O)C[C@@H]1CNC(=O)OC(C)(C)C 2282368970 YQOMWOVSVYTOGJ-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE Cn1nnc(B2OC(C)(C)C(C)(C)O2)c1S(=O)(=O)NCCSSCCN 2282864840 LPYDZUPJOJPULN-UHFFFAOYSA-N 423.395 -0.267 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)Nc1cc(Cl)ccc1B(O)O 2284131171 SPXLEWFEXTZICL-AVGNSLFASA-N 400.624 -0.701 50 10 HBGE O=C(Cn1cc(Br)c(O)nc1=O)NNC(=O)[C@H]1Cc2ccccc2O1 748281559 ZYSRWXOMLHWUOU-LLVKDONJSA-N 409.196 -0.138 50 10 HBGE Cn1c(=O)c2cc(NC(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cnc2n(C)c1=O 755847169 RGQDQDSACWRQIL-AWEZNQCLSA-N 410.390 -0.211 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@H]1CCC(=O)N1)S(=O)(=O)c1ccc(F)cc1 1131508551 SNWOSOYKPREUIO-CYBMUJFWSA-N 400.432 -0.348 50 10 HBGE C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn2c1S(=O)(=O)N(C)CC2 1135533455 MXTXXPIKQMVHQB-SNVBAGLBSA-N 411.415 -0.115 50 10 HBGE CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)CC(F)(F)F)c1 1299911216 RGZPHXHQWROQOR-UHFFFAOYSA-N 417.387 -0.532 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1301696944 HLXATDOCGDCZJI-GRYCIOLGSA-N 419.525 -0.525 50 10 HBGE Cn1cc(C(=O)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCS2(=O)=O)cn1 1586569733 KTTQKYBQNHTAIC-GFCCVEGCSA-N 415.472 -0.395 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1C[C@H](S(C)(=O)=O)C1 1687410278 MPQHBXYLULLORL-XYPYZODXSA-N 417.513 -0.192 50 10 HBGE COC1(CCNC(=O)c2cc(B(O)O)c[nH]2)CN(C(=O)OCc2ccccc2)C1 2267229100 SZFHRRBMPXMSHD-UHFFFAOYSA-N 401.228 -0.148 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NN1CCN(C(=O)OC(C)(C)C)CC1 2267381463 VPIUJAVERNHBBA-UHFFFAOYSA-N 405.307 -0.518 50 10 HBGE C[C@@H](CN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)Cc1ncsc1B(O)O 2267628106 HZAQFVQEYIPCRC-JTQLQIEISA-N 407.323 -0.160 50 10 HBGE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1sccc1B(O)O 2282069739 URJNFQHSJAQROG-NSHDSACASA-N 420.318 -0.316 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COCC[C@@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2282375423 PCRGJTCEABRMFN-QWRGUYRKSA-N 420.318 -0.303 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2CCCCN2C(=O)C(F)(F)F)sc1B(O)O 2282420240 WHDVODRBVNRYFL-SECBINFHSA-N 414.236 -0.042 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H]2COC[C@@H]21 2282711203 YUWVPEIDRUHCPE-QWRGUYRKSA-N 418.302 -0.563 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@](C)(NC(=O)OC(C)(C)C)C1 2282712149 LVVGWXPGKULJQG-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CN(C[C@H](O)CN(C)S(=O)(=O)Cc1ccsc1B(O)O)C(=O)OC(C)(C)C 2282868750 RWPKLBPFQJODIK-LBPRGKRZSA-N 422.334 -0.583 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cn1 1265051258 DXQJOABHMWRXED-AWEZNQCLSA-N 412.454 -0.373 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1C[C@@H](O)CN1c1ccncn1 1468659700 LGFMBDUWANJHFZ-TZMCWYRMSA-N 406.468 -0.190 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)NC[C@]1(OC)CCS(=O)(=O)C1 1479381330 JPTLIHGDJSARTE-QGZVFWFLSA-N 415.468 -0.002 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)OCc1ccccc1 1596923971 ZCBVBWMCHKZXAW-IRXDYDNUSA-N 420.466 -0.326 50 10 HBGE C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@@H](C)S(C)(=O)=O 1624128185 SWYKYKMQSNDZCB-VHSXEESVSA-N 405.336 -0.118 50 10 HBGE CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1OCC(=O)N(CC)[C@@H]1c1nccn1C 1628377056 NAXNMPHPXNIUKK-KBPBESRZSA-N 408.459 -0.839 50 10 HBGE COC(=O)[C@H]1C[C@@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231654202 APIOVTYZFCDBCX-HUUCEWRRSA-N 401.184 -0.512 50 10 HBGE CCC[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267711751 PNBZSDVAIOVNMN-SNVBAGLBSA-N 407.323 -0.064 50 10 HBGE CN(C[C@H]1CCCN1S(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2282082546 KDCUOWYFTLYTAS-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CNS(=O)(=O)c1cncc(B(O)O)c1)C(F)(F)F 2282102911 OECAVBHWVVHNKP-SNVBAGLBSA-N 413.183 -0.505 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2CN(S(=O)(=O)c3ccc(B(O)O)cc3F)C[C@H]12 2282355807 LFIDZFSUWDYUNT-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)sc1B(O)O 2282368982 YUBIYGXDYWLYBM-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CCN(S(=O)(=O)Cc3ncsc3B(O)O)C2)C1 2282379721 YKNZPXGZGUEGOB-UHFFFAOYSA-N 417.318 -0.405 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ccsc1B(O)O 2282857853 NSHLHOQEGRXNNT-WCBMZHEXSA-N 414.236 -0.211 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282858240 UDOPEFFVKRNYLM-STQMWFEESA-N 404.225 -0.924 50 10 HBGE Cc1nc(S(=O)(=O)NC(C)(C)CCNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282860576 COSSCDPEPKNKQM-UHFFFAOYSA-N 404.298 -0.620 50 10 HBGE C[C@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@H]1CCCN1C(=O)OC(C)(C)C 2286913615 WTPDBLICDNAYRW-CMPLNLGQSA-N 402.282 -0.834 50 10 HBGE Cc1sc2ncn(CCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(=O)c2c1C 729274844 FRUFJCGTYIODPV-SECBINFHSA-N 415.497 -0.450 50 10 HBGE CNS(=O)(=O)c1ccccc1N1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1136566938 HGZFRFIRUBANDR-UHFFFAOYSA-N 421.259 -0.624 50 10 HBGE O=C(NNC(=S)Nc1ccccn1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 1154057473 YGAWAGSRLXMUHL-SNVBAGLBSA-N 410.481 -0.435 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 1360182719 YFCZHGNXVJOHBL-AWEZNQCLSA-N 418.454 -0.748 50 10 HBGE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1623509846 LUZXKBYWJBWAFM-RYUDHWBXSA-N 406.505 -0.587 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cccnn1 1625193764 HDKMAEGZLHTHFS-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2([S@](C)=O)CCN(C(=O)OC(C)(C)C)CC2)nn1 1645367835 MJVYCMQVIQLPRK-NDEPHWFRSA-N 414.488 -0.276 50 10 HBGE C[C@@H]1CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2Cl)CC[C@@H]1NC(=O)C(F)(F)F 2195882551 BCCOYNKRYKCDJI-VPOLOUISSA-N 419.853 -0.104 50 10 HBGE COc1ccc(S(=O)(=O)NC2CN(C(=O)OCc3ccccc3)C2)cc1B(O)O 2267381738 ZMERNEFJYYYMJE-UHFFFAOYSA-N 420.252 -0.326 50 10 HBGE CN([C@@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2267392848 PAZHBNHBIVZLEV-CQSZACIVSA-N 422.272 -0.869 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267393125 TXVPWMKAVZDKAB-JTQLQIEISA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267615166 YVBXKUXZCBSJHQ-VHSXEESVSA-N 406.291 -0.612 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 2282079111 RPMVCERQAGNJMU-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)[C@H](O)C1 2282088747 QXBUIVYUZPZKAK-ZIAGYGMSSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C[C@@H](F)C1 2282099010 BDUXERPXMAHGDV-NEPJUHHUSA-N 403.241 -0.613 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCC1(CNC(=O)OC(C)(C)C)CC1 2282709588 DTFJZOGNIXUAFM-UHFFFAOYSA-N 402.282 -0.927 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713934 LJSIKLMNIAWESR-GIPNMCIBSA-N 420.318 -0.223 50 10 HBGE CO[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2cscc2B(O)O)C1 2282736900 XCQMKLCDIXSTOB-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282737298 CQGFPVAPTZQDMK-UHFFFAOYSA-N 412.195 -0.056 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2359281509 ZMOMLIVVUWACKW-WFBYXXMGSA-N 400.237 -0.208 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)n1 2362083640 DNAUZACQDPAMLJ-LLVKDONJSA-N 404.298 -0.682 50 10 HBGE C[C@@](O)(Cn1ccccc1=O)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1 791138989 NNKKVGXNLJAVLA-GOSISDBHSA-N 406.826 -0.284 50 10 HBGE CC(C)n1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 794201365 VEXNZIWZHJKNKV-UHFFFAOYSA-N 422.467 -0.045 50 10 HBGE Cn1cc(S(N)(=O)=O)cc1C(=O)C(=O)NNC(=S)NCCc1cccs1 1136116792 VQFYLHTVIJROHH-UHFFFAOYSA-N 415.522 -0.345 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCO[C@@H]3C)cc2S1(=O)=O 1530203504 DJLMOXJLXNEMHN-ZYHUDNBSSA-N 411.436 -0.337 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1539401652 HPBAHULEFRFNLV-UONOGXRCSA-N 411.455 -0.201 50 10 HBGE CC(C)(C)n1nnc(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)n1 1637456027 LFKMYRDFZUFYNF-UHFFFAOYSA-N 409.310 -0.203 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1ccc(B(O)O)cc1F 2269716658 GPHJMPRZHNEVPN-UHFFFAOYSA-N 420.227 -0.389 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2282069282 OAPVFAJAKNBLAC-RYUDHWBXSA-N 420.318 -0.269 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 2282073090 CKNFGJMXOGPJSA-QWRGUYRKSA-N 402.282 -0.928 50 10 HBGE CO[C@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)N(C(=O)OC(C)(C)C)C1 2282073818 HVZMAUAMXUXQDC-RYUDHWBXSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CCSC[C@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282104308 YCHYESDRWFJDKV-GFCCVEGCSA-N 416.330 -0.003 50 10 HBGE Cn1nc(C(=O)NC2CC(F)(CNC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282248312 RMWUWSCORZZEMX-UHFFFAOYSA-N 404.635 -0.122 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282356200 RAXVSNJTCDGXQB-QWRGUYRKSA-N 402.253 -0.055 50 10 HBGE CN(C[C@H]1CCCN1S(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282367975 JZDWJIPWWZGJHJ-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2CCON(C(=O)OC(C)(C)C)C2)ccc1B(O)O 2282369403 GFEVHCGLUYKFRW-GFCCVEGCSA-N 400.262 -0.106 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)c(B(O)O)nn1C 2282439282 ZJVABEWYXKTRFT-LURBXMNDSA-N 402.282 -0.440 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@]1(CO)CCN(C(=O)OC(C)(C)C)C1 2282722232 CWEKBSPTHCKXFF-HNNXBMFYSA-N 420.318 -0.613 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1cccnn1 1303113640 UPIXVZHSEFFZHK-UHFFFAOYSA-N 411.465 -0.437 50 10 HBGE O=C(C[C@@H]1CCCS1(=O)=O)N1CCN(S(=O)(=O)CBr)CC1 1546252348 ZQQAOCMECUZBFZ-JTQLQIEISA-N 403.320 -0.220 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1638952212 IYKMACPQZNGOEU-RISCZKNCSA-N 412.468 -0.761 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2 1641667736 VGCLVVGASWDXAH-UHFFFAOYSA-N 400.501 -0.164 50 10 HBGE O=C(CN1CCC(CNC(=O)C(F)(F)F)CC1)N[C@H]1CS(=O)(=O)C[C@H]1Cl 2195882509 ANJPNNPUARNKSQ-MNOVXSKESA-N 419.853 -0.103 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(CCO)CCNC(=O)OC(C)(C)C 2267624982 IFEJARQSLQHFTL-UHFFFAOYSA-N 408.307 -0.756 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1sncc1B(O)O 2281914718 UTKIDJZRDZPBPS-UHFFFAOYSA-N 403.266 -0.889 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282326939 AOHSPBIGVYPFHX-LLVKDONJSA-N 402.282 -0.914 50 10 HBGE C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282339752 ZXQRNGCTAFWHDQ-MNOVXSKESA-N 419.334 -0.018 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NS(=O)(=O)Cc3ncsc3B(O)O)C[C@H]21 2282341422 RWUVHHHWUMIKHA-CKYFFXLPSA-N 417.318 -0.360 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282377106 MQZVMNGKCUURLT-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE COC[C@]1(NS(=O)(=O)c2cc(B(O)O)cs2)CCN(C(=O)OC(C)(C)C)C1 2282706702 PHAANOVUCKAHTI-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@]2(CNS(=O)(=O)c3sccc3B(O)O)C[C@H]1CO2 2282708404 LYFAGBUDIBFVIY-BONVTDFDSA-N 418.302 -0.515 50 10 HBGE C[C@@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1nn(C)cc1B(O)O 2284026679 FBHXAXQZIFQDRN-NSHDSACASA-N 404.298 -0.681 50 10 HBGE O=C(NCc1ccccc1OCCN1CCOCC1)NNC(=O)[C@@H]1COCCO1 745784284 RJWOZOXCDYVSMA-KRWDZBQOSA-N 408.455 -0.357 50 10 HBGE Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)cn2C)c1 756082555 ZPXCIXDAQKDQJN-UHFFFAOYSA-N 419.261 -0.739 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@H]2CCc3nncn3C2)CC1=O 816886374 VRRQRFSNUMCHGK-SOUVJXGZSA-N 403.487 -0.679 50 10 HBGE O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ncccn1 1436863233 QLBWRYFSZDMYDH-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CS(C)(=O)=O)c(OC)c1 1630863167 ZWSUXVLAUPVLFW-CYBMUJFWSA-N 413.452 -0.500 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2)cc1 1633925301 KNDVZFWEACXKRM-FDMDGMSGSA-N 415.450 -0.674 50 10 HBGE C#CCNS(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1 1644281566 GKFGISLDQDUZLP-YBEGLDIGSA-N 400.464 -0.276 50 10 HBGE C[C@@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cscc1B(O)O 2013657054 VFZHGYUNCWPXNK-SNVBAGLBSA-N 408.266 -0.296 50 10 HBGE O=C(NCCNS(=O)(=O)c1c(F)cc(F)cc1B(O)O)OCc1ccccc1 2255885405 PQKAFNOPEFGSIH-UHFFFAOYSA-N 414.195 -0.151 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ccsc1B(O)O 2267365681 UCRRIRRMKGPBBL-UHFFFAOYSA-N 406.291 -0.260 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NC(=O)OC(C)(C)C 2267386837 ZSZKEEIOPSAIGA-DDFAGTSDSA-N 402.303 -0.120 50 10 HBGE CCC1(NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2267626345 GRRIDKRHYCLPIL-UHFFFAOYSA-N 405.307 -0.358 50 10 HBGE O=S(=O)(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1sccc1B(O)O 2282088574 OMBUHYDODKYUIM-OAHLLOKOSA-N 410.326 -0.003 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2282507614 JZROTXCFDWDQNO-JTQLQIEISA-N 402.282 -0.976 50 10 HBGE Cc1cccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1Cl 754883639 BJCULWUNQBNLPI-UHFFFAOYSA-N 404.814 -0.143 50 10 HBGE CCc1nc(C)c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)s1 766633238 AHEXTBTUYDMPIH-UHFFFAOYSA-N 405.440 -0.778 50 10 HBGE COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)N2CCOCC2)C1=O 771255266 XIYHTBAKWKXBBW-IBGZPJMESA-N 419.438 -0.156 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 776754569 WSCQNPJFBZEUCE-LLVKDONJSA-N 405.473 -0.406 50 10 HBGE COC(=O)[C@@H]1O[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@H]1C 1135501971 AWBOPACIRQZWFK-LERXQTSPSA-N 413.452 -0.336 50 10 HBGE C[C@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(F)n1 1454096893 CLKRTBNYYMGHIQ-UFBFGSQYSA-N 402.429 -0.229 50 10 HBGE COC(=O)CCN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 1473324485 ASEDGMQXMTZILC-CYBMUJFWSA-N 407.427 -0.075 50 10 HBGE COc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1623698914 MRXNJWOJPLGUKU-UHFFFAOYSA-N 415.230 -0.089 50 10 HBGE Cc1nccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1641081585 WZKJTFRNJBAFFO-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE COCn1nccc1S(=O)(=O)NC[C@H](I)C(=O)OC 2117354668 AWFXQDKHTOPYTB-ZETCQYMHSA-N 403.198 -0.258 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1cc(B(O)O)cs1 2255880159 AFSCUWDZTAVAPT-XMMPIXPASA-N 412.320 -0.261 50 10 HBGE Cc1nc(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)s1 2266898569 ZTSREQSZMGLQCW-KBPBESRZSA-N 419.268 -0.055 50 10 HBGE CC(C)(C)OC(=O)NCC[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2282082412 JLFQCBMQYBWMIJ-NSHDSACASA-N 420.318 -0.268 50 10 HBGE O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1sccc1B(O)O 2282088573 OMBUHYDODKYUIM-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N[C@H](Cc1ncns1)C(=O)NCc1ncc(B(O)O)s1 2284060430 MWJUQDWUDKYPOH-MRVPVSSYSA-N 413.290 -0.573 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1ccccc1B(O)O 2365421230 FGHRIHXJYMYXGH-CYBMUJFWSA-N 402.278 -0.675 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 744648654 HLMPLYZJCKCKBI-HNNXBMFYSA-N 409.420 -0.066 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccccn2)cc1OC 810350179 ZSXMEJFRNFVRKC-UHFFFAOYSA-N 408.436 -0.233 50 10 HBGE CN1CC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)S1(=O)=O 857431371 IGXFYIWIYISPLJ-INIZCTEOSA-N 409.512 -0.620 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=CCS(=O)(=O)C1 1135410255 VNTFDMZUNSLGEN-UHFFFAOYSA-N 413.477 -0.413 50 10 HBGE O=C(NCCN1C[C@@H]2CCCCN2C1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 1470896446 LMMVYYSOFVQMAR-HNNXBMFYSA-N 413.442 -0.104 50 10 HBGE CC(=O)NCCN1C[C@@H](C(=O)N2CCC[C@@H](C(=O)NNc3ccccn3)C2)CC1=O 1872962435 SZDRDBSKSLWGNE-CVEARBPZSA-N 416.482 -0.252 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1C(=O)c1csc(B(O)O)c1 2266880292 JUTPTDIKGWEJSC-UHFFFAOYSA-N 404.275 -0.549 50 10 HBGE CCc1nn(C)c(C(=O)NC2CC(NC(=O)OCc3ccccc3)C2)c1B(O)O 2267402088 UWBTZUUNBLIQKX-UHFFFAOYSA-N 400.244 -0.151 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2C[C@@H]21 2267624978 IDKVSFGLWUTYTK-WDEREUQCSA-N 403.291 -0.654 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OCc1ccccc1)C2 2281744691 BMWVNWDFJZLESJ-RBSFLKMASA-N 413.243 -0.586 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@@](C)(NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282327350 GRPRECFQLAFUCI-OAHLLOKOSA-N 402.282 -0.914 50 10 HBGE COc1ccc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1B(O)O 2282359210 KSLHBNKIBXAHGX-NSHDSACASA-N 400.262 -0.337 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282704169 HFAYZSLBDVQGLD-KBPBESRZSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282740642 CLTROQMHGQFVMX-NWDGAFQWSA-N 420.318 -0.782 50 10 HBGE N#CC(=Cc1cccc(Br)c1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 2329690429 XLHZEAYLLWABSI-SRTKAIALSA-N 413.224 -0.728 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1OC 789378138 DVXYFFKOYWPLNG-SFHVURJKSA-N 405.411 -0.861 50 10 HBGE O=C(NNC(=O)c1cnn2cc(Br)cnc12)N[C@H]1CCS(=O)(=O)C1 1319963818 ZBVGKJAIWRKCHM-QMMMGPOBSA-N 417.245 -0.377 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCO[C@H](CS(C)(=O)=O)C1 1473841096 CQSIZRVEVHFSKI-LBPRGKRZSA-N 419.887 -0.145 50 10 HBGE O=C(NNC(=O)c1cc2ncc(Br)cn2n1)N[C@@H]1CCS(=O)(=O)C1 1625568684 ZCBYVKACVNJPPS-MRVPVSSYSA-N 417.245 -0.377 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)n(C)c1 1627127528 MTVWHHNUBOESLF-UHFFFAOYSA-N 409.468 -0.171 50 10 HBGE CNS(=O)(=O)NCC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 1628582617 DRAAPFXPVCBXFI-UHFFFAOYSA-N 422.463 -0.154 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1630431615 LROJYOYXALUKNN-GXZLGDFZSA-N 416.356 -0.602 50 10 HBGE 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O=C(Cn1ncc(=O)c2ccccc21)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1141421910 CDQDFCMIZYUAHY-KRWDZBQOSA-N 405.370 -0.005 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NN(CC)CCO)o1 1452329945 ILXFYTYCSZXIEP-GFCCVEGCSA-N 403.457 -0.045 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1468659697 LGFMBDUWANJHFZ-OCCSQVGLSA-N 406.468 -0.190 50 10 HBGE O=C(NCCN1CCC2(C1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1 1471409822 NMTGTWZSLVHTQN-UHFFFAOYSA-N 419.486 -0.528 50 10 HBGE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1cc(Br)ncn1 1594711740 SSQDZSDQHXMHEB-SSDOTTSWSA-N 404.250 -0.217 50 10 HBGE COc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)ccc1OC(C)C 1681318161 OPSIIXKBQNQDJX-UHFFFAOYSA-N 417.488 -0.178 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)[C@H](C)OCCOC)cc1 1683440519 ANDYZAQAODNWGS-LBPRGKRZSA-N 402.473 -0.481 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1ccc(B(O)O)s1 2267206259 CSDWFYWRKVSEFR-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE O=C(N1CCC[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C1)C(F)(F)F 2267389448 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Cn1[nH]c(Br)c2c(=NCCNC(=O)c3cccc(B(O)O)c3)ncnc1-2 1464934692 DKSRLAPTKPNEQN-UHFFFAOYSA-N 419.048 -0.979 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1635244371 DYOCGOHNGJBLRC-LBPRGKRZSA-N 421.520 -0.481 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3sccc3B(O)O)C[C@@H]2C1 2267201534 PYJVWNDMOXUABV-QWRGUYRKSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267209392 WIZDGHCXGZPJNZ-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1sccc1B(O)O 2267606740 CBNOBXLQBMSQKG-SCVCMEIPSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2sccc2B(O)O)C1 2267607223 KASNEISNMGFYSS-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CC[C@H]1NC(=O)OC(C)(C)C 2282077823 AGTUEBYYPUUPAW-ZYHUDNBSSA-N 402.282 -0.976 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282078409 INDLYYITWCBNGX-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)[C@@H]2COC[C@H]12 2282507887 NMEHWBBHUVSCEF-YUSALJHKSA-N 418.302 -0.660 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=S1(=O)CCC(NC(=O)OC(C)(C)C)CC1 2362358187 WWFYOPOTCOVVSW-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 744646019 VONHSPWXJALSEB-SNVBAGLBSA-N 405.379 -0.418 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)[C@H]1COCCO1 745816104 UHPMVZFONBLKQH-SNVBAGLBSA-N 418.394 -0.706 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)[C@H]3COCCO3)CC2)cc1 778295910 XYTIKORUYOZVOW-DKRLNXSXSA-N 418.450 -0.537 50 10 HBGE Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1C 790324085 RAUWSOSXQBEXGI-YOEHRIQHSA-N 421.479 -0.273 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2coc3cc(F)ccc23)n(C)c1=O 793677197 UFJXXCSIRSMNAL-UHFFFAOYSA-N 414.353 -0.220 50 10 HBGE Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816873159 ZKJSAZCYDHLEFL-CQSZACIVSA-N 420.495 -0.027 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1(S(C)(=O)=O)CC1 1341898434 KVIBHGSDQHPDAG-SNVBAGLBSA-N 417.513 -0.111 50 10 HBGE O=C(NNC(=O)[C@@]1(O)CCCN(Cc2ccccc2)C1)N[C@@H]1CCS(=O)(=O)C1 1442179448 CEYOGDQZKWYGKW-CRAIPNDOSA-N 410.496 -0.469 50 10 HBGE O=C(Cn1nc(Br)c(Br)n1)NNC(=O)N1CCOCC1 1464538012 AUZXITNKGCVQMP-UHFFFAOYSA-N 412.042 -0.124 50 10 HBGE CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)c1cc(B(O)O)ccc1F)C2 1556574461 KHPUNNHXGLJZQZ-UHFFFAOYSA-N 406.244 -0.046 50 10 HBGE C[C@]1(C(=O)N2CCN(CC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)C[C@H]1Br 1629842289 YZTAKFZUVFPRRG-JMSVASOKSA-N 422.345 -0.393 50 10 HBGE CON1CCC(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1 1630996847 WRCBBIVDTSSICQ-UHFFFAOYSA-N 403.483 -0.135 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)ccc1=O 1636483167 XJDKFOYCULVFKS-UHFFFAOYSA-N 414.390 -0.207 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cn1nc(C(F)(F)F)c2c1CCCC2 1648534577 LKAZJTOLGKAWOW-QMMMGPOBSA-N 411.406 -0.134 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@H](O)C1 2267206070 ZYQLAOMRDCQTGL-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)c1B(O)O 2267387242 GHLBJLPQYFJGTD-JTQLQIEISA-N 406.291 -0.126 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2267392791 OJDGSROSEYFTRT-SECBINFHSA-N 408.669 -0.816 50 10 HBGE O=C(NC1CCN(S(=O)(=O)c2cc(Cl)c(B(O)O)s2)CC1)C(F)(F)F 2270601378 VDXDBZDNCICWSB-UHFFFAOYSA-N 420.627 -0.087 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@@H](O)C1 2282097397 FGTVAYCGNVNETF-KGLIPLIRSA-N 400.262 -0.985 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282857325 GSNPCQXRNBKIHF-PWSUYJOCSA-N 419.334 -0.112 50 10 HBGE COCCN(C=C(C#N)C(=O)NCCCN1CCCC1=O)[C@H]1CCS(=O)(=O)C1 2324077538 BCOKHQQFCSXZHR-INIZCTEOSA-N 412.512 -0.342 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369896653 DGXQOSZHOMDQAF-JFUSQASVSA-N 420.680 -0.961 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1OC 10287544 HANFETXWKAXKCG-UHFFFAOYSA-N 400.395 -0.002 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 1152015003 IEQAQHKVUGRBDT-KGLIPLIRSA-N 408.455 -0.262 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)ccc1=O 1179627915 BCFWERXKYTYRDB-MRXNPFEDSA-N 414.340 -0.222 50 10 HBGE COc1ccc(NCC(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)cc1 1306242915 GRGKSRBHJPKGFK-UHFFFAOYSA-N 407.452 -0.227 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318896303 ANYXZVYRUBSBPJ-OWCLPIDISA-N 422.507 -0.119 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Cc3cnc[nH]3)CC2)cc1 1566278417 CAZDRRIULRZVTC-UHFFFAOYSA-N 420.495 -0.585 50 10 HBGE Cn1c(=O)ccn(CC(=O)NNC(=O)COc2ccccc2Br)c1=O 1583536487 IPXBWLHCXCINFU-UHFFFAOYSA-N 411.212 -0.464 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NNC(=O)[C@H]1CCC(=O)N1 1630431616 LROJYOYXALUKNN-TWXYISROSA-N 416.356 -0.602 50 10 HBGE CSC[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1630862937 VFAZLCVPQWGTPY-AXFHLTTASA-N 405.498 -0.915 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@H](CNC(=O)NNC(=O)[C@@H]2COCCO2)C1 1635207538 ODOZYJRRKYBYBV-OLZOCXBDSA-N 402.448 -0.242 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2282085761 CTSSFNHKQAFVIZ-ZYHUDNBSSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(B(O)O)c(F)c2)CCO1 2282366832 ULOBSLOUAAHQCS-JTQLQIEISA-N 404.225 -0.275 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@@H]2CN(Cc3ccccc3)C[C@H]2C1 2282380125 DQLBQGQCJDLWHO-GJZGRUSLSA-N 407.326 -0.284 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)n1 2282428989 MIQCOJAVRBYGSO-FLESLCNUSA-N 400.266 -0.512 50 10 HBGE CN(C[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1)C(=O)OC(C)(C)C 2282508602 YMXPLFPUVVQGMK-NSHDSACASA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2ccccc2B(O)O)C1 2282718265 UZCGIKJHCIVRBK-CYBMUJFWSA-N 402.253 -0.150 50 10 HBGE CCC(=O)NNC(=O)CSc1nnc(N/N=C/c2ccc(C(=O)OC)cc2)n1N 20914275 RTSOHIPXJUTARP-QGMBQPNBSA-N 420.455 -0.126 50 10 HBGE CCOCCOCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 735117912 IWWDEZSXQLLAQY-UHFFFAOYSA-N 401.489 -0.486 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2cccc(Cl)c2)n(C)c1=O 765726773 FUSJQZSZVKHCRZ-UHFFFAOYSA-N 404.814 -0.523 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1)N[C@@H]1CCS(=O)(=O)C1 919887550 AHUXICJLWHAIFH-BXKDBHETSA-N 416.406 -0.165 50 10 HBGE Cc1[nH]nc(I)c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1290349901 ZYMRESPMONAECM-LURJTMIESA-N 412.209 -0.482 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CCO[C@H]2C)C1 1469404239 ZTMKJMYCENMLLN-IHRRRGAJSA-N 413.500 0.000 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCc3nncn3C2)CC1 1472517810 JGFBCMJXXUVWLN-CYBMUJFWSA-N 420.499 -0.685 50 10 HBGE CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)o1 1635372201 PJWHMZGGYUJFGR-CYBMUJFWSA-N 400.457 -0.657 50 10 HBGE C[C@@]1(c2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2)NC(=O)NC1=O 1646045871 VSVGFLMKOMFIEX-QRWLVFNGSA-N 415.450 -0.245 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)c1ccc(F)cc1 1652305048 XDZOFRLKMRXEQV-JKSUJKDBSA-N 408.430 -0.683 50 10 HBGE C[C@@]1(NNC(=O)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)CCS(=O)(=O)C1 1673834903 GWKUFPWJNBEZDS-IAQYHMDHSA-N 403.482 -0.398 50 10 HBGE CCc1nn(C)c(C(=O)N[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c1B(O)O 2267019915 UWBTZUUNBLIQKX-OKILXGFUSA-N 400.244 -0.151 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267209907 CHPVYVNQGNBJTR-VHSXEESVSA-N 406.291 -0.660 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H]3[C@H](C2)[C@@H]3NC(=O)OC(C)(C)C)sc1B(O)O 2267623770 NRRRCHXQYLEADH-PEGIJTEDSA-N 402.303 -0.120 50 10 HBGE CC[C@H](CN(C)S(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267624574 ASXQPUTWRGPHAN-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2281841832 PFIKMVFEQWCGLV-FVOZGUDWSA-N 400.266 -0.369 50 10 HBGE CC1(CCNS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282743785 UAUOYMIMEZQZDW-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2cc(B(O)O)co2)CC1 2285997310 PLMQZUDAUZEFGE-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE CC(C)(C)OC(=O)N1CC(c2nc(=NC(=O)c3cnsc3B(O)O)s[nH]2)C1 2362574003 HUZRMRLROXKVML-UHFFFAOYSA-N 411.274 -0.317 50 10 HBGE C[C@@H](NC(=O)NNC(=O)[C@H]1COCCO1)c1cccc(S(=O)(=O)N(C)C)c1 745799595 ILGDYNUXGQQYAZ-BXUZGUMPSA-N 400.457 -0.256 50 10 HBGE CO[C@@](C)(C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 766638315 FLWXTPYAXJRDRY-LJQANCHMSA-N 414.422 -0.857 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1116020755 VDDQDGPNJMMISU-BZUAXINKSA-N 422.507 -0.119 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2c(Br)cnn2c1 1306513685 ABXICOJHRVDMEK-SSDOTTSWSA-N 404.246 -0.205 50 10 HBGE O=C(NNC(=O)[C@@]12CCCN(CC1)C2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1472475269 SEUUFIKBZWXRTE-IBGZPJMESA-N 422.507 -0.046 50 10 HBGE O=C(N[C@@H]1Cc2cc(Br)cnc2NC1=O)c1cc(B(O)O)ccc1F 1558708624 ARKGOCYTLBJXMO-GFCCVEGCSA-N 407.992 -0.044 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2267371344 YVCPVMIRDVHHBR-JTQLQIEISA-N 405.307 -0.501 50 10 HBGE COC[C@]1(NS(=O)(=O)c2sccc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282068786 HVMAPFNLYLZDIR-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)nc1B(O)O 2282252243 XLUANFNQQUDFMG-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282333999 VZQUZMXYYUJPSA-SCZZXKLOSA-N 414.236 -0.211 50 10 HBGE C[C@@H]1C[C@H](CNS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 2282372609 ZFERHTPEYJCRGT-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@@H](CNC(=O)OC(C)(C)C)C1 2282706563 NGPMNOMCJRIIOV-NSHDSACASA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2cc(B(O)O)cs2)CCOCC1 2282706988 SXXLLHIVLMMSJP-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@H]2CCCN(C(=O)OCc3ccccc3)C2)n1C 2337397813 HPOGEDBIAXOEPU-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COCCO2)ccc1Cl 744640769 CYEIAHUFTUEENT-LLVKDONJSA-N 407.832 -0.302 50 10 HBGE CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)cc2)CC1 745464598 ZHWQDMCJRSEMLU-INIZCTEOSA-N 405.455 -0.680 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(C)(C)C2CCOCC2)n(C)c1=O 795179606 DLKSOGZKOCNEMG-UHFFFAOYSA-N 406.443 -0.966 50 10 HBGE COc1cccc(NCC(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1 1160472135 RQNSJUOKIJSSCA-UHFFFAOYSA-N 408.440 -0.601 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@H]2CCC(=O)NC2)CC1 1306648079 AHGPAZYHFXBZJK-CYBMUJFWSA-N 410.500 -0.623 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C1(n2cnnn2)CC1 1566281643 RAGJLUJHOFELAD-UHFFFAOYSA-N 418.889 -0.219 50 10 HBGE CC(C)(C)OC(=O)N1CCN(c2cc(CN3CCNCC3)cc(B(O)O)c2)CC1 1887522862 VAKJVBFPQPMAMQ-UHFFFAOYSA-N 404.320 -0.171 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CC[C@@H]1NC(=O)OC(C)(C)C 2282084833 YLYRRLSLDZOHDZ-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282343263 DAHRZIIHVOWREN-MNOVXSKESA-N 402.282 -0.868 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)sc1B(O)O 2282354907 XKUJATFSSBSXKV-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282719577 OAFGCUAZFCWYOV-STQMWFEESA-N 400.262 -0.985 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H]2C[C@@H](C1)[C@H](NC(=O)OC(C)(C)C)[C@H]2CO)B(O)O 2282721778 XACDZMRLWRJQRC-RFGFWPKPSA-N 404.294 -0.662 50 10 HBGE CN(C[C@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cscc1B(O)O 2282734153 HXNORGVDEYUJJD-NSHDSACASA-N 420.318 -0.316 50 10 HBGE NCC1(NS(=O)(=O)c2cscc2B(O)O)CCN(Cc2ccccc2)CC1 2282735652 DYXGSUFTCLKRFG-UHFFFAOYSA-N 409.342 -0.300 50 10 HBGE C[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284054256 ZXJFKRCWRKKLHN-SCZZXKLOSA-N 400.266 -0.841 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)NC(=O)C1(C)C 735837391 SWQAONJUPRFJOS-UHFFFAOYSA-N 410.456 -0.620 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cncc(O)c2)CC1 1160865802 YYMAGKHJGVZXJU-UHFFFAOYSA-N 406.468 -0.196 50 10 HBGE COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1OC 1354837525 XPEMRAPQXFYPBY-VQIMIIECSA-N 409.439 -0.296 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c(OC)c1 1358432947 PBHTURZIZAUETN-UHFFFAOYSA-N 409.424 -0.391 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1OCC(=O)N(CC)[C@@H]1c1ccnn1C 1467895635 HLGINOFXNJECQH-CABCVRRESA-N 411.459 -0.355 50 10 HBGE CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1546175454 QHMABZYADQQYSD-HTQZYQBOSA-N 403.379 -0.118 50 10 HBGE Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 1628649163 IFUWPLBDIOZVEC-VHDGCEQUSA-N 405.455 -0.025 50 10 HBGE CCOCc1nc(C)cc(NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)n1 1644393977 XSGSZCUGAWJPTA-HNNXBMFYSA-N 406.487 -0.055 50 10 HBGE O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)[C@H]1CCC(=O)N1 1647271929 VPRXIJLTWRLKOC-OAHLLOKOSA-N 423.495 -0.155 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2ncsc2B(O)O)C1 2266893305 HKGHXDIHKYEBSW-SANMLTNESA-N 403.291 -0.072 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2csnc2B(O)O)C1 2267435716 NHNPQDKZERHUCY-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282364058 LFTZVKHGFCBSTN-VXNVDRBHSA-N 414.236 -0.186 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C 2282366840 UOEPZPVIYPYYNH-LLVKDONJSA-N 422.334 -0.415 50 10 HBGE COC(=O)[C@H](CCNS(=O)(=O)c1cscc1B(O)O)NC(=O)OC(C)(C)C 2282371519 KQVKQQIGTYJESK-JTQLQIEISA-N 422.290 -0.837 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1cccc(B(O)O)c1)NC(=O)OC(C)(C)C 2282716096 PLGKALBUHKZHMG-CYBMUJFWSA-N 402.278 -0.426 50 10 HBGE COCCN(/C=C(/C#N)C(=O)NCCCN1CCCC1=O)[C@@H]1CCS(=O)(=O)C1 216762387 BCOKHQQFCSXZHR-UGEDRFTOSA-N 412.512 -0.342 50 10 HBGE NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)[C@@H]3COCCO3)c2)C1 745810003 VXBHBJXMFOGCCL-IRXDYDNUSA-N 419.482 -0.370 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)OC2)NNC(=O)c1cc(Br)c[nH]1 1313178997 GIYHLBVXHGOEEE-ZDUSSCGKSA-N 402.205 -0.058 50 10 HBGE Cn1cc([C@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1 1440330800 ZUHIGPNLUXSTFA-HNNXBMFYSA-N 407.452 -0.301 50 10 HBGE C[C@H](C(=O)NNC(=O)CN1CCCC1=O)N1CCN(C(=O)OC(C)(C)C)CC1=O 1557977200 AHVVAMIDJOYTMK-GFCCVEGCSA-N 411.459 -0.776 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)c(=O)n3C)CC2)cc1 1566279422 PCJNCVDWDWTMIS-UHFFFAOYSA-N 400.483 -0.389 50 10 HBGE O=C(CCn1nnc2ccccc2c1=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1635372798 YZAATWAOEICSDV-INIZCTEOSA-N 400.439 -0.418 50 10 HBGE O=C(NNC(=O)[C@H]1C[C@H]2C=C[C@H]1O2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1654138390 JGDBGOUWQGXVCG-VNQPRFMTSA-N 407.448 -0.188 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C[C@H]2NS(=O)(=O)c2cscc2B(O)O)C1 2267387104 DMPAICDSWDNXKQ-HOSYDEDBSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267617553 MQXMBFBCZKLOSE-SNVBAGLBSA-N 408.669 -0.816 50 10 HBGE CCn1cc(C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)nc1B(O)O 2282230253 SZLJWDHTMRCARH-JGFSIVIASA-N 402.282 -0.266 50 10 HBGE COC1(CCNS(=O)(=O)c2cc(B(O)O)cs2)CN(C(=O)OC(C)(C)C)C1 2282707042 UEYSHMCSOFFEHF-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE CN(Cc1ccccc1)[C@]1(CNS(=O)(=O)c2ccc(B(O)O)s2)CCOC1 2282710675 RDNDKOPSBQTIBH-KRWDZBQOSA-N 410.326 -0.003 50 10 HBGE O=C(CCC(=O)N1CCC(O)CC1)NNC(=O)CNC(=O)OCc1ccccc1 794070753 ZGMHSWADPHPKPE-UHFFFAOYSA-N 406.439 -0.176 50 10 HBGE C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1148918784 FYOBDGVRJMZYIA-KWQFWETISA-N 422.385 -0.202 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)ccc1=O 1304258541 KMAIKUFUGPVJMJ-UHFFFAOYSA-N 404.857 -0.160 50 10 HBGE O=C(NNC(=O)[C@]1(O)CCCN(Cc2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1 1442179451 CEYOGDQZKWYGKW-YJBOKZPZSA-N 410.496 -0.469 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(n3cnnn3)CC2)c1 1623860540 MIHPDGSJRHYUCA-UHFFFAOYSA-N 407.456 -0.346 50 10 HBGE C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1684632567 BTZSMHQYSDNKPN-SGTLLEGYSA-N 410.402 -0.449 50 10 HBGE O=C(NNc1cccnn1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1 1686715217 BASPPQBPVGEBBZ-UHFFFAOYSA-N 406.424 -0.053 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 2243367222 POQZBFZJISDZQY-UHFFFAOYSA-N 415.259 -0.243 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(B(O)O)n1C 2282334373 AJINFKTUNPUIBL-MNOVXSKESA-N 402.282 -0.868 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2282338426 RIFMZPQTICGVBJ-SFYZADRCSA-N 415.224 -0.958 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)Cc1ccccc1B(O)O 2282342029 BCHXPZHOHFJCFS-UHFFFAOYSA-N 400.262 -0.320 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(S(=O)(=O)c2ccccc2B(O)O)C1 2282717054 CMKCUXGIZADTHM-VXGBXAGGSA-N 400.262 -0.985 50 10 HBGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282740937 HRZHEIQANUVHPP-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@]2(NS(=O)(=O)Cc3ncsc3B(O)O)CC[C@H]1C2 2369644565 IKKGNDYQFNVQKH-ZUZCIYMTSA-N 417.318 -0.216 50 10 HBGE COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@@H]3COCCO3)C2=O)c(OC)c1 805165523 LZMZMKUWWUOMCR-ZBFHGGJFSA-N 422.438 -0.450 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCS3(=O)=O)cc2)CC1 1151459250 GGIDEEMILHNPFQ-OAHLLOKOSA-N 416.525 -0.357 50 10 HBGE CC1(C)NC(=O)N(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)C1=O 1152746447 SVQLYIWPAVWFCR-UHFFFAOYSA-N 411.278 -0.857 50 10 HBGE CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CS(C)(=O)=O)s2)CC1 1168877807 ZEAKMICLXRPHDA-UHFFFAOYSA-N 423.538 -0.026 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCCCO3)CC2)cn1C 1436513429 XDNVJOPHWOHVLI-CQSZACIVSA-N 413.500 -0.154 50 10 HBGE CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)c2C1 1456037994 LMYXGKJFMCWRMR-YOEHRIQHSA-N 418.498 -0.404 50 10 HBGE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 1463574470 BJZGFWPMWGRANS-WMLDXEAASA-N 417.393 -0.167 50 10 HBGE 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CC(C)(C)OC(=O)N1CC(O)([C@@H](F)C(=O)Nc2ccc(Cl)c(B(O)O)n2)C1 2284040567 PYEHEUWHGOZHDO-JTQLQIEISA-N 403.603 -0.327 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 744653805 KMKZDQPNNMDYGN-XJKSGUPXSA-N 401.423 -0.022 50 10 HBGE O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)[C@@H]1COCCO1 810462497 SOZODMWWPCZSRQ-JTQLQIEISA-N 411.358 -0.454 50 10 HBGE C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc2n(n1)CCN(C)S2(=O)=O 1264054736 AKMVQHJWAIRLEU-SNVBAGLBSA-N 411.415 -0.115 50 10 HBGE CN1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)NC1=O 1538393609 YUTNRMAXSJVMIK-AWEZNQCLSA-N 409.468 -0.354 50 10 HBGE CCn1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 1654138721 YJWMSYIKAMUTMQ-UHFFFAOYSA-N 422.467 -0.677 50 10 HBGE O=S(=O)(CI)NC1CN(S(=O)(=O)C(F)(F)F)C1 2213094798 IEACMXQYIJIAAC-UHFFFAOYSA-N 408.161 -0.168 50 10 HBGE CN(CC1CN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1cncc(B(O)O)c1 2267616134 ODXAFLQRTZOHOX-UHFFFAOYSA-N 419.268 -0.350 50 10 HBGE CN1CCN(Cc2ccccc2)[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282079181 SONZMYJUWTYRMJ-HNNXBMFYSA-N 409.342 -0.478 50 10 HBGE CC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)ccc1OC 2282360624 FSUCSVRUNXJZLJ-GFCCVEGCSA-N 402.278 -0.043 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2282372998 GTPYGUAAJXICIA-NWDGAFQWSA-N 420.318 -0.269 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C2CC2)n1 2282377479 RBQRIICPRFJZDJ-HNNXBMFYSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(F)c(B(O)O)c2)CCO1 2282868646 QJOLFMQSTAGWFR-SNVBAGLBSA-N 404.225 -0.275 50 10 HBGE C=CCOC(=O)c1sc(NC(=O)C[S@](=O)CC(=O)NNC(C)=O)nc1C 586348183 JNKYXYIXJRPNAZ-SANMLTNESA-N 402.454 -0.351 50 10 HBGE C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1 746004902 YNDHCDOXGULSGG-CZUORRHYSA-N 423.445 -0.074 50 10 HBGE COc1cc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc(Cl)c1O 764815636 BDINHPZGXJXCTQ-UHFFFAOYSA-N 420.813 -0.048 50 10 HBGE CCCn1nc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)CC)c2ccccc2c1=O 1290067585 MAUOYFDHTVNKCI-NSHDSACASA-N 409.468 -0.105 50 10 HBGE CCn1c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc2ccccc21 1319229985 FCGVLZMKDWOYCA-UHFFFAOYSA-N 423.433 -0.131 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)NC[C@H](NS(=O)(=O)N(C)C)C1CCCC1 1478899151 BDIIXZPKTAJKLA-UBHSHLNASA-N 405.521 -0.303 50 10 HBGE COc1ccc(CCN2C[C@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2=O)cc1OC 1530230579 IWDIEBVTADPDHL-KGLIPLIRSA-N 418.450 -0.479 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cn(C)nn2)ccc1Cl 1538899954 ZEFPLRXTHJDKNF-UHFFFAOYSA-N 402.820 -0.275 50 10 HBGE CC(C)(C)OC(=O)C1(C(=O)NNC(=O)[C@H]2COCCO2)CCS(=O)(=O)CC1 1539688071 ZBQQXDPIEJXHLO-LLVKDONJSA-N 406.457 -0.914 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)c1sccc1B(O)O)C(F)(F)F 2267616292 QRUBGCWIBLSYDC-MRVPVSSYSA-N 400.209 -0.350 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282368262 NIZJDOOAHMSYCT-HWPZZCPQSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3cscc3B(O)O)CO[C@H]1C2 2282413959 LXZDTHMXXZVKBB-ZETOZRRWSA-N 418.302 -0.469 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC1CCC(NC(=O)OC(C)(C)C)CC1 2282508115 RAJJMNZMMZPLBA-UHFFFAOYSA-N 402.282 -0.786 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282729042 XHGRIXULPUMYCH-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(C(=O)NCc2ccc(B(O)O)s2)CCS(=O)(=O)C1 2284053083 KMVCROYNYSLPPY-OAHLLOKOSA-N 418.302 -0.874 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3sccc3B(O)O)CO[C@@H]1C2 2359269213 NDMFBGJOELNVRO-HFAKWTLXSA-N 418.302 -0.469 50 10 HBGE CCOc1cc(/C=N/NC(=O)CCc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OC 169892499 SVHWAXSHOYZXTR-CAOOACKPSA-N 406.355 -0.143 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ccc(B(O)O)c(F)c1 704309368 HCPUEMATDDKJEL-UHFFFAOYSA-N 406.200 -0.067 50 10 HBGE COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2COCCO2)CC1 745788454 PMEQDTQPVFCLGG-QGZVFWFLSA-N 420.466 -0.026 50 10 HBGE C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)[C@@H]1COCCO1 745981775 ZNNNQPYWOANSMA-IFXJQAMLSA-N 402.407 -0.452 50 10 HBGE COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 749840118 LJWYMCWFROVZDF-INIZCTEOSA-N 421.454 -0.593 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1ccc(F)c(N2CCCS2(=O)=O)c1 756498578 XQDBSCBENIDOII-CYBMUJFWSA-N 402.404 -0.066 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)N1 1131722426 DZEYETAQXFUQGU-HUUCEWRRSA-N 408.480 -0.346 50 10 HBGE CCOCc1nc(C)cc(NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)n1 1154534427 TWTPYEIJMBGLGS-STQMWFEESA-N 411.484 -0.200 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNS(=O)(=O)CCOCCCl 2218609703 ONFOFSMHTXABTL-GRYCIOLGSA-N 402.897 -0.498 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267198793 CNBWLSUWFBZXSI-LLVKDONJSA-N 408.282 -0.089 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2C[C@H](C)N(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282741826 SYWBQLLBMNROKM-GXSJLCMTSA-N 402.282 -0.915 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(B(O)O)c(F)cc2Cl)C1 2285948448 CIHXYBFOMQDOGV-CHWSQXEVSA-N 402.615 -0.131 50 10 HBGE CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1 753162020 YWGYBXCDFBBWFS-CQSZACIVSA-N 421.520 -0.873 50 10 HBGE O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)[C@H]1CCc2nncn2C1 814330218 CSINNHVMDBMEAD-HNNXBMFYSA-N 420.495 -0.172 50 10 HBGE COc1ccc(CCC(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)cc1 1468645213 LJZORMUAHUEFKJ-KZNAEPCWSA-N 415.450 -0.301 50 10 HBGE CO[C@@H]1C[C@H]1C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1545424286 UQKIJKDMLJTADV-HZPDHXFCSA-N 410.496 -0.516 50 10 HBGE O=C1CNC(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cc2N1 1635372128 ORCZMJIOALBDAQ-HNNXBMFYSA-N 401.423 -0.617 50 10 HBGE O=C(CN1CCN(C[C@@H]2CCCS2(=O)=O)CC1)NNC(=O)c1cccs1 1655337550 HDPKDKGRKZIHBG-ZDUSSCGKSA-N 400.526 -0.296 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267198794 CNBWLSUWFBZXSI-NSHDSACASA-N 408.282 -0.089 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(NS(=O)(=O)c2sccc2B(O)O)n[nH]1 2267201777 SWVUPHUVMWPMDK-UHFFFAOYSA-N 403.251 -0.629 50 10 HBGE COCC1(NC(=O)OC(C)(C)C)CC(NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282070013 XSSBQHCVPRGORT-UHFFFAOYSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1C(=O)c1ccsc1B(O)O 2282261358 WQSAJTKSHRHSJY-INIZCTEOSA-N 400.262 -0.844 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C)c(B(O)O)n1C 2282328215 UOMHCJBBFJPRHT-MWLCHTKSSA-N 402.282 -0.915 50 10 HBGE Cc1csc(C(=O)N2CCS(=O)(=O)CCN2C(=O)OC(C)(C)C)c1B(O)O 2282445040 CMQCLGXCIWFCSC-UHFFFAOYSA-N 418.302 -0.241 50 10 HBGE CC(C)N(CCN(C)C(=O)OC(C)(C)C)S(=O)(=O)c1c(B(O)O)cnn1C 2282503893 HHBSWLAGZYYJHO-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE CCN([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282743856 UUBBASQBVMHXHT-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CNS(=O)(=O)c1cncc(B(O)O)c1)C(C)(C)C 2362080460 LKZWPKKRTUFUKL-CYBMUJFWSA-N 401.294 -0.021 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)n1C 2362566671 MYRPVULBNPAOFL-BLBHWQHRSA-N 400.266 -0.686 50 10 HBGE CCOc1cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OCC 169893121 BHUPTMAKJWTXKG-CNHKJKLMSA-N 421.370 -0.274 50 10 HBGE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2COCCO2)c(OC)c1 744650204 WHMIOZHQLDRUIO-GDBMZVCRSA-N 407.423 -0.129 50 10 HBGE Cn1cc(Br)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1=O 1292045587 UFMFLIXGOQSGNL-SSDOTTSWSA-N 407.246 -0.721 50 10 HBGE CN(C)CCn1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)n1 1631771317 CQXWTJJGOBBILX-UHFFFAOYSA-N 408.322 -0.115 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2cc(Cl)c(B(O)O)s2)C1 2267623912 PWKNCRKMVDSXBJ-JTQLQIEISA-N 420.627 -0.087 50 10 HBGE CCCC[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282065053 INIPYDWDXMCVJQ-LLVKDONJSA-N 404.298 -0.538 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@]1(C)CNC(=O)OC(C)(C)C 2282066806 UWDLXHKZGDZOGW-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2282085758 CTSSFNHKQAFVIZ-CMPLNLGQSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C1)CS(=O)(=O)CCN2C(=O)C1(B(O)O)CCC1 2282299157 WPFPMLMTVAVRHL-UHFFFAOYSA-N 402.278 -0.370 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282335352 OJZBMHBTQFAQLJ-LLVKDONJSA-N 402.282 -0.914 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)sc1C 2282367726 GJQDSZQSMLGXJX-WDEREUQCSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCN(S(=O)(=O)c2sccc2B(O)O)CC1 2282508614 YRJPFUAJYUPDLE-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](NC(=O)C(F)(F)F)[C@@H]1C 2282723261 PGBSAONMJJIOHJ-CBAPKCEASA-N 414.236 -0.044 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](O)C[C@@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282726559 BWBIHJZQQJXEKT-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1 772063905 LYFOGGMNKDTOEF-GTNSWQLSSA-N 416.434 -0.049 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cn(C)nn3)CC2)cc1 808376157 QHZRCPVQXKJMHW-UHFFFAOYSA-N 406.468 -0.015 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NNC(=O)N(C)C 813428126 SMLVBQRKMLGVEI-UHFFFAOYSA-N 413.500 -0.063 50 10 HBGE Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1C 816873808 OXPAUSWJXKIKRY-CQSZACIVSA-N 420.495 -0.027 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C[C@@H]3CCCS3(=O)=O)CC2)c1 1460646832 XPXMIGZKHIQXQR-KRWDZBQOSA-N 419.507 -0.486 50 10 HBGE CN1CCN(Cc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)CC1 1624589691 OABMKVMNXZPRJP-GFCCVEGCSA-N 400.526 -0.309 50 10 HBGE CCO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN(C)C 1683987386 VWXDWKJDPIPGSC-CQSZACIVSA-N 415.516 -0.152 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@H](B(O)O)C2)[C@H]2CS(=O)(=O)C[C@H]21 2281876783 IBVQGCNLECIJII-ZDEQEGDKSA-N 402.278 -0.516 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@H](C)[C@H](NC(=O)C(F)(F)F)C2)sc1B(O)O 2282360847 INVPORHIBUVRID-IONNQARKSA-N 414.236 -0.186 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2282437759 KAGULKFIITYTOO-JGFSIVIASA-N 400.266 -0.686 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](NS(=O)(=O)c3sccc3B(O)O)[C@H]2C1 2282703484 WYPIKRBZRFLUAQ-JLLWLGSASA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2ccccc2B(O)O)C1 2282716660 XGZYDPPFDGCEEL-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282721318 ORNUHIUQRZRZKL-JTQLQIEISA-N 406.241 -0.988 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284060014 KAKSKQXDLAYAJB-NXEZZACHSA-N 412.195 -0.139 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncc(B(O)O)s1)[C@H](O)C(F)(F)F 2284060641 PSYZFGCAYIRLGO-BDAKNGLRSA-N 413.183 -0.744 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2285190872 ZEDRWDNNPIBIAL-KRWDZBQOSA-N 413.239 -0.163 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cnc(N2CCOCC2)c(F)c1 765891426 JSQFGEVJEQGYGI-UHFFFAOYSA-N 420.401 -0.089 50 10 HBGE CN(CC(=O)NNC(=O)[C@@H]1CCc2nncn2C1)C1=NS(=O)(=O)c2ccccc21 816871376 HSDHAGWHZKXPRY-LLVKDONJSA-N 417.451 -0.931 50 10 HBGE CCOCCCn1c(NNC(=O)CN2CCNC(=O)C2)nc2ccccc2c1=O 1136795890 MAUYJPPIUAKGFP-UHFFFAOYSA-N 402.455 -0.302 50 10 HBGE CNC(=O)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1251160553 MIGCFPBXFICYBR-GFCCVEGCSA-N 411.484 -0.060 50 10 HBGE CC(C)c1ccc(S(=O)(=O)N2C[C@H](O)C[C@H]2C(=O)NNC(=O)C(C)(C)O)cc1 1556228147 DOBIHMBAZOOYAV-HIFRSBDPSA-N 413.496 -0.148 50 10 HBGE CSCCNC(=S)NNC(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1F 1630723155 NOZCNJNIGPHWRJ-NSHDSACASA-N 401.489 -0.342 50 10 HBGE C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1nnc2c(=O)n(C)ccn12 1683683588 SXJWRPMLTLZGRT-SNVBAGLBSA-N 403.374 -0.135 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](CO)NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267391705 FTVMCAUNQPYFQL-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC1(CNC(=O)OC(C)(C)C)CCCC1 2282083774 RERPTXNDLDWFRF-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@H]1CO 2282374918 HYPONOIKLQACFG-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282700605 RMXHLGPBEVTBSG-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1sncc1B(O)O)C(=O)O 2289804224 YSJIGUWCENNRDN-JTQLQIEISA-N 401.250 -0.299 50 10 HBGE CCn1nc(C(=O)NNC(=S)NCCN2CCOCC2)c2ccccc2c1=O 38291479 DGJQOXPRXQQYNH-UHFFFAOYSA-N 404.496 -0.143 50 10 HBGE O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c(Br)s1 745979629 YPKNYAIHJNAUHD-RXMQYKEDSA-N 415.243 -0.066 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Cc1cc[nH]n1 755289239 PEUWOXKFJDXWGM-UHFFFAOYSA-N 407.452 -0.257 50 10 HBGE C[C@@H](C(=O)N(C)CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)n1cccn1 794071189 GPSNMTKEHLSKJM-AWEZNQCLSA-N 416.438 -0.024 50 10 HBGE CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@]3(C)C[C@H]3Br)CC2)CC1 1624389123 ZYJJCRLCENEEHV-TZMCWYRMSA-N 409.350 -0.204 50 10 HBGE CNC(=O)NC[C@H]1COCCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1 1644263698 ZECKUADJRZUQJQ-ZDUSSCGKSA-N 409.443 -0.905 50 10 HBGE O=C(NNc1cc(Br)ncn1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 1644899441 ARCKAZNGBSCSHM-LLVKDONJSA-N 413.276 -0.137 50 10 HBGE O=C(NCc1cnc2n1CCOC2)NNC(=O)C1CCN(c2ncccn2)CC1 1687811457 VQWITQFXEGHBMK-UHFFFAOYSA-N 400.443 -0.050 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1cscc1B(O)O 2255883441 HNCMYXUNJZYNJM-XMMPIXPASA-N 412.320 -0.261 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N=[S@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2267081654 CIKRDWKWHFYQMW-AREMUKBSSA-N 403.291 -0.011 50 10 HBGE Cc1nn(C)c(C(=O)N(C)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267399304 FZBVQQMAUGNEPK-OAHLLOKOSA-N 400.244 -0.109 50 10 HBGE Cn1nc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2F)c(B(O)O)c1Cl 2281651583 RJIXPSWHOZORRO-RKDXNWHRSA-N 404.635 -0.169 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282339748 ZXGFTYHPZKIIGM-MNOVXSKESA-N 419.334 -0.064 50 10 HBGE C[C@H](CCCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282364340 UTYSNBLEGPWORI-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)CCCC2)n1 2282377763 WEPNFZOKLAAUIF-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282378017 ZOOUVKPHDNHTGI-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE Cc1nc(S(=O)(=O)N(C)CCCN(C)C(=O)OC(C)(C)C)c(B(O)O)n1C 2282410060 UWRICJXOXXZEAG-UHFFFAOYSA-N 404.298 -0.714 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1CNS(=O)(=O)c1nn(C)cc1B(O)O 2282736274 NRTKFAHJPMCVRH-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE C[C@H]1[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282741384 NBJNUQQCQNHBAJ-JQWIXIFHSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NCc1c[nH]nc1NS(=O)(=O)c1ccc(B(O)O)s1 2352328167 XJQVNSFXTBEHTL-UHFFFAOYSA-N 402.263 -0.024 50 10 HBGE O=C(CNC(=O)c1ccccc1I)NNC(=O)c1cnn[nH]1 729541713 XXUBELFQFCNSBB-UHFFFAOYSA-N 414.163 -0.400 50 10 HBGE Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cnn1 786689219 SWSPPXQTRZYBJR-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCCO1 817215420 XVAKIPZLFLBVJL-IGQOVBAYSA-N 401.485 -0.578 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 1163146934 YDMPNVQZSJCZJN-AAEUAGOBSA-N 417.509 -0.116 50 10 HBGE COC(=O)[C@@]1(N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)CCOC1 1196263121 NBZACMFISDMICZ-HXUWFJFHSA-N 415.450 -0.731 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)N3CCCC3)cc2)CC1 1446390079 XCHILSSLIUGEAY-UHFFFAOYSA-N 424.527 -0.129 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCO[C@H]2C)cc1OC 1570690720 ZYUBUGJHUMVGNW-JQWIXIFHSA-N 401.441 -0.446 50 10 HBGE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2CCC(=O)N2)c(OC)c1 1623368229 KJKCRPVCRXJPTI-KGLIPLIRSA-N 404.423 -0.266 50 10 HBGE CNC(=O)[C@@H](CNC(=O)NNC(=O)[C@H]1COCCO1)Cc1ccc(OC)c(F)c1 1673913096 LKKQYJANMXMFRM-IUODEOHRSA-N 412.418 -0.515 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267203884 WONPLNPWPRKXHA-NSHDSACASA-N 406.291 -0.658 50 10 HBGE Cc1nc(S(=O)(=O)N2CC(N(C)C(=O)OCc3ccccc3)C2)c(B(O)O)n1C 2267379623 ZLJPQCRLWLQRIM-UHFFFAOYSA-N 422.272 -0.950 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@@H](CO)C1 2267614672 RGPPXDVYHKQAGF-SNVBAGLBSA-N 406.291 -0.970 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O 2282362660 AJFUTZQUCHGOAK-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1ccc(B(O)O)cc1 2365421005 CHULXYFEEDFDEU-AWEZNQCLSA-N 402.278 -0.675 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@H]2O)N(C)C1 102209916 UHQYIIRIOVIPLI-IPAVCLOWSA-N 410.964 -0.001 50 10 HBGE in-vitro COCCCNC(=O)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1 746841695 NOERYMRGKUTAKA-MRXNPFEDSA-N 403.439 -0.171 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCCN3C)CC2)cc1 766635859 HESMJHSDAANRLV-QGZVFWFLSA-N 423.539 -0.457 50 10 HBGE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1 805836287 IBMNMSUPVBNXJO-IUODEOHRSA-N 412.468 -0.029 50 10 HBGE O=C(CNC(=O)c1cnc(Cl)c(Cl)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1135990448 NIFIBBDXHKDFRQ-SSDOTTSWSA-N 409.251 -0.300 50 10 HBGE COC(=O)C[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccccc1Cl 1175226870 AYXCHBRLXCNQCL-NSHDSACASA-N 417.871 -0.237 50 10 HBGE CO[C@@H]1CCOC[C@H]1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1685403505 RGYMFERVZAYPAN-HUUCEWRRSA-N 414.484 -0.250 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267427549 UIUWJVWDJFLGKS-IBGZPJMESA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H](O)C1 2267610330 ZEQXALFJCQKCIN-LLVKDONJSA-N 406.291 -0.970 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2282296479 ATJFZBWAPLSCSN-RKDXNWHRSA-N 402.644 -0.883 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 2282699174 IIIZKQBEWXBQOB-JQWIXIFHSA-N 402.282 -0.928 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NCC1(F)CN(C(=O)OC(C)(C)C)C1 2282731702 VDLZQJSNTJZKLG-UHFFFAOYSA-N 402.253 -0.088 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)n1C 2362574473 UAHKNZJRHNKPNH-LSDHHAIUSA-N 416.243 -0.778 50 10 HBGE COc1ccc(C(=O)N/N=C(\c2nc3ccccc3[nH]c2=O)[C@@H](O)[C@@H](O)CO)cc1 5285634 UTIQURRKVVUIES-MXIUXFBLSA-N 412.402 -0.220 50 10 HBGE COC(=O)CCS(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 731040631 JZEPCBHSZWGKRU-UHFFFAOYSA-N 419.481 -0.402 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)N1 1136453406 GKEACMUEHXSZLY-JTQLQIEISA-N 408.358 -0.551 50 10 HBGE Cn1cc(C(=O)NC[C@@H]2CCCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1175202054 AUQDIJSIGBLZHK-KRWDZBQOSA-N 409.450 -0.053 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NN(CC)CCO)o1 1452329951 ILXFYTYCSZXIEP-LBPRGKRZSA-N 403.457 -0.045 50 10 HBGE COc1cc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)OC3)cc(OC)c1OC 1471129861 QBVRYJHMVNTLQJ-GOSISDBHSA-N 424.410 -0.122 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)cc1OC 1540581108 PVSWSCFOJSRYCM-BZUAXINKSA-N 417.422 -0.611 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@]1(C)CC1(Br)Br 1610347003 GDYHWEHVYVEWHS-YLWLKBPMSA-N 421.111 -0.032 50 10 HBGE O=C(NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1)c1cccc(F)n1 1647753826 QUKSJVOBSWRDIX-GFCCVEGCSA-N 416.818 -0.026 50 10 HBGE COC(=O)C1CC2(C1)C[C@@H](NC(=O)NNC(=O)[C@H]1CCCCO1)CCS2(=O)=O 1685597535 HNHRPPNQWTXPCO-XPFWZQFZSA-N 417.484 -0.215 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC(NC(=O)OCc3ccccc3)CC2)n1 2267391305 BYAJWFUTQZQELR-UHFFFAOYSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267424171 WCIAEUIKYBXQIM-JTQLQIEISA-N 408.282 -0.089 50 10 HBGE CC(C)(C)OC(=O)NCc1nnc(NS(=O)(=O)c2ccc(B(O)O)s2)o1 2267612778 OLRXVGYVIJPAKM-UHFFFAOYSA-N 404.235 -0.364 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)[C@@H](F)C1 2282429894 YAWZKQBVWDIVIA-KBPBESRZSA-N 402.253 -0.008 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)n1 2282463648 CLEAUZKDQMCEQL-MHZLTWQESA-N 403.270 -0.962 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282728710 HBHQWLRFUYTUOM-MNOVXSKESA-N 402.253 -0.055 50 10 HBGE CN(C[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1)C(=O)OC(C)(C)C 2282733154 RFVADHMWEXSEON-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CN(Cc1ccccc1)[C@]1(CNS(=O)(=O)c2cscc2B(O)O)CCOC1 2282734880 ROXUWENYTPYTST-KRWDZBQOSA-N 410.326 -0.003 50 10 HBGE CC(=O)NCCNC(=O)CCC(=O)NNC(=O)c1cc(Br)cn1C 731866755 ZBSVPGWYSRWCAU-UHFFFAOYSA-N 402.249 -0.419 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)cc1S(=O)(=O)NC(C)(C)C 744648040 NFJGWMFUXWNBLO-ZDUSSCGKSA-N 415.468 -0.052 50 10 HBGE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)COc1ccccc1O 805836766 WCQDVQAMICHEGV-LBPRGKRZSA-N 400.457 -0.085 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)C1 813421864 XLRJLXPGIMCXKL-QWRGUYRKSA-N 408.452 -0.291 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cnccn3)nc2)CC1 1256366280 RRORCRTXFUMTJC-UHFFFAOYSA-N 406.472 -0.366 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1c(Br)nc2n1CCCC2 1648534415 FHJPMFJSJJMTNX-ZETCQYMHSA-N 408.278 -0.319 50 10 HBGE O=C(CN1CCN(C[C@@H]2CCCS2(=O)=O)CC1)NNC(=O)c1ccc(F)cc1 1659796401 DBXHMSRBZZLWPR-INIZCTEOSA-N 412.487 -0.219 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)nn1 1681130039 KALRAXRLGKNHTD-GJZGRUSLSA-N 412.454 -0.642 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)Cc1ccsc1B(O)O 2267711715 OYSKNWKINFJMNN-NWDGAFQWSA-N 402.303 -0.049 50 10 HBGE Cn1nc(B(O)O)c(C(=O)NCC2(F)CCN(C(=O)OCc3ccccc3)CC2)n1 2281853205 ODFCTZDOWVOFIG-UHFFFAOYSA-N 419.222 -0.634 50 10 HBGE CN(C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1)C(=O)OC(C)(C)C 2282074829 OQCVMJCPJBMDNS-GFCCVEGCSA-N 420.318 -0.316 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1 2282706354 KSXMMCJAYGDUFN-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE C[C@@H](NS(=O)(=O)c1cccc(B(O)O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 2282715625 JAROPGMIMRJFHD-LLVKDONJSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282858237 UDOPEFFVKRNYLM-CHWSQXEVSA-N 404.225 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)N2CC[C@](C)(B(O)O)C2)C1 2368342582 IPCGZXHSQCSGLN-LRDDRELGSA-N 404.294 -0.124 50 10 HBGE O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)N1CCOCC1 731620657 DWQDHEZHSZCCCN-HZSPNIEDSA-N 416.500 -0.831 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cn2c(n1)COCC2 1149629455 MAFUTJAZDHUYLT-UHFFFAOYSA-N 412.450 -0.368 50 10 HBGE O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O)c1cc(B(O)O)ccc1F 1153448443 XOJXHMIEIVACOS-UHFFFAOYSA-N 424.215 -0.516 50 10 HBGE Nc1nnc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1 1294587856 PAYPIEGESAZQSA-UHFFFAOYSA-N 403.468 -0.732 50 10 HBGE CC[C@H](CN1CCOCC1)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 1471395446 NLDCXVCQUMDITD-CYBMUJFWSA-N 402.455 -0.012 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)C(F)(F)Oc1ccccc1 1479133071 WAUWNBWPZZAYCP-MRXNPFEDSA-N 414.365 -0.384 50 10 HBGE O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1558950206 ILOQGFQZNLNIBA-NXEZZACHSA-N 409.390 -0.021 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1ccc(C#N)cc1)C2 1656451425 YWJZVXBOCPCCOV-HNNXBMFYSA-N 410.438 -0.808 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@H]2CNC(=O)C2)cc1 1685122384 FVYMWWCSFOUQJA-CYBMUJFWSA-N 411.484 -0.528 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267208882 OHYGUDIVMQPSER-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE C[C@@]1(NS(=O)(=O)c2cncc(B(O)O)c2)CCN(C(=O)OCc2ccccc2)C1 2267410425 JDTOVVAVKMHGAD-GOSISDBHSA-N 419.268 -0.159 50 10 HBGE C[C@@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1c(B(O)O)cnn1C 2282074783 XDYIUZYXUOTHAL-NSHDSACASA-N 404.298 -0.634 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2282359293 LXOKICMPOKRBOX-JQWIXIFHSA-N 420.318 -0.269 50 10 HBGE CCON(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1F 2282374094 WMGIMLWJLGEUGV-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@H]2C[C@H]3CC[C@H]2N(C(=O)OCc2ccccc2)C3)n1 2282468046 PBFCRWPUYHKVLO-QLFBSQMISA-N 413.243 -0.586 50 10 HBGE COC(=O)[C@H](CCNS(=O)(=O)c1sccc1B(O)O)NC(=O)OC(C)(C)C 2282709394 XCHYCDBVHZHVRG-JTQLQIEISA-N 422.290 -0.837 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NCCc1nccn1Cc1ccccc1 2282740191 VULJLEQDAPTWQB-UHFFFAOYSA-N 406.298 -0.270 50 10 HBGE C[C@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cccc(B(O)O)c1 704367973 BYUALODDLAADIE-LBPRGKRZSA-N 402.237 -0.357 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1 807609093 JBFRRABGNRRPKE-KGLIPLIRSA-N 414.484 -0.169 50 10 HBGE CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CN2CCCC2=O)ccc1F 1454879024 MUDPNUMLDCXGMC-UHFFFAOYSA-N 400.432 -0.104 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc(C(N)=O)nc1 1623872558 LGLSYYVMUIBQTJ-UHFFFAOYSA-N 404.452 -0.214 50 10 HBGE CN1CCC(CNC(=O)NNC(=O)COc2ccccc2O)(N2CCOCC2)CC1 1686784813 VUPVDVSPYPJGIT-UHFFFAOYSA-N 421.498 -0.102 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083410 PARNQLIWQRAZKL-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@](C)(NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282327349 GRPRECFQLAFUCI-HNNXBMFYSA-N 402.282 -0.914 50 10 HBGE CN(Cc1ccccc1)[C@@]1(CNS(=O)(=O)c2ccc(B(O)O)s2)CCOC1 2282710676 RDNDKOPSBQTIBH-QGZVFWFLSA-N 410.326 -0.003 50 10 HBGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282711062 WXPVJMQKDQUWNR-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)N(CCCNS(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282736566 SPAAAISBZPLWEA-UHFFFAOYSA-N 404.298 -0.586 50 10 HBGE COc1ccc(C=C(C#N)C(=O)N(CC(=O)O)[C@H]2CS(=O)(=O)C[C@@H]2O)cc1OC 2324522895 FUILCWGUOLEYLP-KBPBESRZSA-N 424.431 -0.318 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1ccsc1B(O)O 2339878130 HXMYCOMSOXCSAQ-NSHDSACASA-N 408.307 -0.613 50 10 HBGE C#CCO[C@H](C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1137299187 MQOACIDLOLMJID-MRXNPFEDSA-N 422.507 -0.513 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)cc1OC 1623599171 YIIZSXRSNBVFQK-LBPRGKRZSA-N 406.370 -0.210 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1C[C@@H](O)C1 1624363676 XWMGUYYZBSZRFV-GASCZTMLSA-N 411.480 -0.442 50 10 HBGE Nc1ncn(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1 1631014684 NATAELDNTZDXAW-UHFFFAOYSA-N 406.878 -0.521 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1csnc1B(O)O 2255779760 LHXJLGPCCJJWAV-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE Cc1cc(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)COC2)sc1B(O)O 2267622281 OOAIWIBLOHWJSV-UHFFFAOYSA-N 406.291 -0.692 50 10 HBGE C=C(CS(=O)(=O)N1C[C@@H]2C[C@H](C1)[C@@H](CO)[C@H]2NC(=O)OC(C)(C)C)B(O)O 2282721779 XACDZMRLWRJQRC-RQJABVFESA-N 404.294 -0.662 50 10 HBGE CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H]1COCCO1 744650033 XSFOBUKVOODCFC-GJZGRUSLSA-N 411.480 -0.134 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](O)Cc1cnn(C)c1 786857024 LYEJQTMXROCSRI-CYBMUJFWSA-N 410.814 -0.010 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1F 1135649474 FPMYYXYHYVOOLU-CYBMUJFWSA-N 413.475 -0.327 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)[C@@H]1CCCCO1 1628548397 XLBLOWPNGWMZBN-BARDWOONSA-N 415.512 -0.187 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)cn(C2CC2)c1=O 1654294973 PLBDODLVGSHFDF-ZETCQYMHSA-N 421.273 -0.356 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2S(=O)(=O)c2cc(B(O)O)cs2)C1 2282076250 FSNOCJSCFMSVKD-LLVKDONJSA-N 418.302 -0.827 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)Cc1ccccc1B(O)O 2282328832 DFYAORLSWRAPLE-AREMUKBSSA-N 420.318 -0.181 50 10 HBGE CCN(CCNS(=O)(=O)c1cc(B(O)O)ccc1OC)C(=O)OC(C)(C)C 2282360228 ZPWPDODMRWWBIX-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE Cc1nc(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c(B(O)O)n1C 2282413673 IIBUEOXBMDQPPI-NSHDSACASA-N 404.298 -0.764 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](F)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282714925 YPTHNTBYXJKFRJ-OLZOCXBDSA-N 402.253 -0.008 50 10 HBGE C[C@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1nn(C)cc1B(O)O 2282738379 UGAQIDMSPOCYAA-LLVKDONJSA-N 404.298 -0.634 50 10 HBGE CN(NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O)S(=O)(=O)C1CCC1 2365320986 NPTABMKMMBNXGO-WBMJQRKESA-N 407.489 -0.436 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3n[nH]c(C)n3)CC2)cc1OC 735872825 YNSCAIZENFHBAA-UHFFFAOYSA-N 417.470 -0.291 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 756295972 VLJPUKFBXSJXCU-OAHLLOKOSA-N 418.454 -0.292 50 10 HBGE CS(=O)(=O)Nc1ccc(N2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1 1296036060 OKOVQBXJDSCBRG-UHFFFAOYSA-N 403.269 -0.300 50 10 HBGE C#CCN1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1 1479314265 SYRHSFDGJXFLPA-OAHLLOKOSA-N 407.496 -0.022 50 10 HBGE Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cccc(F)n3)cnc21 1530274684 WVQJYBYUHMAXNN-UHFFFAOYSA-N 424.190 -0.112 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)[C@@H]1CCN1C1CCOCC1 1558458428 GICFLVAOVRSWMV-PBHICJAKSA-N 401.467 -0.169 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCS2(=O)=O)cc1 1558896856 HUYCINAYHWVEDA-ZDUSSCGKSA-N 403.482 -0.660 50 10 HBGE Cc1csc(CNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)c1B(O)O 2039322170 QPEHFOIROCFVRD-UHFFFAOYSA-N 422.293 -0.158 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)c2cc(B(O)O)cs2)CC1)C(F)(F)F 2267199622 PALMAWHAMKMIOQ-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)c1cc(B(O)O)cs1)C2 2272655370 NWIYQKGCEZGTNI-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282099013 BDUXERPXMAHGDV-VXGBXAGGSA-N 403.241 -0.613 50 10 HBGE Cn1nc(C(=O)N[C@H]2C[C@](F)(CNC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282250067 RMWUWSCORZZEMX-HWJBBNHMSA-N 404.635 -0.122 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)Cc1ccsc1B(O)O)C(F)(F)F 2282333614 QTVRICNTMCHFDS-SNVBAGLBSA-N 414.236 -0.209 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282336730 GVIGNKMCUPSJLP-WDEREUQCSA-N 419.334 -0.064 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H](C)C2(O)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282363580 IDMAXDDBCDPDEI-JTQLQIEISA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CF)(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282731677 UVFIWQRZRNXTCV-AWEZNQCLSA-N 423.297 -0.409 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@@]1(O)CCN(Cc2ccccc2)C1 2282857768 MPIPXJGFEGGXIP-KRWDZBQOSA-N 410.326 -0.516 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2cc(B(O)O)sn2)C1 2288538783 ABNQYVXUSAPJME-UHFFFAOYSA-N 407.204 -0.830 50 10 HBGE Cc1ccc2c(CC(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)coc2c1 765729777 GMTFOTQMEKHRIA-UHFFFAOYSA-N 424.417 -0.122 50 10 HBGE Cn1nnnc1CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 772573593 FAIPQKBRIRWSFC-UHFFFAOYSA-N 401.475 -0.705 50 10 HBGE O=C(N/N=C/c1ccc(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1)c1ccncc1 1076146637 JLTKHQOIUGCLNI-YGZQTEPXSA-N 403.391 -0.976 50 10 HBGE Cc1nc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cn1C 1135899395 FPJYPYOJLWHWSN-UHFFFAOYSA-N 416.554 -0.194 50 10 HBGE CC(C)N1CC[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@@H](c2cnn(C)c2)C1 1327092261 ZGXMBHOORNONHJ-NWANDNLSSA-N 414.532 -0.681 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@H]1CCC(=O)N1 1470496410 CYHSGCSYJVRNMX-SNVBAGLBSA-N 419.257 -0.847 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 1540362977 DKJFHCNSTNUJQB-AWEZNQCLSA-N 406.439 -0.217 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H]1CN(Cc2ccncc2)CCO1 1683164420 DLMRNILQPPJRDH-HNNXBMFYSA-N 416.438 -0.364 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)NC1C[C@@H]2CC[C@H](C1)S2(=O)=O 1685470349 MESNPCMNYLUBCH-FGWVZKOKSA-N 400.482 -0.084 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)cc1 2180983370 PHSGQJOJEQIDLE-CYBMUJFWSA-N 400.262 -0.367 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCOc2cc(B(O)O)ccn2)C1 2240324947 HKKHWPPXKIRJRC-ZDUSSCGKSA-N 400.262 -0.436 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267389887 VSGLGTIOTMJKMM-SNVBAGLBSA-N 405.307 -0.406 50 10 HBGE C[C@@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2sccc2B(O)O)C1 2282068788 HWMPUJBANSMYBJ-BDAKNGLRSA-N 414.236 -0.104 50 10 HBGE Cc1cc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H](O)C2)sc1B(O)O 2282371218 GZUAMHLARNCAJJ-NSHDSACASA-N 420.318 -0.661 50 10 HBGE Cc1sc(C(=O)N2CCS(=O)(=O)CCN2C(=O)OC(C)(C)C)cc1B(O)O 2282469074 BHDDUUZNRRXTMX-UHFFFAOYSA-N 418.302 -0.241 50 10 HBGE CN(C[C@@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 2282702305 GLLMJLHTXCWMSZ-LLVKDONJSA-N 420.318 -0.316 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@]3(C)CCC(=O)NC3)cc2)CC1 798982182 FUGREWGIJVAJHJ-SFHVURJKSA-N 409.512 -0.018 50 10 HBGE O=C(Cn1cc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cn1)NC1CCCCC1 816875635 DRXDBLGXWYICNS-ZDUSSCGKSA-N 414.470 -0.053 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1457618799 NECKHADVPAEANN-GHMZBOCLSA-N 406.505 -0.035 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@H]1C=CS(=O)(=O)C1 1463541384 QPVUCFWTDMPMQX-LLVKDONJSA-N 400.482 -0.002 50 10 HBGE Cc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c2c1CCC2 1465790322 LCWDBKVXEHGFJI-UHFFFAOYSA-N 410.434 -0.308 50 10 HBGE CN(CC(=O)NNC(=O)CSc1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 1557376483 GBOJUFZMZKHGQR-NSHDSACASA-N 416.481 -0.047 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 1611087348 OXXROXXTRLUNNA-JGVFFNPUSA-N 413.232 -0.535 50 10 HBGE O=C(Nc1ccc(S(=O)(=O)N2CCC[C@@H]2CO)cc1)c1ccc(B(O)O)cc1 1635108675 QQGZZFAJOUSEAJ-MRXNPFEDSA-N 404.253 -0.236 50 10 HBGE Cc1nc(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)s1 2266888834 RTQIVEMPPLMNDB-SANMLTNESA-N 403.291 -0.011 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 2266891376 GZIGKBGVDFMDAE-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE Cn1nc(C(=O)N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)cc1B(O)O 2267430003 FKAFPVMCIDLBIF-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@](F)(CNC(=O)c2nscc2B(O)O)C1 2281606649 GYDQCCVHIPCWML-HNNXBMFYSA-N 403.241 -0.472 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2ccsc2B(O)O)[C@H](S(C)(=O)=O)C1 2282226246 NZWGQJJXEJXOSO-WDEREUQCSA-N 418.302 -0.810 50 10 HBGE Cc1nc(S(=O)(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c(B(O)O)n1C 2282344397 KSYXPHHZJCEWBH-ONGXEEELSA-N 402.282 -0.915 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)C(=O)c1ncc(B(O)O)cc1Cl 2282441197 BLWXQJWCASCIPJ-UHFFFAOYSA-N 401.656 -0.236 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCCC(C)(C)NC(=O)OC(C)(C)C 2282711827 HSVBCHOZVWZIEE-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1F 2282720882 HREKTXQEHGPVOT-VXGBXAGGSA-N 404.225 -0.924 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1cccc(B(O)O)c1 2282861355 MVODTWGXPRNIKL-UHFFFAOYSA-N 400.262 -0.321 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2sccc2B(O)O)C1 2288536015 KRISLQSUUDVCHA-UHFFFAOYSA-N 406.216 -0.225 50 10 HBGE CC(C)(C)OC(=O)NCc1c[nH]nc1NS(=O)(=O)Cc1ncsc1B(O)O 2380438090 PYUMMISOWWOWRQ-UHFFFAOYSA-N 417.278 -0.487 50 10 HBGE O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)[C@H]1COCCO1 746333605 WCHZCQOGUXAMTR-HUUCEWRRSA-N 417.422 -0.901 50 10 HBGE O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)[C@H]1CCc2nncn2C1 814304957 BRTPKEABQICBBE-ZDUSSCGKSA-N 413.438 -0.013 50 10 HBGE CC(C)[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 1135416741 MGMDYNFEQMRZCI-NSHDSACASA-N 405.502 -0.686 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)Cn3ccc4ccccc43)cc2S1(=O)=O 1265025103 HILHJMOCRRNEKR-UHFFFAOYSA-N 402.436 -0.067 50 10 HBGE CN1CCN(C)CC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1 1628740809 IAKGUZPNOAGZEW-UHFFFAOYSA-N 411.528 -0.356 50 10 HBGE COc1ccc(C(=O)CCC(=O)NNC(=O)CS(C)(=O)=O)c(OC)c1OC 1648000249 WSDMNULGVYVCGG-UHFFFAOYSA-N 402.425 -0.133 50 10 HBGE O=C(OCc1ccccc1)N1CC[C@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2255669494 PBIYDMZDQYVJAF-HNNXBMFYSA-N 405.241 -0.549 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](O)CNS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2255758358 JOPHRKBWINZAEE-ZETCQYMHSA-N 414.698 -0.755 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N1CCC12CCN(C(=O)OCc1ccccc1)CC2 2282266957 AEAJJXFKIGXENJ-UHFFFAOYSA-N 413.243 -0.488 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F)B(O)O 2282362123 BDJAKCQLLSBATM-HTQZYQBOSA-N 412.117 -0.042 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2282714763 WNSSHCBSVPHEBJ-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)C1=O 816882064 WMHVBJZBRCCJGM-BLVKFPJESA-N 411.422 -0.545 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1156083028 CEZJFPIHUDXIEJ-JIFFNSBPSA-N 422.438 -0.694 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)Cc1ccccc1F 1465036629 ZIDHLGNEMXCOBI-UHFFFAOYSA-N 402.448 -0.650 50 10 HBGE CNC(=O)NC[C@H]1COCCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC 1648118899 MWIRTOJSWFZVIX-LBPRGKRZSA-N 413.862 -0.261 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N[C@@H](CB(O)O)C(=O)O)C1 2124535775 YHMYIBNSIMFGHE-DEYYWGMASA-N 408.216 -0.155 50 10 HBGE CN([C@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2267392847 PAZHBNHBIVZLEV-AWEZNQCLSA-N 422.272 -0.869 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2sccc2B(O)O)CCOC1 2267622103 YYXFDCIPMFJFNQ-AWEZNQCLSA-N 406.291 -0.610 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1cc(B(O)O)cs1 2281919265 CFWBWTKJCSPZHM-UHFFFAOYSA-N 402.278 -0.284 50 10 HBGE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2282070615 HEGMFJRMDKLHPU-GFCCVEGCSA-N 420.318 -0.316 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C 2282365321 XHUAWFPMENSMDP-VXNVDRBHSA-N 414.236 -0.044 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2C[C@@H](NC(=O)OC(C)(C)C)CC2(C)C)n1 2282377949 YQUWQBIKXUVSDF-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE Cc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)nnn1C 741659823 FPVNZLZPXYLWDZ-UHFFFAOYSA-N 400.848 -0.141 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)[C@H]1COCCO1 767467091 OSRLSUFTAPYFFM-XHDPSFHLSA-N 404.416 -0.034 50 10 HBGE CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1156183951 JENXRMWXPXPCHS-IRXDYDNUSA-N 420.514 -0.116 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)Cc1ccncc1 1255223309 CFDJUSZRPAZBFQ-UHFFFAOYSA-N 412.450 -0.271 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C 1457880180 NAQZPSZCCHQEKH-MNOVXSKESA-N 404.427 -0.437 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1OC 1618460908 PAKNKOHNCIJRFK-UHFFFAOYSA-N 423.451 -0.001 50 10 HBGE Cn1nc(I)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1628911708 DUTJSEWHZNEHLQ-ZCFIWIBFSA-N 412.209 -0.780 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2ncsc2B(O)O)C1 2267313865 QYMKCBUZXXRVFB-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 2267626791 NRHTYEFLGYPYKZ-IWIIMEHWSA-N 402.303 -0.120 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282366432 NUFOGPLNJTVDCN-RYUDHWBXSA-N 400.237 -0.112 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282710282 MPCRGFCMNNWSCY-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE COc1ccc(S(=O)(=O)NC/C=C\CNC(=O)OC(C)(C)C)cc1B(O)O 2283719841 IVNJKNMSGUSYON-WAYWQWQTSA-N 400.262 -0.266 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2359281508 ZMOMLIVVUWACKW-DUFXMDAXSA-N 400.237 -0.208 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)ccc1=O 1134417444 POXPPWVMWSGWEN-CQSZACIVSA-N 400.370 -0.594 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCc3nncn3CC2)c1 1135502383 KDJROWAEUKYQSW-LBPRGKRZSA-N 406.468 -0.058 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)OCc1ccccc1 1596923969 ZCBVBWMCHKZXAW-DLBZAZTESA-N 420.466 -0.326 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=C4CCCN=C4NN3)CC2)cc1 1630999793 GTOWLTUMJLJUPC-UHFFFAOYSA-N 411.510 -0.186 50 10 HBGE CC(=O)N[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)c1cccc(Br)c1 1648000190 UQHNNCDLOYETNV-GFCCVEGCSA-N 406.258 -0.182 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@H](CO)C1 2267611917 DKJYQEBHXSKEBM-JTQLQIEISA-N 406.291 -0.970 50 10 HBGE CN([C@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2282076052 CIDGQMKVALMRRQ-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CN([C@@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)c1nn(C)cc1B(O)O 2282372386 APOWHJYHZSJSKG-LBPRGKRZSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)S(=O)(=O)c1ccc(B(O)O)cc1 2282703770 ARTAEBKBQWGBCQ-UHFFFAOYSA-N 402.278 -0.736 50 10 HBGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cncc(B(O)O)c1 2282707961 GAXLWNMSPJCIIL-CYBMUJFWSA-N 401.294 -0.021 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2B(O)O)[C@@H]2C[C@H]21 2282729939 VDOTXNJZWHFLLZ-CHWSQXEVSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(B(O)O)s1)[C@H](O)C(F)(F)F 2284060015 KAKSKQXDLAYAJB-UWVGGRQHSA-N 412.195 -0.139 50 10 HBGE CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N=c2nc(B(O)O)[nH]s2)CC1 2284062598 GXVYSMHQPHHXTJ-UHFFFAOYSA-N 406.220 -0.139 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NCCCN1C(=O)CNC1=O 731118873 XZABNFCLGUJSKL-UHFFFAOYSA-N 401.221 -0.327 50 10 HBGE O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)[C@H]1Cc2ccccc2O1 732066179 JRPLIIDHKAERMO-ZWKOTPCHSA-N 416.478 -0.149 50 10 HBGE COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2COCCO2)CC1 745788450 PMEQDTQPVFCLGG-KRWDZBQOSA-N 420.466 -0.026 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)[C@@H]1COCCO1 767467090 OSRLSUFTAPYFFM-NHYWBVRUSA-N 404.416 -0.034 50 10 HBGE CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)[C@H]2COCCO2)CC1 782078320 KLWQKADIBMWLJF-QGZVFWFLSA-N 405.455 -0.081 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)C1 806033337 GDMZHMDPBMMJLO-CYBMUJFWSA-N 423.499 -0.522 50 10 HBGE COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2)cc1 1131722430 FBLRVIMVTHCJIW-OAHLLOKOSA-N 424.479 -0.478 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](C)CC#N)CC2)cc1 1149622574 OUIJXORMGIXDDV-HNNXBMFYSA-N 407.496 -0.002 50 10 HBGE Cc1ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc1S(=O)(=O)N1CCCCC1 1454276575 ALHXQHYHFYCCNY-UHFFFAOYSA-N 417.509 -0.025 50 10 HBGE CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)NNC(=O)CN1CCCc2ccccc21 1538914923 OMMSSGAPKZNHHT-OAHLLOKOSA-N 403.483 -0.007 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)[C@H]1C[C@H](O)CN1c1ccncn1 1623534493 QFNDVYJTVSYULN-CMPLNLGQSA-N 409.244 -0.022 50 10 HBGE CC1(CNS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2267371992 IGXMSXOXIDHGBU-UHFFFAOYSA-N 405.307 -0.501 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 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Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)CS(C)(=O)=O)C2)s1 1557735207 UUCXAVIWJNVWRZ-NSHDSACASA-N 423.538 -0.351 50 10 HBGE O=C(Cc1nc2ncccn2n1)N1CCN(S(=O)(=O)CBr)CC1 1597886519 SHQWLIRMNVALRX-UHFFFAOYSA-N 403.262 -0.507 50 10 HBGE Cn1nc(C(=O)NNC(=O)[C@H]2COCCN2CC(F)(F)F)c2ccccc2c1=O 1618234438 JWPJNSNOGFWOQA-GFCCVEGCSA-N 413.356 -0.042 50 10 HBGE CO[C@@H]1COC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1673936242 QZOOVFCRARRIAR-HUUCEWRRSA-N 412.468 -0.171 50 10 HBGE C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1687213148 YQOWUTNXHIMVIP-SNVBAGLBSA-N 419.891 -0.072 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267614457 NXJVFCZFWMYZCU-QGZVFWFLSA-N 422.272 -0.821 50 10 HBGE C[C@H](C[S@@](C)(=O)=NC(=O)c1nn(C)c(Cl)c1B(O)O)NC(=O)OC(C)(C)C 2281662940 DHQPXVPWUNOPCJ-HVKUJSFDSA-N 422.700 -0.096 50 10 HBGE CCN(CCN(C)S(=O)(=O)c1nc(C)n(C)c1B(O)O)C(=O)OC(C)(C)C 2282336052 XUUXYDXLZPLJNS-UHFFFAOYSA-N 404.298 -0.714 50 10 HBGE CN([C@@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)c1c(B(O)O)cnn1C 2282704355 JDRJVCKQVOBZSW-LBPRGKRZSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@]2(CNS(=O)(=O)c3cc(B(O)O)cs3)C[C@H]1CO2 2282704930 QZLZMUUVHKHIAC-NHYWBVRUSA-N 418.302 -0.515 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714774 WQZVPVCJECVESW-KGLIPLIRSA-N 416.330 -0.004 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2ccccc2B(O)O)C1 2282717126 DMMMLCMTGZAHAT-GFCCVEGCSA-N 400.262 -0.719 50 10 HBGE C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282857503 JCNJTRDCUCDLFH-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2359281757 ZMOMLIVVUWACKW-DUFXMDAXSA-N 400.237 -0.208 50 10 HBGE Cc1ccc(C=NNC(=O)c2c(CN3CCOCC3)nnn2-c2nonc2N)o1 254529356 YQKMDEYJOCWJSN-UHFFFAOYSA-N 401.387 -0.270 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 744652245 FYJVRFOZBLTLBY-HNNXBMFYSA-N 406.420 -0.519 50 10 HBGE CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)cc1 808096961 NKVCQJLHJUQTFU-CYBMUJFWSA-N 407.470 -0.900 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 1233945603 VKEBGGRPVBHERW-UHFFFAOYSA-N 415.472 -0.715 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CS1(=O)=O 1478930944 AWNNNPIKXZJKGA-MNOVXSKESA-N 417.513 -0.111 50 10 HBGE CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)CC1 1635371273 ADIXIJSWGJLAOJ-ZBCRRDGASA-N 416.544 -0.115 50 10 HBGE CC(C)(C)C(=O)N1CCO[C@@H](C(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)C1 1641457127 VKCSJNOGZFRRPZ-KGLIPLIRSA-N 416.434 -0.142 50 10 HBGE CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1642269779 BHECSMWNNOTKMT-OLZOCXBDSA-N 414.509 -0.487 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C 1652258390 PHYYNBJOMATKAK-STQMWFEESA-N 411.459 -0.730 50 10 HBGE Cn1nc(C(=O)NNC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c2ccccc2c1=O 1683604784 FKRDHRJWHGQQFB-LLVKDONJSA-N 400.395 -0.139 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1cscc1B(O)O 2255883440 HNCMYXUNJZYNJM-DEOSSOPVSA-N 412.320 -0.261 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2267388945 GRIYNVJGZQQENE-SNVBAGLBSA-N 405.307 -0.406 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267614068 ITGSJDZSEJJDLY-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2282359295 LXOKICMPOKRBOX-ZYHUDNBSSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)NC1CC(C[S@@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2282464154 JUVNOCFLBDPWDL-FVOZGUDWSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2cncc(B(O)O)c2)C1 2282714219 OVGDUZLFHOLVBK-ZDUSSCGKSA-N 403.241 -0.755 50 10 HBGE CCc1nn(C)c(C(=O)N2C[C@@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)c1B(O)O 2359273863 HVCYAOPTUFAYQR-JLJPHGGASA-N 412.255 -0.198 50 10 HBGE CN([C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)Cc1ncsc1B(O)O 2369652107 IVFWTIUELOFABT-KOLCDFICSA-N 423.297 -0.458 50 10 HBGE CCOc1cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OC 169893123 YDSDDPUNHOHXGI-UBKPWBPPSA-N 407.343 -0.664 50 10 HBGE O=C(NNC(=O)[C@H]1CSCN1C(=O)C1CCCC1)N[C@H]1CCS(=O)(=O)C1 730074268 ABBMDLCLCSJYLV-NWDGAFQWSA-N 404.514 -0.404 50 10 HBGE CCOCc1nc(C)cc(NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)n1 1154534425 TWTPYEIJMBGLGS-OLZOCXBDSA-N 411.484 -0.200 50 10 HBGE C#CCN(C)CCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1251528309 JQGIFSHTGSXSCM-UHFFFAOYSA-N 409.512 -0.099 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CN(C)CCN1C 1479597496 PUUHJHGPQGZYFM-SWLSCSKDSA-N 401.471 -0.488 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](O)C3CC3)CC2)cc1 1630996471 IWNFXLBCFHWJRM-KRWDZBQOSA-N 410.496 -0.780 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2)cc1 1633925303 KNDVZFWEACXKRM-QWGSZXSUSA-N 415.450 -0.674 50 10 HBGE Cn1nc(C(=O)NC2CC(NC(=O)OCc3ccccc3)C2)c(B(O)O)c1Cl 2255726994 ZCWRFMIGTUMELE-UHFFFAOYSA-N 406.635 -0.060 50 10 HBGE C[C@@H](C[S@](C)(=O)=NC(=O)c1nn(C)c(Cl)c1B(O)O)NC(=O)OC(C)(C)C 2281662941 DHQPXVPWUNOPCJ-OPQPVAGWSA-N 422.700 -0.096 50 10 HBGE COC1(CNS(=O)(=O)c2cccc(B(O)O)c2)CN(C(=O)OC(C)(C)C)C1 2282093072 XTAKSNFHMSBZMV-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1 2282360435 CKRWPNPYYVOHJH-LBPRGKRZSA-N 400.262 -0.337 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282425215 MVJAXEFSJCCIJX-OAHLLOKOSA-N 406.241 -0.941 50 10 HBGE COC1(CCNC(=O)c2cc(B(O)O)n(C)n2)CN(C(=O)OCc2ccccc2)C1 2282431311 QPCBTVDKJNFDHF-UHFFFAOYSA-N 416.243 -0.743 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](CNS(=O)(=O)c2sccc2B(O)O)CO1 2282702624 LIVSKMXDJCKOHU-GHMZBOCLSA-N 420.318 -0.364 50 10 HBGE O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCc3ccco3)cc2)CCN1 748265573 LUTXAQNMTQORBM-UHFFFAOYSA-N 420.447 -0.206 50 10 HBGE COc1ccc(CN2CCCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2=O)cc1 767329587 BAXDEUVARCCDFB-MRXNPFEDSA-N 406.439 -0.114 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 915064363 JMMDFFOCFRXGEK-INIZCTEOSA-N 411.480 -0.041 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)Cc2c[nH]c3ccccc23)[C@H]1c1cnn(C)c1 1628351451 BLRHOSZQRWVBNO-KZNAEPCWSA-N 410.434 -0.218 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@@H]1NC(=O)C(F)(F)F 2267206923 NAIMLKRZVZABAB-YUMQZZPRSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@@](C)(=O)=NC(=O)c2nscc2B(O)O)C1 2267349294 RNXVHVAHQYGATE-AREMUKBSSA-N 403.291 -0.072 50 10 HBGE CN([C@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2267613442 CAPNUMHIMXLSSI-AWEZNQCLSA-N 422.272 -0.869 50 10 HBGE C[C@@H]1[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282077484 WMUADXADWLFNLY-PWSUYJOCSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2ccc(B(O)O)cc2)CCOC1 2282078004 CGTLOUGWHJDRDF-INIZCTEOSA-N 400.262 -0.672 50 10 HBGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC(=O)c1ncncc1B(O)O 2282221671 AMTOUIMLRWNTSO-HHHXNRCGSA-N 400.266 -0.301 50 10 HBGE Cn1nc(C(=O)N(CCNC(=O)OC(C)(C)C)CC(F)F)c(B(O)O)c1Cl 2282262742 RFIPHAWWGYNOLQ-UHFFFAOYSA-N 410.614 -0.015 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1CC[C@@H]1NC(=O)OC(C)(C)C 2282361700 VJCZLHDVWIVAPC-RYUDHWBXSA-N 400.262 -0.291 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282363304 GDUAFCZWUZLODH-RYUDHWBXSA-N 420.680 -0.410 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@@H]2[C@H](CCN2Cc2ccccc2)C1 2282384362 LXMBPODAHCZFAC-GDBMZVCRSA-N 407.326 -0.141 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2ccccc2B(O)O)CCO1 2282713475 FRDYXRQSGAQWLQ-LBPRGKRZSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(F)cc1B(O)O 2359274130 CGTZAKWWGDEPHE-WFBYXXMGSA-N 400.237 -0.208 50 10 HBGE CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)[C@H]3COCCO3)cc2)CC1 757582232 MFYMZDQMSDOAHN-QGZVFWFLSA-N 419.482 -0.039 50 10 HBGE COC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n(C)n1 1135327924 WGLWHVUWLCDYJM-UHFFFAOYSA-N 409.424 -0.468 50 10 HBGE CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1301441895 QQMPBDULNQCNIZ-ZIAGYGMSSA-N 408.480 -0.271 50 10 HBGE CNC(=O)NC[C@@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CCO1 1473652590 ODHQCSWJAGGEJG-GFCCVEGCSA-N 413.862 -0.261 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(c3cnn(C)c3)=NO2)c1 1623993304 JMIFMLJCYGUNQK-OAHLLOKOSA-N 420.451 -0.375 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)N(C)C1 1775962700 UHQYIIRIOVIPLI-FZFGAMNESA-N 410.964 -0.001 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1 2267037044 LYBKIHRJCCQLNO-CQSZACIVSA-N 401.232 -0.727 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267617552 MQXMBFBCZKLOSE-JTQLQIEISA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2cscc2B(O)O)C1 2267622588 UGDTXOAGTWDQQZ-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282070984 LYHWRXFSPPNUDA-LLVKDONJSA-N 420.318 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1csc(B(O)O)c1 2282215054 PPTXBSUFPWAGSK-UHFFFAOYSA-N 402.278 -0.284 50 10 HBGE CCn1cc(C(=O)N=[S@@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)nc1B(O)O 2282229507 IRKQUOJQGSNTIV-MHZLTWQESA-N 400.266 -0.560 50 10 HBGE CCn1cc(B(O)O)cc1C(=O)NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1 2282284845 PBLOWJQHAMIVKZ-KRWDZBQOSA-N 415.255 -0.045 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)Cc1ccc(B(O)O)cc1 2282733218 SEZVOXFACUCFTK-SANMLTNESA-N 420.318 -0.181 50 10 HBGE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ccsc1B(O)O 2287322407 FZVLCXMQBUOIIW-UHFFFAOYSA-N 420.318 -0.829 50 10 HBGE Cc1ncc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[nH]1 765119335 VEFWAWXTDLRNMK-UHFFFAOYSA-N 406.468 -0.514 50 10 HBGE Cn1cc(C(N)=O)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 766640758 GBCVSFLMDGVWPX-UHFFFAOYSA-N 412.450 -0.657 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(F)cc1F 793448102 RLCHHFSPRLGISH-MRVPVSSYSA-N 415.378 -0.085 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)[C@H]1CCCN(S(N)(=O)=O)C1 1295144855 WUMIAIRASNIJQE-NSHDSACASA-N 402.498 -0.150 50 10 HBGE C[C@@]1(NNC(=O)NCc2cnc(N3CCOCC3)c(F)c2)CCS(=O)(=O)C1 1312457846 KFFUKGQJHKEXOJ-MRXNPFEDSA-N 401.464 -0.062 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)c1cc(B(O)O)ccc1F 1455560367 LRKBUSQZWJSKFD-UHFFFAOYSA-N 401.203 -0.990 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cn(C)ccc2=O)CC1 1472517913 PJZWFVFJSYLRIC-UHFFFAOYSA-N 406.468 -0.527 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCN(C)C3=O)cc2)CC1 1545921812 IIXWVZLFQMTNDV-MRXNPFEDSA-N 409.512 -0.066 50 10 HBGE C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1558458048 ALZDQZNXTTZYOK-KRWDZBQOSA-N 420.491 -0.388 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(F)(F)n1cc(-c2ccccc2)nn1 1638300423 PMBBYTZLIPDVFA-VIFPVBQESA-N 402.383 -0.421 50 10 HBGE O=C(NC1CN(S(=O)(=O)c2ccc(F)cc2B(O)O)C1)OCc1ccccc1 2255884389 XLQBWRSEMMOSSY-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE CN([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2267393458 YWKGHDQPCAIQSK-SNVBAGLBSA-N 405.307 -0.406 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)n1 2267625959 YSSYSVTZODUUGS-QGZVFWFLSA-N 422.272 -0.821 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@H]1CCCN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282084787 XWYOYBMEVSHVSI-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC[C@@H]1[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282091279 FMPMBXXLDFEZQH-NWDGAFQWSA-N 402.282 -0.834 50 10 HBGE Cc1c(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282441413 FMMLQKMNTMSGRH-GFVXYOJSSA-N 400.266 -0.686 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2 2282728164 CVJKOKIKYYPVBH-IUCAKERBSA-N 412.220 -0.337 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(NS(=O)(=O)c3ccc(B(O)O)cc3F)[C@H]2C1 2282739245 GLZFGDVAGROWDO-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(C=C(C#N)C(=O)N(CCO)CCO)CC2)cc1 2324967062 SYNBWRNTYCFGII-UHFFFAOYSA-N 422.507 -0.478 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(F)cc1B(O)O 2360549938 VSWCSMQICXUELO-GFCCVEGCSA-N 404.225 -0.618 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1nc(B(O)O)ccc1Cl 2360584184 NBEQJHZMFNKVAC-VIFPVBQESA-N 421.668 -0.709 50 10 HBGE CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 730310655 NVQNAFWFNHUSNX-SMDDNHRTSA-N 409.420 -0.562 50 10 HBGE COc1ccc(/C=C/C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 765729320 BTHLBZZPSUKDMH-RMKNXTFCSA-N 412.406 -0.697 50 10 HBGE O=C(NNC(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1)[C@@H]1COCCO1 776893121 SPWBJZKRUNJCFG-QMMMGPOBSA-N 410.378 -0.165 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCCc2ccsc2)n(C)c1=O 783059582 ADKIDXAPJWEUNP-UHFFFAOYSA-N 404.452 -0.335 50 10 HBGE Cn1cc(C[C@@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1 786689677 WFVYVALBVFJKLX-MRXNPFEDSA-N 421.479 -0.431 50 10 HBGE O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccccn3)cc2)CCN1 1326514719 RJBDTTRHTCBOQX-UHFFFAOYSA-N 410.434 -0.273 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1437641096 SDNOQNRXODZZNL-NTZNESFSSA-N 408.484 -0.127 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)C2)s1 1461838041 PAGHNNZDWDSKLE-NEPJUHHUSA-N 414.509 -0.117 50 10 HBGE O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1597425953 JTOUGAMCMPREKM-SNVBAGLBSA-N 403.486 -0.960 50 10 HBGE Cc1nn(C)c(C(=O)N[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267028132 HNOALMCOAPINKC-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1nscc1B(O)O 2281605281 OVTAEAMYZIVGFU-UHFFFAOYSA-N 403.266 -0.889 50 10 HBGE CN(C)[S@](=O)(=NC(=O)[C@H]1C[C@@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2281868767 MOOIJANQYHKNCX-RPTJNQDTSA-N 404.298 -0.212 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282074207 KBWSGKOQKJSNAU-RYDUCSDGSA-N 418.302 -0.613 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1cc(B(O)O)sc1C 2339877901 FTGIHBBCOPMCEV-JTQLQIEISA-N 408.307 -0.446 50 10 HBGE Cn1cc(C[C@@H](O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1 786682783 KWJQFKFWMODGJK-GOSISDBHSA-N 400.483 -0.317 50 10 HBGE O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)[C@@H]1CCc2nncn2C1 816874662 HXCBIKCAYOSOJV-CYBMUJFWSA-N 421.417 -0.375 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H](c2cnn(C)c2)C1 849486428 KNUSHPAQDUKPCF-DLBZAZTESA-N 409.454 -0.108 50 10 HBGE CC(C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1 1191636265 PDUUMXSBXHZDJM-UHFFFAOYSA-N 408.484 -0.327 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCC(=O)N(C)C1=O 1312901935 NXFKETJEHYTNGB-SNVBAGLBSA-N 410.456 -0.620 50 10 HBGE COC(=O)[C@H](Br)CN1C[C@H](NC(=O)C(F)(F)F)C[C@@H](C(N)=O)C1 1999244671 WNFOHTPIKMDHFD-BWZBUEFSSA-N 404.183 -0.223 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N1CC(NC(=O)OCc2ccccc2)C1 2255752342 IJWOPENVRGKCQZ-UHFFFAOYSA-N 404.253 -0.026 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](CO)NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267391704 FTVMCAUNQPYFQL-SECBINFHSA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2267621804 KEICURQRGWCYKA-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@]1(C)CCCN1C(=O)OC(C)(C)C 2282065932 PFYTUUUXMFAGTP-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282080673 MCAZFXHDDFHEQC-QDXKXIGTSA-N 418.302 -0.180 50 10 HBGE C[C@H]1[C@@H](C)N(S(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282380933 PRFZTWIPCPMOHI-WDEREUQCSA-N 402.282 -0.882 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)c1B(O)O 2282389183 AXMVEPRDUARYQM-LURBXMNDSA-N 402.282 -0.440 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2282707619 AYKRVKQISAHYLM-MNOVXSKESA-N 402.282 -0.930 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1CNS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282723576 GJPNVTAACVIMQY-SNVBAGLBSA-N 406.216 -0.068 50 10 HBGE C[C@@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cscc2B(O)O)C1 2282725025 VBIOGPIVBWSRHE-BDAKNGLRSA-N 414.236 -0.104 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)n1 2282734551 MYNSMMBCSLOIGG-LLVKDONJSA-N 402.282 -0.834 50 10 HBGE C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816877837 DJXWGBIIOOLUOI-SEDUGSJDSA-N 403.443 -0.511 50 10 HBGE CN1C[C@@H](C(=O)NNC(=O)COc2ccccc2O)N(C(=O)OC(C)(C)C)CC1=O 1136693690 SGVGAHGXZZAGOY-LBPRGKRZSA-N 422.438 -0.004 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCCS3(=O)=O)CC2)cc1 1294590600 MFACOHNINLXSNS-QGZVFWFLSA-N 408.524 -0.163 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n(C)c1=O 1294603185 NWAPFOLVWAWOGN-UHFFFAOYSA-N 420.901 -0.044 50 10 HBGE O=C(NNC(=O)[C@@]1(O)CCCN(Cc2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1 1442179449 CEYOGDQZKWYGKW-MAUKXSAKSA-N 410.496 -0.469 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccnnc3)CC2)cn1C 1451681811 GPVFPZDOHQDZPQ-UHFFFAOYSA-N 407.456 -0.620 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1627540164 SUQNNUJIFALCGR-UHFFFAOYSA-N 407.456 -0.625 50 10 HBGE CC(C)(C)OC(=O)CN1CCC[C@@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1=O 1628913127 XAJPHBPORIZYOQ-RYUDHWBXSA-N 417.484 -0.851 50 10 HBGE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NNC(=O)c1cnsn1 1687006974 SEHWIGMQSJFVBJ-UHFFFAOYSA-N 410.481 -0.083 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2sccc2B(O)O)C1 2267201619 QUZBZYAIIHRWQQ-VWLOTQADSA-N 424.331 -0.166 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](O)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2267618075 UHKWPAGNVDGGFW-VIFPVBQESA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)s1)C2 2272653562 SBJYNKYBEBQZEJ-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)C1CCC1 2282335246 NBXQUYHCHRZEEQ-LLVKDONJSA-N 419.334 -0.064 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2282725376 AHTCGUDZGQUKBK-LLVKDONJSA-N 422.334 -0.056 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)c2cc(F)c(B(O)O)cc2Cl)C1 2282972952 WEHCYKQBBTXDTG-STQMWFEESA-N 402.615 -0.131 50 10 HBGE CO[C@@H]1[C@H](OC)CN(C(=O)OC(C)(C)C)[C@H]1C(=O)Nc1ncc(B(O)O)s1 2284141522 DOZCNBJDZYEEPN-FBIMIBRVSA-N 401.250 -0.589 50 10 HBGE 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Cc1sc(B(O)O)c(C(=O)NC(CO)(CO)CNC(=O)OC(C)(C)C)c1C 2281875620 SLRPBRXNKNINIR-UHFFFAOYSA-N 402.278 -0.977 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1cc(B(O)O)ccc1Cl 2360571250 FJHBOJZLAPXQNA-LBPRGKRZSA-N 420.680 -0.104 50 10 HBGE COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@H]3COCCO3)C2=O)cc1 744645034 OECFLQQINYCDBU-ACJLOTCBSA-N 406.395 -0.975 50 10 HBGE O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)[C@@H]1COCCO1 745435218 FHNVAUADAUQPMC-LBPRGKRZSA-N 406.848 -0.636 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)[C@H]1COCCO1 755433300 CTVVYLBBZVYLCL-VXGBXAGGSA-N 400.432 -0.935 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@]3(C)C(=O)NC(=O)[C@@]3(C)C2)cc1OC 1307994808 XDXOWAVPSXWYGS-RTBURBONSA-N 404.423 -0.551 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C2CN(S(C)(=O)=O)C2)C1 1449368594 SFBDMJYIPVIIJH-LLVKDONJSA-N 404.489 -0.328 50 10 HBGE O=C(NNC(=O)C1CN([C@H]2CCOC2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 1463537233 RQOCIFYUJMFNSW-INIZCTEOSA-N 422.507 -0.047 50 10 HBGE COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)[C@H]3CCC(=O)N3)n2)cc1 1543093732 LGYDLTVIPHJYNW-CQSZACIVSA-N 402.411 -0.359 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCS2(=O)=O)CC1 1558940527 YXVNENBTOFTMNE-ZDUSSCGKSA-N 417.513 -0.962 50 10 HBGE CS(=O)(=O)N1CC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1 1623945606 MBBQZANNDBVALN-UHFFFAOYSA-N 409.512 -0.763 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)C2CCOCC2)cc1 1682517193 TYZVBPTUAWHHGR-UHFFFAOYSA-N 415.468 -0.002 50 10 HBGE C[C@H](NS(=O)(=O)c1cc(B(O)O)cs1)C1(O)CN(C(=O)OC(C)(C)C)C1 2267200169 CSHOGKUQWOJIAE-VIFPVBQESA-N 406.291 -0.924 50 10 HBGE COC1(CCNC(=O)c2ncsc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2267315718 XPWPTPVJPYVUCU-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267616571 VTQZHIKSAIUBKQ-ZJUUUORDSA-N 406.291 -0.754 50 10 HBGE CN(CCOCCNC(=O)c1nn(C)c(Cl)c1B(O)O)C(=O)OC(C)(C)C 2281650748 FYUXFETUNHSTOS-UHFFFAOYSA-N 404.660 -0.633 50 10 HBGE C[C@@H]1CC[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 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417.466 -0.619 50 10 HBGE O=C1OC[C@@]23CC[C@@H](O2)[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)[C@@H]13 1597886107 NMSGYQUVNWRXJD-NJBDSQKTSA-N 423.285 -0.467 50 10 HBGE C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(=O)n(C)c1)C2=O 1616316988 WZVLZECOIIWRAB-VXGBXAGGSA-N 403.439 -0.107 50 10 HBGE CS(C)(=O)=NS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1 1617926834 XHURJNNSUZKNIV-UHFFFAOYSA-N 423.542 -0.901 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@]23CCCC[C@@H]2C3(F)F)n(C)c1=O 1629793449 RTCMQAPYVKEEIQ-DYZYQPBXSA-N 424.408 -0.203 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)[C@@H](c2cnn(C)c2)C1 1635374936 KMMCDPHUOYRWOC-KSZLIROESA-N 404.515 -0.144 50 10 HBGE COc1cc(C(=O)NNC(=O)N[C@H]2CCN(S(C)(=O)=O)C2)cc(OC)c1OC 1682415773 FVVLAKBNUVMIHU-NSHDSACASA-N 416.456 -0.310 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267203731 ULFLCFXRQCZXBD-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)N[C@@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2267336317 ZJWJVWKYWBJWMJ-CVEARBPZSA-N 401.228 -0.481 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)CCN(C)C(=O)OC(C)(C)C 2282362944 KJDOHEUMBOEZPS-UHFFFAOYSA-N 402.278 -0.138 50 10 HBGE C=C(CS(=O)(=O)N1CCC(OC2CN(C(=O)OC(C)(C)C)C2)CC1)B(O)O 2282414143 ORIQWMAYGUSIRU-UHFFFAOYSA-N 404.294 -0.015 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ccsc1B(O)O 2282857854 NSHLHOQEGRXNNT-WPRPVWTQSA-N 414.236 -0.211 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(Cl)c1 751267442 IZXVGPOSFSBFMW-SECBINFHSA-N 410.857 -0.129 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3cn(C)nn3)C2)cc1 808375573 ZWIXUSDOVYODAM-CYBMUJFWSA-N 406.468 -0.015 50 10 HBGE CCC(=O)NNC(=O)CSc1nnc(NN=Cc2ccc(C(=O)OC)cc2)n1N 1084422506 RTSOHIPXJUTARP-UHFFFAOYSA-N 420.455 -0.126 50 10 HBGE CS(=O)(=O)SCCNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 1152953711 UXZTWIQZZBTEDY-UHFFFAOYSA-N 421.522 -0.770 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cncc2nc(C(F)(F)F)n(C)c12 1472505446 VPCIUBYGGGAFAU-LURJTMIESA-N 408.362 -0.314 50 10 HBGE CCN1CCC(N2CCC(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)CC1 1583280523 BNGJHICHKRVUMR-OAHLLOKOSA-N 415.560 -0.300 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)[C@@H](c2cnn(C)c2)C1 1635374938 KMMCDPHUOYRWOC-RCCFBDPRSA-N 404.515 -0.144 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)CC1=O 1652302522 ZHHPTBOOEKQKLP-JQHSSLGASA-N 421.542 -0.280 50 10 HBGE CN([C@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1c(B(O)O)cnn1C 2267199316 KQXXUYHRPYJGBI-GJZGRUSLSA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](NS(=O)(=O)c2sccc2B(O)O)C1 2267201459 OVEZJPCWWKJOSO-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2F)CCO1 2282356230 ROOPEKCMOBSFOR-LLVKDONJSA-N 404.225 -0.275 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 2282507853 NBGBVVZMHAUZNR-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC(c2nc(=NC(=O)c3nscc3B(O)O)s[nH]2)C1 2296443451 BRARPDUYMUMGAO-UHFFFAOYSA-N 411.274 -0.317 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(Cl)c(B(O)O)c1 2360551494 PLBWZUXVRCCLHB-LBPRGKRZSA-N 420.680 -0.104 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1(S(C)(=O)=O)CC1 1117467953 MLLNUURONQQBNQ-JTQLQIEISA-N 407.452 -0.157 50 10 HBGE CCOCc1nc(C)cc(NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)n1 1154534426 TWTPYEIJMBGLGS-QWHCGFSZSA-N 411.484 -0.200 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1CN(C)CCN1C 1256464728 JRCRCQGCPFHXGS-JSGCOSHPSA-N 411.532 -0.442 50 10 HBGE CC(C)[C@@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)N(C)Cc1nnc2n1CCC2 1297322984 PJGQHYMMCTWUHM-QGZVFWFLSA-N 417.250 -0.544 50 10 HBGE O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)[C@H]1CCN1C1CCOCC1 1456038111 NSXFJMVIYSZXAQ-CQSZACIVSA-N 421.479 -0.874 50 10 HBGE O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1471976507 MFGQBXILXORDSY-INIZCTEOSA-N 410.496 -0.244 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1479128618 IFNXGGQBIRAQAP-UHFFFAOYSA-N 407.452 -0.520 50 10 HBGE O=C(N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccc(B(O)O)c1 1543092345 VCXCIMFWDXGDLU-KRWDZBQOSA-N 411.271 -0.608 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@@H]2COCCO2)C[C@H](O)CN1C(=O)OCc1ccccc1 1545111646 YWZPPIPIUYPEAR-YZVOILCLSA-N 407.423 -0.289 50 10 HBGE CN1C[C@@H](O)C[C@@]1(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1587968606 KIRIOUXQFJFYCZ-JXFKEZNVSA-N 403.483 -0.953 50 10 HBGE C#Cc1cccc(NC(=S)NNC(=O)C(=O)c2cc(S(N)(=O)=O)cn2C)c1 1594437099 NZVTWDDTRXNRGI-UHFFFAOYSA-N 405.461 -0.146 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)c1 1635807025 RNEMFVUQFAXRJW-LLVKDONJSA-N 403.482 -0.141 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(B(O)O)ccc1F 1636580183 ZVPKBPVLSCDIGI-DLBZAZTESA-N 411.242 -0.166 50 10 HBGE COC(=O)[C@@]1(N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)CCOC1 1643888090 ABQGVRNNFBHMRA-HXUWFJFHSA-N 404.467 -0.294 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282067288 YBYWUEHWAKKRKN-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H]2COC[C@H]12 2282068574 FKXLWVWFUIRBMV-UTUOFQBUSA-N 418.302 -0.660 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282423656 RJJSEPPZSBGDBD-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282423705 SBNNLCXRARAIAR-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2282699711 LTDSEGNPZWJSOO-VHSKPIJISA-N 414.236 -0.106 50 10 HBGE C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)c1c(B(O)O)cnn1C 2282704601 MFEQXKZWOBWUMR-JTQLQIEISA-N 402.282 -0.976 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282722718 KUCIDMZEHUZXNN-UHFFFAOYSA-N 404.225 -0.323 50 10 HBGE O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)c1cnn[nH]1 729455987 KZHXUBTUHKCCEO-UHFFFAOYSA-N 414.394 -0.055 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1178420135 DPJRASYFXYCQCL-TUAOUCFPSA-N 413.418 -0.390 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H]3CC(=O)NC3=O)CC2)cc1 1294590666 OMCKQISIENAGOM-MRXNPFEDSA-N 401.467 -0.687 50 10 HBGE O=C(NNC(=O)[C@H](O)[C@@](O)(c1ccccc1)C(F)(F)F)[C@H]1CCS(=O)(=O)C1 1440705201 PJMUFNMWAVQTQL-CHIMOYNISA-N 410.370 -0.621 50 10 HBGE CO[C@]1(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCS(=O)(=O)C1 1523602894 ALCDGWLZVRTSQF-LJQANCHMSA-N 424.523 -0.450 50 10 HBGE CN1CCn2nc(C(=O)NNc3ncc(Br)cn3)cc2S1(=O)=O 1570821653 AUOXZOKZXWFFOW-UHFFFAOYSA-N 402.234 -0.173 50 10 HBGE C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)C1 1633319159 AWVVHINXUJBSRO-ZBFHGGJFSA-N 405.279 -0.042 50 10 HBGE Cc1nc(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)c(B(O)O)s1 2266898435 YKHPMUUVLXTPTK-UHFFFAOYSA-N 403.291 -0.010 50 10 HBGE CON(C(=O)c1nn(C)c(Cl)c1B(O)O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282299037 QLAYGDUQBCZVKX-VIFPVBQESA-N 402.644 -0.234 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCNC(=O)[C@H]2C[C@H](B(O)O)C2)C1 2282423594 QSPMOXYYNRYOOL-AVGNSLFASA-N 404.294 -0.220 50 10 HBGE Cc1c(C(=O)NC2CC3(C2)C[C@@H]3NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282437313 GQYFNVNUQOVBJX-CHWWFWEZSA-N 412.255 -0.014 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(B(O)O)cc2Cl)COC1 2282726760 DBOSLICNVYZXJQ-UHFFFAOYSA-N 420.680 -0.408 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282739837 QLNKWGBUCDAMBS-NSHDSACASA-N 402.282 -0.880 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1scc(C)c1B(O)O)NC(=O)OC(C)(C)C 2283989170 IDKSWCDKEYZKSC-SNVBAGLBSA-N 400.262 -0.191 50 10 HBGE O=C(O)C[C@@H](COCc1ccccc1)NS(=O)(=O)Cc1ccsc1B(O)O 2284412035 RJCYXDDJGFPLDX-AWEZNQCLSA-N 413.282 -0.093 50 10 HBGE Cc1nc(B(O)O)c(C(=O)NC2CCN(C(=O)OCc3ccccc3)CC2)n1C 2337404412 CDWADYFTQHRNFD-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c(OC)c1 729950592 XTKASFHGAUSFJG-UHFFFAOYSA-N 413.390 -0.276 50 10 HBGE O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)C(F)(F)Oc1ccccc1 742702566 UKJFRYXLFBPSMG-HBJVGIJOSA-N 409.345 -0.032 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)N2CCOCC2)C1 745991695 DOOUPIFVBAILIC-CYBMUJFWSA-N 415.472 -0.235 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 795168250 LASSJSXDSUYYII-MDZDMXLPSA-N 407.452 -0.509 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)CC2CC2)cc1 1472505526 YMDPZTDQLBTFAV-JTQLQIEISA-N 403.482 -0.431 50 10 HBGE CO[C@@H](C)c1noc(CN2CCCN(C(=O)c3cc(B(O)O)ccc3F)CC2)n1 1545199272 TWULGQMQNVIUJE-LBPRGKRZSA-N 406.223 -0.056 50 10 HBGE CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2COCCO2)c1 1566168618 LWNOHWLSCPOGRN-LLVKDONJSA-N 422.257 -0.466 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)C1(C(=O)NNC(=O)CS(C)(=O)=O)CCOCC1 1634361123 XRQHTBYJNDZULB-LLVKDONJSA-N 407.489 -0.112 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1ccc(F)c(F)c1B(O)O 2256220658 WPLCKRFPJJKIGE-UHFFFAOYSA-N 410.163 -0.318 50 10 HBGE Cn1cc(S(=O)(=O)NC(CO)(CO)CNC(=O)OC(C)(C)C)c(CCl)n1 2265718797 MJEIAWBKXQTHGS-UHFFFAOYSA-N 412.896 -0.315 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2267210055 DWRYNQXLOIIRBU-JGVFFNPUSA-N 400.209 -0.352 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1cc(B(O)O)c(C)s1)NC(=O)OC(C)(C)C 2281861761 XVFBKLFRBUAVBW-LLVKDONJSA-N 400.262 -0.077 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282337826 NPXXZXXBIKCZSM-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)C1 2282370067 PGJZFMFVIDBMAP-CHWSQXEVSA-N 420.680 -0.722 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1ccc(B(O)O)cc1O)OCc1ccccc1 2282874975 IWJTWMKWQSZWDK-IAGOWNOFSA-N 414.223 -0.114 50 10 HBGE CN(C)[S@@](=O)(=NC(=O)[C@@H]1C[C@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2359275993 MOOIJANQYHKNCX-GJAUWKINSA-N 404.298 -0.212 50 10 HBGE COc1ccc(C(=O)NNC(=O)N2CCN(c3nccn(C)c3=O)CC2)c(OC)c1 745999453 XYTRBLKSEDIIAV-UHFFFAOYSA-N 416.438 -0.026 50 10 HBGE C[C@H]1[C@H](c2ccccc2)[C@@H]1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 797743471 QVHPJMZUMYUBIJ-NILFDRSVSA-N 410.434 -0.369 50 10 HBGE C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816881898 RWAMQKPGMFOODA-JHJVBQTASA-N 417.470 -0.265 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1=O 1124933528 SLVBJWLJOBMRIJ-CYBMUJFWSA-N 411.436 -0.737 50 10 HBGE C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H](C)S(C)(=O)=O 1137299193 MSZFONRYHQOYKV-LSDHHAIUSA-N 424.523 -0.339 50 10 HBGE CCc1ccc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)cc1S(=O)(=O)N1CCOCC1 1438035015 JCUHMPUNQVGSRF-CQSZACIVSA-N 424.479 -0.691 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC(Cc3nn[nH]n3)CC2)cc1OC 1560114522 QRZIFYJTBGDSHK-UHFFFAOYSA-N 403.443 -0.067 50 10 HBGE CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)cc1 1568042611 RTECTZHKRAGFTG-KOFHJDLBSA-N 409.420 -0.037 50 10 HBGE O=C(NCc1ccc(CN2CCS(=O)(=O)CC2)cc1)c1cc(B(O)O)ccc1F 1643301001 ZRLCXEPUYUHBAA-UHFFFAOYSA-N 420.271 -0.334 50 10 HBGE C[P@]1(=O)C[C@H](Br)[C@H](NS(=O)(=O)N2CCS(=O)(=O)CC2)C1 2177839454 OTFVTRCBUODGCL-ROXHKKKXSA-N 409.264 -0.310 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2Cl)C[C@H]1NC(=O)C(F)(F)F 2195883747 QRBFEBPCSKSBRM-LMLFDSFASA-N 419.853 -0.104 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282335353 OJZBMHBTQFAQLJ-NSHDSACASA-N 402.282 -0.914 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C 2282363006 LBGMBSQAFKKWDG-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NS(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282369738 KUIQDSVZHDFHII-RYUDHWBXSA-N 420.680 -0.722 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCC1(CNC(=O)OC(C)(C)C)COC1 2282429190 OXEUTKUWWXPTEI-UHFFFAOYSA-N 420.318 -0.444 50 10 HBGE CS(=O)(=O)N1CCN(C=C(C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1 2324883017 XLLZXOWKBUKKAI-UHFFFAOYSA-N 413.481 -0.743 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1c(C)sc(C)c1B(O)O 2365422309 SSASFVGFRZCQLA-LLVKDONJSA-N 422.334 -0.137 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1 1149617080 GBDKGVPDJSHQGT-UHFFFAOYSA-N 403.360 -0.246 50 10 HBGE CC(C)(C)OC(=O)CN1CCCC[C@H](NC(=O)NNC(=O)[C@H]2COCCO2)C1=O 1565246734 IGMJUTKPGURSMY-QWHCGFSZSA-N 414.459 -0.545 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NN3CCCN=C3N2)c1 1628159733 LGUXIURHHMAERD-UHFFFAOYSA-N 421.483 -0.544 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNS(=O)(=O)CCOCCCl 2218609704 ONFOFSMHTXABTL-SDDRHHMPSA-N 402.897 -0.498 50 10 HBGE COC(=O)[C@@H](CNC(=O)OC(C)(C)C)Oc1ncc(Br)cc1B(O)O 2223628405 TYLCVBBMVPPZEV-SNVBAGLBSA-N 419.037 -0.031 50 10 HBGE CC(C)(C)OC(=O)NCCONS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2247881763 DQHXFTDDXGBRJJ-UHFFFAOYSA-N 400.671 -0.184 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@H]1NC(=O)C(F)(F)F 2267200152 UEUYXEVZRXSYLA-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1cccc(B(O)O)c1 2267212909 VXITXABBUSBRLL-VWLOTQADSA-N 406.291 -0.322 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2267385526 LNKANRRYVIIITL-SNVBAGLBSA-N 408.669 -0.816 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@@](=O)(=NC(=O)c2csnc2B(O)O)C1 2267435715 NHNPQDKZERHUCY-BGGANLFTSA-N 403.291 -0.024 50 10 HBGE Cn1nc(C(=O)NCC2(F)CC(NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281664449 ZNOWQZRUNXZHGF-UHFFFAOYSA-N 404.635 -0.122 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282071535 SNCXBKLEIFHNFS-NSHDSACASA-N 419.334 -0.743 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282073844 IAQFMQPXCHVOTK-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)c(B(O)O)n1 2282391903 WZNOEZBBRZUVRB-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(O)CCCN(S(=O)(=O)c2sccc2B(O)O)C1 2282706799 QWQOUKWHLCAUKF-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE O=C(O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2284396334 UXYUGGCVYLMBKO-OAHLLOKOSA-N 413.644 -0.032 50 10 HBGE N#CC=C(COC(=O)C=Cc1ccc(O)cc1)CO[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O 2333278716 JDEJUHBDYJVLND-MTEHYEEQSA-N 421.402 -0.785 50 10 HBGE COC(=O)C=c1sc2n(c1=O)C(N)=C(C#N)[C@H](c1cccs1)C=2C(=O)N(C)C 1080323719 QBFBFXWCRMJTGZ-CYBMUJFWSA-N 416.484 -0.388 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN(CC(=O)OC(C)(C)C)C2=O)ccc1=O 1134637699 XPQMOUQQWXNRND-ZDUSSCGKSA-N 406.439 -0.273 50 10 HBGE CN1CCC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1294587813 MUUBLNQRWDDCIL-INIZCTEOSA-N 401.467 -0.540 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NNC(=O)[C@H]1CCC(=O)N1 1530231264 XYCZICDYLKHXJC-GFCCVEGCSA-N 414.509 -0.109 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)N1CCOCC1 1544297795 PMRKZIOJFMUYKO-UHFFFAOYSA-N 421.273 -0.200 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)c3cnn(C)c3)CC2)cc1 1629797512 TWBLHLUUYGEFGZ-LJQANCHMSA-N 400.483 -0.273 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1637742886 GPGPWQIEDAUIJR-SFHVURJKSA-N 402.411 -0.785 50 10 HBGE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNS(=O)(=O)c1sccc1B(O)O 2267620997 QFWPMWGGWDCMLH-UHFFFAOYSA-N 402.263 -0.602 50 10 HBGE Cc1c(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)nn(C)c1B(O)O 2281609514 SUXLLPFLCPMUMB-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2ccc(B(O)O)o2)CC1 2281613630 AHCDWRUZSFBBNZ-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE COC1(CCNC(=O)c2ccc(B(O)O)cn2)CN(C(=O)OCc2ccccc2)C1 2282220011 FHZOYRLBJOGNIZ-UHFFFAOYSA-N 413.239 -0.081 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)CN(C)CCNC(=O)OC(C)(C)C 2284046410 AMLYYJJQZJYHLD-NSHDSACASA-N 400.310 -0.201 50 10 HBGE CCn1nc2c(cc1=O)CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC2 742428310 FYLARIPVENZOLE-UHFFFAOYSA-N 400.395 -0.009 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)nn1 1131111310 DZEBBMJCVAVYFX-CQSZACIVSA-N 406.468 -0.182 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)CSc2ccccc2O)[C@H]1c1cnn(C)c1 1566452545 IZTAKPVXCNLEKC-BZUAXINKSA-N 419.463 -0.444 50 10 HBGE CCCCS(=O)(=O)NCC(=O)N1CCN(S(=O)(=O)CBr)CC1 1597885120 CVUUZNMFSUOIQA-UHFFFAOYSA-N 420.351 -0.468 50 10 HBGE O=C(COCC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)NCc1cccnc1 1638871352 VYFBVFZOZBAQDE-MRXNPFEDSA-N 405.455 -0.885 50 10 HBGE CC(C)(C)OC(=O)N1CCSC[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282084118 NGVMVNIDKXJITK-CYBMUJFWSA-N 416.330 -0.003 50 10 HBGE Cc1c(C(=O)NC2CC3(C2)C[C@@H]3NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2282290017 LPYXLKBBOIHPFS-CHWWFWEZSA-N 412.255 -0.014 50 10 HBGE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cscc1B(O)O 2282421801 SSFYLPMIMIXFEP-NSHDSACASA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1CN2S(=O)(=O)Cc1ncsc1B(O)O 2282423421 ODWHMXSIGZPKJI-WDEREUQCSA-N 417.318 -0.264 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c(B(O)O)n1C 2282858341 VOLIHHLBDAEYOI-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 745981417 UCHRCPZDJCTKFD-CYBMUJFWSA-N 417.415 -0.977 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCS3(=O)=O)cc2)CC1 1151459249 GGIDEEMILHNPFQ-HNNXBMFYSA-N 416.525 -0.357 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CCC(=O)N1 1301441120 MMNPJIJSUGOIJJ-JTQLQIEISA-N 408.358 -0.590 50 10 HBGE NS(=O)(=O)CCOCCNC(=O)NNC(=O)c1ccc(Br)s1 1312834724 XXJZAOMBNGGIEW-UHFFFAOYSA-N 415.291 -0.240 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 1456016694 GZNSMQDAZUXLCH-VOJFVSQTSA-N 409.443 -0.136 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@H]1C(=O)NNC(=O)c1cn(C)nn1 1470083337 IXZKLHWBOGKPLI-YKDSUIRESA-N 414.344 -0.438 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(F)n1 1540363183 LCTKVNJIVCWIDQ-SMDDNHRTSA-N 404.354 -0.701 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 1587410055 KAVLBTFWQBAWKD-UHFFFAOYSA-N 411.484 -0.426 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@]2(C)CCc3ccccc32)n(C)c1=O 1629793537 VLHIXCDTNLAXLP-HXUWFJFHSA-N 410.434 -0.515 50 10 HBGE CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1652302222 VXLACXPESFEHSC-KBPBESRZSA-N 422.573 -0.552 50 10 HBGE C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1683460477 YUQOWCWBKOQHPX-XIKOKIGWSA-N 410.402 -0.449 50 10 HBGE CN([C@H]1CCN(C(=O)OCc2ccccc2)C1)S(=O)(=O)c1cncc(B(O)O)c1 2267612247 GQOCZFZMUVWEOL-INIZCTEOSA-N 419.268 -0.207 50 10 HBGE O=C(N[C@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1cc(B(O)O)cs1)C2)C(F)(F)F 2282071442 RKJHHHMAOPNIMW-FKTZTGRPSA-N 412.220 -0.352 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@@H](NC(=O)C(F)(F)F)C[C@@H]2C)sc1B(O)O 2282364429 OCBLEWOUPJZGMO-DTWKUNHWSA-N 414.236 -0.044 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282729275 ZUQZQIJZFNTHJQ-MFKMUULPSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(NS(=O)(=O)c3ccc(B(O)O)cc3F)[C@@H]2C1 2282739244 GLZFGDVAGROWDO-GHMZBOCLSA-N 400.237 -0.351 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)c1cccc(B(O)O)c1 2369652143 JCMXHCJLPRXMPX-ZIAGYGMSSA-N 402.253 -0.056 50 10 HBGE O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(CCN2CCOCC2)C1 734686033 JQGBMRLFNJQOFS-OAHLLOKOSA-N 406.443 -0.055 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)ccc1F 1178420754 QBXDRDJVWIBLLS-ZDUSSCGKSA-N 400.432 -0.513 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)N1CCOCC1 1627037065 JQQLTGZQFHNJDM-UHFFFAOYSA-N 421.273 -0.200 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)NNC(=O)[C@H]3C[C@H]4CC[C@H]3O4)C2)cc1 1635073902 HULFLVBFPPSBRK-VNQPRFMTSA-N 424.479 -0.034 50 10 HBGE O=C(CCCN1C(=O)c2ccccc2C1=O)NNC(=O)NCCN1CCOCC1 1857991368 MEEAQVCVMULYTL-UHFFFAOYSA-N 403.439 -0.275 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)c1ncc(Br)cc1B(O)O 2217199444 CUDBEJNXEHADDT-SNVBAGLBSA-N 404.070 -0.154 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2267626408 HTYPSXSLDVZXDB-ZJUUUORDSA-N 405.307 -0.502 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@@H](F)C1 2282091777 ISJKDBVIEANUMS-KBPBESRZSA-N 402.253 -0.008 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CCCN1C(=O)OC(C)(C)C 2282710566 PUAFTISVJWQNCD-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CC(c2nc(=NC(=O)c3cc(B(O)O)sn3)s[nH]2)C1 2296446403 SQZMAZSKGFRFSA-UHFFFAOYSA-N 411.274 -0.317 50 10 HBGE C[C@@H](c1cc(B(O)O)cs1)N(C)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2370330793 GFRCTSJTNRFSFS-JTQLQIEISA-N 402.278 -0.805 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)CN1CCCc2ccccc21 755041749 RXNSRGURGLIFQC-ZDUSSCGKSA-N 420.495 -0.313 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)C(=O)N1CCCC1 755209343 BBDZTQYDKWAETC-LBPRGKRZSA-N 411.459 -0.728 50 10 HBGE C[C@H](CO)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1299926573 VVKDODZQFFPRSJ-TZMCWYRMSA-N 407.514 -0.888 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2cn(C)nn2)c1 1538899719 TWCYMIHALQNNQN-UHFFFAOYSA-N 410.456 -0.071 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cn1 1558202421 VXAHXVVAJMSPPX-CYBMUJFWSA-N 422.511 -0.412 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NN(C)[C@@H](C)CO)ccc2F)CC1 1627565485 JRHVFPRQAHUWFO-LBPRGKRZSA-N 416.475 -0.364 50 10 HBGE CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(B(O)O)cc2)C1 1631480517 WAHPWDVOYNAKJF-OAHLLOKOSA-N 419.287 -0.141 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2C[C@]2(F)c2ccccc2)n(C)c1=O 1635500606 KSPJALSJILBXNH-BLVKFPJESA-N 414.397 -0.534 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2cscc2B(O)O)C1 2267619351 QNIFVSVIBXXUHU-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(OC)c(B(O)O)c1 2282733912 DFGTULIWLBSPCQ-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE CC(C)(C)OC(=O)NCCS(=O)(=O)CCOc1ccc(C=O)c(B(O)O)c1 2365117399 MFZRAUJFSOLBFG-UHFFFAOYSA-N 401.246 -0.503 50 10 HBGE O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCCC(=O)N1CCOCC1 792813490 NXWYSVJMBSXZKI-UHFFFAOYSA-N 407.427 -0.508 50 10 HBGE Cc1cc(CC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)n[nH]1 1163241633 IZYRSOQPHVFMFC-UHFFFAOYSA-N 405.480 -0.048 50 10 HBGE C[C@]1(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCS(=O)(=O)N1 1349692347 ONOKVVXDFSQRKK-LJQANCHMSA-N 423.539 -0.182 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc2cccnn12 1445565277 NPKKLZYRJPEJGY-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCN(C)CC1 1479599072 VNGWCVWGGGKKFJ-OAHLLOKOSA-N 404.519 -0.341 50 10 HBGE O=C(NNC(=O)C1CS(=O)(=O)C1)c1cccc(S(=O)(=O)N2CCCCC2)c1 1540328952 RSTIGPMOLDOILK-UHFFFAOYSA-N 415.493 -0.333 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1cn(C)c(C)n1 1624410028 RREOTXUJWFTNRK-UHFFFAOYSA-N 406.534 -0.729 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(Br)cc(S(N)(=O)=O)c1C 1635056913 HOSMHDIIXDIXNF-UHFFFAOYSA-N 424.273 -0.171 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1cc(B(O)O)sn1)OCc1ccccc1 2255576086 ZYXHJDXURWCLSO-TZMCWYRMSA-N 405.241 -0.363 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1NC(=O)C(F)(F)F 2267613484 CSTBVQDFVREESC-HTQZYQBOSA-N 400.209 -0.495 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 2267626793 NRHTYEFLGYPYKZ-UWVGGRQHSA-N 402.303 -0.120 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1C(=O)c1sccc1B(O)O 2281756472 HVQNMLUBEOQYNG-MRXNPFEDSA-N 400.262 -0.844 50 10 HBGE Cn1nc(C(=O)N=[S@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2281914469 VEICXFFBSRNWPT-GFVXYOJSSA-N 400.266 -0.653 50 10 HBGE COC[C@@]1(NS(=O)(=O)c2sccc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282068787 HVMAPFNLYLZDIR-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE Cc1cc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C#N)sc1B(O)O 2282362653 AHDXDBDIHBYEIU-LLVKDONJSA-N 415.302 -0.130 50 10 HBGE C=C(CS(=O)(=O)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1)B(O)O 2282367127 YBNOYMARPHTVCL-CQSZACIVSA-N 403.310 -0.489 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC2(CO)CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2282380092 DIXBJCZKIRITJE-UHFFFAOYSA-N 420.318 -0.695 50 10 HBGE O=C(N[C@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1ccc(B(O)O)s1)C2)C(F)(F)F 2282713769 JKVIFTXXTXERLD-HRDYMLBCSA-N 412.220 -0.352 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2CN(S(=O)(=O)c3ccc(B(O)O)c(F)c3)C[C@H]12 2282730929 JRKDCMMNOQQORA-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE COCCN1CCC[C@H]1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 732467168 SEEYCJXOVRVAEC-ZDUSSCGKSA-N 402.455 -0.012 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnn2cc(Br)cnc12 758046175 FXASHERQHDDOJD-LURJTMIESA-N 405.234 -0.810 50 10 HBGE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 805836285 IBMNMSUPVBNXJO-DOMZBBRYSA-N 412.468 -0.029 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1 1136009246 KAAFLXIQXFVNFX-UHFFFAOYSA-N 416.243 -0.467 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1306514569 VUQHAFPCBPEQBV-WCQYABFASA-N 414.459 -0.698 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)cn1 1328652879 GVONWPSRDHEGBH-BFHYXJOUSA-N 411.484 -0.709 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCS(=O)(=O)CC1 1538401851 QIXYYZMRIKLPKV-UHFFFAOYSA-N 402.498 -0.126 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(F)cc2)C[C@@H](C)O1 1608487194 REWQPDXAZSZPFO-BETUJISGSA-N 416.475 -0.249 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)NCc1cn(CC(F)(F)F)c(=O)nc1O 1676170894 AAWUCXHRVWAEEP-UHFFFAOYSA-N 400.317 -0.021 50 10 HBGE C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCc1nnc2c(=O)n(C)ccn12 1685241035 UTJSRHHORXOXRJ-LLVKDONJSA-N 417.401 -0.093 50 10 HBGE CCn1cc(C(=O)N=S2(=O)CCN(C(=O)OC(C)(C)C)CC2)nc1B(O)O 2281630102 ADSPKORWXKPGCE-UHFFFAOYSA-N 400.266 -0.558 50 10 HBGE CC(C)(C)OC(=O)NCC[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282075270 RCNORLKUJCTGHV-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1cc(B(O)O)nn1C 2282709629 YQBUSOUVKQYNTI-NSHDSACASA-N 404.298 -0.634 50 10 HBGE Cc1cc(S(=O)(=O)NCc2c[nH][nH]c2=NC(=O)OC(C)(C)C)sc1B(O)O 2282734233 IWMRDSROMSIHJI-UHFFFAOYSA-N 416.290 -0.293 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)[C@@H]1COCCO1 744644192 TUXPJMPWCGTDJA-LBPRGKRZSA-N 403.482 -0.362 50 10 HBGE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1=O 750661648 GJEWTDFZBWAEHT-UXIGCNINSA-N 423.495 -0.110 50 10 HBGE Cc1ncsc1/C=C/C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 776982052 BPDKHSVSHSQTTM-SNAWJCMRSA-N 403.424 -0.941 50 10 HBGE Cn1cc([C@@H]2[C@@H](CNC(=O)NNC(=O)[C@H]3COCCO3)CC(=O)N2C(C)(C)C)cn1 1253006752 YSTKPCMVOCLSQX-XPKDYRNWSA-N 422.486 -0.146 50 10 HBGE CN(CC(=O)NNC(=O)[C@H]1CCN1C(=O)OC(C)(C)C)[C@H]1CCS(=O)(=O)C1 1596825836 XNOXYUIWSAFINJ-NWDGAFQWSA-N 404.489 -0.738 50 10 HBGE COC(=O)C[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1cccc(Cl)c1 1647986877 LXAFQLDCWZSQDR-ZDUSSCGKSA-N 417.871 -0.237 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3cscc3B(O)O)C[C@@H]2C1 2267386932 BDBVFBQQGDAQGO-QWRGUYRKSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@](F)(CNC(=O)c2csnc2B(O)O)C1 2281897247 SRGDXMOJOSQAQO-OAHLLOKOSA-N 403.241 -0.472 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282069283 OAPVFAJAKNBLAC-VXGBXAGGSA-N 420.318 -0.269 50 10 HBGE CO[C@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282153585 WEOUCBIRCTYWSP-BDAKNGLRSA-N 402.644 -0.883 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)Cc1cccc(B(O)O)c1 2282348747 OWGFPCHJAZGWCL-MRXNPFEDSA-N 402.278 -0.939 50 10 HBGE Cc1ccc(S(=O)(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C)c(B(O)O)c1 2282366778 SYWBYIPOBGQRPN-AREMUKBSSA-N 420.318 -0.014 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCC[C@@H](NC(=O)OC(C)(C)C)C1 2282705912 DYPOPJBKMNDOHQ-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE COCC(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2ccc(C(=O)OC)cc2)n1 20906123 MSSCTWLGEFMFMN-REZTVBANSA-N 421.439 -0.077 50 10 HBGE O=C(NNC(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)[C@H]1COCCO1 771219530 JBCRCTFFXMIXFI-SWLSCSKDSA-N 418.406 -0.860 50 10 HBGE CCC[C@H]1C[C@@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CCO1 779934784 FFIXFBLQWOXTKD-RYUDHWBXSA-N 406.443 -0.824 50 10 HBGE NC(=O)[C@H](NC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(Br)c1 792970151 HPRDNIIXXCEFJY-WDEREUQCSA-N 401.217 -0.279 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)C1 805031694 NSQWDNLPHABAIQ-HIFRSBDPSA-N 411.484 -0.409 50 10 HBGE CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 814484242 QBDIESDRJSCHBN-NSHDSACASA-N 407.456 -0.056 50 10 HBGE CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)[C@@H]1CCC(=O)N1)=NO2 1301442849 ZCNMCWXKJUPZIN-NSHDSACASA-N 409.443 -0.042 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)C2CC2)[C@@H]2CS(=O)(=O)C[C@@H]21 1460890820 YMZFTLSJUTYQSQ-OLZOCXBDSA-N 416.500 -0.738 50 10 HBGE O=C(C[C@H]1CS(=O)(=O)c2ccccc2O1)NNC(=O)[C@H]1CCS(=O)(=O)C1 1539402444 YVJSZWHFGOTPKN-QWRGUYRKSA-N 402.450 -0.807 50 10 HBGE Cn1cc(S(=O)(=O)N2CCC(I)CC2)c(=O)n(C)c1=O 2198572520 BICCALGHQWAEKY-UHFFFAOYSA-N 413.237 -0.328 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(F)cc1B(O)O 2282374346 ZZJNCLVJKRGQMY-NWDGAFQWSA-N 404.225 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2282382734 PFIKMVFEQWCGLV-XTCNOXHKSA-N 400.266 -0.369 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NCCOCCNC(=O)OC(C)(C)C 2282429148 OLGGEBBKJJNCDZ-UHFFFAOYSA-N 402.278 -0.506 50 10 HBGE CCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2282740737 DSGBXWQNPYFSDY-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE O=C(O)[C@@]1(NS(=O)(=O)c2cc(B(O)O)cs2)CCN(Cc2ccccc2)C1 2284403440 RPYNYSHELMOJJI-MRXNPFEDSA-N 410.282 -0.565 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2362309813 UVXFJDHHYKOEDW-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE COc1cc(B(O)O)ccc1NS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 712395847 ZNKCTUVXSLXLJT-UHFFFAOYSA-N 418.236 -0.197 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2coc3ccccc23)n(C)c1=O 802762463 HSADUXDXIIZYFW-UHFFFAOYSA-N 410.390 -0.430 50 10 HBGE CO[C@H]1COCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1251272843 MZSNHXXEVYJTDD-HIFRSBDPSA-N 414.484 -0.068 50 10 HBGE COc1cccc([C@H]2[C@H](C(=O)NNC(=O)CS(C)(=O)=O)CC(=O)N2C2CC2)c1 1641667200 MYCWAYIWOFUKGT-PBHICJAKSA-N 409.464 -0.061 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)c2sccc2B(O)O)CC1)C(F)(F)F 2267211243 JXXCYUMTKQXWKV-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)c2sccc2B(O)O)C1 2267607224 KASNEISNMGFYSS-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE CCCC1(NS(=O)(=O)c2cc(B(O)O)nn2C)CN(C(=O)OC(C)(C)C)C1 2282083057 FZTMZTGNYILRRR-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)Cc1ccsc1B(O)O 2282343146 CLTROQMHGQFVMX-VXGBXAGGSA-N 420.318 -0.782 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2(NS(=O)(=O)Cc3ncsc3B(O)O)CC2)C1 2282379950 BIFZHSYPMOKSSZ-UHFFFAOYSA-N 417.318 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282726172 NTPRYVWYDOREFU-PHIMTYICSA-N 400.237 -0.112 50 10 HBGE O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(CCN2CCOCC2)C1 734686031 JQGBMRLFNJQOFS-HNNXBMFYSA-N 406.443 -0.055 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@H]1COCCO1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 744653343 WJBVBPDTSFLPBH-XJFOESAGSA-N 413.496 -0.154 50 10 HBGE COc1cc(C(=O)NCC(=O)NNC(=O)[C@@H]2COCCO2)ccc1OC(F)F 746022797 NLHNNAJFAMVSAK-LBPRGKRZSA-N 403.338 -0.411 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C\c2ccccc2Cl)n(C)c1=O 765732787 XBBWGZIROKUIOE-FPLPWBNLSA-N 416.825 -0.052 50 10 HBGE Cc1csc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1Cl 790783589 FPYSEDHCVRNXPY-UHFFFAOYSA-N 410.843 -0.082 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cnn(C)n2)c1 807566788 YYKFVFDQVDDQOC-UHFFFAOYSA-N 409.472 -0.010 50 10 HBGE CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)CS(C)(=O)=O 1454278772 SNZSXNUYGNJYPV-CYBMUJFWSA-N 402.448 -0.014 50 10 HBGE CN(C)C(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 1464538136 GHRAPPJGPAEELP-IJLUTSLNSA-N 404.489 -0.041 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2C[C@@]2(F)c2ccccc2)n(C)c1=O 1635500609 KSPJALSJILBXNH-HXPMCKFVSA-N 414.397 -0.534 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2267394849 SWZVYHUCUXVZEA-SNVBAGLBSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)c2cscc2B(O)O)C1 2267624365 XOOHCIMAUQHBLW-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE CCc1nc(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c(B(O)O)s1 2281629029 XBCCJPJASLOKRP-UHFFFAOYSA-N 401.294 -0.001 50 10 HBGE CC(C)(C)OC(=O)NCCc1nc(NS(=O)(=O)c2ccc(B(O)O)s2)n[nH]1 2282077302 UHHNMNFZVXDOFY-UHFFFAOYSA-N 417.278 -0.586 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1CCO 2282703232 TZIYPSDQUYGEFB-LBPRGKRZSA-N 420.318 -0.580 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728885 HXNWARBFAXGXOF-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2S(=O)(=O)c2cscc2B(O)O)C1 2282738537 WDUUGLIPWZGMPM-JTQLQIEISA-N 418.302 -0.827 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2359265621 DAVHHEXYLUWNSK-NGZCFLSTSA-N 420.680 -0.848 50 10 HBGE COC(=O)[C@@H](Br)CNS(=O)(=O)c1c(Br)nnn1C 234590459 ILAAHNZZOMBHMF-BYPYZUCNSA-N 406.056 -0.208 50 10 HBGE CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)[C@H]1COCCO1 755531015 JQBHFZDHOLKLRR-CQSZACIVSA-N 415.472 -0.429 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)nn1 1131111309 DZEBBMJCVAVYFX-AWEZNQCLSA-N 406.468 -0.182 50 10 HBGE CNC(=O)[C@H](CNC(=O)NNC(=O)c1cn(C)nn1)Cc1ccc(OC)c(F)c1 1230370502 POKHUQNGUBJPEG-NSHDSACASA-N 407.406 -0.488 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 1623321658 PSUHHYJEAAECTI-UHFFFAOYSA-N 420.513 -0.212 50 10 HBGE CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CN2CCCC2=O)ccc1Cl 1632320672 AVZHFTGWEJUZQQ-UHFFFAOYSA-N 418.859 -0.095 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)Cn1nc(Br)c(Br)n1 1648934708 GMVZKKLWFDQZMC-UHFFFAOYSA-N 424.053 -0.427 50 10 HBGE CS(=O)(=O)CS(=O)(=O)NCC1(CBr)CCS(=O)(=O)CC1 2199808514 GZRDQEMHXKFRTF-UHFFFAOYSA-N 412.349 -0.502 50 10 HBGE O=C(N[C@H]1COCC[C@H]1NC(=O)c1ncc(B(O)O)cc1F)OCc1ccccc1 2282292302 TUAKXZOKYTVCJA-CVEARBPZSA-N 417.202 -0.286 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282373719 QMHAMDYLENMETO-MGPLVRAMSA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)cc2F)[C@@H]2C[C@H]21 2282739107 DHCIOZMUUCHFHE-CHWSQXEVSA-N 400.237 -0.112 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 744643455 VKAGPFRIQVXKAA-CYBMUJFWSA-N 401.416 -0.213 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NCCOCCS(C)(=O)=O 745855071 ORGHIDBJRBESCJ-UHFFFAOYSA-N 411.278 -0.207 50 10 HBGE C[C@@H]1CCCN1S(=O)(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 769863206 RZUQPHHIMPVDKO-OAHLLOKOSA-N 409.512 -0.206 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3COCCOC3)nc2)CC1 813817458 BXCKFGIJNNTMFJ-UHFFFAOYSA-N 414.488 -0.941 50 10 HBGE Cn1c(=O)c2cc(C(=O)NNC(=S)NCCc3cccs3)n(C)c2n(C)c1=O 1135899828 QGLGOEVZCZTSFG-UHFFFAOYSA-N 420.520 -0.011 50 10 HBGE O=C(CN1CCC(CO)CC1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1149628967 CVUYXCQHQBMGGN-UHFFFAOYSA-N 417.510 -0.704 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)CN1CCCC1=O 1171827985 CXFNPFBEJLKCEE-LBPRGKRZSA-N 411.459 -0.728 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCO[C@@H]3C)CC2)cn1C 1526606316 VDAZROMLZVKLBX-RISCZKNCSA-N 413.500 -0.298 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1CCC(=O)N1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 1533743953 ARWKXGOVZSZGAO-ZDEQEGDKSA-N 410.496 -0.291 50 10 HBGE Cn1nc(C(=O)NNC(=O)CCC(=O)N2CCC(O)CC2)c2ccccc2c1=O 1540381277 WLGJQSUYTHSEOE-UHFFFAOYSA-N 401.423 -0.542 50 10 HBGE CC[C@H](O)Cn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1 1631773617 ZVXROIIIIDRQQU-JTQLQIEISA-N 410.294 -0.511 50 10 HBGE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(B(O)O)ccc1F)CCS2(=O)=O 1636976361 WKPLBSQGNBRCEN-FBWYHRDQSA-N 413.232 -0.866 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)c1cc(B(O)O)ccc1F)C1CCCC1 1642455632 YCLCYJMEAOBKDX-OAHLLOKOSA-N 401.269 -0.810 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1c1ncc(Br)cc1B(O)O 2223678073 WTFBMVXRPTWQEZ-QWRGUYRKSA-N 416.081 -0.012 50 10 HBGE Cn1cc(C(=O)N=[S@@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)c(B(O)O)n1 2282166236 CHNBRWWOJOSCCB-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CNS(=O)(=O)c1cscc1B(O)O 2282371270 HQTUIXLJEIXPAS-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)sc2C)C[C@H]1NC(=O)OC(C)(C)C 2282726100 MTKWBDPRGVZIAV-GHMZBOCLSA-N 420.318 -0.351 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)Cc2ccccn2)CC1 729230506 KIVWZNWUVABFPX-UHFFFAOYSA-N 422.467 -0.024 50 10 HBGE CN(C)CCOc1ccccc1N1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 746004638 WTZKELWJFUIMBT-SFHVURJKSA-N 421.498 -0.095 50 10 HBGE CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)c2cc(Br)cn2C)n1 756768897 AHOZFHDCQGMKAE-UHFFFAOYSA-N 413.236 -0.066 50 10 HBGE COc1cc(C)ccc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 780925672 IFHLEFSPRXJDLP-UHFFFAOYSA-N 400.395 -0.788 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)c1ccccc1Cl 1463826256 AMYLAFJFENIVAH-UHFFFAOYSA-N 404.876 -0.065 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1=O 1636285401 ILNOCGFFHJMXGG-CQSZACIVSA-N 412.468 -0.208 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2cccnc2)C[C@@H](C)O1 1638063373 QZJLPUKOFFETNP-CFGMGRTJSA-N 419.482 -0.373 50 10 HBGE CCO[C@@H]1COC[C@H]1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1682338906 MJLGBOGKZBVOFY-HUUCEWRRSA-N 414.484 -0.250 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)C1CCOCC1)C1CCCC1 1682374852 IMJFIHIBPUFCOB-CQSZACIVSA-N 405.521 -0.302 50 10 HBGE Cn1nc(C(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c2ccccc2c1=O 1687743283 LZSUMNSITDLOPS-YOGCLGLASA-N 419.463 -0.014 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1nscc1B(O)O 2255451872 AQSRMNNKIBGRGM-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)n1C 2267711708 OXHSERJNEQLWKQ-KBPBESRZSA-N 422.272 -0.856 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@@H](C)CNS(=O)(=O)Cc1ncsc1B(O)O 2267712726 HBHXBBMRRMEZSJ-JTQLQIEISA-N 407.323 -0.112 50 10 HBGE COCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1sccc1B(O)O 2282087723 WITZYGZLDKKGDD-UHFFFAOYSA-N 420.318 -0.316 50 10 HBGE CO[C@@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282153588 WEOUCBIRCTYWSP-RKDXNWHRSA-N 402.644 -0.883 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2(B(O)O)CCC2)[C@H]2CS(=O)(=O)C[C@@H]21 2282165206 AOKQJDAZLURWAB-RYUDHWBXSA-N 402.278 -0.372 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H]2CC[C@H]21 2282345757 QZWRINVOZITSDW-NEPJUHHUSA-N 417.318 -0.264 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](NC(=O)C(F)(F)F)C[C@@H](C)C2)sc1B(O)O 2282364051 LFTZVKHGFCBSTN-APPZFPTMSA-N 414.236 -0.186 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)n1 2282736633 UDNHUIPBVPTZDC-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@]2(NS(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]2C1 2282861181 LDDLVPDQAJUJKS-BMIGLBTASA-N 417.318 -0.358 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1F 2365477353 MRIRZQFZSLPPPS-LLVKDONJSA-N 406.241 -0.677 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(/C=C(/C#N)C(=O)N(CCO)CCO)CC2)cc1 217122073 SYNBWRNTYCFGII-ICFOKQHNSA-N 422.507 -0.478 50 10 HBGE CC(=O)N[C@@H]1[C@H](OC(=O)CCl)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O 256020606 WRIXCIGJYAONQN-GAUGTXIDSA-N 423.802 -0.576 50 10 HBGE O=C(NNC(=O)N1CCN(CC(F)(F)F)C(=O)C1)c1ccc(-n2cnnn2)cc1 804867521 DGBBCSVYXPCQMH-UHFFFAOYSA-N 412.332 -0.277 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@]3(C)C[C@@H](O)CN3C)CC2)cc1 1137300267 LHOMRJHCHXCITR-NQIIRXRSSA-N 403.527 -0.285 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCS(=O)(=O)CC2)C1 1297754437 UMMCEDAFXOETTC-ZDUSSCGKSA-N 418.516 -0.489 50 10 HBGE C[C@H](CC(=O)NNC(=O)CN1CCCC1=O)NS(=O)(=O)c1cccnc1Cl 1302575070 BUEPWNVPHJLARI-SNVBAGLBSA-N 417.875 -0.438 50 10 HBGE CCN(CCO)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 1469434326 FARSQBIUVGOJJQ-UHFFFAOYSA-N 412.512 -0.355 50 10 HBGE CCO[C@H](C)c1noc(CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)n1 1566170377 SRISPWKEYDVYAW-GFCCVEGCSA-N 406.223 -0.056 50 10 HBGE O=C1CCc2cc(OC[C@H](O)CNC(=O)c3cc(B(O)O)ccc3F)ccc2N1 1622505288 JIWYVZTZYCYWNY-CYBMUJFWSA-N 402.187 -0.440 50 10 HBGE O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1645054426 SOSJPKJFRTZBPU-KRWDZBQOSA-N 402.499 -0.396 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1cccc(Cl)c1)C2 1660567537 JHHJYUNQOVNPAZ-AWEZNQCLSA-N 419.873 -0.026 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1C[C@H]2CC[C@@H]1O2 1674112174 DRDOPFDMLFUUTJ-BMFZPTHFSA-N 424.479 -0.029 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201425 OMWOMKGYTYYMMW-WDEREUQCSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3ccc(B(O)O)s3)CO[C@H]1C2 2282082789 LDZVKHSVFJJBKT-FTGAXOIBSA-N 418.302 -0.469 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)Cc1ccsc1B(O)O 2282353472 VTUXEAATHXHQTL-UHFFFAOYSA-N 422.334 -0.221 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282363305 GDUAFCZWUZLODH-VXGBXAGGSA-N 420.680 -0.410 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H](C)CN1C(=O)OC(C)(C)C 2282380835 OQNRUYKTCWHITR-WDEREUQCSA-N 419.334 -0.018 50 10 HBGE CN(C[C@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)cs1 2282510105 UPCOEIXMPUREFN-LBPRGKRZSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCNS(=O)(=O)c2cccc(B(O)O)c2)C1 2362285110 KQQIBFCACRHTRE-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@@H](NS(C)(=O)=O)C2)cc1OC 735079020 ZZIKEQVONXHDHP-GFCCVEGCSA-N 400.457 -0.912 50 10 HBGE C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816881899 RWAMQKPGMFOODA-JHXTVGTDSA-N 417.470 -0.265 50 10 HBGE COC(=O)c1ccc(C=NNc2nnc(SCC(=O)NNC(C)=O)n2N)cc1 1084001887 YZRIASXQASDUQI-UHFFFAOYSA-N 406.428 -0.516 50 10 HBGE CNC(=O)COc1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1OC 1558458489 HNFBQHJHWIFCMK-OAHLLOKOSA-N 420.466 -0.166 50 10 HBGE O=C(CN1CCC[C@H](CNC(=O)C(F)(F)F)C1)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 2195884420 ZRHQVGKFSVPKFZ-OUAUKWLOSA-N 419.853 -0.103 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cncc(B(O)O)c1 2282104014 VSXMYIUYIRXMTJ-OLZOCXBDSA-N 417.318 -0.609 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCCC2CN(C(=O)OC(C)(C)C)C2)n1 2282739706 NZAPSKWVFUWKMJ-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE C[C@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1cc(B(O)O)nn1C 2284044249 XXTWEXFCLIKBTB-LLVKDONJSA-N 404.298 -0.681 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)CN1CCCc2ccccc21 728511353 KHZQUDJPHKANME-KRWDZBQOSA-N 401.467 -0.286 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1COCCO1 810462038 KLLARTDROWFQDK-LLVKDONJSA-N 422.257 -0.710 50 10 HBGE O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)[C@@H]1CCc2nncn2C1 814333765 WTAXIEXHDYJYRP-GHMZBOCLSA-N 405.381 -0.566 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ncccn1 1130013590 MFMMTGMGXYUEKX-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2CCCS2(=O)=O)c1 1623994503 VUPWPEIEOQEEDR-GFCCVEGCSA-N 403.482 -0.335 50 10 HBGE CN(C)S(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(Br)c1 1635484673 NCZOMIBYVYTEBU-UHFFFAOYSA-N 408.278 -0.211 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267208881 OHYGUDIVMQPSER-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NS(=O)(=O)c3cc(B(O)O)cs3)[C@H]2C1 2267612734 NVJKWYLTPWSWCU-DLOVCJGASA-N 402.303 -0.038 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cscc1B(O)O 2269793877 PZIDHAJXJLRDCP-SNVBAGLBSA-N 408.307 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)[C@@H](F)C1 2282103630 TVEZTNRZZKSRDC-QWHCGFSZSA-N 403.241 -0.613 50 10 HBGE Cn1ncc(C(=O)N2CC=CCC23CN(C(=O)OCc2ccccc2)C3)c1B(O)O 2282250735 BRINSJBGFVYIGM-UHFFFAOYSA-N 410.239 -0.107 50 10 HBGE CON(CCCNS(=O)(=O)c1ccc(B(O)O)c(F)c1)C(=O)OC(C)(C)C 2282366066 IPGTWOJYRJPYHM-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2ccc(B(O)O)cc21 712998236 YNOZPJDFDIZWHD-UHFFFAOYSA-N 400.221 -0.645 50 10 HBGE Cn1cc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1 735462065 NMBMRRVDOCLIDL-UHFFFAOYSA-N 413.481 -0.172 50 10 HBGE CN1C(=O)N(CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)C(=O)C12CCCCC2 816882683 KJIJHSLZMJOAGA-GFCCVEGCSA-N 403.443 -0.415 50 10 HBGE CCS(=O)(=O)c1ccc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 1115982250 PEZKSCPDNMWSHV-LBPRGKRZSA-N 403.482 -0.460 50 10 HBGE O=C(Cn1ncc(=O)c2ccccc21)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1141421911 CDQDFCMIZYUAHY-QGZVFWFLSA-N 405.370 -0.005 50 10 HBGE O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F 1448300594 MMOWZHSKSXJPSF-HOCLYGCPSA-N 401.398 0.000 50 10 HBGE Cc1cncn1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1457488263 UUMYFDDWQSTUDQ-UHFFFAOYSA-N 407.452 -0.326 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CO[C@@H](CCC(=O)OC(C)(C)C)C1 1641247128 PLYLGERBXYQAOC-SRVKXCTJSA-N 407.489 -0.402 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNC(=O)COc1ccccc1Br 1644567953 XYNHRWLQVCSLOY-UHFFFAOYSA-N 423.289 -0.287 50 10 HBGE Cn1nc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c(B(O)O)c1Cl 2255726629 WRGZTVDWOVAGJD-UHFFFAOYSA-N 406.635 -0.152 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)c1sccc1B(O)O)C(=O)OC(C)(C)C 2267474397 UIYYVGCONIHDNW-JTQLQIEISA-N 408.307 -0.676 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)CO1 2282072816 JGDUUANPHOZSAB-WDEREUQCSA-N 420.318 -0.364 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)[C@H](C)CN1C(=O)OC(C)(C)C 2282078246 GEFYKTRYXMJHSE-WDEREUQCSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282083172 NBFSINPZXRIYID-WDEREUQCSA-N 420.318 -0.222 50 10 HBGE CO[C@H]1C[C@H](CNS(=O)(=O)c2ccc(B(O)O)s2)N(C(=O)OC(C)(C)C)C1 2282084165 TYENXYPPDMRSHI-MNOVXSKESA-N 420.318 -0.269 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@]1(C)CCN(C(=O)OC(C)(C)C)C1 2282711466 CLOAMHXNFRFKOH-HNNXBMFYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1cnsc1B(O)O 2362502725 HRSBUOJHQWUNAM-UHFFFAOYSA-N 403.266 -0.889 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)Cc1nnc(C)n1C 747336806 KFBNYMCOKCQZDI-UHFFFAOYSA-N 422.515 -0.382 50 10 HBGE CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(Br)cn2C)CC1 794879981 ONRLSIQAIXUGKI-UHFFFAOYSA-N 422.305 -0.275 50 10 HBGE CN1CCN(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)CC1 807381386 QFUWIELORCMZKP-QGZVFWFLSA-N 414.466 -0.550 50 10 HBGE O=C1CCCCN(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)C1=O 1446956800 JBWHTBGPOPREHO-UHFFFAOYSA-N 410.290 -0.606 50 10 HBGE CS(=O)(=O)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)N1CCOCC1 1542427277 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Cn1nc(C(=O)NNC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c2ccccc2c1=O 1683604785 FKRDHRJWHGQQFB-NSHDSACASA-N 400.395 -0.139 50 10 HBGE O=C(NC[C@H]1CCN1C1CCOCC1)NNC(=O)c1ccc(-n2cnnn2)cc1 1685483894 SIKUMIBPUVRMQO-MRXNPFEDSA-N 400.443 -0.140 50 10 HBGE C[C@@H]1CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)CC[C@H]1NC(=O)C(F)(F)F 2195882549 BCCOYNKRYKCDJI-GWOFURMSSA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267208880 OHYGUDIVMQPSER-UWVGGRQHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ccsc2B(O)O)CCO1 2267372180 KNOJXJFNJVAWHP-LLVKDONJSA-N 406.291 -0.212 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@H]2[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 2267386838 ZSZKEEIOPSAIGA-IWIIMEHWSA-N 402.303 -0.120 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282087515 VBRXHZOQYZGPKR-CHWSQXEVSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2282341425 RWUVHHHWUMIKHA-SCVCMEIPSA-N 417.318 -0.360 50 10 HBGE 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CC(C)(C)OC(=O)N1CC2(CC(=O)NCCN2CC(=O)NNC(=O)C(C)(C)C)C1 1307977900 HPFKKGVAYNFFRG-UHFFFAOYSA-N 411.503 -0.009 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1 1470661031 JDNQKQFZXPMBAA-UHFFFAOYSA-N 409.511 -0.272 50 10 HBGE NS(=O)(=O)CCOCCNC(=O)NNC(=O)c1ccc(Br)cc1 1478782356 KXTGVTMRQGRMNC-UHFFFAOYSA-N 409.262 -0.302 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@]1(C)CC1(Br)Br 1610347002 GDYHWEHVYVEWHS-XRGYYRRGSA-N 421.111 -0.032 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NCc1nnc2c(=O)n(C)ccn12 1687432301 LWCGLXPGWPZATF-UHFFFAOYSA-N 423.231 -0.327 50 10 HBGE C[C@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ccc(B(O)O)cn1 2108235225 VQIQISOCQJBYMJ-KRWDZBQOSA-N 421.215 -0.473 50 10 HBGE Cn1nc(C(=O)N=[S@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1B(O)O 2281915472 ZMOOCJDRNKPYHJ-BLBHWQHRSA-N 400.266 -0.747 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1B(O)O 2282418156 MNWJEGXNFNUYOU-MNOVXSKESA-N 420.318 -0.385 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2CC(B(O)O)C2)[C@H]2CS(=O)(=O)C[C@H]21 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COCCOCC(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 1642238760 AJTYNPPOKKGGKN-FQEVSTJZSA-N 416.434 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CCO1 2267379493 YUEUENHPCWNFCY-SECBINFHSA-N 407.279 -0.817 50 10 HBGE CC(C)N(CCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2267391304 BXYZHOZICFASFK-UHFFFAOYSA-N 407.323 -0.112 50 10 HBGE Cn1nc(C(=O)NCCSSCCNC(=O)OC(C)(C)C)cc1B(O)O 2267425937 XOAZJXYVJPIZGB-UHFFFAOYSA-N 404.323 -0.264 50 10 HBGE CC(C)(C)OC(=O)N1CCSC(C)(C)[C@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2268713599 ZAUPRZJHRLGHNU-MRVPVSSYSA-N 402.307 -0.291 50 10 HBGE Cn1ncc(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)c1B(O)O 2282246457 RAYSFODWWNKENP-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2CC[C@H]21 2282345764 QZWRINVOZITSDW-VXGBXAGGSA-N 417.318 -0.264 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)Cc2ccsc2B(O)O)[C@H](O)C1 2282345921 KDMLXNLXHPWVTJ-VXGBXAGGSA-N 420.318 -0.782 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 2282719809 RAJJMNZMMZPLBA-XYPYZODXSA-N 402.282 -0.786 50 10 HBGE O=C(O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2284400910 CLIREPXPSHKWNT-CQSZACIVSA-N 413.644 -0.032 50 10 HBGE COc1ccc(C=C(C#N)C(=O)N(CC(=O)O)[C@H]2CS(=O)(=O)C[C@H]2O)cc1OC 2324522897 FUILCWGUOLEYLP-UONOGXRCSA-N 424.431 -0.318 50 10 HBGE CC(C)(C)OC(=O)NCc1c[nH]nc1NS(=O)(=O)c1cc(B(O)O)cs1 2352332672 ZIDMPHOVFBGDGQ-UHFFFAOYSA-N 402.263 -0.024 50 10 HBGE CC(=NNC(=O)c1nnn(-c2nonc2N)c1CN1CCOCC1)c1cccnc1 254843968 DUWPXPXSHUDGGJ-UHFFFAOYSA-N 412.414 -0.386 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)N1CCN([C@H]2CCCN(c3cc(C)nn3C)C2=O)CC1 780566205 QNQSJEHBWGXGPD-HOTGVXAUSA-N 419.530 -0.213 50 10 HBGE CS(=O)(=O)Nc1ccc(N2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)cc1 1296035864 KTXCPGVPVFYNOE-UHFFFAOYSA-N 421.259 -0.161 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1cc[nH]n1 1453302503 FXUVTBFYKJAVKC-UHFFFAOYSA-N 402.230 -0.088 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 1471222320 PDZQSOAWXQNKLX-UHFFFAOYSA-N 416.406 -0.211 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1cccc(B(O)O)c1 2282092403 PIKLJXRBFBVAMI-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE Cc1cc(S(=O)(=O)NCCCOCCNC(=O)OC(C)(C)C)sc1B(O)O 2282367215 ZCLHQDMMGNLVCM-UHFFFAOYSA-N 422.334 -0.054 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 2282418347 IALOUDCNRVNGCV-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE CN(C[C@@H]1CCCN1S(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282506246 POCMVWDSVCRSAJ-NSHDSACASA-N 402.282 -0.880 50 10 HBGE C[C@@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@@H]1CCCN1C(=O)OC(C)(C)C 2286910038 ZHDUTLSPOGMMNJ-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369896654 DGXQOSZHOMDQAF-KPXOXKRLSA-N 420.680 -0.961 50 10 HBGE CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)CC1 730826428 KBJJIYLMUODZGP-INIZCTEOSA-N 403.439 -0.599 50 10 HBGE CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)CN1CCCc2ccccc21 747905537 DVFDRWZGKDLVLL-UHFFFAOYSA-N 412.512 -0.069 50 10 HBGE CCOC(=O)CNC(=O)[C@@H]1COCCN1CC(=O)NNC(=O)Cc1ccccc1C 1459879468 DVMJXTFGVKHOBV-INIZCTEOSA-N 420.466 -0.935 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(O)(COCCO)CC1 1473808404 FHGCTXIPQGGCSH-UHFFFAOYSA-N 415.874 -0.055 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 1586191408 XJKAMNZPSLABBJ-LLVKDONJSA-N 409.420 -0.733 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CC1COC1 1628671813 NXZBHEYLFJPFGZ-UHFFFAOYSA-N 411.480 -0.176 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2C[C@H]2c2cnn(C)c2)CC1 1638390416 XBQFOXHIIZQMOP-LSDHHAIUSA-N 419.511 -0.002 50 10 HBGE Cc1nc(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)s1 2267443762 PWYAWZPLZBYUFE-CQSZACIVSA-N 419.268 -0.101 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNS(=O)(=O)c2cscc2B(O)O)C1 2267624232 VDSGXMRJMJLFIG-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE C[C@@H]1[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282077485 WMUADXADWLFNLY-ZYHUDNBSSA-N 402.282 -0.834 50 10 HBGE CC(C)[C@@H](CCNS(=O)(=O)c1cncc(B(O)O)c1)NC(=O)OC(C)(C)C 2282095465 CZZADAVAWHUKDC-CQSZACIVSA-N 401.294 -0.021 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2282379504 VJQGKBWNACCROV-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282380060 CZKKMTPPPNFYLS-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2282437628 VCFKYHMULPCWQY-HHHXNRCGSA-N 402.282 -0.487 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2282709209 VPWBRJOPCFTJER-NSHDSACASA-N 402.282 -0.976 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCN1C(=O)OC(C)(C)C 2282734485 MANYXNXNFQVNER-LBPRGKRZSA-N 400.262 -0.337 50 10 HBGE C[C@@H](NC(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(B(O)O)cs1 2284041963 UOQBDZQBVVVYHV-SKDRFNHKSA-N 402.253 -0.075 50 10 HBGE CN(Cc1csc(B(O)O)c1)C(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360571570 IYHHQRGECLVUPO-NSHDSACASA-N 420.318 -0.676 50 10 HBGE CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CN1CCCc2ccccc21 728511354 KHZQUDJPHKANME-QGZVFWFLSA-N 401.467 -0.286 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 742060742 RKJKNXUJCFWBQL-ABAIWWIYSA-N 421.479 -0.145 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C/C=C\c2ccc(F)cc2)n(C)c1=O 766643071 KKYNULROUCJKOZ-ARJAWSKDSA-N 414.397 -0.176 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(Cl)cnn2C)c1 797428341 WJKNDEPWSVMSIJ-UHFFFAOYSA-N 421.888 -0.053 50 10 HBGE CO[C@@H]1C[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)N(C(=O)OCc2ccccc2)C1 1454276958 JEQAVQYCZBOICW-KGLIPLIRSA-N 413.452 -0.396 50 10 HBGE O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCS(=O)(=O)C1 1478319995 WJADLVILNDNJSG-SNVBAGLBSA-N 403.486 -0.499 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)N1CCN(CCNS(=O)(=O)c2ccccc2)CC1 1654345486 IKBRRGNUHPRVSH-HNNXBMFYSA-N 411.528 -0.472 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1 2266950441 GEPHBTNTGXJNCP-CQSZACIVSA-N 401.232 -0.727 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C)sc1B(O)O 2267626535 JYFQDPDWCYNHIY-CQSZACIVSA-N 408.307 -0.710 50 10 HBGE C=C(CCNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1ncsc1B(O)O 2267714470 KHGANPIGIJLHOQ-UHFFFAOYSA-N 405.307 -0.287 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CC[C@@H]1NC(=O)OC(C)(C)C 2282084834 YLYRRLSLDZOHDZ-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282718611 ZYDZIPNRCUKICF-RYZVSIALSA-N 418.302 -0.180 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N[C@@H]1CS(=O)(=O)C[C@H]1Cl 703992903 HATGNEOZKKJFGY-VXGBXAGGSA-N 406.869 -0.394 50 10 HBGE COc1cccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1F 761489391 VVFCGBAMIFFEEB-UHFFFAOYSA-N 404.358 -0.957 50 10 HBGE CC[C@H](C)n1nc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1C 778379044 GOTJDUVXGFMPNO-JTQLQIEISA-N 416.442 -0.629 50 10 HBGE C[C@@](O)(Cn1ccccc1=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1 790918653 CARLGAXWLJVPMT-CQSZACIVSA-N 422.301 -0.574 50 10 HBGE Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2)c1 1116249081 VEUVXUGFUACXBB-UHFFFAOYSA-N 416.257 -0.078 50 10 HBGE COCCn1cc(N2C[C@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cn1 1124467491 BVGBYDIOUTXOTA-KGLIPLIRSA-N 413.500 -0.625 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(C)C[C@@H](O)CN2C)c1 1289966633 FLTLVVAKEVSTPX-RDTXWAMCSA-N 412.512 -0.067 50 10 HBGE COc1ccc(CC(=O)NN(C)[C@H](C)CO)cc1S(=O)(=O)N1CCOCC1 1299926580 WEHVBEBSUVSYHR-CYBMUJFWSA-N 401.485 -0.398 50 10 HBGE CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1303881755 NUKVCYYMPDZMHV-MRXNPFEDSA-N 410.496 -0.049 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)N1 1530230269 BFVDCMXHOOYNEP-MNOVXSKESA-N 400.482 -0.283 50 10 HBGE O=C(COc1ccccc1CNC(=O)c1cccc(B(O)O)c1)NC[C@@H]1CCCO1 1625891634 OFXMNYDZGQSJDB-SFHVURJKSA-N 412.251 -0.030 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncc(B(O)O)cn2)C1 2235611310 VWGTWCBSBCDOIZ-HNAYVOBHSA-N 414.227 -0.089 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cscc2B(O)O)C1 2267385063 HRBXNRDSOSBBPJ-YUMQZZPRSA-N 400.209 -0.495 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2267607777 QQWBYZRBZCQFEU-QWRGUYRKSA-N 406.291 -0.660 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C 2282377685 VAACEZMEXBHKAE-INIZCTEOSA-N 402.278 -0.771 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OCc2ccccc2)C3)n1 2282468047 PBFCRWPUYHKVLO-RBSFLKMASA-N 413.243 -0.586 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@H]1CO 2282709575 YBNKVEOLROTUAL-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CNS(=O)(=O)c2cccc(B(O)O)c2)CCOC1 2282709599 YKNFDNXXQPHHJC-MRXNPFEDSA-N 400.262 -0.672 50 10 HBGE CN(C)CCN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)cs1 2282710374 NRNSGKNHGKQHSV-UHFFFAOYSA-N 421.350 -0.495 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2282738485 VMEQJKGXEXXMNT-WDEREUQCSA-N 420.318 -0.758 50 10 HBGE N#C[C@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)CCN1Cc1ccccc1 2282857624 KRPYKLZJKFRCHG-INIZCTEOSA-N 405.310 -0.032 50 10 HBGE CC[C@H]1C[C@H](C(=O)N[C@H]([C@@H](C)Cl)[C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)N(C)C1 77285989 UHQYIIRIOVIPLI-CSEXQPIXSA-N 410.964 -0.001 50 10 HBGE in-vitro C[C@@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cccc(B(O)O)c1 704367971 BYUALODDLAADIE-GFCCVEGCSA-N 402.237 -0.357 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(CC(=O)N2CCc3ccccc32)CC1 1544359838 RFZGUZXQNFQYOR-UHFFFAOYSA-N 411.242 -0.147 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN(C)C[C@H](C)O)c1 1556926238 LDAYLPXPBPBKGT-ZDUSSCGKSA-N 400.501 -0.209 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C23CCC(CC2)C3(C)C)n(C)c1=O 1622153685 OXTOGVIGCOBZRD-UHFFFAOYSA-N 402.455 -0.203 50 10 HBGE O=C(NNC(=O)C1CN([C@H]2CCOC2)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1 1641062337 SLZBISULMCGDQE-INIZCTEOSA-N 422.507 -0.047 50 10 HBGE COC(=O)Cc1ccc(NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 1644566885 VDYMPPAXYDFQBK-ZFWWWQNUSA-N 409.464 -0.119 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)C[C@@H]1CCO 1648386058 XYDZXAPFAMABMV-LBPRGKRZSA-N 419.887 -0.409 50 10 HBGE CC(C)C(=O)NNC(=O)CN1CCN(C(=O)c2cccc(S(C)(=O)=O)c2)CC1 1657355927 BHWWCZJWVMPNPG-UHFFFAOYSA-N 410.496 -0.349 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]2CNC(=O)c2cnn(C)c2)n1 1659716464 IAAQKIJKOYINHC-CQSZACIVSA-N 419.511 -0.231 50 10 HBGE N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1866128244 FJTFOJVKPWVKDQ-GFMIBQMHSA-N 413.224 -0.728 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1nc(B(O)O)ccc1Cl 2217492083 FWDFTOAGRSSUIX-UHFFFAOYSA-N 409.616 -0.547 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2255756955 NKJXXAIMAYXHLF-ZETCQYMHSA-N 414.698 -0.755 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1C(=O)c1cscc1B(O)O 2266853159 GGHGNLNXMJMREF-UHFFFAOYSA-N 404.275 -0.549 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 2282078984 PPVIDCAVKZLDQE-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE CC(C)[C@@H](CCNS(=O)(=O)c1nn(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282371603 LWIUICBQVQCVKW-GFCCVEGCSA-N 404.298 -0.682 50 10 HBGE C[C@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282704654 MTIOQXJHOBPKOL-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)C[C@H]1NC(=O)OC(C)(C)C 2282722735 KYMIKLKHXABUGO-ZIAGYGMSSA-N 400.262 -0.721 50 10 HBGE C[C@H]1[C@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1cscc1B(O)O 2282725220 YCKGVAUASTXSQA-VHSKPIJISA-N 414.236 -0.106 50 10 HBGE C[C@H](OC(C)(C)C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N=c1nc(B(O)O)[nH]s1 2284066030 OPJDJFBVNDBPAN-DTWKUNHWSA-N 402.282 -0.325 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)CN1CCN(Cc2ccccc2)CC1 764342885 TYNGCBXVPLNNNC-UHFFFAOYSA-N 410.478 -0.223 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1(S(C)(=O)=O)CC1 1341898431 KVIBHGSDQHPDAG-JTQLQIEISA-N 417.513 -0.111 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCN(CCc3cnccn3)CC2)n1 1460669625 CNUAZMXCOVMEQN-UHFFFAOYSA-N 403.512 -0.208 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)c1 1540291367 SWWBNTJICCDCOM-YQNCKWHISA-N 406.464 -0.387 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@]3(C)CCNC(=O)C3)cc2)CC1 1545921754 FSMXECGIRNTOHK-SFHVURJKSA-N 409.512 -0.018 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN1C1CCOCC1)[C@H]1CC(=O)N(Cc2ccccn2)C1 1558458431 GICFLVAOVRSWMV-YOEHRIQHSA-N 401.467 -0.169 50 10 HBGE COCc1nn(C)cc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1558897479 VNJFXDSWZJBRTO-UHFFFAOYSA-N 409.468 -0.043 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCS(=O)(=O)C[C@H]2C(=O)OC)cc1C 1620642652 DIBPUMUKBUZEDX-NSHDSACASA-N 417.509 -0.348 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNc2ccccc2I)N1 1633393277 JDPZHUGSFIQDAX-VIFPVBQESA-N 409.205 -0.353 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CCCN(C(=O)OCc3ccccc3)C2)n1 2267626998 REMFORSYMREABZ-AWEZNQCLSA-N 422.272 -0.821 50 10 HBGE CO[C@@H]1C[C@H](CNS(=O)(=O)c2cc(B(O)O)cs2)N(C(=O)OC(C)(C)C)C1 2282073819 HVZMAUAMXUXQDC-VXGBXAGGSA-N 420.318 -0.269 50 10 HBGE CN([C@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282345540 PPZVGYLQYISWJV-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)Cc1cccc(B(O)O)c1 2282351639 CZGAJBPWHYOSLD-UHFFFAOYSA-N 408.232 -0.054 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(F)cc2B(O)O)CCO1 2282362829 JZMGIVNYGFSLTI-NSHDSACASA-N 404.225 -0.275 50 10 HBGE COC(=O)[C@@H](CC(=O)N(C)Cc1csc(B(O)O)c1)NC(=O)OC(C)(C)C 2283937691 XIQSLXDZGOBSHL-LLVKDONJSA-N 400.262 -0.157 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2284052261 DFLXBQGLJYHUKM-VIFPVBQESA-N 400.628 -0.488 50 10 HBGE CN(C)CCN(C=C(C#N)C(=O)N(C)C1CCN(C)CC1)[C@H]1CCS(=O)(=O)C1 2324778005 GWQYIGDCMXCHDM-SFHVURJKSA-N 411.572 -0.003 50 10 HBGE CC(=O)N1CCN(C(=O)/C(C#N)=C\N(CCN(C)C)[C@@H]2CCS(=O)(=O)C2)CC1 216992838 IDXVHIJSBZLHJX-VZVUQDNOSA-N 411.528 -0.865 50 10 HBGE COc1cc(C=NNC(=O)c2c(C)nnn2-c2nonc2N)ccc1OCC(N)=O 254876029 DANZNORCXHACDM-UHFFFAOYSA-N 415.370 -0.822 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)[C@@H]1COCCO1 755433294 CTVVYLBBZVYLCL-NEPJUHHUSA-N 400.432 -0.935 50 10 HBGE Cn1c(=O)c2ccc(C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)nc2n(C)c1=O 790321757 NKOCZCFOLVVOSQ-BBRMVZONSA-N 423.429 -0.034 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)cc1 2180983371 PHSGQJOJEQIDLE-ZDUSSCGKSA-N 400.262 -0.367 50 10 HBGE Cn1nc(C(=O)N[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)c1Cl 2255725296 LXKWSWPULOLICZ-NEPJUHHUSA-N 406.635 -0.060 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1NC(=O)C(F)(F)F 2267608872 YYFWDBKGGJPPLU-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2282359294 LXOKICMPOKRBOX-PWSUYJOCSA-N 420.318 -0.269 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cncc(B(O)O)c1 2282710851 UDMZTRPJVYLSKB-UHFFFAOYSA-N 401.250 -0.677 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282717435 JMJBEQTXIBNWOO-AREMUKBSSA-N 418.302 -0.228 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCCCONC(=O)OC(C)(C)C 2282721716 VTTVPZLVXWMOMI-UHFFFAOYSA-N 404.250 -0.500 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)Cc2ccc(B(O)O)cc2)C1 2282735738 GCGALZARTFJQRI-UHFFFAOYSA-N 402.253 -0.255 50 10 HBGE COC(=O)[C@@H](CC(=O)N[C@H](C)c1nscc1B(O)O)NC(=O)OC(C)(C)C 2283989857 UGFGFKOAZKMKPQ-PSASIEDQSA-N 401.250 -0.544 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)Nc1nc(B(O)O)ccc1Cl 2284060377 MCQRNOMLNIXMJA-VIFPVBQESA-N 400.628 -0.488 50 10 HBGE CN(Cc1sccc1B(O)O)C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284062436 KSUQMYWWXQKALE-LBPRGKRZSA-N 402.253 -0.294 50 10 HBGE O=C(CSc1nc(O)cc(O)n1)NNC(=O)CSc1nc(O)cc(O)n1 15777498 QXQRWNJWYFKXLF-UHFFFAOYSA-N 400.398 -0.879 50 10 HBGE COc1ccccc1C(=O)NCC(=O)NN=C1C(=O)N(CC(N)=O)c2ccccc21 254744171 SFCQGSMCHLVTAK-UHFFFAOYSA-N 409.402 -0.223 50 10 HBGE CC(=O)NNC(=O)C[S@@](=O)CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 586355053 ZMBDBOVDKXOCIO-NDEPHWFRSA-N 407.452 -0.661 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)[C@H]1COCCO1)N1C(=O)c2ccccc2C1=O 744649076 RSOSIWIXWDBVLB-UONOGXRCSA-N 407.448 -0.033 50 10 HBGE O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)[C@H]1Cc2ccccc2O1 748277786 WGJRVSSQSVFOKI-CQSZACIVSA-N 401.400 -0.018 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC2CC(OC(C)(C)C)C2)n(C)c1=O 792605696 KMMVSQYWCMBKMS-UHFFFAOYSA-N 420.470 -0.435 50 10 HBGE O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@H]1COCCO1 810461921 INXRAYUNFRCGMG-SNVBAGLBSA-N 412.251 -0.166 50 10 HBGE O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)[C@@H]1CCN1C1CCOCC1 1303881527 MURZOIZBUOGKIM-DZGCQCFKSA-N 409.468 -0.883 50 10 HBGE C[C@@H]1CN(C(=O)Cn2cc(NC(=O)c3cc(B(O)O)ccc3F)cn2)C[C@@H](C)O1 1587246427 FGDGCURWWAOVPZ-VXGBXAGGSA-N 404.207 -0.410 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1ncccn1 1643040923 CBNJTTIQJFYRHZ-UHFFFAOYSA-N 411.465 -0.437 50 10 HBGE CC(C)(C)OC(=O)NCCSSCCNC(=O)c1ncncc1B(O)O 2266926731 GIHLTWVNLRUGIX-UHFFFAOYSA-N 402.307 -0.208 50 10 HBGE O=C(N1CCCC[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)s1)C(F)(F)F 2267610738 JLXWPTOPSQAITQ-MRVPVSSYSA-N 400.209 -0.350 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCOCCN(C)C(=O)OC(C)(C)C 2282378129 BAFWXRPBEOQHKD-UHFFFAOYSA-N 422.334 -0.102 50 10 HBGE CC(C)(C)OC(=O)NCC1(CNS(=O)(=O)c2ccccc2B(O)O)COC1 2282718773 CASZLXSXSLRLRZ-UHFFFAOYSA-N 400.262 -0.814 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1 2282724003 UQJUTDWMFXBJQO-APPZFPTMSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)Cc3ncsc3B(O)O)[C@H]2C1 2282737561 HUCXGHIWKRZAAR-GHMZBOCLSA-N 417.318 -0.645 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(C(=O)N=c2nc(B(O)O)[nH]s2)C1 2284057629 BRVPMMNNOVOBBZ-CABCVRRESA-N 400.241 -0.292 50 10 HBGE CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)CC1 730826432 KBJJIYLMUODZGP-MRXNPFEDSA-N 403.439 -0.599 50 10 HBGE Cc1cc(C)n(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)n1 735116784 FMNRNFRWJQGMKQ-UHFFFAOYSA-N 407.500 -0.026 50 10 HBGE O=C(Cn1cc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cn1)NC1CCCCC1 816875634 DRXDBLGXWYICNS-CYBMUJFWSA-N 414.470 -0.053 50 10 HBGE COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@H]3CCC(=O)N3)C2=O)c(OC)c1 1312666633 VLYVQKPUVZXEER-KGLIPLIRSA-N 419.438 -0.586 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2COCCN2C)cc1 1313153781 KNLDWBUZRQKLND-CQSZACIVSA-N 413.500 -0.723 50 10 HBGE Cc1cnc2nc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)nn2c1 1540291415 VDPNPSKFPCEZPE-UHFFFAOYSA-N 403.424 -0.242 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)c2)C[C@@H](C)O1 1543093502 GJKSYGFXSQLSFZ-JMSVASOKSA-N 424.479 -0.476 50 10 HBGE CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2cn[nH]c2)c1 1543119147 XSCYNPLLTSPJIU-UHFFFAOYSA-N 422.467 -0.429 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSc3n[nH]c(O)n3)CC2)cc1 1566278407 BSEKTALKCZTDMQ-UHFFFAOYSA-N 419.511 -0.124 50 10 HBGE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NNc1ccccc1I 1644642049 XGSGPYWKVDBOOV-MRVPVSSYSA-N 415.195 -0.074 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1 1647996615 BINLZTSNOLTISY-SECBINFHSA-N 418.269 -0.006 50 10 HBGE O=C(NC1CN(S(=O)(=O)c2c(Cl)cc(B(O)O)cc2Cl)C1)C(F)(F)F 2267382128 GFHKVEOSZPYHGU-UHFFFAOYSA-N 420.989 -0.275 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2267606792 CXGQXPFFXPEKKK-APPZFPTMSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267612697 NDNINOHIXATERJ-OLUQVHSISA-N 424.331 -0.118 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)n1 2267626999 REMFORSYMREABZ-CQSZACIVSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CCNS(=O)(=O)c2sccc2B(O)O)C1 2282083595 PVYCCPRTABHIIF-NSHDSACASA-N 420.318 -0.268 50 10 HBGE Cc1cc(S(=O)(=O)N2CCOC[C@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282359953 VLZNSMWNHUPYEW-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](OCCNS(=O)(=O)c2sccc2B(O)O)C1 2282719706 PKSLZAOKRWYJOP-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)[C@H]1COCCO1 745999723 JOADUWQXYANLGU-IUODEOHRSA-N 419.438 -0.162 50 10 HBGE O=C(NNC(=O)N1CCN2C(=O)OCC[C@H]2C1)C1CCN(c2ncccn2)CC1 763499623 UGEBPWWPJWQNGA-AWEZNQCLSA-N 403.443 -0.040 50 10 HBGE O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)[C@@H]1CCc2nncn2C1 816885552 CIFMRELVMJNTKZ-VXGBXAGGSA-N 424.508 -0.097 50 10 HBGE CC(C)NC(=O)c1cnn2c1C[C@@H](CNC(=O)c1cc(B(O)O)ccc1F)CC2 1640391816 WZIZTEODWHLCRE-LBPRGKRZSA-N 402.235 -0.167 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282335613 RSUVAPYUNLXDDJ-RYUDHWBXSA-N 420.318 -0.518 50 10 HBGE O=C(O)[C@@]1(NS(=O)(=O)c2cscc2B(O)O)CCN(Cc2ccccc2)C1 2284402552 OEKFFYGMKZRDRW-MRXNPFEDSA-N 410.282 -0.565 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)c(F)c1 2360635009 ISUKAPNAZGLANK-GFCCVEGCSA-N 404.225 -0.618 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 744643711 DUAZULWPKILTRT-CQSZACIVSA-N 422.463 -0.590 50 10 HBGE CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)[C@@H]3COCCO3)ccc2O1 751549123 QRJWOQUBZGXWMP-KGLIPLIRSA-N 400.409 -0.722 50 10 HBGE O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccccc1)N[C@H]1CCS(=O)(=O)C1 919889942 XGLAUXBEODPYQI-STQMWFEESA-N 412.493 -0.281 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3ncon3)CC2)cc1 1472179131 MOHRTTZVOWOMQD-SREVYHEPSA-N 400.395 -0.256 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 1626650292 NYULQWWCKGDAMS-AWEZNQCLSA-N 417.509 -0.183 50 10 HBGE C[C@@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ncccc1B(O)O 2108229943 WLCJHNZTZCWDQV-QGZVFWFLSA-N 421.215 -0.473 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)Cc2ccccc2B(O)O)C1 2255752892 NBPPXNRDSGDTMJ-UHFFFAOYSA-N 404.253 -0.193 50 10 HBGE CC(C)(C)OC(=O)NCC1CC(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267625787 VYXIHLIFFYTIAC-UHFFFAOYSA-N 405.307 -0.454 50 10 HBGE Cn1nc(C(=O)N[C@]2(CF)CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281662781 AVNYFQOAKURFNK-HNNXBMFYSA-N 404.635 -0.168 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@](C)(CO)C1 2282700975 UMLGDSOTFKAAKY-HNNXBMFYSA-N 420.318 -0.580 50 10 HBGE C=C(CS(=O)(=O)N[C@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC)B(O)O 2289593419 QNTLSGHMWQYLSI-GFCCVEGCSA-N 408.282 -0.289 50 10 HBGE O=C(NNS(=O)(=O)c1cc2c(cc1Br)OCCO2)[C@H]1COCCO1 745979542 VJEUIKHUJVHKAV-LLVKDONJSA-N 423.241 -0.055 50 10 HBGE Cc1cccc2c(CC(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c[nH]c12 765729998 CBZHYRAGKASZLC-UHFFFAOYSA-N 423.433 -0.386 50 10 HBGE C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N(C)C 1251153195 XUATXKMJJSKIKI-ZDUSSCGKSA-N 413.500 -0.398 50 10 HBGE CCn1nc(C(=O)NNC(=O)NC[C@H](C)N2CCN(C)CC2)c2ccccc2c1=O 1251660187 MGBIHHURZMSXAB-AWEZNQCLSA-N 415.498 -0.004 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCCCO2)cc1 1468450655 IHSDAUMHQHNPEC-CQSZACIVSA-N 413.452 -0.142 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)COC3CC3)CC2)cc1 1587964944 ZNABJHJSHIEJAD-UHFFFAOYSA-N 410.496 -0.372 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)CN2CCN(S(C)(=O)=O)CC2)cc1 1637299000 FBEMFDLHVZWOSC-UHFFFAOYSA-N 414.557 -0.353 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(c2ncc(Br)cc2B(O)O)C1 2223677487 OMGBRXRUYMHCBG-WDEREUQCSA-N 416.081 -0.012 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@](=O)(=NC(=O)c2nscc2B(O)O)C1 2267361926 KEFPTTVWDULGKC-UAXLGHPASA-N 403.291 -0.024 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 2267467097 LLTAWDIGAVUTRT-CQSZACIVSA-N 422.272 -0.821 50 10 HBGE Cc1sc(B(O)O)cc1C(=O)N1CCS(=O)(=O)CCN1C(=O)OC(C)(C)C 2282169421 IKIVTOMKAWVIQZ-UHFFFAOYSA-N 418.302 -0.241 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2282296478 ATJFZBWAPLSCSN-IUCAKERBSA-N 402.644 -0.883 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(C)C)c(B(O)O)n1C 2282336192 ZRUDWEKPORJZLT-NSHDSACASA-N 404.298 -0.764 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)Cc1ccc(B(O)O)cc1 2282370857 BLIIZSHYYQFCOR-UHFFFAOYSA-N 400.262 -0.320 50 10 HBGE 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CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nc(C3CC3)nn2C)c1 1623992617 AXGGXADZLIZRCD-UHFFFAOYSA-N 406.468 -0.054 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)N2CCN(C)CC2)CN(C(=O)OC(C)(C)C)CCO1 1626125952 POIKBRCXCDFWIM-GOSISDBHSA-N 415.491 -0.373 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2cscc2B(O)O)C1 2267617714 PDIBCBCPWHDIAK-RUZDIDTESA-N 424.331 -0.166 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@H](CO)C1 2267619439 RSAFSBBVYGXECL-SNVBAGLBSA-N 406.291 -0.970 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NS(=O)(=O)Cc1ccsc1B(O)O 2267716220 JSQIXGAZPPUAOX-WOPDTQHZSA-N 402.303 -0.145 50 10 HBGE CC[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)ccc1OC 2282360625 FSUCSVRUNXJZLJ-LBPRGKRZSA-N 402.278 -0.043 50 10 HBGE C[C@H]1C[C@H](CNS(=O)(=O)c2nn(C)cc2B(O)O)CN1C(=O)OC(C)(C)C 2282372614 ZFERHTPEYJCRGT-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE COc1ccc([C@H](CNC(=O)NNC(=O)[C@@H]2COCCO2)N2CCOCC2)cc1 745289700 OPCKTDPLNFQPRU-IRXDYDNUSA-N 408.455 -0.186 50 10 HBGE COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)[C@@H]1COCCO1 756258350 SNARRSMJJPLXOH-HNNXBMFYSA-N 408.411 -0.264 50 10 HBGE COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1OC 790068931 QNIQOORJWKMGDO-JTQLQIEISA-N 408.816 -0.140 50 10 HBGE CCN(CC)c1nc(NNC(=O)NCCN2CCNC(=O)C2)nc(N(CC)CC)n1 1226057025 IFEFTTCJWQBVJD-UHFFFAOYSA-N 422.538 -0.378 50 10 HBGE COC1(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CS(=O)(=O)C1 1636371101 ZIMWSMHYCKVUIR-NSHDSACASA-N 405.473 -0.406 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CC2(O)CCOCC2)CC1 1638390220 SHVOQAZYTVYJTK-UHFFFAOYSA-N 413.500 -0.608 50 10 HBGE Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)c1ccc(=O)n(C)c1 1639797655 MRMZLLZSQFRQGN-UHFFFAOYSA-N 415.450 -0.237 50 10 HBGE O=C(CN1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 2195882824 FAAGHTCAWGJDKQ-NAKRPEOUSA-N 417.837 -0.256 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267608260 UTVJSOMESUZGFM-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(B(O)O)cc1F 2282364970 ZMOMLIVVUWACKW-LQJRIPTKSA-N 400.237 -0.208 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(NS(=O)(=O)c3ccc(F)cc3B(O)O)[C@H]2C1 2282366616 QPDQXCDQMBRYQQ-QWRGUYRKSA-N 400.237 -0.351 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2282437629 VCFKYHMULPCWQY-MHZLTWQESA-N 402.282 -0.487 50 10 HBGE COC(=O)[C@H](CBr)NS(=O)(=O)c1c(Br)nnn1C 2320332416 XVRJLDOYSCTIFC-BYPYZUCNSA-N 406.056 -0.208 50 10 HBGE CCCn1nc(C(=O)NNC(=O)[C@]2(OC)CCS(=O)(=O)C2)c2ccccc2c1=O 1352972472 TZBKAMYSIGQIRH-SFHVURJKSA-N 422.463 -0.229 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@@H]2CCO[C@H]2C)c1 1461147795 IPKMFUSWINDPJL-GXTWGEPZSA-N 414.484 -0.549 50 10 HBGE CO[C@@]1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CCS(=O)(=O)C1 1479381619 OKQVRJGCHSUWKE-GFCCVEGCSA-N 409.262 -0.075 50 10 HBGE Cn1ncc(C(=O)NNC(=O)c2nc[nH]c3ncnc2-3)c1I 1558272865 MWBHAKKLYHPTLA-UHFFFAOYSA-N 412.151 -0.283 50 10 HBGE O=C(COCC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)NCc1cccnc1 1638871351 VYFBVFZOZBAQDE-INIZCTEOSA-N 405.455 -0.885 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)Cc2ccc(B(O)O)cc2)C1 2255760766 WFCZFMZDDNZTBL-UHFFFAOYSA-N 404.253 -0.193 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1 2266899158 JQEAOPWHCZKNLY-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267212899 YXBNYNGOSIYCTO-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CN(C1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12)S(=O)(=O)c1cscc1B(O)O 2267387948 QIISNWGONSHNCN-NXEZZACHSA-N 402.303 -0.086 50 10 HBGE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)c2scc(B(O)O)c2Cl)C1 2267452618 HMTXYEUZZRUHGO-UHFFFAOYSA-N 403.653 -0.714 50 10 HBGE O=C(N[C@H]1CCN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)c(O)cc1O 2267814021 ZAWAQMBLYMHJPO-ZDUSSCGKSA-N 400.196 -0.082 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@](F)(CNC(=O)c2ncsc2B(O)O)C1 2281635230 XWABZTIBMFLFBM-OAHLLOKOSA-N 403.241 -0.472 50 10 HBGE C=C(CS(=O)(=O)N1CCn2c(CNC(=O)OC(C)(C)C)nnc2C1)B(O)O 2282379420 ULYITSTUSBRCBZ-UHFFFAOYSA-N 401.254 -0.984 50 10 HBGE C[C@@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282710768 SGUKPSGRXKIROI-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282725226 YFGQMIYEZBZDHW-UHFFFAOYSA-N 422.696 -0.473 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2362282274 HZZKXJKDFUTSAN-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE CN1CCN(C(=O)NNC(=O)C2(C(=O)OC(C)(C)C)CCS(=O)(=O)CC2)CC1 1556362003 PDZIMQMYVKIQDE-UHFFFAOYSA-N 418.516 -0.489 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)C[C@@H]2NC(=O)c3ccccc3NC2=O)C[C@@H](C)O1 1608487813 ZXHFAHCKOJQQLS-ZENOOKHLSA-N 417.466 -0.226 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cccn2c(I)cnc12 1630867056 QUQVBQWWBAHLGU-UHFFFAOYSA-N 422.204 -0.256 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1 1643799656 DITLWCKEVVVTTB-UHFFFAOYSA-N 410.452 -0.909 50 10 HBGE Cc1cc(CN(C)S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)sc1B(O)O 2082347974 HEEQIVDIOOZORT-UHFFFAOYSA-N 422.293 -0.206 50 10 HBGE CO[C@@H]1C[C@@H](CNS(=O)(=O)c2sccc2B(O)O)N(C(=O)OC(C)(C)C)C1 2282069289 OBHTZHPZGJDNET-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1ccccc1B(O)O 2282094825 VUGFNDLTACGKGU-QWHCGFSZSA-N 400.262 -0.673 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)n1 2282428990 MIQCOJAVRBYGSO-GFVXYOJSSA-N 400.266 -0.512 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)c1ccc(F)cc1B(O)O 2282726686 SSXNTWSPXJPWEX-UHFFFAOYSA-N 406.241 -0.675 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1(C)C 2282736598 SVVYJPUFQUMXKC-GHMZBOCLSA-N 419.334 -0.066 50 10 HBGE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCc2sc(B(O)O)cc2C1 2283946024 ISKPHWIGFUENOQ-NSHDSACASA-N 400.262 -0.216 50 10 HBGE CC(C)(C)OC(=O)N1CC(c2nc(=NC(=O)c3sncc3B(O)O)s[nH]2)C1 2296457852 VEDZODCWYZBXSP-UHFFFAOYSA-N 411.274 -0.317 50 10 HBGE C#CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)[C@@H]1CCS(=O)(=O)C1 756587169 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MWYVGMMCRSNPIS-ZETCQYMHSA-N 417.278 -0.068 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2282085760 CTSSFNHKQAFVIZ-PWSUYJOCSA-N 420.318 -0.269 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282334491 CAUQBYIRJIRGTQ-JTQLQIEISA-N 406.241 -0.988 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282723428 QGYFLYOEIBCRDG-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1=O 750661034 ACSPCBNIHDVLCX-NQBHXWOUSA-N 408.484 -0.067 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 1255194151 APHSKTDLILDINW-IPYPFGDCSA-N 412.468 -0.315 50 10 HBGE Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)CS(C)(=O)=O)cc1C 1586191345 USTDUYFRTIZSGK-UHFFFAOYSA-N 405.498 -0.446 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2sccc2B(O)O)[C@H](O)C1 2267210586 FTBICSTYLJQGKC-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cscc2B(O)O)[C@@H](O)C1 2267627933 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HKIIRNIODNFFOH-UHFFFAOYSA-N 424.527 -0.249 50 10 HBGE C[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765729740 FQGXWQRSWDZCDZ-LLVKDONJSA-N 416.413 -0.401 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NC1CC(NS(C)(=O)=O)C1 802418015 APFZBFVJLJEWIQ-UHFFFAOYSA-N 408.278 -0.188 50 10 HBGE COc1nn(C)cc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1471559844 IPCLBBALNYCXDT-UHFFFAOYSA-N 410.456 -0.177 50 10 HBGE Nc1ncn(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1 1629814260 QVGGJZBDAXNZDR-UHFFFAOYSA-N 406.878 -0.521 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2266925002 UAHZANHLUZSXKS-MRXNPFEDSA-N 401.228 -0.528 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267609748 VGFJNWHIYPDABY-VXNVDRBHSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)[C@@H]2COC[C@@H]12 2282068572 FKXLWVWFUIRBMV-QJPTWQEYSA-N 418.302 -0.660 50 10 HBGE O=S(=O)(c1cscc1B(O)O)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 2282724859 RUTPSKJBIGMJAK-JKSUJKDBSA-N 408.310 -0.298 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@H](C)N1C(=O)OC(C)(C)C 2282741203 KSQHLUKNTMAOAM-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1 745978826 CNSUFJBJATZNQO-AWEZNQCLSA-N 421.497 -0.558 50 10 HBGE O=C(NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1)[C@H]1COCCO1 746003551 PVFZKOPTOZDOAY-OAHLLOKOSA-N 410.402 -0.495 50 10 HBGE Cc1oc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1S(=O)(=O)N1CCCC1 816880609 OLHLSJSMBAJTMF-GFCCVEGCSA-N 422.467 -0.012 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C[C@H]3CCCS3(=O)=O)CC2)cc1 1175390013 MVELSGPLDYBQHA-QGZVFWFLSA-N 419.507 -0.486 50 10 HBGE O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1597425952 JTOUGAMCMPREKM-JTQLQIEISA-N 403.486 -0.960 50 10 HBGE CC(C)(C)C(=O)N1CCO[C@H](C(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)C1 1641457126 VKCSJNOGZFRRPZ-KBPBESRZSA-N 416.434 -0.142 50 10 HBGE CCN(CC)c1nc(NNC(=O)CN2C(=O)CN(C)C2=O)nc(N(CC)CC)n1 1642825544 PEORUJPBZGDSIM-UHFFFAOYSA-N 407.479 -0.099 50 10 HBGE Cn1ncc(C(=O)N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1B(O)O 2267257750 ANTKKISZVSSXHA-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE CCN(CCN(CC)S(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2282076040 BZRNDEINEPDTCW-UHFFFAOYSA-N 404.298 -0.633 50 10 HBGE C=CC1(NS(=O)(=O)c2ccc(F)c(B(O)O)c2)CN(C(=O)OC(C)(C)C)C1 2282339298 TZAFFJAXYQGYMH-UHFFFAOYSA-N 400.237 -0.041 50 10 HBGE CC[C@H](CN(CC)S(=O)(=O)c1c(B(O)O)cnn1C)NC(=O)OC(C)(C)C 2282710444 OOKHZRHCKHLSOL-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N[C@H]1CCC=C1B(O)O 2283961452 DNQDAOCNKKMXBB-AAEUAGOBSA-N 402.278 -0.372 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CC[C@H]1N(S(=O)(=O)Cc1ncsc1B(O)O)C2 2359281517 ADEYGFGBISAGNG-JLLWLGSASA-N 417.318 -0.360 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2365478583 XVEKQJXPUYHFRJ-LLVKDONJSA-N 422.696 -0.162 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N1CC[C@@](C)(B(O)O)C1 2368336047 LKELWBQOSWPYKT-BLLLJJGKSA-N 404.294 -0.124 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 748284346 MAORWHNAQKWMDQ-IUODEOHRSA-N 420.447 -0.697 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)Nc1cnn(CC(=O)N2CCOCC2)c1 756836065 SCLJKYVSBRNTFK-MRXNPFEDSA-N 414.422 -0.102 50 10 HBGE C[C@H]1C(=O)CC[C@@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1(C)C 780925373 DEQRCRLULBNXHW-QWRGUYRKSA-N 418.454 -0.778 50 10 HBGE COC(=O)c1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n(C)n1 1306190979 OMZXQPGXPOWEBJ-UHFFFAOYSA-N 423.451 -0.403 50 10 HBGE CCn1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 1472474815 ALGJCOJTXWXDCA-UHFFFAOYSA-N 407.452 -0.001 50 10 HBGE CCS(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1538484611 RZRMUCXVHLBOSS-HNNXBMFYSA-N 411.528 -0.326 50 10 HBGE CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)[C@@H]2CCC(=O)N2)CC1 1563864949 NOIUVCFIYJJCGL-HNNXBMFYSA-N 402.455 -0.536 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCc2nn[nH]c21 1566278988 ZAWLXWHRKFLXNJ-OAHLLOKOSA-N 411.466 -0.170 50 10 HBGE CC(C)N1CC[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@@H](c2cnn(C)c2)C1 1623510089 QGSKWSIECZKMKO-VNQPRFMTSA-N 411.528 -0.184 50 10 HBGE C[C@@]1(C(=O)NNC(=O)CN2CCCC2=O)C[C@@H](O)CN1C(=O)OCc1ccccc1 1635877739 IYUQATGUJSQWQU-QRWLVFNGSA-N 418.450 -0.082 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2nc[nH]c3ncnc2-3)CC1=O 1651588236 CTJHDUQKMCXWEW-VXGBXAGGSA-N 400.443 -0.602 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1 1654295001 QEKQVTPIICDYJQ-SECBINFHSA-N 420.875 -0.009 50 10 HBGE CN(C)S(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 1675954937 CBSBKBFZXPSZFN-CQSZACIVSA-N 400.457 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282069749 UTCFCJVKGBZAQZ-NSHDSACASA-N 420.318 -0.268 50 10 HBGE C[C@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282704653 MTIOQXJHOBPKOL-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2365478122 SYUGDRUEOXAQCW-JTQLQIEISA-N 406.241 -0.677 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H]3CCCN3C)nc2)CC1 139328624 BKJYCJIDRUCILJ-CQSZACIVSA-N 411.532 -0.262 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cn(C)nn2)c1 783293978 WJBSKQNGXQLDDV-UHFFFAOYSA-N 409.472 -0.010 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=S)NCCc2cccs2)[C@H]1c1cnn(C)c1 1463858297 VUBFEDCIIWQPIF-MGPQQGTHSA-N 422.536 -0.290 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CS(=O)(=O)C3CC3)cc2)CC1 1545922190 XDCUMKQCZHLESJ-UHFFFAOYSA-N 416.525 -0.357 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@@H]1NC(=O)C(F)(F)F 2267608870 YYFWDBKGGJPPLU-CBAPKCEASA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2c(Cl)cccc2B(O)O)[C@H](O)C1 2282369737 KUIQDSVZHDFHII-NWDGAFQWSA-N 420.680 -0.722 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3cc(B(O)O)cs3)[C@H]2C1 2282704445 KBMTUNLAKDCPMP-RYUDHWBXSA-N 418.302 -0.563 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282722549 IHVZZMXPOZUPNW-STQMWFEESA-N 400.262 -0.721 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)[C@@H](CN(C)C)NC(=O)OC(C)(C)C 2283963490 LXDJEBFWLWRRRT-CMPLNLGQSA-N 400.310 -0.203 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](Nc2cc(B(O)O)c(Cl)cn2)[C@@H](S(C)(=O)=O)C1 2294913127 ASBQZSBZZSWEFG-RYUDHWBXSA-N 419.696 -0.141 50 10 HBGE Cn1c(O)ncc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1=O 751557220 AJLRTUVSBNWWBI-UHFFFAOYSA-N 400.439 -0.541 50 10 HBGE CN(C)S(=O)(=O)NCCNC(=O)NNC(=O)c1cc(Br)cn1C 1470250368 QGEFUDAPYSIXSJ-UHFFFAOYSA-N 411.282 -0.872 50 10 HBGE COC(OC)[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1471149504 STRZSNPHRATRAN-GFCCVEGCSA-N 416.504 -0.349 50 10 HBGE C[C@H](C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1532641400 WWNMPANYRQKHLR-FWZIUSJTSA-N 422.482 -0.373 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)ccc1=O 1536984961 UIEMTYIHIQGPGQ-UHFFFAOYSA-N 418.475 -0.310 50 10 HBGE COC1(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CS(=O)(=O)C1 1545426172 JHJJKMHGZYGMJD-UHFFFAOYSA-N 424.523 -0.926 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)C1 2195883700 PZARGZJTTCPYNQ-LMLFDSFASA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)NC(CO)(CO)CNc1ncc(Br)cc1B(O)O 2258281138 JELBONRJFOVEEN-UHFFFAOYSA-N 420.069 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(NS(=O)(=O)Cc3ccsc3B(O)O)[C@H]2C1 2267375214 DJILXOIMHKQGHW-QWRGUYRKSA-N 402.303 -0.287 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1cscc1B(O)O 2267387936 QERXTXZDETUOST-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE COC(=O)[C@H](CCNS(=O)(=O)c1cc(B(O)O)cs1)NC(=O)OC(C)(C)C 2282068690 GQZCWDXFCHILFA-JTQLQIEISA-N 422.290 -0.837 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282357852 PMTOKOKQJRAPJT-WDEREUQCSA-N 402.253 -0.055 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2282378141 BCSGCXUADYGVPL-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC[C@@H](C)N(C)C(=O)OC(C)(C)C 2282417220 AXJYVYQKJPNLBZ-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714823 XKKVWSHVPPKCED-KGLIPLIRSA-N 400.262 -0.721 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)c2cc(F)c(B(O)O)cc2Cl)C1 2282987109 YYULYQNYVVVAKX-UHFFFAOYSA-N 402.615 -0.130 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)N=c2nc(B(O)O)[nH]s2)OC(C)(C)C1 2284045465 NCMIGFBWJIEKJT-RKDXNWHRSA-N 400.266 -0.571 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N1CCc2ccc(B(O)O)cc21 712996601 SUYHZDDIXJSERC-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)C1 813421862 XLRJLXPGIMCXKL-GHMZBOCLSA-N 408.452 -0.291 50 10 HBGE CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)CC1=O 816886371 VRRQRFSNUMCHGK-QLFBSQMISA-N 403.487 -0.679 50 10 HBGE O=C(NC1CCN(S(=O)(=O)C2CCOCC2)CC1)c1cc(B(O)O)ccc1F 1147245600 YTLLFUPJAPMEIW-UHFFFAOYSA-N 414.264 -0.792 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2COCCO2)c(CN2C(=O)c3ccccc3C2=O)n1 1265592321 YKMXNVHBUGNENA-OAHLLOKOSA-N 413.390 -0.607 50 10 HBGE CO[C@]1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCSC1 1457671967 STQYESHAKFOMGZ-MRXNPFEDSA-N 415.541 -0.017 50 10 HBGE CN(C)S(=O)(=O)Cc1ccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1 1471310994 JVDSZUGMZDHZPP-MRXNPFEDSA-N 418.541 -0.041 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)ccc1=O 1564643255 WTCFAZUANCXDNP-UHFFFAOYSA-N 406.464 -0.013 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 1632321294 VFKSUUHIBMTIBU-UHFFFAOYSA-N 415.497 -0.864 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 1670983875 HYBAWKOJUXKEDI-FZKQIMNGSA-N 421.479 -0.057 50 10 HBGE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)N2CCC(Cl)CC2)C1 2240604098 PGYPHVCYOJURFF-WCBMZHEXSA-N 420.841 -0.211 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267612696 NDNINOHIXATERJ-IJRMKIOGSA-N 424.331 -0.118 50 10 HBGE CN([C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1cc(B(O)O)nn1C 2267616204 PBXKKONFRKKOFP-UONOGXRCSA-N 422.272 -0.822 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282102947 MWBFMHKZEUNEMP-FZMZJTMJSA-N 400.262 -0.816 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C)ccc1B(O)O 2282356957 CNLNXIDVJBOXAV-INIZCTEOSA-N 402.278 -0.771 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2282379505 VJQGKBWNACCROV-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2282462694 PAVLAUNQUPFAKP-MHZLTWQESA-N 400.266 -0.560 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1cc(B(O)O)ccc1O)OCc1ccccc1 2282976643 WATJNKLRRBFNQU-IRXDYDNUSA-N 414.223 -0.114 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(CCN(C)C)c2)cc1 763660835 HXMSGMIGQHKPRL-UHFFFAOYSA-N 404.427 -0.382 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)Cn2ccccc2=O)c1 790465799 HWSFTRQRRPZHOE-GOSISDBHSA-N 422.463 -0.689 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)[C@@H]1COCCO1 794589565 LAISASNIKKJECC-QMMMGPOBSA-N 400.381 -0.592 50 10 HBGE O=C(NNC(=O)[C@@H]1CCc2nncn2C1)[C@@H]1CCCN1S(=O)(=O)c1cccs1 816885549 CIFMRELVMJNTKZ-NEPJUHHUSA-N 424.508 -0.097 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@H]1C(=O)NNC(=O)[C@@H]1COCCO1 1445052235 QSXACELBSPKPRQ-DGORSVRFSA-N 419.356 -0.465 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@]2(CC(C(=O)NNC(=O)[C@H]3CCC(=O)N3)=NO2)C1 1454061126 JWQRBMYKLOHUSW-ZMZPIMSZSA-N 409.443 -0.042 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3cn(C)nn3)CC2=O)cc1OC 1528541949 SPKBBAFBWSBVJC-ZDUSSCGKSA-N 416.438 -0.316 50 10 HBGE C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1558458816 LQRZQWSZBJAJBF-UTKZUKDTSA-N 416.478 -0.206 50 10 HBGE O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1558950209 ILOQGFQZNLNIBA-ZJUUUORDSA-N 409.390 -0.021 50 10 HBGE O=C1C[C@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1 1636162686 FYKNXPNWGBJGFE-LBPRGKRZSA-N 409.468 -0.449 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCCc1ccc(B(O)O)cc1 2121778160 CDOZHHMVWVHJMO-UHFFFAOYSA-N 416.264 -0.485 50 10 HBGE Cn1nc(C(=O)N2C[C@@H](F)C[C@@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281660310 ODDXPYMEAKNWHE-DTWKUNHWSA-N 404.635 -0.169 50 10 HBGE Cn1nc(C(=O)N2C[C@H](F)C[C@@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281660312 ODDXPYMEAKNWHE-RKDXNWHRSA-N 404.635 -0.169 50 10 HBGE CC1(C[S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2281834914 HTBIULUOMWMLTP-HHHXNRCGSA-N 400.266 -0.416 50 10 HBGE Cc1c(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)nn(C)c1B(O)O 2282159482 ACAPLTPXJODERT-HHHXNRCGSA-N 400.266 -0.734 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@H]2C1 2282381637 WAOFIMUZVVPRHS-PHIMTYICSA-N 417.318 -0.549 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2ccc(B(O)O)s2)CCOCC1 2282704968 RKRMLUDGCNLYCP-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714825 XKKVWSHVPPKCED-ZIAGYGMSSA-N 400.262 -0.721 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]3OCCNC(=O)[C@H]32)cc1OC 1308023752 NOLKZFNFPJCDBW-PBHICJAKSA-N 406.439 -0.556 50 10 HBGE O=C(NNC(=O)C1CCN(C(=O)c2cccnc2)CC1)N[C@@H]1CCS(=O)(=O)C1 1626649610 CYQULINDWUKJEE-CQSZACIVSA-N 409.468 -0.549 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)c1 1681025080 JEHQJIYGPUWNDR-UHFFFAOYSA-N 403.482 -0.141 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@@H]1NC(=O)C(F)(F)F 2267387984 QVLROGCHIGKSDM-CBAPKCEASA-N 400.209 -0.495 50 10 HBGE O=C(N1CCC[C@H](CNS(=O)(=O)c2cscc2B(O)O)C1)C(F)(F)F 2267389447 OOPUSIQLBBMMJG-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE Cn1cc(C(=O)N[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c(B(O)O)n1 2267398931 ZXQNRCIZOMSWPE-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1sccc1B(O)O 2267610704 IWYYITYXLUZSOE-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CN(C[C@H](O)CN(C)S(=O)(=O)c1ccc(B(O)O)s1)C(=O)OC(C)(C)C 2267611401 SEPCNZVLWPFVCR-JTQLQIEISA-N 408.307 -0.724 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281836924 WEKGSNADASEXTN-BLBHWQHRSA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282080671 MCAZFXHDDFHEQC-GWQKEKGPSA-N 418.302 -0.180 50 10 HBGE Cn1nc(C(=O)NC[C@H]2COCCN2C(=O)OC(C)(C)C)c(B(O)O)c1Cl 2282246853 XPCCZEWLIOJBQG-VIFPVBQESA-N 402.644 -0.881 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)c1cscc1B(O)O 2282371271 HQTUIXLJEIXPAS-NSHDSACASA-N 419.334 -0.743 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713088 ZTMMHYHVLRSREM-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2359274093 ZYWKTCMUDZWCMN-QCZZGDTMSA-N 400.237 -0.208 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2365421143 DIONONCCOXYGNU-JTQLQIEISA-N 422.696 -0.162 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1ccc(B(O)O)s1 704311628 YROORFCMCVPISX-UHFFFAOYSA-N 408.266 -0.466 50 10 HBGE CN1CCO[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1=O 1149649787 PUQQZGXNDUKWCN-QGZVFWFLSA-N 423.901 -0.538 50 10 HBGE C=C[C@@H]1OCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1251164839 OFFUJARLTAOCBY-CVEARBPZSA-N 424.479 -0.005 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 1312899352 BVHZREHRQOYVQG-VXGBXAGGSA-N 401.441 -0.397 50 10 HBGE CCC[C@H](O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1445551557 NVJXYGVPWMFNQU-INIZCTEOSA-N 412.512 -0.390 50 10 HBGE CCOc1ccc(NC(=S)NNC(=O)CN2CCN(S(C)(=O)=O)CC2)cc1 1540446274 TUKFNQHZZRFGLU-UHFFFAOYSA-N 415.541 -0.020 50 10 HBGE O=C(COc1ccc(Br)cc1)NNC(=O)c1cnn(C[C@@H](O)CO)c1 1587666365 RHMRNMDJFZRNQZ-GFCCVEGCSA-N 413.228 -0.161 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCC(=O)N2C)CC1 1648592938 VZWFGUSGEGUEKC-ZDUSSCGKSA-N 410.500 -0.528 50 10 HBGE C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1nnc2n1CCNC2=O 1687452685 BEHFBENGMGSOMA-SECBINFHSA-N 407.818 -0.027 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1sccc1B(O)O 2255882100 JEADPLZVRXQNFC-DEOSSOPVSA-N 412.320 -0.261 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1 2266891377 GZIGKBGVDFMDAE-OAHLLOKOSA-N 400.244 -0.122 50 10 HBGE C[C@@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2267369038 RLJULMQLQKHMHJ-LLVKDONJSA-N 400.209 -0.599 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)nn(C)c1B(O)O 2281609485 SPPKSIUJLGKSAC-LURBXMNDSA-N 402.282 -0.440 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)Cc1cccc(B(O)O)c1 2282330119 VMJPPCSEAGDLKG-ZIAGYGMSSA-N 400.262 -0.922 50 10 HBGE Cc1nc(S(=O)(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(B(O)O)n1C 2282335799 UZDRKPDJTOCCOD-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@H]1CNC(=O)OC(C)(C)C 2282361632 UGLIDEQJKSFIIF-GHMZBOCLSA-N 420.318 -0.446 50 10 HBGE CN(CCCNC(=O)OC(C)(C)C)CCCNC(=O)c1sncc1B(O)O 2282460385 KCYVZNWSEHHHRC-UHFFFAOYSA-N 400.310 -0.211 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](O)C[C@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282726560 BWBIHJZQQJXEKT-QWRGUYRKSA-N 420.318 -0.615 50 10 HBGE COCC1(C(=O)N=c2nc(B(O)O)[nH]s2)CCN(C(=O)OC(C)(C)C)CC1 2283980389 ZJXVCKBLCDGHQZ-UHFFFAOYSA-N 400.266 -0.758 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 758046258 GRCPWWQVYVTDEJ-SSDOTTSWSA-N 417.387 -0.321 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 763691663 ROJRORAAKNSVOR-AWEZNQCLSA-N 406.464 -0.150 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2ccc3c(c2)CCCC3)n(C)c1=O 765723718 DCLPHUMPZBJKKU-UHFFFAOYSA-N 424.461 -0.297 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@H]2CCc3ccccc3C2)n(C)c1=O 765723865 DXOHDHUOXFAMFB-ZDUSSCGKSA-N 424.461 -0.224 50 10 HBGE O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)[C@H]1CCc2nncn2C1 814333767 WTAXIEXHDYJYRP-QWRGUYRKSA-N 405.381 -0.566 50 10 HBGE O=C(NNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)N[C@@H]1CCS(=O)(=O)C1 1136389883 MTBIHUZIJLQYLZ-LLVKDONJSA-N 401.466 -0.246 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C/C=C(Cl)Cl)n(C)c1=O 1137299500 UAPMTQMUWXOJIL-HWKANZROSA-N 401.210 -0.544 50 10 HBGE CC[C@H](C)[C@@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)NCCN1CCOCC1 1143965640 SQLQRGLWRHEATA-SUMWQHHRSA-N 409.267 -0.902 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 1168869602 QYDGERMFGBSWBR-UHFFFAOYSA-N 403.482 -0.333 50 10 HBGE O=C(NNc1ncc(Br)cn1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 1557235221 AQJFRAUPJJXDKU-PSASIEDQSA-N 418.273 -0.282 50 10 HBGE C[C@@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NCCSS(C)(=O)=O 1636470371 LFKUUJHSIQQCFZ-SCZZXKLOSA-N 402.541 -0.415 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2=NOC3(C2)CN(C(=O)OC(C)(C)C)C3)ccc1=O 1636482505 NNYMYDHCKBBFSD-UHFFFAOYSA-N 405.411 -0.088 50 10 HBGE NS(=O)(=O)CCCNC(=O)NNC(=O)COc1ccccc1Br 1683660745 FDRSSAMGOMDJPL-UHFFFAOYSA-N 409.262 -0.163 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1cccc(OC(F)F)c1 1687346325 GNIKLSDZJDKFHA-KRWDZBQOSA-N 414.365 -0.140 50 10 HBGE C[C@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1cc(B(O)O)cs1 2008405120 LGYPBIAPVMLOIK-JTQLQIEISA-N 408.266 -0.296 50 10 HBGE Cc1cc(S(=O)(=O)NC2(C(=O)O)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282365441 YTGYLKXJCYHDIL-UHFFFAOYSA-N 420.274 -0.911 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@@H]2NC(=O)OC(C)(C)C)ccc1B(O)O 2282736969 YAJMOLQTUCDNPB-UONOGXRCSA-N 400.262 -0.755 50 10 HBGE C[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284054257 ZXJFKRCWRKKLHN-WCBMZHEXSA-N 400.266 -0.841 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2Cc3ccccc3S2)n(C)c1=O 765726830 GSONSQVRGNOLAG-LBPRGKRZSA-N 414.447 -0.702 50 10 HBGE Cc1nnc2n1C[C@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1ccccc1Cl)C2 1176861488 ZPGIGIRIOBMXKG-CQSZACIVSA-N 419.873 -0.026 50 10 HBGE CN1C(=O)CO[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccnc1 1618145951 XORWGVGTFHBERG-JQHSSLGASA-N 412.402 -0.033 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2CCCS2(=O)=O)c1 1623994504 VUPWPEIEOQEEDR-LBPRGKRZSA-N 403.482 -0.335 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)ccc1=O 1627127857 WKOPJHDSTSUXSZ-UHFFFAOYSA-N 407.427 -0.774 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](CS(N)(=O)=O)C1 1660446714 DMRDPKXXSRVFMN-SNVBAGLBSA-N 404.876 -0.280 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2267062263 QOEOLRRRMRYWME-UONOGXRCSA-N 419.268 -0.055 50 10 HBGE C[C@H]1CN(C(=O)c2cn(C)nc2B(O)O)C[C@H](C)N1C(=O)OCc1ccccc1 2267070955 MGVFCOXOULAQHH-KBPBESRZSA-N 400.244 -0.029 50 10 HBGE C=C(CS(=O)(=O)N1CCC[C@]2(CN(C(=O)OC(C)(C)C)CCO2)C1)B(O)O 2282363629 PDTLBGJOSFGXND-INIZCTEOSA-N 404.294 -0.014 50 10 HBGE Cc1csc(CNC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1B(O)O 2360552067 WPBUGCXLCNQUCZ-SNVBAGLBSA-N 420.318 -0.710 50 10 HBGE Cn1cccc1C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 731598751 XIBGRLAQAJYJGA-MGPQQGTHSA-N 410.496 -0.104 50 10 HBGE COCCN1CCC[C@@H]1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 732467165 SEEYCJXOVRVAEC-CYBMUJFWSA-N 402.455 -0.012 50 10 HBGE CN1CCCc2cc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)ccc21 764812128 HBGTZAKPMNZMDL-UHFFFAOYSA-N 409.450 -0.034 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC(C)(C)C(F)(F)F)n(C)c1=O 795180259 UABZVEVAMRJYSO-UHFFFAOYSA-N 404.349 -0.440 50 10 HBGE C#CCO[C@@H](C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1137299186 MQOACIDLOLMJID-INIZCTEOSA-N 422.507 -0.513 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1ccc(B(O)O)cc1 1556326957 HUVFAUGGYRRACX-UHFFFAOYSA-N 400.624 -0.133 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC(=O)NCCN2C(=O)c2cccc(B(O)O)c2)C1 1648016999 XAJPCNHIKFNKPT-UHFFFAOYSA-N 403.244 -0.682 50 10 HBGE Cc1ccc(S(=O)(=O)N2CC(NC(=O)OCc3ccccc3)C2)c(B(O)O)c1 2255758719 OIZVGTROGVRTPU-UHFFFAOYSA-N 404.253 -0.026 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267201807 UAMGRFZAMQTULC-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC(NC(=O)OCc2ccccc2)CC1 2267203442 PXFHNYSDGPYATC-UHFFFAOYSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COCCN(S(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083605 JZNDMQFQUDZQOC-CYBMUJFWSA-N 400.262 -0.719 50 10 HBGE CN1CCN(S(=O)(=O)c2sccc2B(O)O)[C@@H](CNC(=O)OC(C)(C)C)C1 2282087745 WOLZMAGKWKRLED-NSHDSACASA-N 419.334 -0.743 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734772347 YHPJXLMLPQYNTJ-DUVNUKRYSA-N 409.464 -0.203 50 10 HBGE O=C(CNC(=O)OCc1ccccc1)NNC(=O)CS[C@H]1CCS(=O)(=O)C1 794062824 BWGQNDVGPDGQHD-ZDUSSCGKSA-N 415.493 -0.020 50 10 HBGE CCN(CC)Cc1ccc(C(=O)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)o1 920248580 JUHRLUINAWJKBH-JXMROGBWSA-N 403.439 -0.007 50 10 HBGE COC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)O1 1137298906 GJCPELKDOBIBTC-CVEARBPZSA-N 418.450 -0.688 50 10 HBGE O=C(CSCC(=O)N1CCOCC1)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1141421915 CENZGEVOEXORRO-OAHLLOKOSA-N 420.447 -0.823 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(NC(=O)C(F)(F)F)cc1 1306514286 OJEDCPCAXCNZLC-MRVPVSSYSA-N 410.374 -0.185 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1558459450 UVFQWMQYRBAVBR-UONOGXRCSA-N 400.476 -0.337 50 10 HBGE COC(=O)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1618795148 HVJLVYYAEDDJJY-UHFFFAOYSA-N 413.452 -0.649 50 10 HBGE COCCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)nn1 1622153695 PIPKTPMKBYFHNK-UHFFFAOYSA-N 415.498 -0.188 50 10 HBGE O=C(N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1)c1nscc1B(O)O 2255458110 MYSGTZPILUPPJR-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE O=C(NC[C@@H](NC(=O)c1ncc(B(O)O)cn1)C(F)(F)F)OCc1ccccc1 2267421213 DPQBWWLZQVHDOQ-GFCCVEGCSA-N 412.133 -0.257 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C1CC1 2282081976 GWLPGZRMBWKBAE-HNNXBMFYSA-N 402.282 -0.928 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)[C@H](C)CN1C(=O)OC(C)(C)C 2282368614 SRAHXSACBHMWTE-GHMZBOCLSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)NCc2ncc(B(O)O)s2)C1 2283988061 QEYCQOJTXJXFHU-UHFFFAOYSA-N 407.204 -0.944 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1C(=O)c2ccccc2C1=O 744649074 RSOSIWIXWDBVLB-KBPBESRZSA-N 407.448 -0.033 50 10 HBGE COCc1nc(Cl)cc(NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)n1 753972533 TWVLWZUGHCSBFZ-UHFFFAOYSA-N 405.802 -0.021 50 10 HBGE C[C@@H](CO)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1299926570 VVKDODZQFFPRSJ-GXTWGEPZSA-N 407.514 -0.888 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)COC1CC1 1348363636 XXEXDMXDJUEXMQ-UHFFFAOYSA-N 411.480 -0.034 50 10 HBGE O=C(NNC(=O)N1CCOCC1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1464538811 CZGCKLDOMJSYIB-LBPRGKRZSA-N 406.848 -0.948 50 10 HBGE COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)c2cc(B(O)O)ccc2F)C1 1467708366 XROMBEYVPVCONQ-CYBMUJFWSA-N 402.253 -0.982 50 10 HBGE CN1CCCC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1=O 1545424325 VTHBTFZCDBWFPK-QGZVFWFLSA-N 415.494 -0.150 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)NNC(=O)[C@H]3CCC(=O)N3)O2)C1 1565094657 KCZTYZNIWAMPQB-NWDGAFQWSA-N 411.459 -0.236 50 10 HBGE C=CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 1608469807 MNXGZSLOHLFWJY-UHFFFAOYSA-N 420.451 -0.440 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCCN(C)C2=O)CC1 1610948164 PJANMQYWGJUNBA-AWEZNQCLSA-N 424.527 -0.281 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@](=O)(=NC(=O)c2cc(B(O)O)sn2)C1 2267062757 SQWDQTHOUPCNIN-UAXLGHPASA-N 403.291 -0.024 50 10 HBGE C[C@@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2267378648 QZIUPNBKSPVKTO-ZJUUUORDSA-N 405.307 -0.360 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267609729 VGFJNWHIYPDABY-CBAPKCEASA-N 400.209 -0.495 50 10 HBGE CC(C)[C@H](CCNS(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282069436 PYBHFKIPCZYAOS-NSHDSACASA-N 404.298 -0.682 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282078407 INDLYYITWCBNGX-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282415072 BNAVKQKPHSJQIM-BMIGLBTASA-N 417.318 -0.358 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282420601 BNMXDWZCOLWQAQ-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE Cc1cnc(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)c1 2282487439 CQCQTJSUKKGUNM-SJORKVTESA-N 413.239 -0.116 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cccc(B(O)O)c2)C[C@@H]1NC(=O)OC(C)(C)C 2282722734 KYMIKLKHXABUGO-UONOGXRCSA-N 400.262 -0.721 50 10 HBGE Cc1cc(B(O)O)sc1CNC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2284055423 STZFIBSXUARYRK-GFCCVEGCSA-N 402.253 -0.328 50 10 HBGE CSCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 765727181 GCQJRUZCHUAJLJ-UHFFFAOYSA-N 400.526 -0.188 50 10 HBGE O=C1C[C@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1 1248484214 CRASMPNNBPSNNP-ZDUSSCGKSA-N 423.495 -0.059 50 10 HBGE CCc1nn(C)c(CC)c1C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1320193615 GJDGNIZOOGSAOC-UHFFFAOYSA-N 400.443 -0.558 50 10 HBGE O=C(NNc1ncc(Br)cn1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 1557235818 OPVXRHQWJRCZHW-LLVKDONJSA-N 413.276 -0.137 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 1630862966 VPYULKXZOZTDSE-UHFFFAOYSA-N 407.445 -0.584 50 10 HBGE CCS(=O)(=O)c1ccccc1CC(=O)NNC(=O)CNC(=O)c1cccnc1 1650867070 BIXUMSYMZXKOLX-UHFFFAOYSA-N 404.448 -0.005 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC1CC(CCNC(=O)OC(C)(C)C)C1 2282084045 SXABNTYXHSGUHL-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2282084470 WDUFNKSXLJQIMK-GHMZBOCLSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H]2CC[C@@H]21 2282345761 QZWRINVOZITSDW-RYUDHWBXSA-N 417.318 -0.264 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2F)CCO1 2282356231 ROOPEKCMOBSFOR-NSHDSACASA-N 404.225 -0.275 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)n1 2282365863 FYSYNXRHEKXHMS-MNOVXSKESA-N 402.282 -0.930 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1[C@H](OC)[C@@H](OC)CN1C(=O)OC(C)(C)C)B(O)O 2282376433 DONMTRMNQRZKQQ-AGIUHOORSA-N 408.282 -0.877 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2B(O)O)[C@H]2C[C@H]21 2282729940 VDOTXNJZWHFLLZ-OLZOCXBDSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2CN(S(=O)(=O)Cc3ncsc3B(O)O)C2)C1 2282860567 CLKAJHJSGZPLAU-UHFFFAOYSA-N 417.318 -0.549 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2362083990 HXHOFWIMRPWPJL-SNVBAGLBSA-N 404.298 -0.682 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 748284352 MAORWHNAQKWMDQ-WFASDCNBSA-N 420.447 -0.697 50 10 HBGE CN(C)S(=O)(=O)CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 752404776 CRAWNKOBMPMHMK-UHFFFAOYSA-N 407.493 -0.392 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(=O)c2ccc(Cl)cc2)n(C)c1=O 766638375 GCPXWFWPFIYRIK-UHFFFAOYSA-N 418.797 -0.883 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(C2CCC2)C2CCC2)n(C)c1=O 802762312 BAUIAHOYZAWCBV-UHFFFAOYSA-N 402.455 -0.203 50 10 HBGE Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1C 816873807 OXPAUSWJXKIKRY-AWEZNQCLSA-N 420.495 -0.027 50 10 HBGE Cn1cc(I)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n1 1135990295 LJNCPSODDCESHE-LURJTMIESA-N 412.209 -0.780 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(CO)CCOCC1 1149622675 RBOBIQVUOOXZCL-UHFFFAOYSA-N 404.467 -0.619 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCCOCC2)c1 1229209234 DDOBNZDKDGDQHM-UHFFFAOYSA-N 413.500 -0.397 50 10 HBGE Cn1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1=O 1289966980 PNAUBYOGOLCZSI-UHFFFAOYSA-N 405.436 -0.360 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN[C@@H]2C(=O)NCC23CCOCC3)cc1OC 1308108259 FFOKZFBJLYFRRV-MRXNPFEDSA-N 406.439 -0.650 50 10 HBGE C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)C1 1463774908 ZBMLPHNUFPMOEO-GJZGRUSLSA-N 405.279 -0.232 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCC(=O)N2C)CC1 1648592937 VZWFGUSGEGUEKC-CYBMUJFWSA-N 410.500 -0.528 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@@H]3[C@H]2CCCN3CCO)cc1OC 1655020000 NLSQTAFGSZGGMA-HZPDHXFCSA-N 406.483 -0.004 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ncccc1B(O)O 1913619307 UTQHOTWJCWHYRJ-UHFFFAOYSA-N 417.252 -0.175 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2267371985 IFCXLYICPMBACK-ZJUUUORDSA-N 405.307 -0.597 50 10 HBGE CC(C)(C)OC(=O)N1CCSC(C)(C)[C@@H]1C(=O)N=c1nc(B(O)O)[nH]s1 2268703009 ZAUPRZJHRLGHNU-QMMMGPOBSA-N 402.307 -0.291 50 10 HBGE 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CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)c1ccc(B(O)O)cc1 2369652912 SLRVEURGLYRZGW-ZIAGYGMSSA-N 402.253 -0.056 50 10 HBGE CN(C)S(=O)(=O)n1ccnc1C=NNC(=O)c1csc(N2CCOCC2)n1 814752130 YUZILOZNBKLODJ-UHFFFAOYSA-N 413.485 -0.405 50 10 HBGE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(=O)n(C)c3)C2=O)cc1 1179623124 CORUAWBOLKNJHY-FQEVSTJZSA-N 411.418 -0.078 50 10 HBGE COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@@H]3CCC(=O)N3)C2=O)c(OC)c1 1312666632 VLYVQKPUVZXEER-KBPBESRZSA-N 419.438 -0.586 50 10 HBGE CN(C)S(=O)(=O)CCC(=O)N1CCN(S(=O)(=O)CBr)CC1 1446928517 LSXXINUAGXCOHF-UHFFFAOYSA-N 406.324 -0.906 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1cc(Br)ncn1 1594711741 SSQDZSDQHXMHEB-ZETCQYMHSA-N 404.250 -0.217 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=CS(=O)(=O)CCC2)c1 1623993696 NFPHCCGWDSINPV-UHFFFAOYSA-N 401.466 -0.210 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CC3(O)CCOCC3)cc2)CC1 1630968111 ZPTNLYDJNWDMKC-UHFFFAOYSA-N 412.512 -0.003 50 10 HBGE COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc(=O)n(C)c2)CC1 1645962799 ZUPXKWNHVWPDHQ-UHFFFAOYSA-N 408.455 -0.516 50 10 HBGE C[C@@H]1CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)CC[C@@H]1NC(=O)C(F)(F)F 2195882548 BCCOYNKRYKCDJI-CHWFTXMASA-N 419.853 -0.104 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2267627118 SWZVYHUCUXVZEA-JTQLQIEISA-N 405.307 -0.358 50 10 HBGE COC1(CCNC(=O)c2ncccc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2281755918 DUKHMJPFWVUWDI-UHFFFAOYSA-N 413.239 -0.081 50 10 HBGE CC[C@@H]1[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282070000 XPQWVMXICUYPDW-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@@H](O)C1 2282097396 FGTVAYCGNVNETF-KBPBESRZSA-N 400.262 -0.985 50 10 HBGE C[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282341311 QFYLWKHFULEXSE-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2282373927 UDWBSCQJULSBJH-VIFPVBQESA-N 414.236 -0.184 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2282711663 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O=C(NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1)c1ccc2c(c1)OCCO2 1624649215 ZDQPOJMHJACPSG-LBPRGKRZSA-N 404.354 -0.456 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1sccc1B(O)O 2267202544 DOSYHZSRTICFJT-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)sc1B(O)O 2267390045 YAXKTUIBHMEWPR-IAZYJMLFSA-N 402.303 -0.120 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1c(B(O)O)cnn1C 2282064797 FLIYTMATXJKXBZ-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)n1 2282224641 NULCQWXRXCEPOP-MHZLTWQESA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)c2ccc(F)c(B(O)O)c2)C1 2282350113 IWTOKTXKELOJTR-UHFFFAOYSA-N 406.216 -0.257 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282368263 NIZJDOOAHMSYCT-MGPLVRAMSA-N 400.237 -0.207 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COCCN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282731887 XYMNIJJTJUVSDC-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282848328 MGZYTPAJPJWENV-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ncc(B(O)O)s1 704380231 IPNQNMFIWZTBFA-UHFFFAOYSA-N 423.281 -0.113 50 10 HBGE O=C(NCc1cccc(OCCN2CCOCC2)c1)NNC(=O)[C@H]1COCCO1 745781125 PHCAWSZQHKUFDK-QGZVFWFLSA-N 408.455 -0.357 50 10 HBGE O=C(CCc1cn[nH]c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1160403847 VHIFSNAYEDAPSY-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE O=C(CN1CCS(=O)(=O)[C@H]2COCC[C@@H]21)NNC(=O)c1ccccc1Cl 1195002513 FVZXVZCGOGVRDY-KBPBESRZSA-N 401.872 -0.011 50 10 HBGE CO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1CCOC1 1252900134 JSFPGDSXQSMQRE-ZFWWWQNUSA-N 414.484 -0.068 50 10 HBGE CN(C)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)N=S(C)(C)=O)c1 1255553941 AZSCOOKMRNPIII-UHFFFAOYSA-N 405.502 -0.246 50 10 HBGE C=CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)CN2CCCC2=O)s1 1302583505 UZGUTPPNOOUYIR-UHFFFAOYSA-N 400.482 -0.475 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cn1 1303284056 MPQPAMWKINLYFZ-QGOIZSIMSA-N 419.463 -0.041 50 10 HBGE O=C(NNC(=O)c1ccc(C(=O)N2CCOCC2)cc1)N[C@H]1CCS(=O)(=O)C1 1583281175 PFMPABUCHGFZTE-AWEZNQCLSA-N 410.452 -0.710 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2ncc(Br)cc2B(O)O)C1 2217204227 GYEKZPFISAPWOK-GHMZBOCLSA-N 402.054 -0.084 50 10 HBGE CC(C)(C)OC(=O)NCCCN(CCO)S(=O)(=O)c1cc(B(O)O)cs1 2267614307 MCMGEIHBNPAFHY-UHFFFAOYSA-N 408.307 -0.674 50 10 HBGE CC(C)(C)OC(=O)N1CC(CNC(=O)c2scc(B(O)O)c2Cl)(C(N)=O)C1 2281788059 WBDPHHUCZFRLFS-UHFFFAOYSA-N 417.680 -0.467 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281837924 MXDKYBYUJALMJC-YKBSNTEPSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282717568 LIGBKBJWOYAUMR-YPMHNXCESA-N 400.262 -0.816 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(C)c(B(O)O)s1 2282737841 LUHJUAUEQMRPQB-QWRGUYRKSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]1C2 2359281365 NIKWJQZIIZBZRR-ZIBATOQPSA-N 418.302 -0.469 50 10 HBGE C/C(=C\c1ccc(C)cc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 778688002 HNXNOQUXKSMSNP-UKTHLTGXSA-N 410.434 -0.007 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)ccc1=O 1134637243 LMVUNZIPKTUNHA-HXUWFJFHSA-N 409.402 -0.460 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2S1(=O)=O 1465398071 JNGQZABBZOTXEL-UHFFFAOYSA-N 415.378 -0.050 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 1586191206 ONOJDFDUGFJIBW-UHFFFAOYSA-N 417.387 -0.824 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)c2cc(B(O)O)ccc2F)c2ccccc2c1=O 1618241445 NYSFCZJLVBIMDK-UHFFFAOYSA-N 412.186 -0.129 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)Cc1cc2c(cc1Br)OCCO2 1630863111 XOFZACSFOOJKBE-UHFFFAOYSA-N 407.242 -0.045 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)C1=O 1638110355 XYRQLSXJWPJFOO-LLVKDONJSA-N 413.452 -0.047 50 10 HBGE Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)CS(C)(=O)=O 1642619611 NMAAAMUMAJOLGB-UHFFFAOYSA-N 405.498 -0.123 50 10 HBGE COC1(CNS(=O)(=O)c2ccc(B(O)O)s2)CN(C(=O)OC(C)(C)C)C1 2267207036 OJGFTZQYVUOSKN-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE Cc1cnc(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)c1 2281867237 UWFBTXVUYSHVDC-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1 2281905526 BSQIUMRQMXGZKQ-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2282335141 LJZCDYFTGKYOSM-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)NCCn1cc(NS(=O)(=O)c2cscc2B(O)O)cn1 2282359223 KVTVYPFXJLXBTP-UHFFFAOYSA-N 416.290 -0.050 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(F)cc1B(O)O 2282360419 CGTZAKWWGDEPHE-LQJRIPTKSA-N 400.237 -0.208 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H](CNC(=O)OC(C)(C)C)C1 2282706562 NGPMNOMCJRIIOV-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2CC[C@@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282728628 UEFFPLYOZCLRPO-STQMWFEESA-N 400.262 -0.291 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H]2C[C@@H](C1)[C@@H](CO)[C@H]2NC(=O)OC(C)(C)C)B(O)O 2359281725 XACDZMRLWRJQRC-DGAVXFQQSA-N 404.294 -0.662 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(C)cc1B(O)O 2365422303 SPWWMKCPYRYKSX-GFCCVEGCSA-N 402.278 -0.507 50 10 HBGE CCOC(=O)C1(O)CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1 746463187 QUBLKBHZAKNBAL-UHFFFAOYSA-N 409.439 -0.145 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H]2COCCO2)cc(Br)cc1S(N)(=O)=O 747413261 LJIAYJIQSVPILS-SNVBAGLBSA-N 422.257 -0.419 50 10 HBGE O=C(CC1(CC(=O)NNC(=O)[C@H]2CCCO2)CCCC1)NNC(=O)[C@H]1CCCO1 817214645 CQSGBSYTAFRVNM-ZIAGYGMSSA-N 410.471 -0.020 50 10 HBGE NS(=O)(=O)c1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)co1 1295729723 HVCYSZOGNKGUSK-UHFFFAOYSA-N 416.275 -0.633 50 10 HBGE C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1(S(C)(=O)=O)CC1 1323137726 LRHBHRQXPMGGEA-JTQLQIEISA-N 403.482 0.000 50 10 HBGE O=C(NCCN1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1)c1ccccc1F 1543272362 LVFISJVKLNCZIP-UHFFFAOYSA-N 417.221 -0.168 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=S)NCCc1cccs1 1623681562 LNNFCUIAWITROD-JTQLQIEISA-N 416.554 -0.114 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(c2cccc(F)c2)C1 1654295129 WMCLRHBUZCUMSB-WDEREUQCSA-N 400.432 -0.346 50 10 HBGE C[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)C1CN(C(=O)OC(C)(C)C)C1 2267411242 WKJCWNVLJDQUOM-SECBINFHSA-N 405.307 -0.502 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282081103 AHFWFPLRSNDDEP-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282707124 VDIWLQVVQUFDMF-UONOGXRCSA-N 400.262 -0.673 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@H]1CCCN1C(=O)OC(C)(C)C 2282713743 JCMNPYPSDHYEPL-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)C1CN(C(=O)OC(C)(C)C)C1 2282724628 NYHSTSOEFHRIMW-UHFFFAOYSA-N 400.262 -0.385 50 10 HBGE CCOc1c(F)cccc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766635561 FDDBBLNXOYSSGO-UHFFFAOYSA-N 418.385 -0.567 50 10 HBGE O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)[C@H]1CCc2nncn2C1 816884111 RHRZJHDOCVDRRJ-GDXASINISA-N 418.479 -0.032 50 10 HBGE CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CCN1C(=O)CCNC1=S 1137975396 FLTDHIJOOPOYFA-UHFFFAOYSA-N 401.489 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)NNC(=O)[C@H]2CCCO2)C1 1450396721 HVZPESVEAINLRC-VXGBXAGGSA-N 405.473 -0.263 50 10 HBGE CC(C)NC(=S)NNC(=O)CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1 1463686132 HZRTZXSRWLASCA-UHFFFAOYSA-N 408.527 -0.728 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)NNC(=O)[C@H]3CCC(=O)N3)O2)C1 1565094659 KCZTYZNIWAMPQB-VXGBXAGGSA-N 411.459 -0.236 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)cc2)CC1 1566550094 QXJFUMBCBGOZIH-KGLIPLIRSA-N 409.512 -0.033 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@@H]1CN(C)C(=O)CN1C(=O)OC(C)(C)C 1587329347 DGBHRDJAKUQSHU-LBPRGKRZSA-N 417.532 -0.062 50 10 HBGE CO[C@H]1CS(=O)(=O)C[C@@H]1NC(=O)NNC(=O)c1cc(Br)cn1C 1636814948 PBMBXRSNQGOUBD-WPRPVWTQSA-N 409.262 -0.456 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1sccc1B(O)O 2267202182 YXSVSOLGDWDMMN-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE CCn1cc(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)nc1B(O)O 2281642525 XVTOQGWWOAZBQH-HNNXBMFYSA-N 416.243 -0.650 50 10 HBGE COCC[C@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2282338581 OJZTVQAEJUSGNI-SNVBAGLBSA-N 423.322 -0.828 50 10 HBGE CN(CC(C)(C)CNS(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282704778 OWVRCZKMXQWEAG-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282731898 YAZWADIGHPUSRJ-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(B(O)O)s1 2283971511 YFFFBPLSVMOMBP-GFCCVEGCSA-N 400.262 -0.157 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1cncc(B(O)O)c1 2369652505 NRJFFRPQPMVIBG-QWHCGFSZSA-N 403.241 -0.661 50 10 HBGE C[C@@H]([C@H](C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)S(C)(=O)=O 1137299191 MSZFONRYHQOYKV-GJZGRUSLSA-N 424.523 -0.339 50 10 HBGE COC(=O)N(C)NC(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1 1312829275 BJWHIFNRXFSHSG-UHFFFAOYSA-N 400.413 -0.257 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cn(C)nn2)CC1 1472517924 PTUUAQXNODHKHD-UHFFFAOYSA-N 408.488 -0.778 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 1558927062 GLEHQBRPKJJJKM-LJWDBELGSA-N 400.432 -0.570 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C[C@H]3CCOC3)nn2)c1 1586905627 YUXUYBJINCEDGC-GFCCVEGCSA-N 422.467 -0.360 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)[C@H]2COCCO2)CN(C(=O)OC(C)(C)C)CCO1 1587237799 BJIQILWXUHPGHW-SJKOYZFVSA-N 403.432 -0.798 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NCCSS(C)(=O)=O)c1 1588190733 MTVBNZRPBBBKFX-UHFFFAOYSA-N 423.538 -0.524 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 1630862166 ASSHMWIAVTTWJK-LRDDRELGSA-N 415.468 -0.092 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NCCSS(C)(=O)=O)cc1OC 1643367209 FKAFIIDMPOZLAR-UHFFFAOYSA-N 412.511 -0.209 50 10 HBGE C[C@]1(NC(=O)C(F)(F)F)CCN(CC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Cl)C1 1884252066 FDEIKLXFXHYBNX-AUTRQRHGSA-N 405.826 -0.350 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)C[C@H]1NC(=O)OC(C)(C)C 2267613298 AZUDNPMJAXJZEI-GHMZBOCLSA-N 406.291 -0.660 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282085593 AHGYGZVFDJQFHE-UONOGXRCSA-N 416.330 -0.004 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@@H]2COC[C@H]21 2282703603 YOOSZAUVXYJULX-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)NCCn1cc(NS(=O)(=O)c2ccc(B(O)O)s2)cn1 2282713337 DAIUEBLCYBGEIO-UHFFFAOYSA-N 416.290 -0.050 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282850167 LTQKGZQLYRGAFU-GHMZBOCLSA-N 402.253 -0.055 50 10 HBGE Cc1cc(CNC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)sc1B(O)O 2360552111 WZYSJXGLKFMWKJ-LLVKDONJSA-N 420.318 -0.710 50 10 HBGE COCCCNC(=O)NNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 755161839 GBGNWNJVYNGGSV-LBPRGKRZSA-N 401.464 -0.131 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2c[nH]c3cccc(F)c23)n(C)c1=O 761953132 NPHMJEFKWVBQLA-UHFFFAOYSA-N 413.369 -0.485 50 10 HBGE O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)CN1CCOCC1=O 790889434 AKHRQXJSCKQKAY-UHFFFAOYSA-N 423.901 -0.536 50 10 HBGE O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCN(C(=O)COc2ccccc2)C1 802467591 AVLBDNBBUOKGTR-AWEZNQCLSA-N 403.439 -0.381 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)cc1S(=O)(=O)N1CCCC1 1131507756 FFWHRFRZWRGCMM-GFCCVEGCSA-N 410.452 -0.481 50 10 HBGE COC(=O)C1CC2(C1)C[C@@H](NC(=O)NNC(=O)C1CCOCC1)CCS2(=O)=O 1251484671 KSGPXUKZMRGCMU-JZLYGMAVSA-N 417.484 -0.358 50 10 HBGE CNS(=O)(=O)C[C@H]1CCCN(CC(=O)NNC(=O)Cc2nc(C)cs2)C1 1560042052 DQZJOUAGSQFSID-LBPRGKRZSA-N 403.530 -0.597 50 10 HBGE COC(=O)c1ccsc1N1CC[C@@H](NC(=O)c2cc(B(O)O)ccc2F)C1=O 1587731329 AGEKMOLTTZNGNP-CYBMUJFWSA-N 406.200 -0.111 50 10 HBGE COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)CS(C)(=O)=O 1634356000 XOUOLFHMDDEUKP-UHFFFAOYSA-N 403.482 -0.653 50 10 HBGE COC(=O)[C@H](CCNS(=O)(=O)c1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2282080498 KMAYEBBJIXPBRS-VIFPVBQESA-N 422.290 -0.837 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)n1 2282240972 OYDXHHWXDPTMBR-BLBHWQHRSA-N 400.266 -0.747 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1C[C@@H]1CNC(=O)OC(C)(C)C 2282362170 BTBHSUXQCKINFI-ZYHUDNBSSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)N[C@H]1CCC=C1B(O)O 2283961455 DNQDAOCNKKMXBB-YPMHNXCESA-N 402.278 -0.372 50 10 HBGE COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1 749840120 LJWYMCWFROVZDF-MRXNPFEDSA-N 421.454 -0.593 50 10 HBGE O=C(NNC(=O)N1CCN2C(=O)OCC[C@@H]2C1)c1csc(N2CCOCC2)n1 763460016 DDDLADIPBLKPSE-LLVKDONJSA-N 410.456 -0.139 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)nc1I 1131722437 FLGNJJAMHPMYEX-ZCFIWIBFSA-N 404.164 -0.266 50 10 HBGE CN1CCN(S(=O)(=O)c2cccc(NC(=O)c3ccc(B(O)O)cc3)c2)CC1 1136383086 ZPLNEXCNRSGJEO-UHFFFAOYSA-N 403.269 -0.445 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@H]2CCCCO2)c1 1274118653 HRLWPCQLDPJBQH-CQSZACIVSA-N 414.484 -0.405 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCc3ccccc3C2)n(C)c1=O 1294587997 VPEVDBWWSMQXSJ-AWEZNQCLSA-N 410.434 -0.614 50 10 HBGE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)c2C1 1456037986 LMYXGKJFMCWRMR-PBHICJAKSA-N 418.498 -0.404 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cncc2nc(C(F)(F)F)n(C)c12 1472505447 VPCIUBYGGGAFAU-ZCFIWIBFSA-N 408.362 -0.314 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@]2(OC)CCS(=O)(=O)C2)c2ccccc2c1=O 1540305432 SNHQLSGAGVYROI-KRWDZBQOSA-N 408.436 -0.619 50 10 HBGE CN1CCN(C)CC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1 1540354022 AUCGTGUPWXOFJW-UHFFFAOYSA-N 402.543 -0.161 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(Br)cc1-n1cncn1 1642619431 KIUUNTISELBKFL-UHFFFAOYSA-N 402.230 -0.165 50 10 HBGE CCc1nn(C)c(C(=O)N[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)c1B(O)O 2267019774 TVYVZKCQBUNCHQ-LSDHHAIUSA-N 400.244 -0.151 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282356938 CFKWJMAWQNFSQC-VHSXEESVSA-N 423.297 -0.410 50 10 HBGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2282377418 QJGRZDFJGXDPEU-LLVKDONJSA-N 419.334 -0.016 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 2282380124 DQLBQGQCJDLWHO-GASCZTMLSA-N 407.326 -0.284 50 10 HBGE CC(C)[C@H](CCNS(=O)(=O)c1nn(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282737848 LWIUICBQVQCVKW-LBPRGKRZSA-N 404.298 -0.682 50 10 HBGE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 805836290 IBMNMSUPVBNXJO-WFASDCNBSA-N 412.468 -0.029 50 10 HBGE CC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816883008 ROHOKABOTQIGMK-LASWEOPPSA-N 403.443 -0.511 50 10 HBGE NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNC(=O)CC(F)(F)F)CC2=O)c1 1163247692 KOQQYJSMASONTN-QMMMGPOBSA-N 408.358 -0.213 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1 1306514750 ZEKHBIDFMWRHCW-AAEUAGOBSA-N 406.468 -0.407 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1457689916 TXXKRMLNXYHKLS-NXEZZACHSA-N 408.358 -0.818 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NCC1(S(=O)(=O)N(C)C)CC1 1479333517 XBLRNXVMOTYPTI-UHFFFAOYSA-N 400.457 -0.172 50 10 HBGE C=CCNC(=S)NNC(=O)CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1 1540371610 NBGUNTBRIUSCJD-UHFFFAOYSA-N 406.511 -0.950 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H](O)C1 2267613375 WOPMKABBZMOZEY-JTQLQIEISA-N 406.291 -0.970 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713087 ZTMMHYHVLRSREM-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1CNC(=O)OC(C)(C)C 2282739513 KNDAMJIBXDEDRW-QWRGUYRKSA-N 419.334 -0.255 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1 2337290970 AFLYPNJPGILVSQ-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE CN(Cc1ccc(B(O)O)s1)C(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360551627 QORAUZBKRFLBOP-LLVKDONJSA-N 420.318 -0.676 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)n1C 2362566672 MYRPVULBNPAOFL-FLESLCNUSA-N 400.266 -0.686 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cnn[nH]2)(c2ccccc2)CC1 729457692 MTUPORCFNUWQFO-UHFFFAOYSA-N 406.468 -0.051 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734772349 YHPJXLMLPQYNTJ-IVMMDQJWSA-N 409.464 -0.203 50 10 HBGE C=CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 780895806 GLEKWNHUVSGJHK-UHFFFAOYSA-N 412.468 -0.146 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)ccc1=O 1157844143 GXTIBSDSEROYKQ-UHFFFAOYSA-N 413.438 -0.935 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC(C(=O)NNC(=O)[C@H]3CCC(=O)N3)=NO2)C1 1454061107 JWQRBMYKLOHUSW-ADLMAVQZSA-N 409.443 -0.042 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1S(=O)(=O)N(C)C 1463155847 HSCHIOBODGDCDC-UHFFFAOYSA-N 408.436 -0.281 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCC(=O)C3)CC2)cc1 1545424097 LWAYEYYKEWWJRI-HNNXBMFYSA-N 422.507 -0.182 50 10 HBGE 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COCCO[C@H](C)C(=O)NNC(=O)NCc1cccc(N(C)S(C)(=O)=O)c1 1687814941 CMGDJQPHMSWVKI-GFCCVEGCSA-N 402.473 -0.036 50 10 HBGE CN(C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)S(=O)(=O)c1ccc(B(O)O)s1 2267205933 YHVNJHKWRWTZOP-UWVGGRQHSA-N 402.303 -0.086 50 10 HBGE CCC[C@@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267711750 PNBZSDVAIOVNMN-JTQLQIEISA-N 407.323 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2cc(B(O)O)c[nH]2)CC1 2281610813 KKCIMHZAMADYDK-MHZLTWQESA-N 400.266 -0.600 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282334428 AYGBZFIRLLEKNR-UWVGGRQHSA-N 423.297 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282739796 PUTLJFJTCFTHAM-AREMUKBSSA-N 424.281 -0.183 50 10 HBGE CC(C)(C)OC(=O)NCC1(CNS(=O)(=O)Cc2ncsc2B(O)O)CCC1 2282740986 IGCCLGRXVVVGOC-UHFFFAOYSA-N 419.334 -0.063 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 2283950179 IGKBPHDBVQAHKD-WPRPVWTQSA-N 400.266 -0.889 50 10 HBGE CCOc1c(OC)cc(/C=N/NC(=O)CCc2n[nH]c(=O)[nH]c2=O)cc1[N+](=O)[O-] 169892487 YZDSCPJUDUPVTL-CAOOACKPSA-N 406.355 -0.143 50 10 HBGE CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)n1 746004417 WMNAYOGUOIAPSM-CHWSQXEVSA-N 412.447 -0.559 50 10 HBGE COc1ccc(/C=C\C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 765729438 BTHLBZZPSUKDMH-TWGQIWQCSA-N 412.406 -0.697 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)COCc2ccccc2)C1 805140930 SDJRJBHDVVYMBC-OAHLLOKOSA-N 413.500 -0.196 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)nn3)c2)C[C@@H](C)O1 1131111247 BLGFSUFSTANVJR-VXGBXAGGSA-N 422.467 -0.312 50 10 HBGE COC[C@]1(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)CN(C(=O)OC(C)(C)C)CCO1 1454062691 MCWPQMNCEASWEW-GTNSWQLSSA-N 400.432 -0.935 50 10 HBGE NS(=O)(=O)c1ccc(N2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)cc1 1464182395 WFKUVVOJHUZWQJ-UHFFFAOYSA-N 407.232 -0.885 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@H]1CCC(=O)N1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1533743952 ARWKXGOVZSZGAO-YVECIDJPSA-N 410.496 -0.291 50 10 HBGE Cc1nc(CS(C)(=O)=O)sc1CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1540554931 RWNSVCAQMOVULM-VIFPVBQESA-N 409.511 -0.879 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@@H](C(=O)NNC(=O)N2CCOCC2)C1=O 1542427329 QMHQVHCPXBLRGP-ZDUSSCGKSA-N 413.475 -0.177 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CC(F)(F)C(F)(F)F)n(C)c1=O 1630996641 OQVVXJRBBJCVPF-UHFFFAOYSA-N 412.275 -0.831 50 10 HBGE COCCn1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1 1641071007 DHSKPLXKACNHMB-UHFFFAOYSA-N 409.468 -0.080 50 10 HBGE O=C(CN1CCO[C@]2(CCS(=O)(=O)C2)C1)NNC(=O)c1ccccc1Cl 1654017368 YCHYBNCVPYRDFE-MRXNPFEDSA-N 401.872 -0.010 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NS(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2267613658 DZQSAACLGIALDY-GARJFASQSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2271974902 HJOAKIZKERMBIN-VHSXEESVSA-N 405.307 -0.454 50 10 HBGE Cn1nc(C(=O)N[C@@]2(CF)CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281662782 AVNYFQOAKURFNK-OAHLLOKOSA-N 404.635 -0.168 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282068660 GGCFAAFAIPLBTJ-HNNXBMFYSA-N 420.318 -0.268 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1C[C@@H](O)C[C@H]1CNC(=O)OC(C)(C)C 2282368972 YQOMWOVSVYTOGJ-QWRGUYRKSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)NCCc1nnc(NS(=O)(=O)c2cscc2B(O)O)o1 2282425020 JUSNCQDPLAWPLV-UHFFFAOYSA-N 418.262 -0.321 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(NS(=O)(=O)Cc2ccsc2B(O)O)n[nH]1 2282857301 GLHWRVBTLCIDSW-UHFFFAOYSA-N 417.278 -0.487 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1ccc(B(O)O)cc1O)OCc1ccccc1 2282874976 IWJTWMKWQSZWDK-IRXDYDNUSA-N 414.223 -0.114 50 10 HBGE COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1 745979579 WUHMCYYVFZCWKX-LLVKDONJSA-N 423.241 -0.039 50 10 HBGE CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 812881180 MMJZUCJSEIWPOB-ZFWWWQNUSA-N 424.479 -0.644 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NN(C)C[C@H](C)O 1141853662 WUZWRDBRDMCCAE-JSGCOSHPSA-N 401.485 -0.428 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1303882805 HCKWTAXELBTSHA-AWEZNQCLSA-N 411.503 -0.803 50 10 HBGE COCCCNC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)OC(C)(C)C)CC1=O 1464489978 ZBQJCYNGSFRGRK-GFCCVEGCSA-N 401.464 -0.179 50 10 HBGE C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C 1564797235 MWYZFKUKYCBGBY-JTQLQIEISA-N 407.880 -0.166 50 10 HBGE CSC[C@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1630862941 VFAZLCVPQWGTPY-GMTAPVOTSA-N 405.498 -0.915 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc(Br)c2ncc(C=O)n2c1 1648000127 RBPOAJQHJBDDTB-UHFFFAOYSA-N 403.214 -0.285 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 1670983874 HYBAWKOJUXKEDI-ACJLOTCBSA-N 421.479 -0.057 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cscc2B(O)O)C1 2267385061 HRBXNRDSOSBBPJ-JGVFFNPUSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2282383741 DAVHHEXYLUWNSK-WCABBAIRSA-N 420.680 -0.848 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C[C@@H]1NC(=O)OC(C)(C)C 2282706219 JGFQWNBZNAFHIO-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE CO[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282712863 WVQLKUVLVYNPBC-VXGBXAGGSA-N 420.318 -0.269 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccccc1B(O)O 2282720371 ZGIDUOYSFSFYPR-LBPRGKRZSA-N 400.262 -0.072 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2282726122 MYICDLJSQQNEMH-OAHLLOKOSA-N 422.696 -0.426 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C 2283963494 LXDJEBFWLWRRRT-JQWIXIFHSA-N 400.310 -0.203 50 10 HBGE CC[C@H]1CCCC[C@@H]1OCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 768273975 BQECROUNNDITAX-STQMWFEESA-N 420.470 -0.434 50 10 HBGE CCC(=O)NNC(=O)[C@@H](C)N1CCN([C@H]2CCCN(c3cc(C)nn3C)C2=O)CC1 780566204 QNQSJEHBWGXGPD-CVEARBPZSA-N 419.530 -0.213 50 10 HBGE COCC[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 812574029 AXEZCMVHHSVKPD-ZDUSSCGKSA-N 402.473 -0.068 50 10 HBGE COC(=O)CN(CCN1CCOCC1)CC(=O)NNC(=O)c1ccc(C#N)cc1 1191099811 PAMHNUPEHCFNDP-UHFFFAOYSA-N 403.439 -0.874 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 1539401384 BZYHNSLIQQAWGS-PEBVRCNWSA-N 419.500 -0.017 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCN1CC(F)F)c1csc(N2CCOCC2)n1 1540330997 FEOUEUKFYQRNLS-NSHDSACASA-N 405.427 -0.293 50 10 HBGE CN1CCN(S(=O)(=O)c2cccc(NC(=O)c3cccc(B(O)O)c3)c2)CC1 1542270320 YLUWDORMCSMBAH-UHFFFAOYSA-N 403.269 -0.445 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O 1652258184 LVPHQACEWBYKRU-NWDGAFQWSA-N 404.489 -0.043 50 10 HBGE Cn1cc([C@@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1 1658523844 FVCHJQAVIFZLTL-WNNBVUDTSA-N 420.451 -0.105 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1cc(B(O)O)cs1 2267606793 CXGQXPFFXPEKKK-CBAPKCEASA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)[C@@H](CO)C1 2282074488 MOHJPUNKVYMOEP-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE COCC1(NC(=O)OC(C)(C)C)CC(NS(=O)(=O)c2sccc2B(O)O)C1 2282084418 VVPBBUFJZZPDHH-UHFFFAOYSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(B(O)O)cc1Cl 2282356329 SWDPFAKGPNFGKS-UHFFFAOYSA-N 422.696 -0.473 50 10 HBGE Cn1cc(C(=O)N2CC=CCC23CN(C(=O)OCc2ccccc2)C3)c(B(O)O)n1 2282386832 UWUVBABNCDWAHH-UHFFFAOYSA-N 410.239 -0.107 50 10 HBGE Cc1nc(S(=O)(=O)N(C)C2CC(NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282867606 BHGYIFCMCZEJDP-UHFFFAOYSA-N 402.282 -0.915 50 10 HBGE Cc1cc(B(O)O)c(CNC(=O)[C@H](F)C2(O)CN(C(=O)OC(C)(C)C)C2)s1 2284032921 BJCWSMGPJYGRFE-LBPRGKRZSA-N 402.253 -0.328 50 10 HBGE CC(C)(C)OC(=O)n1cc(B(O)OC(C)(C)C(C)(C)O)c2cc(B(O)O)cnc21 200309689 GLVMCKIAYNLFCE-UHFFFAOYSA-N 406.053 -0.247 50 10 HBGE COCCN1C(=O)/C(=C\NNC(=O)c2ccc(OC)cc2OC)C(=O)NC1=S 730035669 BWNWFWGYYPDKDN-XFXZXTDPSA-N 408.436 -0.288 50 10 HBGE NS(=O)(=O)c1ccc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Br 807959148 OAFXQWYGHXKSIV-VIFPVBQESA-N 424.298 -0.019 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CS1(=O)=O 1478930946 AWNNNPIKXZJKGA-WDEREUQCSA-N 417.513 -0.111 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NC[C@]1(OC)CCS(=O)(=O)C1 1479382709 WODHCHYWPRIJPV-MRXNPFEDSA-N 401.441 -0.392 50 10 HBGE CCCN(CCC)S(=O)(=O)N1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1635969105 QKWSOAZPBHBMFW-UHFFFAOYSA-N 415.296 -0.370 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2cccn3c(I)cnc23)N1 1642269813 BZKIQOOJXOWZHC-MRVPVSSYSA-N 413.175 -0.022 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267203230 NRKLRZUUPLXVAT-SFYZADRCSA-N 400.209 -0.495 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1ccc(B(O)O)cc1 2369652911 SLRVEURGLYRZGW-UONOGXRCSA-N 402.253 -0.056 50 10 HBGE CC(=O)NNC(=O)C[S@@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2 586298747 GGXVFMQNWWMTPG-SANMLTNESA-N 400.482 -0.420 50 10 HBGE O=C(Cn1cc(Br)c(O)nc1=O)NNC(=O)[C@@H]1Cc2ccccc2O1 748281560 ZYSRWXOMLHWUOU-NSHDSACASA-N 409.196 -0.138 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCOc2ccc(F)cc2)n(C)c1=O 765721446 AYUHOOZWWYFFJF-UHFFFAOYSA-N 418.385 -0.811 50 10 HBGE CO[C@H]1COCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1251272845 MZSNHXXEVYJTDD-ZFWWWQNUSA-N 414.484 -0.068 50 10 HBGE O=C(NNc1ncc(Br)cn1)[C@H]1CC(=O)N(CCN2CCOCC2)C1 1557235819 OPVXRHQWJRCZHW-NSHDSACASA-N 413.276 -0.137 50 10 HBGE COc1cccc(C[C@H](C(=O)NNC(=O)CN2CCCC2=O)n2nnnc2C)c1 1632321048 NLMQPPGSIOFSBB-OAHLLOKOSA-N 401.427 -0.456 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1nscc1B(O)O 2255451873 AQSRMNNKIBGRGM-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1sccc1B(O)O 2267199334 KUTQWOLOTJPYDN-VXNVDRBHSA-N 400.209 -0.352 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(B(O)O)n1C 2282332058 VUVKFPCDEFKBID-JTQLQIEISA-N 402.282 -0.962 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282355963 NTPRYVWYDOREFU-QWRGUYRKSA-N 400.237 -0.112 50 10 HBGE N#CC(=CN1CCN(S(=O)(=O)c2ccccc2)CC1)C(=O)N(CCO)CCO 2318469419 VCPWWJUOIXOJKR-UHFFFAOYSA-N 408.480 -0.786 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@](F)(CNC(=O)c2cnsc2B(O)O)C1 2362567046 AJYKFPWXFSGXLG-HNNXBMFYSA-N 403.241 -0.472 50 10 HBGE COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]2COCCO2)C1=O 771266009 NPQPUEPCCCDRMI-SCLBCKFNSA-N 406.395 -0.975 50 10 HBGE O=C(Cc1ccc(CC(=O)NNC(=O)[C@H]2CCCO2)cc1)NNC(=O)[C@H]1CCCO1 817214341 LEPLTIDXNHJFMA-HZPDHXFCSA-N 418.450 -0.576 50 10 HBGE O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)C1CCN(c2ncccn2)CC1 1136718569 XLBIQGJRAFUPBX-CYBMUJFWSA-N 413.525 -0.239 50 10 HBGE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(=O)n(C)c3)C2=O)cc1 1179623125 CORUAWBOLKNJHY-HXUWFJFHSA-N 411.418 -0.078 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)N1 1469889203 QZSQTACXRHYBCB-LBPRGKRZSA-N 413.431 -0.525 50 10 HBGE CNS(=O)(=O)c1ccccc1N1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1546256242 PNRFIVURMMPMIQ-UHFFFAOYSA-N 403.269 -0.763 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@]1(C)CC1(Br)Br 1610347001 GDYHWEHVYVEWHS-XNCJUZBTSA-N 421.111 -0.032 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@@H]1CC(=O)N(c2cnn(CCOC)c2)C1 1628717917 JMYCBONQZREODL-CYBMUJFWSA-N 412.516 -0.244 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O 1631539401 LGSCAUJRWDTRHF-UHFFFAOYSA-N 401.441 -0.399 50 10 HBGE Cc1sc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1646038933 KRIQXIIKVOYEAC-GFCCVEGCSA-N 402.498 -0.282 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281868992 ORYFGQCLUUBDLZ-GFVXYOJSSA-N 400.266 -0.273 50 10 HBGE CN(C[C@H](O)CN(C)C(=O)c1ncc(B(O)O)cc1Cl)C(=O)OC(C)(C)C 2281898011 CUSZOFHCSBZXOD-LLVKDONJSA-N 401.656 -0.285 50 10 HBGE CC(C)(C)OC(=O)NCCn1cc(NS(=O)(=O)c2cc(B(O)O)cs2)cn1 2282076754 MMKBQOLRISIDNB-UHFFFAOYSA-N 416.290 -0.050 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)Nc1nnc(CNC(=O)OC(C)(C)C)o1 2282354258 OBMARUBIMGVPEU-UHFFFAOYSA-N 418.262 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282368264 NIZJDOOAHMSYCT-QFYYESIMSA-N 400.237 -0.207 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C 2282373375 LSAXLTPAXGPYJO-CYBMUJFWSA-N 402.278 -0.819 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(F)C[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282376429 DNJFNEDLLZHJFS-DEZZCRIOSA-N 423.297 -0.362 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCC[C@@]1(C)CCN1C(=O)OC(C)(C)C 2282710449 OOTLVPXLRSFTHK-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CO[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282712862 WVQLKUVLVYNPBC-RYUDHWBXSA-N 420.318 -0.269 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282729045 XHGRIXULPUMYCH-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)c1sncc1B(O)O)C(=O)O 2289804225 YSJIGUWCENNRDN-SNVBAGLBSA-N 401.250 -0.299 50 10 HBGE O=C(NCC1CC1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 731617448 KXKMUUIUWKADSY-HZSPNIEDSA-N 400.501 -0.164 50 10 HBGE COc1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1Cl 759607098 GRUUUIRMBMGRNB-UHFFFAOYSA-N 420.813 -0.443 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H]1C(=O)NCC12CCOCC2 1176505699 RWQDMQADGQVKKL-OAHLLOKOSA-N 410.858 -0.006 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 1306514567 VUQHAFPCBPEQBV-AAEUAGOBSA-N 414.459 -0.698 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(C)CCCS2(=O)=O)c1 1628315132 BEBLHBGSEMKRMW-OAHLLOKOSA-N 403.482 -0.335 50 10 HBGE C[C@@H](C(=O)NNC(=O)N1CCN(C)CC1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1635084351 RBNILAMMHXSCML-ZDUSSCGKSA-N 412.491 -0.558 50 10 HBGE CC(C)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)N[C@H](CB(O)O)C(=O)O 2042873771 WYJPNPSFEMNIFP-GFCCVEGCSA-N 412.229 -0.846 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613021 RXLHVEUZIMZOTB-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2C[C@H](B(O)O)C2)[C@@H]2CS(=O)(=O)C[C@@H]21 2281876782 IBVQGCNLECIJII-LPWJVIDDSA-N 402.278 -0.516 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)CC1 2282082769 KZQIOBREOAIDMI-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282085594 AHGYGZVFDJQFHE-ZIAGYGMSSA-N 416.330 -0.004 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282862768 ICPYYFDQAKZRJB-NSHDSACASA-N 402.282 -0.962 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1(C)C 2380428715 UJCWNMCEWRJZOM-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE CC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1 205478362 UHQYIIRIOVIPLI-MHXMMLMNSA-N 410.964 -0.001 50 10 HBGE CCCCn1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(C)n1 770244197 ICVOXFHELBECCT-UHFFFAOYSA-N 416.442 -0.800 50 10 HBGE O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)[C@@H]1CCc2nncn2C1 814333766 WTAXIEXHDYJYRP-MNOVXSKESA-N 405.381 -0.566 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)[C@@H]1COCCO1 815736223 REEDQIVDDVUEIJ-YWZLYKJASA-N 416.434 -0.062 50 10 HBGE Cc1nn(C)cc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1160403700 OVDRVLMTYHJAOE-UHFFFAOYSA-N 421.479 -0.247 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1OC 1235026854 GNIUTTYVXCTWNY-IBGZPJMESA-N 422.438 -0.334 50 10 HBGE CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)cc1 1251277735 MEVNPSYDPORPSG-LBPRGKRZSA-N 417.488 -0.421 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2cccnn2)cc1S(=O)(=O)N1CCOCC1 1598371442 JNBXBSNGYKQWHH-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CS(C)(=O)=O)n(C)c2)C1 1634355658 OYWWRTMFRCZXTM-LLVKDONJSA-N 420.513 -0.749 50 10 HBGE CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)o1 1635372202 PJWHMZGGYUJFGR-ZDUSSCGKSA-N 400.457 -0.657 50 10 HBGE COCCNS(=O)(=O)c1c[nH]c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1 1642080463 UTLJREVWSMAAKS-LLVKDONJSA-N 408.502 -0.955 50 10 HBGE Cc1nn(C)c(C(=O)NC2CCN(C(=O)OCc3ccccc3)CC2)c1B(O)O 2267028373 LEWKCEOMBYCYSA-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)N1CCC([S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)CC1 2281840059 PLMKVHXOJHZHKS-HHHXNRCGSA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282070985 LYHWRXFSPPNUDA-NSHDSACASA-N 420.318 -0.410 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1 2282361638 UGUJVJDEPFUINS-HAQNSBGRSA-N 400.262 -0.291 50 10 HBGE Cc1c(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282441412 FMMLQKMNTMSGRH-FLESLCNUSA-N 400.266 -0.686 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)[C@@H](C(=O)O)C1 2282715631 JBYHYGPZPGLUTE-SNVBAGLBSA-N 420.274 -0.878 50 10 HBGE O=C(/C=C/c1ccccc1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 8648160 XRJZDZLQWAVFHA-VOTSOKGWSA-N 416.467 -0.755 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(B(O)O)c3)cc2)CC1 1630968107 ZMVQHKVEFUZWNL-UHFFFAOYSA-N 418.284 -0.941 50 10 HBGE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201895 VEAYZOXBJZGUMM-CBAPKCEASA-N 400.209 -0.352 50 10 HBGE Cn1nc(C(=O)N2CC=CCC23CN(C(=O)OCc2ccccc2)C3)cc1B(O)O 2281916101 MCTROUMCFRNIFM-UHFFFAOYSA-N 410.239 -0.107 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2282064461 AGNPJAHFQGXGAC-GHMZBOCLSA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@H](CCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282710178 KWJWNGYTPUBVGR-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@H]1[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282741383 NBJNUQQCQNHBAJ-CMPLNLGQSA-N 402.282 -0.834 50 10 HBGE Cc1c(C(=O)NNC(=O)C(=O)N2CCCC2)nnn1-c1cccc2c1CCN(C)C2 731473944 CRSFJJSHBBBYJW-UHFFFAOYSA-N 411.466 -0.053 50 10 HBGE CN(C)CCNC(=O)Cn1cc(NC(=O)C(=O)NNc2cccc(F)c2F)cn1 785015796 RXYFKKYHJBGNLY-UHFFFAOYSA-N 409.397 -0.079 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccccn3)CC2)cn1C 1322509050 LYLQNKDHDRNNRY-UHFFFAOYSA-N 420.495 -0.086 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N(C)C)cc1 1331471890 IHOJATGDVWOLCB-AAEUAGOBSA-N 417.509 -0.378 50 10 HBGE COC(=O)C[C@@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1cccc(Cl)c1 1647986876 LXAFQLDCWZSQDR-CYBMUJFWSA-N 417.871 -0.237 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncc(B(O)O)cn2)C1 2235611311 VWGTWCBSBCDOIZ-KXBFYZLASA-N 414.227 -0.089 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)Cc1ccccc1B(O)O 2282332759 GLWZZXGHMYCJMH-UHFFFAOYSA-N 408.232 -0.054 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CNS(=O)(=O)Cc3ccsc3B(O)O)[C@@H]2C1 2282338480 NWZZAKYIOPQUQK-XYYAHUGASA-N 416.330 -0.040 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CF)(NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282718863 DGYKLSJTTNNDOD-INIZCTEOSA-N 402.253 -0.006 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C)n1C 2362565581 AUWOYLFAUYHEOH-MHZLTWQESA-N 402.282 -0.487 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)[C@@H]1COCCO1 744653803 KMKZDQPNNMDYGN-CJNGLKHVSA-N 401.423 -0.022 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1cccc(S(=O)(=O)NCc2ccco2)c1 746022739 IXGSLUPXSZZZNC-OAHLLOKOSA-N 409.420 -0.066 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN(C)CCN2CCCS2(=O)=O)cc1OC 752305556 LNHFUCLQXUUITM-UHFFFAOYSA-N 414.484 -0.568 50 10 HBGE CCOC(C)(OCC)C(=O)NNC(=O)c1cnc2c(c1CC)c(=O)n(C)c(=O)n2C 807371415 IQFWFVVXMKTISS-UHFFFAOYSA-N 421.454 -0.255 50 10 HBGE Cc1cccc(-c2nnc3n2C[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC3)c1 1160733135 MWDRFAZWQDFFNF-TZMCWYRMSA-N 420.495 -0.099 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COCCO2)sc1Br 1294208791 KQGAARXZKWEHDA-RXMQYKEDSA-N 414.259 -0.666 50 10 HBGE CN1CCN(c2cc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)ccn2)CC1 1456036625 GYMYPIBYQDMUCS-QGZVFWFLSA-N 402.499 -0.152 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C[C@@H]2CCCS2(=O)=O)CC1 1460641107 OSROXABHPLMXEO-SFHVURJKSA-N 422.551 -0.120 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1464440430 BBVWOJPTPXSYHW-NEPJUHHUSA-N 419.504 -0.945 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@H]1c1cnn(C)c1 1465032806 PDALQEAHHGBWPS-BRWVUGGUSA-N 423.433 -0.443 50 10 HBGE Cc1nnc(NNC(=O)N[C@@H]2CC(=O)N(C3CN(C(=O)OC(C)(C)C)C3)C2)n1C 1479500273 UWHLBIUGIDDANL-LLVKDONJSA-N 408.463 -0.030 50 10 HBGE C[C@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CS1(=O)=O 1674203349 BLESCDSRKRTIRY-JQWIXIFHSA-N 403.482 0.000 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CO1 1682431073 KRVUJILGEBJNCI-TZMCWYRMSA-N 412.468 -0.171 50 10 HBGE O=C(CN1CCC[C@H](CNC(=O)C(F)(F)F)C1)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 2195884421 ZRHQVGKFSVPKFZ-VWYCJHECSA-N 419.853 -0.103 50 10 HBGE COCCN(CCNS(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2267626050 ACXGBRKANDIUQZ-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272653574 SHIRCZDPWNNHQY-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@]1(=O)CC[C@@H](NC(=O)OC(C)(C)C)C1 2281914082 AZISNEYTEAANLI-GFVXYOJSSA-N 400.266 -0.512 50 10 HBGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1c(B(O)O)cnn1C 2282073330 MQVODINIJQPCDF-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CCN(S(=O)(=O)c2cc(B(O)O)cs2)CC1 2282705458 YJZZQDDCGXHKFJ-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C[C@@H](F)C1 2282708202 JCQICGUJDQZVEV-OLZOCXBDSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(S(=O)(=O)c3sccc3B(O)O)[C@@H]2C1 2282715288 DYWYLEJWFCOGOE-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N1CCC(B(O)O)CC1 2285909749 KRAALJXPCOTQIB-ZDUSSCGKSA-N 404.294 -0.124 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 703992898 HATGNEOZKKJFGY-NWDGAFQWSA-N 406.869 -0.394 50 10 HBGE CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c(Cl)s1 770637539 REIFHNXYPHJYJN-LURJTMIESA-N 404.875 -0.470 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@H]2[C@H]1C(=O)NNC(=O)c1ncon1 1179588919 RINJGXWZOZUCJJ-RYPBNFRJSA-N 401.301 -0.184 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NN(C)[C@@H](C)CO)o1 1631070566 IUXHZUOITPWOJY-NWDGAFQWSA-N 403.457 -0.047 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@@H](CNC(=O)NNC(=O)[C@H]2COCCO2)C1 1635207539 ODOZYJRRKYBYBV-QWHCGFSZSA-N 402.448 -0.242 50 10 HBGE 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CC(C)(C)OC(=O)N1CC(O)(CC(=O)NNC(=O)CNC(=O)c2cccs2)C1 1631989127 AZUZUQSLUPHWAX-UHFFFAOYSA-N 412.468 -0.003 50 10 HBGE CO[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NNC(=O)c1cc(Br)cn1C 1636814946 PBMBXRSNQGOUBD-SCZZXKLOSA-N 409.262 -0.456 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@]2(C)CCC(=O)N2)cc1 1673428261 UMLIPIRQIAGAKW-QGZVFWFLSA-N 411.484 -0.385 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267608617 XFWSGYYNKYWJPC-ONGXEEELSA-N 406.291 -0.754 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267614029 IEMXXCLUKKBJTF-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2281849917 RKNWNEVKTLARCY-MHZLTWQESA-N 400.266 -0.734 50 10 HBGE CN1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@@H](CNC(=O)OC(C)(C)C)C1 2282074671 NVACJJQBZZZHIX-LBPRGKRZSA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282360081 XJFBRZJJQFYGEH-QWRGUYRKSA-N 400.237 -0.112 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)NC[C@@H]1COCCN1Cc1ccccc1 2282742154 YOUYAZBYBJKOAF-CQSZACIVSA-N 411.314 -0.857 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(Cl)c(B(O)O)n1 2360551756 SADURCJNWHKSLE-SECBINFHSA-N 421.668 -0.709 50 10 HBGE CC(=NNC(=O)[C@@H]1COCCO1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 745213242 OQCIWUSPCNKJGH-AWEZNQCLSA-N 419.481 -0.332 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@](C)(O)Cn1ccccc1=O 790483805 SLWSOYVYQQOMBG-SFHVURJKSA-N 421.479 -0.338 50 10 HBGE CN1CCn2nc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2S1(=O)=O 1135495095 QIAYUNGKWGDWGD-CYBMUJFWSA-N 407.408 -0.882 50 10 HBGE CCn1nc(C)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)n1 1160865011 DSRQNBFBBLSYAN-UHFFFAOYSA-N 408.488 -0.306 50 10 HBGE Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)N2)cc1 1182261284 HVUKATJQUJCFCX-LBPRGKRZSA-N 410.481 -0.440 50 10 HBGE Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CS(C)(=O)=O)c(C)c1 1301697701 OTKYMHFFHHMENJ-UHFFFAOYSA-N 405.498 -0.528 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)nn1 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50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2282714765 WNSSHCBSVPHEBJ-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE Cc1cc(S(=O)(=O)N(C)CC2(O)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2287323514 VCCZXNDFFQRVEU-UHFFFAOYSA-N 420.318 -0.661 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2380427788 IHZUNDCOIYLJDW-LLVKDONJSA-N 402.282 -0.834 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC(=O)N2C)cc1 758029826 NZCJWWQLVOPALU-WDBKCZKBSA-N 412.468 -0.700 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)COC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 767276974 MLVALBKVJPSRFP-HJWRWDBZSA-N 414.418 -0.661 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1 1470660994 HRVDLNRTDCEBTB-UHFFFAOYSA-N 418.280 -0.536 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1532226754 MKRMSMUMEDQNAE-CZPYZCIJSA-N 422.482 -0.371 50 10 HBGE CN(Cc1ccccc1)C(=O)CNC(=O)CNC(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2 1684002433 QIGNNNOPKULKIJ-BZUAXINKSA-N 417.466 -0.341 50 10 HBGE Cn1ncc(C(=O)N=[S@@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1B(O)O 2281593085 FSIVTFXUMMXJSP-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE C=C(CS(=O)(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F)B(O)O 2282362124 BDJAKCQLLSBATM-JGVFFNPUSA-N 412.117 -0.042 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)COC2)c1B(O)O 2282371738 OEOQLAOBCPYMOA-UHFFFAOYSA-N 420.318 -0.383 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](NS(=O)(=O)c3ccc(B(O)O)s3)[C@H]2C1 2282715843 MEQWDMMVDHZOBI-MXWKQRLJSA-N 418.302 -0.660 50 10 HBGE CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)[C@H]1COCCO1 744649853 WKQMPWHBIWKIEU-UONOGXRCSA-N 424.479 -0.297 50 10 HBGE Cc1oc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1S(=O)(=O)N1CCCC1 816880610 OLHLSJSMBAJTMF-LBPRGKRZSA-N 422.467 -0.012 50 10 HBGE Cc1nnc2n1C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)CC2 1152745671 MEXCEWQBOHLUEL-LLVKDONJSA-N 406.306 -0.025 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 1539401383 BZYHNSLIQQAWGS-NVGCLXPQSA-N 419.500 -0.017 50 10 HBGE CC(C)(C)C(=O)N1CCO[C@H](C(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)C1 1641457128 VKCSJNOGZFRRPZ-UONOGXRCSA-N 416.434 -0.142 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)N1C(=O)NC2(CCCC2)C1=O 1645053530 ICXDJFFPEGOTJY-GXTWGEPZSA-N 407.471 -0.360 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267208520 YSWAWZCTNHPFIL-DCAQKATOSA-N 402.303 -0.038 50 10 HBGE C[C@H](C[S@@](C)(=O)=NS(=O)(=O)c1cncc(B(O)O)c1)NC(=O)OC(C)(C)C 2282095185 ZYLFXAHVXXITOB-AFNXNYLOSA-N 421.306 -0.539 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(F)C[C@@H](NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282097758 JOTISCCQVYDISV-WGRBQBNCSA-N 403.241 -0.565 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)cc2F)[C@H]2C[C@H]21 2282739108 DHCIOZMUUCHFHE-OLZOCXBDSA-N 400.237 -0.112 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N1CCc2c(B(O)O)cccc21 712216877 HVKFMMJOYUNWOV-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(C2CCOCC2)C1=O 747595030 YGHXPRWOBSCFMQ-OAHLLOKOSA-N 400.439 -0.013 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=S)Nc2ccccc2C#N)n(C)c1=O 764515430 PQACUCZSMIMFGK-UHFFFAOYSA-N 412.435 -0.677 50 10 HBGE CNC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(N)=C(C#N)[C@H]1c1cccs1 1080323756 ZFWGRHSEKUIMIB-LBPRGKRZSA-N 402.457 -0.730 50 10 HBGE CCN(CCO)NC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 1143303639 TZWDCRMSDIPDDW-UHFFFAOYSA-N 401.485 -0.396 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)c1cc(Br)c[nH]1 1254316596 XHTDVCVHLSKOAX-CQSZACIVSA-N 416.232 -0.651 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2 1586191099 JHNSKBPXCFUSMK-UHFFFAOYSA-N 417.509 -0.574 50 10 HBGE Cn1nc(C(=O)NNC(=O)[C@H]2CN(C(=O)C(C)(C)C)CCO2)c2ccccc2c1=O 1628355264 IHEKPPBNDCXACI-CQSZACIVSA-N 415.450 -0.032 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)c2cccc(OC(F)F)c2)[C@H]1c1cnn(C)c1 1632552106 FEFUUISXJUWGIO-MGPQQGTHSA-N 423.376 -0.027 50 10 HBGE O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2)C(=O)N1 1646045796 STJPXXXRHRIQRZ-DOTOQJQBSA-N 414.462 -0.094 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(S(C)(=O)=O)[C@H](C)C2)cc1OC 1654236744 QRYOBMYXBYLUTE-GFCCVEGCSA-N 414.484 -0.570 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2267201922 VNZARNSMAXNYPZ-QWRGUYRKSA-N 406.291 -0.612 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NS(=O)(=O)Cc3ccsc3B(O)O)[C@H]2C1 2267373471 DJILXOIMHKQGHW-GDNZZTSVSA-N 402.303 -0.287 50 10 HBGE Cc1c(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)nn1C 2281841161 FVUKGPKFRFFGHV-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2281914165 SAWSBVPJIXRAJJ-MHZLTWQESA-N 400.266 -0.795 50 10 HBGE O=S(=O)(NC[C@@]1(O)CCCN(Cc2ccccc2)C1)c1ccc(B(O)O)s1 2282080147 GJBLGSAFIRFTBU-KRWDZBQOSA-N 410.326 -0.267 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282340360 DWSDQPXPSDWFEH-HNNXBMFYSA-N 420.318 -0.781 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CCCCN1C(=O)C(F)(F)F 2282366799 UAZHWDMIIVQZNM-SECBINFHSA-N 414.236 -0.042 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)c1c(B(O)O)cnn1C 2282705555 ZPDKCKDEZVQQGC-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C 2282733808 BIEVRJOSTKGGSE-WDEREUQCSA-N 402.278 -0.045 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282851699 FYSFHBPHPJSNPP-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)c2cc(B(O)O)c(F)cc2Cl)C1 2285954502 IGCVSHYBOUPNMU-UHFFFAOYSA-N 402.615 -0.130 50 10 HBGE O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 16145929 VLNZMNYAWNEXRM-LBPRGKRZSA-N 423.472 -0.069 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccsc3)c2)CCN1 734332614 FBXJOZUQJSECAW-UHFFFAOYSA-N 422.488 -0.128 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 744644163 GFLOFDCYMPKWQJ-WFASDCNBSA-N 403.391 -0.362 50 10 HBGE COc1cc(CNC(=O)NNC(=O)[C@H]2COCCO2)ccc1OCC(=O)N(C)C 745625828 WSRTZOYUPCOVPX-OAHLLOKOSA-N 410.427 -0.592 50 10 HBGE COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@H]2COCCO2)C1=O 771266008 NPQPUEPCCCDRMI-FZKQIMNGSA-N 406.395 -0.975 50 10 HBGE Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816873158 ZKJSAZCYDHLEFL-AWEZNQCLSA-N 420.495 -0.027 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 1586191229 POZKVNIKZMLGAS-AWEZNQCLSA-N 417.509 -0.580 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)c1 1637742735 FMYGNORFSZSKHY-GOSISDBHSA-N 408.411 -0.724 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ccc(Cl)c(B(O)O)n1 2224187295 QKQOXIUDLQPLHJ-UHFFFAOYSA-N 423.643 -0.157 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F)S(=O)(=O)c1ccccc1B(O)O 2369652520 NUIGOEFBLXIYNQ-CHWSQXEVSA-N 402.253 -0.056 50 10 HBGE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2 758030946 UHGABNLQOMFUFZ-APPZFPTMSA-N 423.417 -0.006 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2(c3ccc(F)cc3)CC2)n(C)c1=O 766636269 MHOFYKHYWQQBLR-UHFFFAOYSA-N 414.397 -0.548 50 10 HBGE O=C(COC(=O)[C@@]12[C@@H]3[C@H]4C(=O)[C@H]1[C@@H]1[C@@H]4C[C@@H]3[C@H]12)NNC(=O)[C@@H]1COc2ccccc2O1 800250241 FAHYMFFFBSBBKE-WCHXWIMKSA-N 424.409 -0.156 50 10 HBGE Cn1nccc1-c1ccccc1C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 814225293 RIIYOMJOADZOIS-UHFFFAOYSA-N 420.433 -0.016 50 10 HBGE CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc2c(c1)CCNCC2 814785613 YXBUKTSLHFCZFC-UHFFFAOYSA-N 416.507 -0.200 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1 1135713917 RFKFMKSRKGOASQ-UHFFFAOYSA-N 407.452 -0.026 50 10 HBGE O=C1CN(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCN1 1294603497 UWACFZFPCIZGHB-UHFFFAOYSA-N 422.917 -0.963 50 10 HBGE Cn1cc([C@@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1307739889 FKPZVVGBHFBGES-OLRZCDJHSA-N 400.464 -0.142 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)Cc1cn3ccccc3n1)CS(=O)(=O)CC2 1534196429 QHBWJWFYNLUJKD-UHFFFAOYSA-N 402.436 -0.458 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 1540475300 WKKLAAMCZQMEJL-CQSZACIVSA-N 402.494 -0.118 50 10 HBGE O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cc(B(O)O)ccc1F 1633567603 VSEJLJUIQQSRQE-SFHVURJKSA-N 400.215 -0.295 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2Cl)C1 2130056491 WJXQHCFIMCANJN-GHMZBOCLSA-N 411.908 -0.922 50 10 HBGE O=C(OCc1ccccc1)N1CC(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2247880159 BRZKUOWTMZHYQH-UHFFFAOYSA-N 410.282 -0.132 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267389605 QZFXVKJETXGGSK-SNVBAGLBSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267717211 ZEMSRHWDIILWGQ-ABAIWWIYSA-N 402.303 -0.143 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1O 2282071181 ODRVSYDJNJVJRR-MXWKQRLJSA-N 420.318 -0.630 50 10 HBGE CON(CCCNS(=O)(=O)c1ccc(F)c(B(O)O)c1)C(=O)OC(C)(C)C 2282338660 OYFSVFGXGOWYKF-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE C[C@@H](NS(=O)(=O)Cc1ccsc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2282417278 GYNNSPFLDBDZCV-SNVBAGLBSA-N 420.318 -0.782 50 10 HBGE O=S(=O)(c1sccc1B(O)O)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2282701464 APHYCQMBPKOBPQ-HZPDHXFCSA-N 408.310 -0.298 50 10 HBGE CN(CCOCCN(C)S(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2282704438 JZTVMMNZWLAKJT-UHFFFAOYSA-N 422.334 -0.068 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282724440 MQRRUEANULZQAC-QWHCGFSZSA-N 420.680 -0.410 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](O)C[C@@H](NC(=O)OC(C)(C)C)C2)sc1B(O)O 2282726198 OJEMQQOTUKGJKY-MNOVXSKESA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](NS(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2282736282 NVBDJTWFXXYJPG-JLLWLGSASA-N 418.302 -0.660 50 10 HBGE C[C@@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1nscc1B(O)O 2284061464 FDWAUEOIFDDTFA-LDYMZIIASA-N 403.241 -0.680 50 10 HBGE CN([C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)Cc1ncsc1B(O)O 2369652106 IVFWTIUELOFABT-GXSJLCMTSA-N 423.297 -0.458 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)[C@@H]1COCCO1 763429933 DFHPTFOLWRAKLJ-AWEZNQCLSA-N 401.416 -0.213 50 10 HBGE COc1cc(N2CCS(=O)(=O)CC2)ccc1NC(=O)c1ccc(B(O)O)cc1 1296667820 SWAZRUOZAMKSMI-UHFFFAOYSA-N 404.253 -0.138 50 10 HBGE O=C(CN1CCN(CCNS(=O)(=O)c2ccccc2)CC1)NNC(=O)C1CC1 1460519358 XNVGKYSBFWTCLM-UHFFFAOYSA-N 409.512 -0.860 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H]1CN(C)C(=O)CN1C(=O)OC(C)(C)C 1587329344 DGBHRDJAKUQSHU-GFCCVEGCSA-N 417.532 -0.062 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(=O)n(C)c1=O 1627321387 BDQCEZGJLRWALF-NSHDSACASA-N 409.443 -0.508 50 10 HBGE CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC(F)(F)F)s1 1631031910 HNXBYVNGWAMJNN-UHFFFAOYSA-N 416.403 -0.238 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2)cc1 1633925302 KNDVZFWEACXKRM-HLRDLLSLSA-N 415.450 -0.674 50 10 HBGE CS(=O)(=O)SCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1cccc(F)c1 1636475645 QUGSMJDLZNEWRR-LBPRGKRZSA-N 405.473 -0.463 50 10 HBGE CCOC(=O)[C@](C)(NC(=O)c1ccc(B(O)O)cc1)c1ccc(S(C)(=O)=O)cc1 1639631385 DYJOWWACPZYTNO-LJQANCHMSA-N 419.264 -0.022 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1ncsc1B(O)O)OCc1ccccc1 2255470774 JSBIDABSQAYENN-QWHCGFSZSA-N 405.241 -0.363 50 10 HBGE Cc1nc(C(=O)N[C@H]2CCOC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)s1 2266898571 ZTSREQSZMGLQCW-UONOGXRCSA-N 419.268 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267209594 ZCGNGXYBKZOGTG-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCN=c1cc(B(O)O)c(Cl)c[nH]1 2294908472 DVLGVZLHERMGND-UHFFFAOYSA-N 403.672 -0.194 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3cnn[nH]3)CC2=O)cc1OC 729456254 YUEVFGOHWXUZCG-LBPRGKRZSA-N 402.411 -0.326 50 10 HBGE O=C(CCC(=O)N1CCOc2ccccc21)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 731616623 HEHAEUFUIODCJF-GFCCVEGCSA-N 410.452 -0.290 50 10 HBGE CC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1CCc3nncn3C1)C2=O 816883007 ROHOKABOTQIGMK-BJCXPLBRSA-N 403.443 -0.511 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3CC2)c1 1135502382 KDJROWAEUKYQSW-GFCCVEGCSA-N 406.468 -0.058 50 10 HBGE Cn1cc([C@@H](O)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1 1149622953 UHIAPJWREFNCIR-QGZVFWFLSA-N 400.439 -0.941 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2CCc3ccccc3CC2)n(C)c1=O 1149623335 XSPNEHJWNLLWAD-UHFFFAOYSA-N 424.461 -0.224 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CS(C)(=O)=O)c1 1168869915 WOHRQSALQMIJNM-UHFFFAOYSA-N 405.498 -0.169 50 10 HBGE CCc1ccccc1OCC(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1313166693 KTRCRHAGVVOLMI-IBGZPJMESA-N 406.439 -0.414 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1 1565219852 KBESYAQWHHJMMY-HNNXBMFYSA-N 404.514 -0.482 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)C1 1625566963 AKFNYKGVCHWOFQ-LYOVBCGYSA-N 402.473 -0.239 50 10 HBGE Cc1cc(CC(=O)NNC(=O)[C@@H](C)N2CCN(C(=O)OC(C)(C)C)CC2=O)n[nH]1 1639996376 XEIXDOKYEVQADV-GFCCVEGCSA-N 408.459 -0.124 50 10 HBGE COc1ccc(NS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)c(B(O)O)c1 2229050653 YFIORWKVFHVBMN-UHFFFAOYSA-N 418.236 -0.197 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CCO1 2267614126 JUTNTDHCAMDDSV-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE O=C(NCc1ccccc1OCCN1CCOCC1)NNC(=O)[C@H]1COCCO1 745784285 RJWOZOXCDYVSMA-QGZVFWFLSA-N 408.455 -0.357 50 10 HBGE CN(C)C(=O)C1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1 807094361 WWNIZBTUNDFLDU-UHFFFAOYSA-N 401.467 -0.540 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 1456016460 GZNSMQDAZUXLCH-ADLMAVQZSA-N 409.443 -0.136 50 10 HBGE CCN1CCN(C(=O)CC2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)CC1 1465085704 GEJPDJRASBDKGF-UHFFFAOYSA-N 405.279 -0.088 50 10 HBGE O=C(Cn1nc(-c2ccccc2)oc1=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1471976079 CVDMMUOXLDAZLQ-HNNXBMFYSA-N 401.423 -0.096 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNC(=O)c2cccc3ncccc23)[C@H]1c1cnn(C)c1 1616753763 AURUDQGPYOAFSV-BRWVUGGUSA-N 408.418 -0.080 50 10 HBGE COCCOCC(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 1631536860 SBFJYRWVDZQUNM-UHFFFAOYSA-N 413.374 -0.206 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2C[C@@]2(F)c2ccccc2)n(C)c1=O 1635500608 KSPJALSJILBXNH-CWTRNNRKSA-N 414.397 -0.534 50 10 HBGE O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2)N1 1638870679 FOYLHZLWRQKZNQ-MRXNPFEDSA-N 415.450 -0.141 50 10 HBGE CN1C(=O)CC[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 1682183847 RJGSTJODAXRNDY-INIZCTEOSA-N 416.482 -0.324 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)c1cscc1B(O)O 2267624927 HDUBRTMCLHGREI-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE O=S(=O)(NCCN1CCN(Cc2ccccc2)CC1)c1cscc1B(O)O 2282362304 DPUAMCVQYGQYJF-UHFFFAOYSA-N 409.342 -0.476 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(F)cc2B(O)O)COC1 2282365961 HFQYTJVJSMNZKW-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE COC(=O)[C@H](CC(=O)NCc1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2284012190 TYPBGZXMWPNUKX-NSHDSACASA-N 400.262 -0.191 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)Nc1ccc(F)cc1B(O)O 704308739 FEXBBAZHWCIANF-UHFFFAOYSA-N 406.200 -0.067 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@]2(C)CCc3ccccc3C2)n(C)c1=O 766634294 FVASQUCPFWYRGW-OAQYLSRUSA-N 424.461 -0.224 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H](O)C1CCOCC1 766649739 JPGYPDMSYLJSMQ-SFHVURJKSA-N 404.467 -0.621 50 10 HBGE COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)N2CCOCC2)C1=O 771255286 XIYHTBAKWKXBBW-LJQANCHMSA-N 419.438 -0.156 50 10 HBGE CN1CCO[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1=O 1135409726 HQXOEECMHFXEBW-CQSZACIVSA-N 410.452 -0.911 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1306513845 GGUWONGEXBAURI-KXNHARMFSA-N 404.489 -0.426 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)nn1 1531943503 QDKTXGFSPACSLS-UHFFFAOYSA-N 406.468 -0.007 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(B(O)O)c3)CC2)cc1 1630999903 KIKHMKIOUJBDEU-UHFFFAOYSA-N 410.283 -0.746 50 10 HBGE C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CN1CCCC1=O 1635878045 OVPIRMOLFPEVIL-HNNXBMFYSA-N 404.345 -0.612 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCCS(=O)(=O)Nc1ncccc1B(O)O 1913618397 CWPXIINNVGRDTO-UHFFFAOYSA-N 417.252 -0.030 50 10 HBGE CN(CC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(F)cc1B(O)O 2282365068 TVWCLGMXBAPHGV-UHFFFAOYSA-N 402.253 -0.007 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282423659 RJJSEPPZSBGDBD-WDEREUQCSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(S(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282732822 LXOVXBUGJKQYSV-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282736525 RZDXCWAKDRLNEX-WDEREUQCSA-N 419.334 -0.064 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282849694 FRDZNWSCHBVSGA-SFYZADRCSA-N 415.224 -0.958 50 10 HBGE C[C@@H]1CCN(CC(=O)N[C@H]2CS(=O)(=O)C[C@H]2Cl)C[C@@H]1NC(=O)C(F)(F)F 2357445351 QRBFEBPCSKSBRM-ZNSHCXBVSA-N 419.853 -0.104 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)Cc1cccc(B(O)O)c1 2365476111 BOZUTUQOYFWOHE-CQSZACIVSA-N 402.278 -0.675 50 10 HBGE CCOCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(Br)cn1C 758154882 CUJFFWOERSYDJX-UHFFFAOYSA-N 411.278 -0.496 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@H]2CCO[C@H]2C)c1 1461147800 IPKMFUSWINDPJL-JSGCOSHPSA-N 414.484 -0.549 50 10 HBGE C[C@@]1(NNC(=O)NCc2ccc(CN3C(=O)CNC3=O)cc2)CCS(=O)(=O)C1 1471136799 ZUGNCDAIKHRBGC-QGZVFWFLSA-N 409.468 -0.381 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)C[C@H](O)CN1C(=O)OCc1ccccc1 1630431262 BWBRVIVJQIKWHT-IQUTYRLHSA-N 404.423 -0.426 50 10 HBGE CC(C)(C)OC(=O)NCCN1CCC[C@H](C(=O)NNC(=O)[C@@H]2COCCO2)C1=O 1634837875 KLCUJCDHXMKWRY-OLZOCXBDSA-N 414.459 -0.688 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@H](O)C1 2267382527 MNDYROFRYKANMW-SNVBAGLBSA-N 406.291 -0.970 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)cs1 2267608602 HWXUSNZLCDDLTN-UHFFFAOYSA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NS(=O)(=O)c3ccc(B(O)O)s3)C[C@H]2C1 2267613656 DZQSAACLGIALDY-AXFHLTTASA-N 402.303 -0.038 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282071936 XXTFRUFCFPIGBS-NEPJUHHUSA-N 420.318 -0.269 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282072795 JFAPXKOVLKKIMK-NSHDSACASA-N 402.282 -0.880 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(B(O)O)n1C 2282327720 MLDZCEJLJKZSQJ-SNVBAGLBSA-N 402.282 -0.962 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282346935 ZJZZMPMYMLHTOQ-OAHLLOKOSA-N 406.241 -0.941 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282725839 INYVNOWGXDZGNT-OAHLLOKOSA-N 406.241 -0.941 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)n1 2282741781 SHUZYWKKFHANTF-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE N#CC(=CNCCc1ccc(S(N)(=O)=O)cc1)C(=O)NCCN1CCOCC1 2325490539 DBBGAZWMINPVJO-UHFFFAOYSA-N 407.496 -0.678 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3ccc(B(O)O)s3)CO[C@@H]1C2 2359269189 LDZVKHSVFJJBKT-FCHSOHFDSA-N 418.302 -0.469 50 10 HBGE CC(=O)N[C@@H]1[C@H](OC(=O)CCl)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 256020607 WRIXCIGJYAONQN-ZIRHEVKLSA-N 423.802 -0.576 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc(F)c1F 793452478 ZOUCYUDWULTUIR-QMMMGPOBSA-N 415.378 -0.085 50 10 HBGE O=C1CN(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCN1 1137304282 OGYQQHJFNKWKNH-UHFFFAOYSA-N 422.917 -0.963 50 10 HBGE CN1CCN(C(=O)NNC(=O)Cc2csc([C@H]3CCS(=O)(=O)C3)n2)CC1 1139083544 BJQCIHBDXBFLCT-NSHDSACASA-N 401.514 -0.424 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1=O 1457466830 VEVUDNVFOUTNQM-LBPRGKRZSA-N 401.423 -0.325 50 10 HBGE CNC(=O)NC[C@@H]1CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCO1 1460445986 AKGPGVTXMXCBSG-CYBMUJFWSA-N 409.443 -0.905 50 10 HBGE O=C(Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1cccc(B(O)O)c1 1540306617 AZILTJOPKYUURJ-UHFFFAOYSA-N 408.216 -0.221 50 10 HBGE CN(CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)S(=O)(=O)c1ccccc1 1635372530 VYTWCSPEJXQFAC-MRXNPFEDSA-N 410.496 -0.292 50 10 HBGE O=C(COCC(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393733 WCBWGCFNSSPVCT-UHFFFAOYSA-N 407.395 -0.250 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@]2(C#N)CCCOC2)CC1 1650833818 JNFSEDMSTIBSKO-QGZVFWFLSA-N 408.484 -0.219 50 10 HBGE COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1681581523 DYFQIKPSWPSWSV-UHFFFAOYSA-N 422.463 -0.050 50 10 HBGE CN(C(=O)OCc1ccccc1)C1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C1 2255485406 QOQSMPNBKLJMGG-UHFFFAOYSA-N 406.635 -0.154 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](F)CN1S(=O)(=O)c1ccccc1B(O)O 2282091046 DHTXDNRREUPZEE-VXGBXAGGSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@@H](F)C1 2282091782 ISJKDBVIEANUMS-UONOGXRCSA-N 402.253 -0.008 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H](C)N1C(=O)OC(C)(C)C 2282380803 OEWSKWRRUHBUKC-QWRGUYRKSA-N 419.334 -0.018 50 10 HBGE CC[C@]1(NS(=O)(=O)c2cc(B(O)O)nn2C)CCN(C(=O)OC(C)(C)C)C1 2282707788 CYIRDJJNHIFMOP-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1ncsc1B(O)O)C(=O)O 2289798462 WZPACBCLJAWMMC-VIFPVBQESA-N 401.250 -0.299 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(NS(=O)(=O)c3cscc3B(O)O)CO[C@H]1C2 2359273909 LXZDTHMXXZVKBB-JRPNMDOOSA-N 418.302 -0.469 50 10 HBGE C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 746004900 YNDHCDOXGULSGG-CJNGLKHVSA-N 423.445 -0.074 50 10 HBGE CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)[C@H]2COCCO2)cc1 769475510 RHJSJJGLHWQCSG-CYBMUJFWSA-N 401.366 -0.192 50 10 HBGE CCO/C=C\C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1137298820 CNKKXFQBPZUDNK-JYRVWZFOSA-N 410.496 -0.001 50 10 HBGE O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H](O)C1CC1 1440626641 QSQPMVJHJIKNSA-QGZVFWFLSA-N 411.480 -0.442 50 10 HBGE COCCCNC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1 1542343525 QEHLXWIWNNJATI-UHFFFAOYSA-N 420.513 -0.126 50 10 HBGE C[C@@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)NCC(F)(F)F 1556392523 XNTHIERRZWROLL-SVRRBLITSA-N 404.392 -0.332 50 10 HBGE O=C(Cn1ccc2ccccc21)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1565223865 XJTLYYRRPZOIDR-LJQANCHMSA-N 401.423 -0.401 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@H]1CCCN(C(=O)OCc2ccccc2)C1 2267024355 KUVVJXSYWIKGSV-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE C=C(CS(=O)(=O)N=[S@](C)(=O)N1CCN(C(=O)OC(C)(C)C)CC1)B(O)O 2267623030 COXIFZOXRYASGG-VWLOTQADSA-N 411.311 -0.550 50 10 HBGE CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1c(B(O)O)cnn1C 2282073501 NMDWMEJRCFRFIZ-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC[C@H](CN(C)S(=O)(=O)c1nc(C)n(C)c1B(O)O)NC(=O)OC(C)(C)C 2282335868 VRZZAFJCKSODHU-LLVKDONJSA-N 404.298 -0.668 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@]2(NC(=O)OC(C)(C)C)CCOC2)sc1B(O)O 2282375299 NLAXZHLVCCDYSF-HNNXBMFYSA-N 420.318 -0.302 50 10 HBGE C[C@H](NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cscc1B(O)O 2360552234 YHHBXCYONKEGOZ-JOYOIKCWSA-N 420.318 -0.457 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)cc1F 2360571936 NFTFNSWNUKQTTM-LBPRGKRZSA-N 404.225 -0.618 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(C)(C)c2ccccc2F)n(C)c1=O 766641609 AUXFASGNDIIFJF-UHFFFAOYSA-N 416.413 -0.302 50 10 HBGE CCn1cncc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1 767849573 GUZWOLXRSPXNPF-UHFFFAOYSA-N 401.308 -0.109 50 10 HBGE COc1ccc(C(=O)NCCN2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1 1144698738 MCMWOGFCYJWNQS-UHFFFAOYSA-N 411.267 -0.437 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc2)C1 1301698238 XTRPZVXLTZSIQL-LBPRGKRZSA-N 417.509 -0.087 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N(C)C)cc1 1331471891 IHOJATGDVWOLCB-DGCLKSJQSA-N 417.509 -0.378 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCCCO2)cc1 1468450653 IHSDAUMHQHNPEC-AWEZNQCLSA-N 413.452 -0.142 50 10 HBGE COC(=O)[C@]1(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)CCOC1 1473657774 LCFCZDRVHAEUID-NRFANRHFSA-N 418.494 -0.365 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCCn2cc(Br)ccc2=O)ccc1=O 1682790118 OHKBIIPMNQTFPG-UHFFFAOYSA-N 410.228 -0.046 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NS(=O)(=O)c2sccc2B(O)O)C1 2267201618 QUZBZYAIIHRWQQ-RUZDIDTESA-N 424.331 -0.166 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)c1B(O)O 2281833789 HTLMDHCYFBZJAA-FLESLCNUSA-N 400.266 -0.686 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 2282707618 AYKRVKQISAHYLM-GHMZBOCLSA-N 402.282 -0.930 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282722611 JDLPQDRAQJIOIR-RYUDHWBXSA-N 402.253 -0.008 50 10 HBGE CN1CCN(Cc2ccccc2)[C@@H](CNS(=O)(=O)c2cscc2B(O)O)C1 2282736469 QVORHMUBBUYMDP-HNNXBMFYSA-N 409.342 -0.478 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)n1C 2337400645 XEMYBHIKZPIKLM-LJQANCHMSA-N 400.244 -0.061 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)[C@H]1CCc2nncn2C1 816875052 PWKKXTFSMXSOLZ-QMMMGPOBSA-N 418.888 -0.319 50 10 HBGE CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1156183950 JENXRMWXPXPCHS-IAGOWNOFSA-N 420.514 -0.116 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COCCN2CC(F)F)c1 1440438392 OHNKUFFSDPIJPR-ZDUSSCGKSA-N 420.438 -0.336 50 10 HBGE COc1ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc1S(=O)(=O)N1CCCC1 1454276706 DTYHXWLBSPOGJJ-UHFFFAOYSA-N 419.481 -0.715 50 10 HBGE CC(C)[C@@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)N1CCCS1(=O)=O 1558459167 PXWCBBVWBZILNV-GJZGRUSLSA-N 402.517 -0.553 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)CS(C)(=O)=O)C(C)C)cc1 1641671718 VHIDDECRZMAXPM-AWEZNQCLSA-N 405.498 -0.510 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1CCc2c(cccc2B(O)O)C1 2093521747 ZZULTNOBDUYGJB-UHFFFAOYSA-N 414.248 -0.650 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1 2282083920 MBJHEVKCWXIGPD-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE COCCN(CCNS(=O)(=O)Cc1ccsc1B(O)O)C(=O)OC(C)(C)C 2282343915 ILSHDZHCRFEUCQ-UHFFFAOYSA-N 422.334 -0.269 50 10 HBGE COc1ccc(S(=O)(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1B(O)O 2282355145 BQZHNFXIBNPCDC-NSHDSACASA-N 402.278 -0.091 50 10 HBGE Cc1nn(C)c(C(=O)NC2CC3(C2)C[C@@H]3NC(=O)OCc2ccccc2)c1B(O)O 2282391239 RUJZRXNQEFOVEX-CHWWFWEZSA-N 412.255 -0.014 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CF)(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282731678 UVFIWQRZRNXTCV-CQSZACIVSA-N 423.297 -0.409 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ccc(B(O)O)cc1O 2282871318 FETJDQPFABXZNJ-MRXNPFEDSA-N 414.223 -0.161 50 10 HBGE Cc1c(C(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCO3)nnn1-c1nonc1N 254555955 UCSNUEIIERLWFB-UHFFFAOYSA-N 401.299 -0.058 50 10 HBGE O=C(NNC(=O)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1)[C@@H]1COCCO1 746003275 OVLJTVSSQFDIGH-IRXDYDNUSA-N 417.466 -0.434 50 10 HBGE COCC[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 812574028 AXEZCMVHHSVKPD-CYBMUJFWSA-N 402.473 -0.068 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1OC 1252878344 QQJRNYRIZDTPEM-PWSUYJOCSA-N 403.482 -0.070 50 10 HBGE COC(=O)CCNC(=O)CCNC(=O)NNC(=O)c1cc(Br)cn1C 1254058887 ZAVNUTVPXIQVSO-UHFFFAOYSA-N 418.248 -0.199 50 10 HBGE CO[C@]1(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCS(=O)(=O)C1 1618241858 WKNFMXJLCNROBE-GOSISDBHSA-N 422.463 -0.058 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 1624409906 NRVMYEMJVDZLJB-UHFFFAOYSA-N 417.532 -0.060 50 10 HBGE CC(=O)NCC(=O)N1CCCN(CC(=O)NNC(=O)Cc2ccccc2C)CC1 1655281143 UBZNFQHNBRYWQI-UHFFFAOYSA-N 403.483 -0.645 50 10 HBGE N#C/C(=C\c1cccc(Br)c1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1866131085 XLHZEAYLLWABSI-QIAOALMLSA-N 413.224 -0.728 50 10 HBGE Cc1c(C(=O)N(C)CC2CN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2267256176 BVBGGBIXHBEKAB-UHFFFAOYSA-N 400.244 -0.251 50 10 HBGE O=S(=O)(NC[C@]1(O)CCCN(Cc2ccccc2)C1)c1ccc(B(O)O)s1 2282080148 GJBLGSAFIRFTBU-QGZVFWFLSA-N 410.326 -0.267 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282705565 ZROWKJKAUSTRHB-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2282736160 LRCWVGQPVLPZIK-IIMNLJJBSA-N 400.237 -0.208 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1c(C)nn(C)c1C 742069159 NIIAUCNYODIYFI-SECBINFHSA-N 400.486 -0.070 50 10 HBGE NC(=O)[C@H](NC(=O)NNC(=O)[C@H]1COCCO1)c1cccc(Br)c1 792970148 HPRDNIIXXCEFJY-GHMZBOCLSA-N 401.217 -0.279 50 10 HBGE COC(=O)[C@@H](CS(=O)(=O)NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1 793449828 FWOJWFRRXDNJQM-KBPBESRZSA-N 407.452 -0.252 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1 807609092 JBFRRABGNRRPKE-KBPBESRZSA-N 414.484 -0.169 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccoc2C(F)(F)F)n(C)c1=O 810591332 BLHADNVDMMNDAB-UHFFFAOYSA-N 414.300 -0.493 50 10 HBGE O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)[C@@H]1CCc2nncn2C1 814330219 CSINNHVMDBMEAD-OAHLLOKOSA-N 420.495 -0.172 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1 1540375102 APVJWAVNSOHASP-UHFFFAOYSA-N 407.452 -0.026 50 10 HBGE COC(=O)[C@@H]1CN(CC(=O)NNC(=O)C2CC2)CC12CN(C(=O)OC(C)(C)C)C2 1620615717 CWSAANBVIJNHMQ-ZDUSSCGKSA-N 410.471 -0.114 50 10 HBGE Cn1nc(C(=O)N=[S@@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1B(O)O 2281915480 ZMOOCJDRNKPYHJ-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1C[C@H](NC(=O)OC(C)(C)C)CC1(C)C 2282072664 HXJVJTYQUKPASW-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282076523 JJJOCZWZEONTKG-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282080503 KMTSEXYNKPPHTK-BXGBBSSXSA-N 418.302 -0.613 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)n1 2282371362 ITYHHKYRCLBAGY-NSHDSACASA-N 402.282 -0.976 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O 2282378143 BCSGCXUADYGVPL-WDEREUQCSA-N 420.318 -0.615 50 10 HBGE O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNC(=O)[C@@H]1COCCO1 745781800 VZCZWMHCVCTSHV-CVEARBPZSA-N 406.439 -0.159 50 10 HBGE CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1 748215960 YIMKOXWIQJJRKC-OAHLLOKOSA-N 411.461 -0.092 50 10 HBGE CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)[C@H]1COCCO1 756674265 OLMDFBZZUVAZDX-CQSZACIVSA-N 416.456 -0.096 50 10 HBGE COC(=O)[C@H](CS(=O)(=O)NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1 793449830 FWOJWFRRXDNJQM-UONOGXRCSA-N 407.452 -0.252 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NC[C@H]1CS(=O)(=O)c2ccccc2O1 1312899351 BVHZREHRQOYVQG-RYUDHWBXSA-N 401.441 -0.397 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)N[C@H](C)C1CC1 1557285500 BEZMPVPJURBAQE-SCZZXKLOSA-N 402.546 -0.002 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1)N[C@H]1CCS(=O)(=O)C1 1631028892 GDHKEUAVHNWNCD-ZDUSSCGKSA-N 405.436 -0.577 50 10 HBGE C[C@@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1ccc(B(O)O)cn1 2108235226 VQIQISOCQJBYMJ-QGZVFWFLSA-N 421.215 -0.473 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H](C)CCNC(=O)OC(C)(C)C 2282360578 FFLHYBDDSVRVII-LLVKDONJSA-N 402.278 -0.043 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1 2282376512 FJQNKUMPLVICEV-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE C[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282378019 ZOOUVKPHDNHTGI-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE C=C(CS(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2)B(O)O 2282736331 OMKDLZNIJGMWMM-ZDUSSCGKSA-N 404.294 -0.110 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)n1C 2362570728 CPENVSWWSPXDRQ-RWXBIINUSA-N 402.282 -0.440 50 10 HBGE O=C(NNC(=O)c1ccc2c(c1)C(=O)N(c1c[nH]c(=O)[nH]c1=O)C2=O)c1ccccc1 13957562 HFLCPKNFLQOICF-UHFFFAOYSA-N 419.353 -0.061 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)Cn1cnc2c(cnn2C)c1=O 21302174 CLDDUKPNIDCEHG-UHFFFAOYSA-N 400.395 -0.245 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 744645367 RINWDYGVDGYWOO-SWLSCSKDSA-N 415.443 -0.211 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)[C@@H]2COCCO2)CC1 745784403 AALUQBQESMDLDG-ZDUSSCGKSA-N 401.464 -0.715 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CCCc3sccc32)n(C)c1=O 771647868 FLAXQMVCGMUQCT-LLVKDONJSA-N 416.463 -0.237 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2C[C@@]3(C)C(=O)NC(=O)[C@]3(C)C2)cc1OC 1307994807 XDXOWAVPSXWYGS-OALUTQOASA-N 404.423 -0.551 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)CN(C(=O)OC(C)(C)C)CCO1 1454062680 MCWPQMNCEASWEW-APPDUMDISA-N 400.432 -0.935 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)nn1 1469888208 HRTKKIPUPXNEKG-UHFFFAOYSA-N 411.419 -0.362 50 10 HBGE C/C(=C/C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1C 1545423942 GXMDWQTYPNXZTP-LCYFTJDESA-N 410.434 -0.007 50 10 HBGE CN1C(=O)CCC[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278433 COJDMACTLXOTRU-INIZCTEOSA-N 401.467 -0.397 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)c2cscc2B(O)O)C1 2267623591 KOYCPGOXSAIKHW-NSHDSACASA-N 408.282 -0.089 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NC(=O)c2c[nH]nc2B(O)O)C(C)(C)C1 2281871893 OOLVXWDOTPZEDR-HHHXNRCGSA-N 400.266 -0.273 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1CO 2282378056 ACSIXAPKEQGEQD-LLVKDONJSA-N 420.318 -0.661 50 10 HBGE CC(C)[C@H](CCNS(=O)(=O)c1c(B(O)O)cnn1C)NC(=O)OC(C)(C)C 2282709963 HKZJSXBMPQNIMO-LBPRGKRZSA-N 404.298 -0.682 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2cscc2B(O)O)CCOCC1 2282731886 XYKAYLCNBNNEIA-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](C(=O)N=c2nc(B(O)O)[nH]s2)[C@@H](C(F)(F)F)C1 2283946223 KUOARQQPJMMTKY-BQBZGAKWSA-N 410.183 -0.376 50 10 HBGE O=S(=O)(CCBr)CCNS(=O)(=O)C1CCS(=O)(=O)CC1 2360910984 PMBPYGQDRRZIDF-UHFFFAOYSA-N 412.349 -0.707 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2365421144 DIONONCCOXYGNU-SNVBAGLBSA-N 422.696 -0.162 50 10 HBGE C[C@H]1CN(CCC(=O)NNC(=O)Cn2c(O)nc3ccccc3c2=O)C[C@H](C)O1 732261181 LEFGKIWKQMVMEL-STQMWFEESA-N 403.439 -0.251 50 10 HBGE CCc1c(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cnc2c1c(=O)n(C)c(=O)n2C 753988607 YEDPGRVQPPWXLJ-HNNXBMFYSA-N 423.429 -0.041 50 10 HBGE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NNc2ccc(-n3cccn3)nn2)C1 807577844 KXNSWFIAEPNIQV-GFCCVEGCSA-N 409.476 -0.441 50 10 HBGE O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1cccc(Cl)n1 1300836470 MXXQIIRDEXRMNV-UWVGGRQHSA-N 400.844 -0.468 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3n2CCC3)CC1 1306648807 YUMJDGTXEIGXEZ-UHFFFAOYSA-N 405.484 -0.083 50 10 HBGE CC(C)NC(=S)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318636943 WPQOKDWYPOJREA-FRRDWIJNSA-N 404.558 0.000 50 10 HBGE CCn1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)nn1 1478942725 DLIJRQFNUNYIBM-UHFFFAOYSA-N 409.472 -0.242 50 10 HBGE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c(OC)c1 1623368228 KJKCRPVCRXJPTI-KBPBESRZSA-N 404.423 -0.266 50 10 HBGE CCS(=O)(=O)N[C@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1 1631772543 MIPOJKZAFOMEIC-SECBINFHSA-N 406.324 -0.859 50 10 HBGE NS(=O)(=O)CCCNC(=O)NNC(=O)COc1ccc(Br)cc1 1674000631 KTGROWBIHJUVKE-UHFFFAOYSA-N 409.262 -0.163 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2sccc2B(O)O)C1 2267201589 QMVHKCPIRGNKBR-JGVFFNPUSA-N 400.209 -0.495 50 10 HBGE C[C@H]1[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282077482 WMUADXADWLFNLY-CMPLNLGQSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282102946 MWBFMHKZEUNEMP-BXUZGUMPSA-N 400.262 -0.816 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)Cc1cccc(B(O)O)c1 2282330116 VMJPPCSEAGDLKG-KBPBESRZSA-N 400.262 -0.922 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@@]2(C)CCN2C(=O)OC(C)(C)C)n1 2282373573 OKIKIHHDUHCHJG-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2282706765 QDRAPISCQGDNNQ-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2ccccc2B(O)O)C1 2282717127 DMMMLCMTGZAHAT-LBPRGKRZSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CC(CO)(NS(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282730761 HJIWPZMOQGFLQN-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE C[C@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)Cc1ncsc1B(O)O 2282858063 RGVNILWYNOWDFH-SNVBAGLBSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)c(F)c1 2360550951 ISUKAPNAZGLANK-LBPRGKRZSA-N 404.225 -0.618 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cc2ccccn2)c1 729394724 VNQJBXDNOLASNW-UHFFFAOYSA-N 421.479 -0.336 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=S)Nc2ccc(Cl)nc2)n(C)c1=O 764512299 BFMBHESJCVXKCQ-UHFFFAOYSA-N 422.858 -0.500 50 10 HBGE COCCCNC(=O)C(=O)NN=Cc1ccc(OCC(=O)NC[C@@H]2CCCO2)cc1 1084471142 FDGVEBNSZBFCOR-KRWDZBQOSA-N 420.466 -0.037 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)C1=O 1178358797 OGHNMZDUYDDXLO-NWDGAFQWSA-N 412.443 -0.445 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)c1ccc(B(O)O)cc1 1467383791 ZJOYXQPSNKZIFI-UHFFFAOYSA-N 400.624 -0.133 50 10 HBGE Cn1ccnc1COCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1630996772 SXWFYJAALRDCHG-UHFFFAOYSA-N 414.466 -0.458 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](CNS(=O)(=O)c2cscc2B(O)O)CO1 2282364815 YNQBLZBIMNLPCV-MNOVXSKESA-N 420.318 -0.364 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)cc1B(O)O 2282365672 CHWHMQVUDFVHQK-NSHDSACASA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@](F)(CNC(=O)c2cc(B(O)O)sn2)C1 2282440907 XRVUYEKUTILRFF-OAHLLOKOSA-N 403.241 -0.472 50 10 HBGE C[C@H]1[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCCN1C(=O)OC(C)(C)C 2282719272 JMPVKZJMWCNPFK-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2284046881 FJSDVTWASYLCTQ-YNEHKIRRSA-N 400.624 -0.701 50 10 HBGE Cc1c(NC(=O)C(CO)(CO)NC(=O)OC(C)(C)C)ccc(B(O)O)c1Cl 2370333081 RUYRWKSTEVZSME-UHFFFAOYSA-N 402.640 -0.485 50 10 HBGE Cc1sc2ncn(CCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(=O)c2c1C 729274845 FRUFJCGTYIODPV-VIFPVBQESA-N 415.497 -0.450 50 10 HBGE COCCN1C(=O)/C(=C/NNC(=O)c2ccc(OC)cc2OC)C(=O)NC1=S 730035667 BWNWFWGYYPDKDN-FMIVXFBMSA-N 408.436 -0.288 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C23CC(c4ccccc4)(C2)C3)n(C)c1=O 790784700 RGBHGIRYENINHF-UHFFFAOYSA-N 422.445 -0.297 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1nc(S(N)(=O)=O)c2ccccn12 1440638914 FGKVMFJVSXZGSD-UHFFFAOYSA-N 400.486 -0.531 50 10 HBGE Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)CS(C)(=O)=O)c1C 1454277607 KZMWLBXEKRVKJN-UHFFFAOYSA-N 405.498 -0.609 50 10 HBGE O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1cnsn1 1455600414 XAWUVJHVAIPLTE-UHFFFAOYSA-N 402.483 -0.322 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ncccn3)nc2)CC1 1471237808 OSIDVNPBFKUBTO-UHFFFAOYSA-N 406.472 -0.366 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2267608614 XFWSGYYNKYWJPC-GXSJLCMTSA-N 406.291 -0.754 50 10 HBGE CC[C@H](CN(C)S(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267626083 ASXQPUTWRGPHAN-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1cscc1B(O)O 2282373000 GTPYGUAAJXICIA-VXGBXAGGSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(B(O)O)cc1F 2360549251 NFTFNSWNUKQTTM-GFCCVEGCSA-N 404.225 -0.618 50 10 HBGE NC(=O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2I)c2ncnc(N)c12 26843303 OOZJUZZEMXCESE-ADVRJHOBSA-N 419.179 -0.833 50 10 HBGE C[C@](O)(Cn1ccccc1=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794077502 WQMQMCKXOLKTPW-IBGZPJMESA-N 402.407 -0.327 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)C(=O)C1 816878444 RXITXPMYRFNPGE-GFCCVEGCSA-N 421.458 -0.933 50 10 HBGE CC(C)(C)OC(=O)C1(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CCOCC1 1136389611 DNMMDBJOAWKBLE-LLVKDONJSA-N 405.473 -0.358 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1cc(Br)c[nH]1 1254316595 XHTDVCVHLSKOAX-AWEZNQCLSA-N 416.232 -0.651 50 10 HBGE Cn1cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)cn1 1350199271 MDUFXQSYQKUUIR-LBPRGKRZSA-N 405.436 -0.362 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)N[C@H]2CS(=O)(=O)C[C@H]2OC)cc1OC 1682618216 LSGCEKZSHCQJMC-SMDDNHRTSA-N 401.441 -0.150 50 10 HBGE O=S1(=O)CCN(S(=O)(=O)NC[C@H](Br)CBr)CC1 2005151096 MMYFWMXOCUHNCV-SSDOTTSWSA-N 414.141 -0.290 50 10 HBGE Cc1c(C(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2267421260 FLJQWCAJAXOQMP-LJQANCHMSA-N 400.244 -0.061 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H](C)C2(O)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282363583 IDMAXDDBCDPDEI-SNVBAGLBSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)NCCOCCNS(=O)(=O)Cc1ccc(B(O)O)cc1 2282378358 FDVRZSWJXZCZDX-UHFFFAOYSA-N 402.278 -0.673 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282727949 MXMRRXATNACZQV-OAHLLOKOSA-N 406.241 -0.941 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@@H](C)Cl)[C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)N(C)C1 77285985 UHQYIIRIOVIPLI-ODSACRAUSA-N 410.964 -0.001 50 10 HBGE in-vitro CCOC(=O)c1nnn(CC(=O)NNC(C)=O)c1CN1C(=O)c2ccccc2C1=O 327941160 XCOAKJMPTQZOMV-UHFFFAOYSA-N 414.378 -0.582 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cc2c(cc1Cl)OCCO2 728510752 SFUBMKDXRPDWEC-SSDOTTSWSA-N 413.861 -0.642 50 10 HBGE C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2nccn2S(=O)(=O)N(C)C)C[C@@H](C)O1 814766890 SQCKSQDMNWZWJV-MELADBBJSA-N 400.505 -0.267 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCO[C@@H]2C)cc1 1437079420 UZWZJGCDSJGFAC-ABAIWWIYSA-N 412.468 -0.162 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1456015409 CZADFNVXBSDSCI-ZZVJUGKHSA-N 418.450 -0.050 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)N1 1461835062 GAAJEVXGXJQTPX-GFCCVEGCSA-N 400.844 -0.081 50 10 HBGE O=C(NCc1ccc(Cl)cc1)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1471097729 AGZUGPUETRRNDC-QGZVFWFLSA-N 411.846 -0.019 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1 1545320507 RSFDUNKTDAEISX-ZDUSSCGKSA-N 400.370 -0.651 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccn2nccc2n1 1566278693 NRPXVHBPFNFWSV-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE CN(CCCC(=O)NNC(=O)[C@@H]1CCC(=O)N1)C1=NS(=O)(=O)c2ccccc21 1587113663 HQQDKTXJTGHOBY-LBPRGKRZSA-N 407.452 -0.727 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCS1(=O)=O 1627449255 VEAVLURXBLSOOW-RWMBFGLXSA-N 419.500 -0.017 50 10 HBGE Cn1cc(/C=C/C(=O)NNC(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)c(=O)n(C)c1=O 1645022235 YYNJUKNYHRJIPN-SYTKJHMZSA-N 407.427 -0.746 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](S(C)(=O)=O)[C@H](Nc2nccc(B(O)O)c2F)C1 2240310604 RIANFCNUOMEMKM-MNOVXSKESA-N 403.241 -0.655 50 10 HBGE Cc1nn(C)c(C(=O)N[C@H]2CCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267028131 HNOALMCOAPINKC-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE C[C@@H]1[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CCN1C(=O)OC(C)(C)C 2267392535 YLRUDCMEIUHORZ-NXEZZACHSA-N 405.307 -0.360 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282078628 LKBYWKBSZNYCNC-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282084980 SWMZRKOAIOXPIP-MRXNPFEDSA-N 400.262 -0.983 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1Cl 2282373009 GXEPLZDMZKJVIN-NSHDSACASA-N 422.696 -0.474 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC1(C)C 2282377277 OTWWFDHSWQCVHI-NSHDSACASA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282726056 LUVGXVMGKAOEQB-TXEJJXNPSA-N 400.237 -0.112 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@H]2C[C@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282729276 ZUQZQIJZFNTHJQ-ZWNOBZJWSA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282731738 VNRIWSNGVFJHEB-QPUJVOFHSA-N 406.216 -0.164 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NC(=O)c2cnsc2B(O)O)C1 2337398760 VADYPVDZYGBMEY-MGGBDBEPSA-N 403.291 -0.024 50 10 HBGE Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cn1C 725896065 XEAHOGXAVGIRHK-CQSZACIVSA-N 407.452 -0.452 50 10 HBGE Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)Cc3ccccn3)cnc21 729399160 MMZNJSQNBOXYSI-UHFFFAOYSA-N 420.227 -0.322 50 10 HBGE CN(C)CC1(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CCCCC1 787440849 PHVMINDEJZKTTO-UHFFFAOYSA-N 419.486 -0.907 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)CC1 807379335 XGLBZYDJIHRKGW-LBPRGKRZSA-N 421.520 -0.697 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)[C@H]2CCc3nncn3C2)CC1 816881259 CEPZAHDVSWDVLA-AWEZNQCLSA-N 421.502 -0.069 50 10 HBGE O=C(COc1ccccc1CNC(=O)c1ccc(B(O)O)cc1)NC[C@H]1CCCO1 1141770330 OBZYKOAUBYVSSN-GOSISDBHSA-N 412.251 -0.030 50 10 HBGE CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2cn(C)nn2)CC1 1216725772 IZEUPLPHQOVVBY-UHFFFAOYSA-N 400.443 -0.054 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)NCc1cn(CC(F)(F)F)c(=O)nc1O 1251127164 AOWLMUKYRGRRAC-UHFFFAOYSA-N 400.317 -0.021 50 10 HBGE CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCO[C@H]2C)cc1 1437079422 UZWZJGCDSJGFAC-NHYWBVRUSA-N 412.468 -0.162 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)N1CCC(NS(=O)(=O)NCC(F)(F)F)CC1 1473401229 RIUHSEBHYDSNDR-VIFPVBQESA-N 403.427 -0.617 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)[C@@H]1CCC(=O)N1 1647297611 UUIRAQHJXCTFRB-HNNXBMFYSA-N 408.480 -0.340 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2267389886 VSGLGTIOTMJKMM-JTQLQIEISA-N 405.307 -0.406 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC1CCN(C(=O)OCc2ccccc2)CC1 2267613809 FQTDUZPNTPIPKT-UHFFFAOYSA-N 422.272 -0.821 50 10 HBGE CN(CCCCN(C)S(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282074722 WKQQETYALYBPOT-UHFFFAOYSA-N 404.298 -0.633 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282083413 PARNQLIWQRAZKL-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE O=C(NC1CCN(S(=O)(=O)c2ccc(Cl)c(B(O)O)c2)CC1)C(F)(F)F 2286120246 KABRWRQADDGAHN-UHFFFAOYSA-N 414.598 -0.149 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1c1cc(B(O)O)c(Cl)cn1 2294919309 ZUDYOFLFUSWASF-INIZCTEOSA-N 401.656 -0.493 50 10 HBGE N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3COCCO3)CC2)cc1 744646669 GHULGBSVVOPAFR-MRXNPFEDSA-N 422.463 -0.478 50 10 HBGE CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1 759660729 CZPSYILOKLAGGQ-HNNXBMFYSA-N 414.484 -0.133 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1CN([C@@H]2CCOC2)C1 1137299341 OKMAKQFUINGTFP-GOSISDBHSA-N 415.494 -0.688 50 10 HBGE O=C(NCCNC(=O)c1cc(B(O)O)ccc1F)c1ccc(Br)cn1 1166463775 HNOQSEMLOMZWPJ-UHFFFAOYSA-N 410.008 -0.177 50 10 HBGE CN(C)c1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2cn(C)cn2)cc1 1455406684 PRNPFVWKWFXMCF-UHFFFAOYSA-N 411.513 -0.218 50 10 HBGE CC(C)c1ccc(S(=O)(=O)N2C[C@@H](O)C[C@@H]2C(=O)NNC(=O)C(C)(C)O)cc1 1556228146 DOBIHMBAZOOYAV-DZGCQCFKSA-N 413.496 -0.148 50 10 HBGE C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C 1564797237 MWYZFKUKYCBGBY-SNVBAGLBSA-N 407.880 -0.166 50 10 HBGE CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@]3(C)C[C@@H]3Br)CC2)CC1 1624389116 ZYJJCRLCENEEHV-GXTWGEPZSA-N 409.350 -0.204 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCN3[C@H](CNS3(=O)=O)C2)cc1C 1644632796 HAGVIXJPFWJLKS-LLVKDONJSA-N 401.514 -0.786 50 10 HBGE O=C(NC[C@H]1CC(=O)N(C2CC2)C1)NNC(=O)c1csc(N2CCOCC2)n1 1680738105 FBWLWEMPYLILSB-LLVKDONJSA-N 408.484 -0.065 50 10 HBGE CO[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1683885818 RSWHTRGQONDCSS-GFCCVEGCSA-N 400.457 -0.314 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)C(F)(F)Oc2ccccc2)C1 1684434852 KSMAVEPFWJWHFC-UHFFFAOYSA-N 407.399 -0.521 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2282079643 YXBVRRNLVCRCEM-PWSUYJOCSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](CNS(=O)(=O)Cc3ccsc3B(O)O)[C@@H]2C1 2282338477 NWZZAKYIOPQUQK-CLLJXQQHSA-N 416.330 -0.040 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282362567 HROYEZWAUIYKPN-JQWIXIFHSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)COC1 2282380209 FVLHQRKAGXMOMT-UHFFFAOYSA-N 420.680 -0.408 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282728714 HBHQWLRFUYTUOM-WDEREUQCSA-N 402.253 -0.055 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2C[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282741828 SYWBQLLBMNROKM-MWLCHTKSSA-N 402.282 -0.915 50 10 HBGE O=C(NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1)[C@H]1COCCO1 746004368 WAQQUUKWEXQABC-QGZVFWFLSA-N 406.439 -0.268 50 10 HBGE COc1cc(N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc(OC)c1OC 759272543 FOUDFIDUZLORNX-INIZCTEOSA-N 424.454 -0.009 50 10 HBGE CNC(=O)[C@H](CNC(=O)NNC(=O)[C@@H]1CCC(=O)N1)Cc1ccc(OC)c(F)c1 1230367730 ACIUGBOAFKMKBT-AAEUAGOBSA-N 409.418 -0.652 50 10 HBGE Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)Cc3ccccn3)CC2)cn1 1339430960 DIUDMHUIOXUYPP-UHFFFAOYSA-N 421.483 -0.459 50 10 HBGE CN(C)N(C(=O)CNc1ccc(S(N)(=O)=O)cc1F)[C@H]1CCS(=O)(=O)C1 1450813705 UJZJVPKPQGPWPV-JTQLQIEISA-N 408.477 -0.623 50 10 HBGE C[C@]1(c2cccc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)c2)NC(=O)NC1=O 1645053594 JDEZDSPMCYFXQP-FOIQADDNSA-N 415.450 -0.245 50 10 HBGE O=C(NC1CC(NS(=O)(=O)c2cncc(B(O)O)c2)C1)OCc1ccccc1 2255887089 SVXIPBSLAYJQTJ-UHFFFAOYSA-N 405.241 -0.503 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2sccc2B(O)O)C1 2267200045 CLSNWVJKUXCNRV-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE COC1(CNS(=O)(=O)c2cscc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2267381150 PWIJVJJKSMMUIG-UHFFFAOYSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267613246 ALNPAYXWRWPXLP-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2267625243 MFHGKWNKAZAVFW-SNVBAGLBSA-N 405.307 -0.454 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1 2282084126 NKXAHZOMBJKSJN-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(B(O)O)n1C 2282328318 VUVKFPCDEFKBID-JTQLQIEISA-N 402.282 -0.962 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NS(=O)(=O)Cc3ncsc3B(O)O)[C@H]1C2 2282736984 YCPMFZOANWUDCW-HOSYDEDBSA-N 417.318 -0.360 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COCC[C@@H]1NC(=O)OC(C)(C)C 2282742561 DTLJJMLKPBUFJK-QWRGUYRKSA-N 420.318 -0.303 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282743689 SBIKEEMLZXONPV-BONVTDFDSA-N 417.318 -0.501 50 10 HBGE N[C@H](CCC(=O)N[C@H](CSC(F)(F)[C@H](F)Cl)C(=O)NCC(=O)O)C(=O)O 255986522 LVXLCZPTUBQNHH-VCGAMNKESA-N 423.797 -0.276 50 10 HBGE COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)[C@@H]3COCCO3)n2)cc1 744644966 NDKTZSRUFWDBLG-HNNXBMFYSA-N 405.411 -0.223 50 10 HBGE O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 745979643 ZGHOURIZFXNDDZ-NSHDSACASA-N 411.358 -0.296 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](O)C3CCOCC3)cc2)CC1 748619513 JBTKQILABRMFLX-KRWDZBQOSA-N 412.512 -0.147 50 10 HBGE O=C(NCc1ccccc1CS(=O)(=O)N1CCCC1)NNC(=O)C(=O)NC1CC1 755086809 KFBMINGYPMHBKN-UHFFFAOYSA-N 423.495 -0.279 50 10 HBGE COc1ccc(C(=O)CCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OC 758037307 ZIZCNFUADMUFMX-JTQLQIEISA-N 401.441 -0.248 50 10 HBGE CN(C)C(=O)CCN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 760982509 APNBZZWKJOKFJI-UHFFFAOYSA-N 406.443 -0.548 50 10 HBGE CC[C@]1(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCNC1=O 1151459486 PVLPSLLMQNMYRR-SFHVURJKSA-N 409.512 -0.018 50 10 HBGE C[C@@H](C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)S(=O)(=O)C1CCOCC1 1156183679 FONYUJNLAMRFET-WFASDCNBSA-N 403.501 -0.631 50 10 HBGE COc1cc(N2C[C@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2=O)cc(OC)c1OC 1530230274 BHXBJHTZYMLZIE-PWSUYJOCSA-N 420.422 -0.509 50 10 HBGE CC1=NO[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 1538972343 NLWVIEJLQIODSQ-MRXNPFEDSA-N 424.479 -0.048 50 10 HBGE Cc1sc(=O)n(CC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1-c1ccccc1 1558927131 JNEYCOLAXFYFMW-SNVBAGLBSA-N 412.493 -0.030 50 10 HBGE C#CCSCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1587963690 IVPZFCOWLLETBI-UHFFFAOYSA-N 424.548 -0.185 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)c1c(Br)nc2n1CCOC2 1611015529 RQQXDZSSTJLJAD-UHFFFAOYSA-N 423.227 -0.238 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)CN3CCCc4ccccc43)c2S1(=O)=O 1628626357 HQYJNKGMGAGOPI-UHFFFAOYSA-N 418.479 -0.269 50 10 HBGE Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)C2=O 1635372282 QYPVVKDRMLEYTN-MRXNPFEDSA-N 400.435 -0.008 50 10 HBGE C[C@@]1(c2cccc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)c2)NC(=O)NC1=O 1645053597 JDEZDSPMCYFXQP-YWZLYKJASA-N 415.450 -0.245 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2c(F)cc(F)cc2B(O)O)CC1 2282366988 WFGXBGRNOWJPEN-UHFFFAOYSA-N 406.216 -0.114 50 10 HBGE CC[C@H](CN(CC)S(=O)(=O)c1nn(C)cc1B(O)O)NC(=O)OC(C)(C)C 2282740213 WDWMTOMOMVKZEV-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)NCc2sccc2B(O)O)C1 2283988493 WHZXEZJSQWYFNC-UHFFFAOYSA-N 406.216 -0.339 50 10 HBGE CC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1 256004196 UHQYIIRIOVIPLI-WDOALSMWSA-N 410.964 -0.001 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@@H]1COCCO1 744640917 FITPCKHKXYYYSA-HNNXBMFYSA-N 414.436 -0.426 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C\c2ccc3[nH]ccc3c2)n(C)c1=O 765800801 BNEHLLBJGZXRCW-XQRVVYSFSA-N 421.417 -0.224 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(C(=O)N2CCOCC2)cc1 1160955017 SALHRLWIKKNZKX-UHFFFAOYSA-N 411.418 -0.255 50 10 HBGE O=C(N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1ccc(B(O)O)cc1 1585447552 DGSYNYBUZXDFFI-KRWDZBQOSA-N 411.271 -0.608 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)[C@H]1CCCCO1)C1CCCC1 1674042476 VBUQBHINDBGINM-ZIAGYGMSSA-N 405.521 -0.159 50 10 HBGE CN([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)nn1C 2282081484 CSMQOSUYPNNDRN-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@@H]2C[C@H]21 2282345001 FHSQTSVJWAHHRX-JBLDHEPKSA-N 417.318 -0.360 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2282700048 NYGADDJKZZDBEO-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)CC[C@H]1CO 2282717104 DEBYVQSRKQEGGK-WDEREUQCSA-N 420.318 -0.676 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282719318 KESPKPMEYIDLKI-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@@H](F)CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282739147 FBTLOWZAZHOUAS-JTQLQIEISA-N 423.297 -0.553 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282861660 QVIYMLRCVBQYCS-NHCYSSNCSA-N 417.318 -0.502 50 10 HBGE C[C@@H](C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1c(F)cccc1F 763586264 CPQYBSXEDKGGFM-SECBINFHSA-N 420.376 -0.337 50 10 HBGE O=C(Cn1cnc(-c2ccccc2)cc1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1292046089 ZLGDJSSOYQTFSN-ZDUSSCGKSA-N 405.436 -0.572 50 10 HBGE O=C(NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)N[C@@H]1CCS(=O)(=O)C1 1625564313 QBAOCZPCFSCUJO-LLVKDONJSA-N 409.399 -0.497 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNS(=O)(=O)c2sccc2B(O)O)C1 2267201257 LUEWPEJIXURQJN-BONVTDFDSA-N 402.303 -0.037 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1sccc1B(O)O 2267615253 ZZNNCLRMRYYMQI-SNVBAGLBSA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626558 KFUAAWMAKUFQGA-NXEZZACHSA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)c1cc(B(O)O)c(Cl)s1 2270654340 OUSCTJMGXBVLKC-UHFFFAOYSA-N 408.669 -0.941 50 10 HBGE CN(C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ncsc1B(O)O 2282357587 LYSGBEVMRWWTMP-NSHDSACASA-N 419.334 -0.159 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282365994 HTIXAHLDLQOPIW-JTQLQIEISA-N 406.216 -0.068 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2B(O)O)[C@H]2C[C@@H]21 2282729942 VDOTXNJZWHFLLZ-STQMWFEESA-N 400.237 -0.112 50 10 HBGE COCC[C@]1(C(=O)N=c2nc(B(O)O)[nH]s2)CCN(C(=O)OC(C)(C)C)C1 2284124045 CVXYJOJKAYYLPV-OAHLLOKOSA-N 400.266 -0.758 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 778295919 XYTIKORUYOZVOW-TUYSUELWSA-N 418.450 -0.537 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCN(S(=O)(=O)NC(C)C)CC2)n1 1194290033 DIHBWURBTOWMBM-UHFFFAOYSA-N 418.545 -0.998 50 10 HBGE Cn1cc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC2=O)cn1 1264889805 VQSMLSZNNYSMCF-LLVKDONJSA-N 404.452 -0.198 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)cc1OC 1473774537 GYMSTTFXOTUNRM-KBPBESRZSA-N 411.480 -0.169 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@](F)(C(=O)NNC(=O)[C@H]2CCC(=O)N2)C1 1630431508 HMQFJLXHOKIQGP-BMLIUANNSA-N 400.407 -0.612 50 10 HBGE O=C(NC[C@@H](NC(=O)c1n[nH]cc1B(O)O)C(F)(F)F)OCc1ccccc1 2255552845 QGROHBXCGBGKNJ-LLVKDONJSA-N 400.122 -0.323 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1CCON(C(=O)OC(C)(C)C)C1 2267387928 QDHUHXMRFTYXAW-JTQLQIEISA-N 406.291 -0.044 50 10 HBGE CON(CCCNS(=O)(=O)c1ccc(F)cc1B(O)O)C(=O)OC(C)(C)C 2282735205 XHVAPGKHPUEYBY-UHFFFAOYSA-N 406.241 -0.028 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(B(O)O)ccc1Cl 2283957549 QBPXXHSDLCQFIA-SNVBAGLBSA-N 401.612 -0.190 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1cc(Cl)ccc1B(O)O 2359391278 SPXLEWFEXTZICL-JHJVBQTASA-N 400.624 -0.701 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@](C)(=O)C2CN(C(=O)OC(C)(C)C)C2)n1C 2362568602 JGBNSMNAQOWCSW-HHHXNRCGSA-N 400.266 -0.734 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccn1 731596058 REFMOIOCSYBOCY-MGPQQGTHSA-N 408.480 -0.048 50 10 HBGE COCC(=O)NNC(=O)CSc1n[nH]c(NN=Cc2ccc(C(=O)OC)cc2)n1 1083872355 MSSCTWLGEFMFMN-UHFFFAOYSA-N 421.439 -0.077 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCOCCF)nc2)CC1 1233758899 VTUVDVUQSQIQAY-UHFFFAOYSA-N 404.468 -0.370 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)N[C@H]1CCS(=O)(=O)C1 1292039074 RCRJHHVVUHIJMA-NSHDSACASA-N 409.399 -0.497 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 1539175367 XENRISDOMGEDDL-APYUEPQZSA-N 404.467 -0.117 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)[C@H](c2cnn(C)c2)C1 1635374937 KMMCDPHUOYRWOC-OKZBNKHCSA-N 404.515 -0.144 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2cnn(C)n2)c1 1681349403 IMXJYAXHEGRBPB-UHFFFAOYSA-N 409.472 -0.358 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1683460474 YUQOWCWBKOQHPX-KPZWWZAWSA-N 410.402 -0.449 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)c1cc(B(O)O)cs1 2255880734 KFHVBSRCWHKAOL-UHFFFAOYSA-N 400.234 -0.134 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2267203548 RONZHCHQOFNLIP-GHMZBOCLSA-N 406.291 -0.660 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2267393867 FGMXKMMXLTWKNY-JZYVYDRUSA-N 403.291 -0.892 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282069748 UTCFCJVKGBZAQZ-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE C[C@@H]1C[C@@H](CNS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282081816 GARBAHUYYXXRCC-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 2282711664 FXAZKEQSYDQQCS-UWVGGRQHSA-N 402.282 -0.930 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H](NS(=O)(=O)c2ccc(B(O)O)c(F)c2)C1 2282728226 PXZOURUHFVZTIQ-LLVKDONJSA-N 400.237 -0.041 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H](NC(=O)OC(C)(C)C)C2(CCOCC2)C1)B(O)O 2282729465 NMMDVDAGIQUDLH-ZDUSSCGKSA-N 404.294 -0.110 50 10 HBGE C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282736810 WDEYJEKQXSAJJU-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE COC(=O)[C@@H](CC(=O)N(C)Cc1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2283934974 AFVQULDYXVHBBG-LLVKDONJSA-N 400.262 -0.157 50 10 HBGE CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)[C@@H]1COCCO1 746001859 HWNSWUHQODJMEO-HNNXBMFYSA-N 415.468 -0.053 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(C2CCOCC2)C1=O 747502500 NSRMSOFYQAGVRF-GFCCVEGCSA-N 409.468 -0.412 50 10 HBGE O=C(NNC(=O)C1(n2cnnn2)CC1)c1cccc(S(=O)(=O)N2CCCC2)c1 1350495663 HNXKQJIAUUXINJ-UHFFFAOYSA-N 405.440 -0.592 50 10 HBGE CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]cc2F)c1 1472605981 SHTUEDYBZRYFAG-UHFFFAOYSA-N 402.429 -0.532 50 10 HBGE CO[C@H](C)c1noc(CN2CCCN(C(=O)c3cc(B(O)O)ccc3F)CC2)n1 1545199271 TWULGQMQNVIUJE-GFCCVEGCSA-N 406.223 -0.056 50 10 HBGE CN(CC(=O)NNC(=O)c1ncon1)S(=O)(=O)c1ccc(Br)cc1 1585613380 CAWGTPRKEORDKI-UHFFFAOYSA-N 418.229 -0.086 50 10 HBGE C[C@@]1(NNC(=O)NC[C@H]2CS(=O)(=O)c3ccccc3O2)CCS(=O)(=O)C1 1673834905 GWKUFPWJNBEZDS-XHDPSFHLSA-N 403.482 -0.398 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N[C@]2(C)CCCN(C(=O)OCc3ccccc3)C2)n1 2267448230 VPZCRIQPLSNHDM-GOSISDBHSA-N 401.232 -0.584 50 10 HBGE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)c1scc(B(O)O)c1Cl 2270654219 MUFDGUYGZWDIEE-UHFFFAOYSA-N 408.669 -0.941 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N=c1nc(CCNC(=O)OC(C)(C)C)[nH]s1 2281896256 GIYDOCVSLSQKER-UHFFFAOYSA-N 413.290 -0.276 50 10 HBGE C[C@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)nn2C)CN1C(=O)OC(C)(C)C 2282087226 UAGMUKVFOBUQLJ-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1cccc(B(O)O)c1 2282088769 RETNJJIYSUCOEY-UHFFFAOYSA-N 402.278 -0.424 50 10 HBGE Cn1nc(C(=O)N[C@H]2CSCCN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282287222 WJLDIHHROSBQDE-SECBINFHSA-N 418.712 -0.164 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H]2COC[C@H]21 2282418175 GVMMVCPPUYOXLW-NEPJUHHUSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@@H]2COC[C@H]21 2282711201 YUWVPEIDRUHCPE-GHMZBOCLSA-N 418.302 -0.563 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2282718396 XBERLEDVJVVBKS-NSHDSACASA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](Cc1ncns1)C(=O)NCc1ncc(B(O)O)s1 2284060431 MWJUQDWUDKYPOH-QMMMGPOBSA-N 413.290 -0.573 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccsc1B(O)O 2285413849 SSFKCCPCBGQORF-NSHDSACASA-N 422.334 -0.535 50 10 HBGE N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 744646668 GHULGBSVVOPAFR-INIZCTEOSA-N 422.463 -0.478 50 10 HBGE CCC(=O)NNC(=O)[C@H](C)N1CCN([C@@H]2CCCN(c3cc(C)nn3C)C2=O)CC1 780566207 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O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=NN2CCCN=C2N1 1617979346 CSXZZMWCMIGXGG-UHFFFAOYSA-N 419.467 -0.790 50 10 HBGE COC(=O)c1ccc(Br)c(NNC(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)c1 1628678802 YFNADQCMFGOIQG-JTQLQIEISA-N 420.241 -0.408 50 10 HBGE CC(=O)N1CCC[C@@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1638390149 PJTCCMLQSLNIGX-CQSZACIVSA-N 410.500 -0.528 50 10 HBGE CN(c1cccc(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)c1)S(C)(=O)=O 1685626124 AOCOZFQXDUQXDG-UHFFFAOYSA-N 407.452 -0.075 50 10 HBGE C[C@@H](NS(=O)(=O)c1cc(B(O)O)cs1)C1(O)CN(C(=O)OC(C)(C)C)C1 2267200168 CSHOGKUQWOJIAE-SECBINFHSA-N 406.291 -0.924 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267203228 NRKLRZUUPLXVAT-HTQZYQBOSA-N 400.209 -0.495 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCC(C)(NC(=O)OC(C)(C)C)CC1 2282076144 DDVUALJEKSMTJO-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282507217 DIYOTJHWPMYCDR-OAHLLOKOSA-N 404.298 -0.682 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282741663 QSDCZFGXMYUNKB-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)n1 2362083641 DNAUZACQDPAMLJ-NSHDSACASA-N 404.298 -0.682 50 10 HBGE CCNC(=O)N1CC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 1116831965 SZQYZTWUKVUZCL-NSHDSACASA-N 411.488 -0.273 50 10 HBGE O=C(NNC(=O)[C@@H](O)c1cccc(Br)c1)N[C@@H]1CCS(=O)(=O)C1 1136390125 UKKDUZMCSAYNIC-MNOVXSKESA-N 406.258 0.000 50 10 HBGE O=C(Cn1c(=O)cnc2ccccc21)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1159494633 KLFZJBFONAWXDP-KRWDZBQOSA-N 405.370 -0.005 50 10 HBGE C[C@@]1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCCS1(=O)=O 1466476018 QOENKAZMHDXBDL-NSHDSACASA-N 403.320 -0.220 50 10 HBGE O=C(NCC[C@H]1CCCS1(=O)=O)NNC(=O)c1csc(N2CCOCC2)n1 1471204369 PCEUNFWELXGLDH-LLVKDONJSA-N 417.513 -0.109 50 10 HBGE O=C(NNc1ncc(Br)cn1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 1557235223 AQJFRAUPJJXDKU-WCBMZHEXSA-N 418.273 -0.282 50 10 HBGE CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1 1558956856 FRWMVHJPYHRYCN-KGLIPLIRSA-N 400.476 -0.072 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@@H]2CNC(=O)C2)cc1 1685122385 FVYMWWCSFOUQJA-ZDUSSCGKSA-N 411.484 -0.528 50 10 HBGE CC(C)(C)OC(=O)NC1CC(C[S@@](C)(=O)=NC(=O)c2cc(B(O)O)n[nH]2)C1 2281837320 YXTQYLKUGISCCN-FVOZGUDWSA-N 400.266 -0.369 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282068661 GGCFAAFAIPLBTJ-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2ccccc2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282105377 KAKONWCFIVBLGH-QWHCGFSZSA-N 400.262 -0.721 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)sc1B(O)O 2282369764 LCIPGCIYZOOXGT-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CF)(NS(=O)(=O)c2cncc(B(O)O)c2)C1 2282719018 GBUFJTNLEITQOP-HNNXBMFYSA-N 403.241 -0.611 50 10 HBGE CC(C)(C)OC(=O)NCC1CN(S(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282732281 DINYHWMBGDGZQH-UHFFFAOYSA-N 406.216 -0.210 50 10 HBGE O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cscc1B(O)O 2282741341 MNMPNBNCTIZTHH-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1cc(B(O)O)ccn1 2283957552 ZBVVNWTVPUCNNX-NSHDSACASA-N 401.250 -0.972 50 10 HBGE C[C@@H]1[C@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)[C@H]1c1ccccc1 797743469 QVHPJMZUMYUBIJ-GLQYFDAESA-N 410.434 -0.369 50 10 HBGE O=C(C1CC2(C1)CS(=O)(=O)C2)N1CCN(S(=O)(=O)CBr)CC1 1137881714 BHGBERYUVMCTMR-UHFFFAOYSA-N 415.331 -0.362 50 10 HBGE CN1CCn2ncc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2S1(=O)=O 1290390311 ZEMHNPGORWHUFJ-UHFFFAOYSA-N 407.408 -0.637 50 10 HBGE O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@]1(F)CCS(=O)(=O)C1 1349691588 BQHDZRPRDRYEGS-GOSISDBHSA-N 412.487 -0.127 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)c2cc(B(O)O)ccc2F)CC1 1597017270 BXNMZHPBMXOGPZ-UHFFFAOYSA-N 409.223 -0.685 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2cc(Cl)c(B(O)O)s2)CO1 2255758946 RCCXOAXKGNOFPB-ZETCQYMHSA-N 412.682 -0.090 50 10 HBGE CC(C)(C)OC(=O)N1CC(ONS(=O)(=O)c2cc(Cl)c(B(O)O)s2)C1 2255760283 OANFZRIQYZFMPZ-UHFFFAOYSA-N 412.682 -0.090 50 10 HBGE CC(C)(C)OC(=O)NCC1CCS(=O)(=NC(=O)c2n[nH]cc2B(O)O)CC1 2281844904 METBPZWHTUBJKR-UHFFFAOYSA-N 400.266 -0.368 50 10 HBGE C[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H]1NC(=O)C(F)(F)F 2282338427 RIFMZPQTICGVBJ-YUMQZZPRSA-N 415.224 -0.958 50 10 HBGE CC(C)(C)OC(=O)NC1CC(NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282366576 QCVIYZBFIDFZLJ-UHFFFAOYSA-N 406.216 -0.021 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741148 KBGSOUINRQSRMX-QWRGUYRKSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)Cc2ccccc2B(O)O)COC1 2282856040 MTJOLRHEOJCXNI-UHFFFAOYSA-N 400.262 -0.921 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2284012189 TYPBGZXMWPNUKX-LLVKDONJSA-N 400.262 -0.191 50 10 HBGE NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COCCO2)ccc1Br 746022792 MTIUMLXWHWYORM-SECBINFHSA-N 408.230 -0.727 50 10 HBGE COc1cccc(/C=C(/C(=O)NNC(=O)N2CCN(C)CC2)n2nnnc2C)c1 1155655443 CHIAEYLWPMXTCB-VBKFSLOCSA-N 400.443 -0.024 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1301696945 HLXATDOCGDCZJI-IJLUTSLNSA-N 419.525 -0.525 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)cc2c1OCCO2 1457616215 DEMNWFBNRPOWQC-SSDOTTSWSA-N 422.257 -0.081 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CCCCO)CC2)cc1 1622153941 ZYQHOKJZJNBHFP-UHFFFAOYSA-N 412.512 -0.389 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1ccc(Br)c(S(C)(=O)=O)c1 1641666757 HYDLRNBDUZKYHN-UHFFFAOYSA-N 413.271 -0.342 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](C)[C@@H]1NC(=O)C(F)(F)F 2282725219 YCKGVAUASTXSQA-SOCHQFKDSA-N 414.236 -0.106 50 10 HBGE O=C(O)C[C@H](COCc1ccccc1)NS(=O)(=O)Cc1ncsc1B(O)O 2284407691 OARULQQQSVKWBH-GFCCVEGCSA-N 414.270 -0.698 50 10 HBGE O=C(NNC(=O)[C@H]1CSCN1C(=O)C1CCCC1)N[C@@H]1CCS(=O)(=O)C1 730074272 ABBMDLCLCSJYLV-VXGBXAGGSA-N 404.514 -0.404 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)[C@@H]3COCCO3)CC2=O)cc1OC 744642492 QAVPJIQULIQYAQ-YOEHRIQHSA-N 421.450 -0.342 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)n1cnc(C#N)n1 798980377 NOICPMMSDFBBNR-AWEZNQCLSA-N 410.438 -0.684 50 10 HBGE CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(N)(=O)=O)C2)o1 1142390413 ZXUSVGQPODBQNG-LBPRGKRZSA-N 401.489 -0.202 50 10 HBGE CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)CN1CCCC1=O 1152015501 WRADPOFTYXTDQD-GFCCVEGCSA-N 411.484 -0.251 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)NNC(=O)[C@H]2CCCO2)C1 1450396703 HVZPESVEAINLRC-NWDGAFQWSA-N 405.473 -0.263 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1 1586191277 RRTOJXZDQDQUBW-UHFFFAOYSA-N 406.218 -0.513 50 10 HBGE C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)C1 1633319157 AWVVHINXUJBSRO-GOEBONIOSA-N 405.279 -0.042 50 10 HBGE O=C(CNC(=O)N1CCCC1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1635500845 PKSDANWNPKLQIU-UHFFFAOYSA-N 416.482 -0.603 50 10 HBGE CC(C)(C)OC(=O)NC1CCN(CCNC(=O)NNC(=O)[C@@H]2COCCO2)CC1 1685236835 PIOBNIBHDQRBIO-AWEZNQCLSA-N 415.491 -0.279 50 10 HBGE CS(=O)(=O)N1CCC(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)CC1 1858081629 WFDJWTNQKAFHDD-UHFFFAOYSA-N 405.454 -0.634 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1ccc(B(O)O)cc1 2089784546 KWAJZPOOJKZQRN-UHFFFAOYSA-N 416.264 -0.138 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2267062269 QOEOLRRRMRYWME-ZIAGYGMSSA-N 419.268 -0.055 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272653162 LICJYEPEAMBUEX-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(NS(=O)(=O)c3cc(B(O)O)cs3)CO[C@H]1C2 2282069233 NIKWJQZIIZBZRR-PGUXBMHVSA-N 418.302 -0.469 50 10 HBGE CN([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1nn(C)cc1B(O)O 2282363001 LBABULNAZAVLQW-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2282444016 OOWOXOZENBBKKF-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NS(=O)(=O)c1nn(C)cc1B(O)O 2282728055 BYGQTTIZPBVIMZ-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)n1 2282735474 AVYHPHNUXOTLDV-HNNXBMFYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@]12CCN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282736589 STSGQDNUWPCLCX-OAHLLOKOSA-N 417.318 -0.262 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369890758 DGXQOSZHOMDQAF-GGZOMVNGSA-N 420.680 -0.961 50 10 HBGE O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)[C@H]1COCCO1 745435217 FHNVAUADAUQPMC-GFCCVEGCSA-N 406.848 -0.636 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccn(CCN2CCOCC2)n1 764411555 OTBDRCDLLUGELQ-UHFFFAOYSA-N 414.466 -0.148 50 10 HBGE C[C@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCNC(=O)C1 1137300657 RQMPXZSLTFIDOO-FQEVSTJZSA-N 401.467 -0.492 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1318896300 ANYXZVYRUBSBPJ-ARFHVFGLSA-N 422.507 -0.119 50 10 HBGE CN(C)c1ncc(Br)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n1 1440706101 UGHGURFHIANVKA-SSDOTTSWSA-N 406.262 -0.499 50 10 HBGE O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)[C@H]1CCN1C1CCOCC1 1645054427 SOSJPKJFRTZBPU-QGZVFWFLSA-N 402.499 -0.396 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2267622638 USHYEMLRGJGYBC-GHMZBOCLSA-N 402.303 -0.181 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)C1CC1 2267625242 MFHGKWNKAZAVFW-JTQLQIEISA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626766 NKDHZFDLSVLIDQ-UWVGGRQHSA-N 405.307 -0.312 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C1 2282080638 LWHROOQZGKJWLQ-NSHDSACASA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)Nc1cc(B(O)O)ccc1Cl 2284050514 ZXZPCKSZZVWNAH-AVGNSLFASA-N 400.624 -0.701 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2(C)C)n1 2380428782 VHEMTRTZMVFWCU-NSHDSACASA-N 402.282 -0.834 50 10 HBGE Cn1c(=O)c2ccc(C(=O)NNC(=O)CN3CCCc4ccccc43)nc2n(C)c1=O 914221948 HSRKVNWMBCBRSR-UHFFFAOYSA-N 422.445 -0.154 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)N1 1131723558 XYCBARIEVXLJFX-RISCZKNCSA-N 412.443 -0.348 50 10 HBGE Cn1cc([C@@H]2[C@@H](CNC(=O)NNC(=O)[C@@H]3COCCO3)CC(=O)N2C(C)(C)C)cn1 1253006751 YSTKPCMVOCLSQX-INWMFGNUSA-N 422.486 -0.146 50 10 HBGE COc1ccc(C(=O)NC2=S=C(C(=O)NNC(=O)CS(C)(=O)=O)C=C2)cc1 1454277113 GVBWEVVCHBPGPW-UHFFFAOYSA-N 411.461 -0.778 50 10 HBGE CNC(=O)NC[C@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CCO1 1473652591 ODHQCSWJAGGEJG-LBPRGKRZSA-N 413.862 -0.261 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CN(C)CCN1C 1479597495 PUUHJHGPQGZYFM-IUODEOHRSA-N 401.471 -0.488 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)c1cccc(N(C)C)c1 1538980470 LKTCLMJOEJAHQR-UHFFFAOYSA-N 413.500 -0.652 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)cc1OC 1540423819 XASWRSGWZDOYPF-UHFFFAOYSA-N 423.451 -0.001 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc2n(n1)CCN(C)S2(=O)=O 1623500436 WNMCDJJVWVDNTA-UHFFFAOYSA-N 403.424 -0.452 50 10 HBGE Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1 1650648266 VFOMZPWKYDQZPM-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE N#Cc1ccc(C(=O)NNC(=O)CN2CCOC3(CCS(=O)(=O)CC3)C2)cc1 1660651362 BBCMBAZNTQSJFL-UHFFFAOYSA-N 406.464 -0.401 50 10 HBGE C[P@]1(=O)C[C@@H](Br)[C@@H](NS(=O)(=O)N2CCS(=O)(=O)CC2)C1 2177839452 OTFVTRCBUODGCL-IDHHQXPSSA-N 409.264 -0.310 50 10 HBGE CC(C)(C)OC(=O)N=S1(=O)CC2(CN(C(=O)c3cc(B(O)O)sn3)C2)C1 2267431175 WBSQCGDDJVCYQZ-UHFFFAOYSA-N 401.275 -0.318 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626768 NKDHZFDLSVLIDQ-ZJUUUORDSA-N 405.307 -0.312 50 10 HBGE Cc1nn(C)c(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2281849195 MMONRDRZXYZWNZ-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H]2COC[C@H]12 2282708873 SKONBZUGISLYGI-MXWKQRLJSA-N 418.302 -0.660 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 2282719136 HVRIOGQFFYPLFL-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C 2282733807 BIEVRJOSTKGGSE-QWRGUYRKSA-N 402.278 -0.045 50 10 HBGE CC(C)(C)OC(=O)N1CC(N(C2COC2)S(=O)(=O)c2cscc2B(O)O)C1 2282736250 NDPGWIDTPZIJIN-UHFFFAOYSA-N 418.302 -0.563 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2nn(C)cc2B(O)O)CC[C@H]1NC(=O)OC(C)(C)C 2282740765 FHECREAZZYSOTI-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccncc1 731595946 LSFKYVOQUQNPQW-RBSFLKMASA-N 408.480 -0.048 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)CN1CCN(S(C)(=O)=O)CC1 759302655 XZNGNLGVDUKMIS-UHFFFAOYSA-N 422.305 -0.874 50 10 HBGE O=C1CC[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CN1 1160403725 QBOJKSAHFGHVFG-ZDUSSCGKSA-N 424.479 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1456015405 CZADFNVXBSDSCI-ZCRGAIPPSA-N 418.450 -0.050 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C 1457880170 NAQZPSZCCHQEKH-GHMZBOCLSA-N 404.427 -0.437 50 10 HBGE Cc1nc(N)nc(C)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278468 FENHXJWHSMKMMM-UHFFFAOYSA-N 411.466 -0.105 50 10 HBGE O=C1CS(=O)(=O)C[C@@H](C(=O)NNC(=O)c2ccc(F)cc2Br)N1 1626202891 RMLIDUZIYQUIQA-VIFPVBQESA-N 408.205 -0.738 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)CS(C)(=O)=O 1634355315 IRNHYQPAJHHUCU-LBPRGKRZSA-N 417.509 -0.261 50 10 HBGE O=C(CN(Cc1ccccc1)CC1(O)CNC1)N[C@@H]1CS(=O)(=O)C[C@H]1Cl 1915486379 QATKHEQYXSLYJT-HUUCEWRRSA-N 401.916 -0.657 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1csnc1B(O)O)OCc1ccccc1 2255581722 QRFRILDXLOLPPU-KBPBESRZSA-N 405.241 -0.363 50 10 HBGE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1sccc1B(O)O 2267207020 OENAKLMBBYQGNQ-HTQZYQBOSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2csnc2B(O)O)C1 2267435718 NHNPQDKZERHUCY-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE C[C@H](NS(=O)(=O)Cc1ccsc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2282417276 GYNNSPFLDBDZCV-JTQLQIEISA-N 420.318 -0.782 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282723426 QGYFLYOEIBCRDG-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CN(NC(=O)[C@@H]1[C@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)S(=O)(=O)C1CCC1 2365267643 FMQFPZQDSZRTMD-RWMBFGLXSA-N 407.489 -0.437 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@@H]2COCCO2)nnn1-c1cccc2c1CCN(C)C2 744646106 XQEUOYUATMPGLE-INIZCTEOSA-N 400.439 -0.260 50 10 HBGE CCOc1ccc(O)c(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1 764811847 BSWRRVIUSLKFJR-UHFFFAOYSA-N 400.395 -0.312 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 792855480 SAFQNAFZZNYQMR-NWDGAFQWSA-N 407.489 -0.015 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 1360182720 YFCZHGNXVJOHBL-CQSZACIVSA-N 418.454 -0.748 50 10 HBGE CCc1nn(C)c(C(=O)N2CC(N(C)C(=O)OCc3ccccc3)C2)c1B(O)O 2267400061 PTFDFUASCDCTER-UHFFFAOYSA-N 400.244 -0.245 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1S(=O)(=O)c1cscc1B(O)O 2267623648 LDSJYJMHEPFNEV-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNS(=O)(=O)c2sccc2B(O)O)C[C@H]1O 2282074128 RUBOYFLKYLYFJJ-MVWJERBFSA-N 420.318 -0.630 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2282507615 JZROTXCFDWDQNO-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1ccc(B(O)O)cc1 2282717843 OOHLCXULGDGUDJ-UHFFFAOYSA-N 402.278 -0.424 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCCNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282735982 JBXVDFJWNVXJJF-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE O=C(Cc1ccccc1)NN=Cc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1 2297659760 AMXHZYWDUXDUDV-KPACCLEDSA-N 416.430 -0.442 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)[C@@H]1COCCO1 744643668 QQUWHOOHPQDDME-INIZCTEOSA-N 411.480 -0.203 50 10 HBGE CCC[C@H]1C[C@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CCO1 779934780 FFIXFBLQWOXTKD-NEPJUHHUSA-N 406.443 -0.824 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccnn2-c2ccccc2)n(C)c1=O 792236968 DFWZUQCMVHZRAG-UHFFFAOYSA-N 422.405 -0.919 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1(F)F 1135772305 ZWWKXLIYVLNUOK-IVZWLZJFSA-N 411.427 -0.026 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)Cn1nnc2ccccc2c1=O 1156083668 OJCJQRDQASPTRU-CYBMUJFWSA-N 402.411 -0.052 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)c1c(Br)nc2n1CCOC2 1292564283 MKWYNVBAKHJWKN-UHFFFAOYSA-N 412.200 -0.040 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)=NO2)C1 1454061115 JWQRBMYKLOHUSW-BBATYDOGSA-N 409.443 -0.042 50 10 HBGE C=CCn1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1 1478855058 ASYBWJMDALUZQX-UHFFFAOYSA-N 407.456 -0.141 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(B(O)O)ccc1F 1618614782 IKKAUCIGHAEXJI-UHFFFAOYSA-N 423.231 -0.717 50 10 HBGE CC(C)n1nc(C(=O)NNC(=O)CN2CC(=O)N(C)C2=O)c2ccccc2c1=O 1624039204 WMODZEGGRBQKCC-UHFFFAOYSA-N 400.395 -0.368 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)c(I)n1 1627130799 NBGCYINZUKCVJD-UHFFFAOYSA-N 401.164 -0.202 50 10 HBGE COCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 1642239039 GOZUKJFHWWJHMQ-AWEZNQCLSA-N 415.468 -0.432 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@]2(C#N)CCCOC2)CC1 1650833817 JNFSEDMSTIBSKO-KRWDZBQOSA-N 408.484 -0.219 50 10 HBGE COc1cc([C@@H](C)NC(=O)NNC(=O)[C@H]2COCCO2)ccc1S(C)(=O)=O 1676809078 VOWUXSDYIIXJQI-ZWNOBZJWSA-N 401.441 -0.095 50 10 HBGE CN(C)S(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1684014526 KLSXBZQTBPTOQA-UHFFFAOYSA-N 421.479 -0.079 50 10 HBGE Cn1cc(S(=O)(=O)NC[C@@H](Br)CBr)c(=O)n(C)c1=O 2116352946 CKRMDNKQRTYMBM-LURJTMIESA-N 419.095 -0.479 50 10 HBGE Cn1cc(C(=O)N2CCC(CNC(=O)OCc3ccccc3)CC2)c(B(O)O)n1 2267395487 DCLMGWZPTIONRT-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE CC(C)(C)OC(=O)NCC[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1 2282416990 DMHCIFUICKPVGW-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE COC1(CCNC(=O)OC(C)(C)C)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282704740 OESUNIHWHDRJSI-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CC(F)(CNS(=O)(=O)Cc2cccc(B(O)O)c2)C1 2282858708 BGOZQLRAECIHLH-UHFFFAOYSA-N 402.253 -0.255 50 10 HBGE CCCN(CCNS(=O)(=O)c1nc(C)n(C)c1B(O)O)C(=O)OC(C)(C)C 2282860535 BZEMMIJSLIUULM-UHFFFAOYSA-N 404.298 -0.666 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NC(=O)c1cc(F)c(B(O)O)cc1O 2364936200 XTZUBPFASFFTLK-HHHXNRCGSA-N 404.225 -0.026 50 10 HBGE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1C(=O)NCc1sc(Cl)cc1B(O)O 2369888500 DMWSQWXJOVGWDV-VIFPVBQESA-N 417.680 -0.567 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)CC1 816881260 CEPZAHDVSWDVLA-CQSZACIVSA-N 421.502 -0.069 50 10 HBGE CO[C@]1(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CCS(=O)(=O)C1 1136529370 XPASKKOKIVUGLM-OAHLLOKOSA-N 403.482 -0.226 50 10 HBGE O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cccc(B(O)O)c1 1141675657 VZPSDZKZIGUWRO-UHFFFAOYSA-N 418.280 -0.542 50 10 HBGE CO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1CCOC1 1252900131 JSFPGDSXQSMQRE-DZGCQCFKSA-N 414.484 -0.068 50 10 HBGE Cc1ccccc1C[C@H](C)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1545424164 OTCSZSDGMJLBCA-ZDUSSCGKSA-N 412.450 -0.232 50 10 HBGE COc1ccc(Br)c(C(=O)NNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)c1 1565563328 BKEGWZWZOIWRPS-JHJVBQTASA-N 401.213 -0.369 50 10 HBGE O=C(NNC(=O)c1c[nH]c2cc(F)c(F)cc2c1=O)N[C@@H]1CCS(=O)(=O)C1 1625567104 DBXPTXFZIAQNJS-SSDOTTSWSA-N 400.363 -0.063 50 10 HBGE CCc1c(C(=O)NN(C)C(=S)NCCCOC)cnc2c1c(=O)n(C)c(=O)n2C 1628718156 NMVFSIWTQXFLNX-UHFFFAOYSA-N 422.511 -0.318 50 10 HBGE COCCNS(=O)(=O)c1cccc(CNC(=O)c2cc(B(O)O)ccc2F)c1 1629626554 NVEHDOZFTPMJRP-UHFFFAOYSA-N 410.232 -0.640 50 10 HBGE Cc1c(C(=O)N[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)nn(C)c1B(O)O 2267349978 BTQIQPZBZZUWDU-OAHLLOKOSA-N 400.244 -0.061 50 10 HBGE CC(C)(C)OC(=O)NCC(F)(F)CNS(=O)(=O)Cc1ncsc1B(O)O 2267419112 NKLZZNMPTVSMPQ-UHFFFAOYSA-N 415.249 -0.598 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cncc(B(O)O)c1 2282104010 VSXMYIUYIRXMTJ-CHWSQXEVSA-N 417.318 -0.609 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2C[C@H](NC(=O)OC(C)(C)C)CC2(C)C)n1 2282377950 YQUWQBIKXUVSDF-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1 2282731139 MTGTUFGXJGSGFA-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@]12CC[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282739668 NEISFDRNLAPDJL-BONVTDFDSA-N 417.318 -0.358 50 10 HBGE CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 730310652 NVQNAFWFNHUSNX-BXUZGUMPSA-N 409.420 -0.562 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 746022351 BIUZATIFJJWHLQ-DZGCQCFKSA-N 413.452 -0.680 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1 800837123 ATIDGWHIVKLEGC-CQSZACIVSA-N 421.497 -0.558 50 10 HBGE Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cnsn3)CC2)c1 1462715375 MFOVNCPNSHSMLL-UHFFFAOYSA-N 424.508 -0.240 50 10 HBGE C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1635372270 QUOUMHGUJGBQRI-QGZVFWFLSA-N 420.491 -0.388 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1638952211 IYKMACPQZNGOEU-FZMZJTMJSA-N 412.468 -0.761 50 10 HBGE CCN1C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1=O 1672947620 JNJMJKZLWPZKER-CYBMUJFWSA-N 411.484 -0.433 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCOC[C@H]1CNC(=O)OC(C)(C)C 2282356074 PEUYXUUYQYNMTK-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE Cc1cc(S(=O)(=O)Nc2nnc(CNC(=O)OC(C)(C)C)o2)sc1B(O)O 2282359943 VEUXUEKWHXLXLJ-UHFFFAOYSA-N 418.262 -0.055 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)n1 2282364165 SUDHFRMHADDVCX-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)NCCO[C@H]1CCN(S(=O)(=O)c2cscc2B(O)O)C1 2282380684 MUNOVRJHHVMPIK-NSHDSACASA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cscc2B(O)O)[C@@H](CO)C1 2282742169 YTAVRYRQHWZESL-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]3COCCO3)C2=O)cc1 744645043 OECFLQQINYCDBU-SCLBCKFNSA-N 406.395 -0.975 50 10 HBGE O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c(Br)s1 745979630 YPKNYAIHJNAUHD-YFKPBYRVSA-N 415.243 -0.066 50 10 HBGE CCn1nc(C(=O)NNC(=O)CN(C)Cc2nnc(C)n2C)c2ccccc2c1=O 747337275 NMAMYOSIGYUBFO-UHFFFAOYSA-N 412.454 -0.254 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)c1cn(C)nn1 1470084256 RYYVYEQXERKFCF-LJQANCHMSA-N 411.422 -0.035 50 10 HBGE O=C(N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccc(B(O)O)c1 1543092349 VCXCIMFWDXGDLU-QGZVFWFLSA-N 411.271 -0.608 50 10 HBGE CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)c2cccc(B(O)O)c2)CC1 1543344365 RAGCXIUNGDYWPA-UHFFFAOYSA-N 417.296 -0.768 50 10 HBGE Cn1cc(/C=C(/C#N)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1 1566278604 KBIPCHSDEMUJSV-WQRHYEAKSA-N 421.461 -0.068 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc2ccnn12 1587968219 BFFXQAKEBJJTEI-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2CN(S(=O)(=O)c3sccc3B(O)O)C2)C1 2267207934 UXELGLOQXQKTKU-UHFFFAOYSA-N 402.303 -0.085 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267368196 FOSAPGXUKVCRMX-VHSXEESVSA-N 405.307 -0.502 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626559 KFUAAWMAKUFQGA-UWVGGRQHSA-N 405.307 -0.454 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282373542 OAQVGMFLZCAFBC-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)Cc1ccc(B(O)O)cc1 2282378745 KDWHODGAEVJYEO-UHFFFAOYSA-N 400.262 -0.321 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282730714 GUTRNOHTDKKNHG-NSHDSACASA-N 400.262 -0.337 50 10 HBGE Cc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1Cl 765723906 FULRNGQQUPKGPK-UHFFFAOYSA-N 404.814 -0.143 50 10 HBGE COC(=O)CCS(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1 811690114 VBRZFTGCYGKUMS-UHFFFAOYSA-N 412.512 -0.374 50 10 HBGE O=C(c1cccc(B(O)O)c1)N1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1 1442097596 WHTSPIQTGCURAL-UHFFFAOYSA-N 414.252 -0.611 50 10 HBGE COCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 1642239044 GOZUKJFHWWJHMQ-CQSZACIVSA-N 415.468 -0.432 50 10 HBGE CS(=O)(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2ccccc2Cl)CC1 1857965383 HSAFCKWKFRZBPW-UHFFFAOYSA-N 416.887 -0.111 50 10 HBGE O=C(NC[C@H](NC(=O)c1ncc(B(O)O)cn1)C(F)(F)F)OCc1ccccc1 2267421214 DPQBWWLZQVHDOQ-LBPRGKRZSA-N 412.133 -0.257 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](OCCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282075036 PZWUETODDOWQNT-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282849957 JEHBLUMUEKMZNA-UHFFFAOYSA-N 404.225 -0.323 50 10 HBGE C[C@@H](NS(=O)(=O)c1nn(C)cc1B(O)O)[C@H]1CCCN1C(=O)OC(C)(C)C 2286908563 WTPDBLICDNAYRW-ZYHUDNBSSA-N 402.282 -0.834 50 10 HBGE Cc1ccc(NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)cc1B(O)O 2360550997 JFTLIBWNEPZSAL-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 730310654 NVQNAFWFNHUSNX-RISCZKNCSA-N 409.420 -0.562 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN2CCCN(S(=O)(=O)C3CC3)CC2)n1 801980521 YYVYOLAAZFUIDT-UHFFFAOYSA-N 415.541 -0.359 50 10 HBGE CS(=O)(=O)C[C@@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1 1292038205 CNPDNFOADYQFJI-QWHCGFSZSA-N 403.482 -0.668 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1532226755 MKRMSMUMEDQNAE-MPTQWLOMSA-N 422.482 -0.371 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(-c3cccnc3)nn2)c1 1623994519 WOHTZFVYFDULRJ-UHFFFAOYSA-N 415.435 -0.013 50 10 HBGE N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1645053477 GXBSJWCZJRHKTR-KRWDZBQOSA-N 420.491 -0.126 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2267377052 FGMXKMMXLTWKNY-JZYVYDRUSA-N 403.291 -0.892 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1cscc1B(O)O 2267625512 QYBOIANLAZLTSB-CKYFFXLPSA-N 402.303 -0.038 50 10 HBGE Cc1c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2281604474 ROWDXBGSUIBITO-CABCVRRESA-N 416.243 -0.778 50 10 HBGE CC(C)(C)OC(=O)N1CCC(CO)(NS(=O)(=O)c2cc(B(O)O)cs2)CC1 2282065060 IPPFAOOCQGWLPQ-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE COC1(CCNC(=O)OC(C)(C)C)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282079839 BGNCWOROBNDHRY-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE C[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282341308 QFYLWKHFULEXSE-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE CC[C@@H](CNS(=O)(=O)c1ccc(OC)c(B(O)O)c1)NC(=O)OC(C)(C)C 2282365139 UVWSZCLCJBUVSW-NSHDSACASA-N 402.278 -0.043 50 10 HBGE Cc1ccc(S(=O)(=O)N=[S@@](C)(=O)CCNC(=O)OC(C)(C)C)c(B(O)O)c1 2282366779 SYWBYIPOBGQRPN-SANMLTNESA-N 420.318 -0.014 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)n1 2282376475 DWXOBDAEPZLPPB-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)NCCCONS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282418388 IFMKJNZONXWXGX-UHFFFAOYSA-N 410.204 -0.231 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2sccc2B(O)O)[C@@H](CO)C1 2282708743 QRCUQWKDOWUXFU-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2359274384 ZYWKTCMUDZWCMN-HERUPUMHSA-N 400.237 -0.208 50 10 HBGE CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H]1COCCO1 744650036 XSFOBUKVOODCFC-HUUCEWRRSA-N 411.480 -0.134 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)OCCCI)n(C)c1=O 781218343 HAGBBBCACAFSTG-UHFFFAOYSA-N 406.180 -0.198 50 10 HBGE CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816885510 BPHOWOMBDOJCJM-ZDUSSCGKSA-N 420.495 -0.363 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2nc(C)n(C)c2=O)c1 1135410240 UXQUTWNCVPIJHR-UHFFFAOYSA-N 424.483 -0.618 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@]3(C)CCN(C)C3=O)cc2)CC1 1137652006 WCZADBKBBICVNR-SFHVURJKSA-N 409.512 -0.066 50 10 HBGE C[C@]1(NNC(=O)NCc2cnc(N3CCOCC3)c(F)c2)CCS(=O)(=O)C1 1312457838 KFFUKGQJHKEXOJ-INIZCTEOSA-N 401.464 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1CC(N2C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC2=O)C1 1456831199 VADUYFLIZRNSKW-AWEZNQCLSA-N 403.244 -0.684 50 10 HBGE CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1OC 1470765223 XBRQXXONGCWTLD-RISCZKNCSA-N 401.441 -0.394 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1 1558447481 OLZATBPMGDGFEE-AWEZNQCLSA-N 418.454 -0.212 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc2ncnn12 1566278913 VUQPXNQOHFIORJ-UHFFFAOYSA-N 407.434 -0.052 50 10 HBGE O=C(Nc1ccc(S(=O)(=O)N2CCC[C@@H]2CO)cc1)c1cccc(B(O)O)c1 1627186342 NMVCUHLUHHYHLW-MRXNPFEDSA-N 404.253 -0.236 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](O)C3CC3)CC2)cc1 1630996472 IWNFXLBCFHWJRM-QGZVFWFLSA-N 410.496 -0.780 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)ccc1=O 1636483005 UMLHOPMSOAVNIJ-UHFFFAOYSA-N 417.447 -0.335 50 10 HBGE CCn1nc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)[C@@H]2C)c2ccccc2c1=O 1675094568 RALJQFADYHVPES-ZWNOBZJWSA-N 407.452 -0.064 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N=S1(=O)CCN(C(=O)OC(C)(C)C)CC1 2267252693 TZNZVXYPLDKJBJ-UHFFFAOYSA-N 403.291 -0.010 50 10 HBGE Cn1ncc(C(=O)N=[S@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1B(O)O 2281593086 FSIVTFXUMMXJSP-FLESLCNUSA-N 400.266 -0.653 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2282376618 GVMMVWYWVUVPRL-UHFFFAOYSA-N 423.322 -0.874 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C)c1B(O)O 2282390828 OSAVQCDKHGOELU-HHHXNRCGSA-N 402.282 -0.487 50 10 HBGE Cc1nc(S(=O)(=O)NCCCCCNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282408019 DYLGPPCDYAXTIH-UHFFFAOYSA-N 404.298 -0.618 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H]1CNS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282725977 KJWPOFXQOKELJK-LLVKDONJSA-N 400.237 -0.041 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1cc(Cn2cc(Br)cn2)on1 752032433 CYDMVOICBONXJZ-NSHDSACASA-N 400.189 -0.142 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCN1CCN(c2ccccc2)CC1 758048775 VWZHNMSMGMWKOO-OAHLLOKOSA-N 411.528 -0.326 50 10 HBGE CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OC)cc2OC)CC1 796196435 FCTUNYJMSJNDCT-UHFFFAOYSA-N 400.457 -0.359 50 10 HBGE COC(=O)[C@H]1CN(C)C(=O)CN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC 1198431552 YQLHFQHMBJRKBP-GFCCVEGCSA-N 412.830 -0.575 50 10 HBGE O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 1448300601 MMOWZHSKSXJPSF-ZBFHGGJFSA-N 401.398 0.000 50 10 HBGE COC(=O)N(C)CCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 1478982239 RUPHRPGKAYRYHQ-UHFFFAOYSA-N 400.461 -0.070 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](O)c3cnn(C)c3)CC2)cc1 1629797511 TWBLHLUUYGEFGZ-IBGZPJMESA-N 400.483 -0.273 50 10 HBGE CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1638870747 GYKIOAGTWIYYIO-KRWDZBQOSA-N 424.523 -0.072 50 10 HBGE CN(C)CC(=O)NNC(=O)C[C@@H]1CS(=O)(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 1641243214 MGBSYQAPOBMGBU-JHJVBQTASA-N 418.516 -0.634 50 10 HBGE O=C(c1cccc(B(O)O)c1)N1CCN(CCNS(=O)(=O)c2ccccc2)CC1 1641937126 YGFWIKLIACRKEY-UHFFFAOYSA-N 417.296 -0.897 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)c2sccc2B(O)O)CC1)C(F)(F)F 2270598801 MEHHYRMNWCCJQW-MRVPVSSYSA-N 400.209 -0.350 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282070089 YQOMPJVDWXIPEX-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@@H]1CO 2282083188 NFUMEMOHZZLQFW-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)nn2C)CC[C@H]1NC(=O)OC(C)(C)C 2282084832 YLYRRLSLDZOHDZ-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE COC(=O)[C@@H](CCNS(=O)(=O)c1cscc1B(O)O)NC(=O)OC(C)(C)C 2282371520 KQVKQQIGTYJESK-SNVBAGLBSA-N 422.290 -0.837 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CC[C@H](NC(=O)C(F)(F)F)[C@H](C)C1 2282383692 CJRJIFNDVQBQCS-APPZFPTMSA-N 414.236 -0.186 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2282383739 DAVHHEXYLUWNSK-ATZCPNFKSA-N 420.680 -0.848 50 10 HBGE CN(C)S(=O)(=O)CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 752490302 QZIQUCRMSBBVHC-UHFFFAOYSA-N 406.486 -0.958 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CS(=O)(=O)C3)cc2)CC1 1466200411 GDJGOUJWVAUAFJ-UHFFFAOYSA-N 402.498 -0.890 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1C[C@H](O)CN1c1ccncn1 1468659694 LGFMBDUWANJHFZ-GXTWGEPZSA-N 406.468 -0.190 50 10 HBGE O=C(NNC(=O)c1ccc(I)cn1)N[C@H]1CCS(=O)(=O)C1 1583280578 CJZXAUMQFCCPTL-QMMMGPOBSA-N 424.220 -0.183 50 10 HBGE O=C(CO)NCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1 1635525311 XRCZYMVAZMZUBC-UHFFFAOYSA-N 411.890 -0.896 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267203732 ULFLCFXRQCZXBD-NSHDSACASA-N 406.291 -0.658 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2281849916 RKNWNEVKTLARCY-HHHXNRCGSA-N 400.266 -0.734 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281868991 ORYFGQCLUUBDLZ-FLESLCNUSA-N 400.266 -0.273 50 10 HBGE O=S(=O)(NCC1(O)CCN(Cc2ccccc2)CC1)c1cc(B(O)O)cs1 2282067133 XLHKWPREOQFUGY-UHFFFAOYSA-N 410.326 -0.267 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CCN1S(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282363722 JGUQFFNRMODLBZ-JTQLQIEISA-N 406.216 -0.068 50 10 HBGE C[C@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(B(O)O)cc1 704374921 XIKZTIMJNLNSCX-LBPRGKRZSA-N 402.237 -0.357 50 10 HBGE COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)N1CCN(C)CC1 807381976 RIWFAVRDWZRBRF-LBPRGKRZSA-N 401.464 -0.179 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)S1(=O)=O 857431377 IGXFYIWIYISPLJ-MRXNPFEDSA-N 409.512 -0.620 50 10 HBGE CN1CCN(C(=O)NNC(=O)Cc2csc([C@@H]3CCS(=O)(=O)C3)n2)CC1 1139083543 BJQCIHBDXBFLCT-LLVKDONJSA-N 401.514 -0.424 50 10 HBGE COc1ccc(NC(=O)c2ccc(B(O)O)cc2)cc1S(=O)(=O)N1CCOCC1 1463694481 NNJWWTBZIIVNPR-UHFFFAOYSA-N 420.252 -0.352 50 10 HBGE CN(CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCC[C@H]1O 1465791750 LHDVLSHEANNWJA-QZTJIDSGSA-N 417.510 -0.563 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@@]2(OC)CCS(=O)(=O)C2)c2ccccc2c1=O 1540305433 SNHQLSGAGVYROI-QGZVFWFLSA-N 408.436 -0.619 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CC(=O)NC(=O)N1 1587991145 WDPZLBPUZQJGSE-AWEZNQCLSA-N 422.873 -0.797 50 10 HBGE COC(=O)CCN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 1616746375 UTENCGAMNHWQGK-ZDUSSCGKSA-N 407.427 -0.075 50 10 HBGE COC(=O)c1cccc(NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c1F 1624136167 RKIOIAFNPBUSIZ-BPLDGKMQSA-N 405.386 -0.021 50 10 HBGE C#CC[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1674887483 GUIQYPLIDNOQAJ-OAHLLOKOSA-N 424.479 -0.310 50 10 HBGE Cc1csc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)c1B(O)O 1950865089 DGHKUPRHZYZSCD-UHFFFAOYSA-N 408.266 -0.548 50 10 HBGE CC(C)(C)OC(=O)NCC1(CNS(=O)(=O)c2ccc(B(O)O)s2)COC1 2267205342 QSGSXUKWPOWVTO-UHFFFAOYSA-N 406.291 -0.753 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2267386539 VQOZNGUKSXZBFJ-JTQLQIEISA-N 408.307 -0.676 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)N2CC[C@@](C)(B(O)O)C2)C1 2368342581 IPCGZXHSQCSGLN-BLLLJJGKSA-N 404.294 -0.124 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cnn(C)c2)C1 735446359 RNRJVBUHFCAAGY-LBPRGKRZSA-N 410.456 -0.113 50 10 HBGE O=C(CN1CCOCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 790471749 IVTVUGBYBLOYMP-UHFFFAOYSA-N 410.452 -0.909 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(C(=O)Nc2c(F)cccc2F)CC1 1182609269 HWLXRFSZBDXPJN-QMMMGPOBSA-N 404.395 -0.231 50 10 HBGE Cn1cccc1C(=O)NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1540499145 DJDOYGBLHLHVIH-GFCCVEGCSA-N 400.844 -0.221 50 10 HBGE CNC(=S)N(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC 1642163529 XXDUKYGIIOOYAC-UHFFFAOYSA-N 402.498 -0.203 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)C[C@H]1CCO 1648386057 XYDZXAPFAMABMV-GFCCVEGCSA-N 419.887 -0.409 50 10 HBGE Cc1nnc2n1C[C@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1cccc(Cl)c1)C2 1660567538 JHHJYUNQOVNPAZ-CQSZACIVSA-N 419.873 -0.026 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2267210058 DWRYNQXLOIIRBU-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2282713932 LJSIKLMNIAWESR-BREBYQMCSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)N1CCC(CO)(NS(=O)(=O)c2cscc2B(O)O)CC1 2282725327 ZUYLSOSVJFNMKU-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE COc1ccc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c(OC)c1 729951813 UYDDWTAZYJMONT-UHFFFAOYSA-N 406.420 -0.038 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COCCO2)ccc1OC 744652977 QELZNVOWRDLVLJ-AWEZNQCLSA-N 415.468 -0.098 50 10 HBGE O=C(NNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1)[C@@H]1COCCO1 746002608 LBMODZKYUDXYDC-LBPRGKRZSA-N 418.497 -0.353 50 10 HBGE O=C(CNC(=O)c1ccccn1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 765731678 AQVXFGXUNRCTOQ-UHFFFAOYSA-N 424.461 -0.583 50 10 HBGE O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)[C@@H]1CCc2nncn2C1 814304956 BRTPKEABQICBBE-CYBMUJFWSA-N 413.438 -0.013 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1 1136538323 SFUVAXVPZJYDOQ-ZDUSSCGKSA-N 422.438 -0.516 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)Cn1ccc2ccccc21 1144729637 FYYOCUCGUQHLEW-UHFFFAOYSA-N 423.495 -0.377 50 10 HBGE CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1156184028 KUVRXMVGYLAQRD-KRWDZBQOSA-N 424.523 -0.207 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nnc(C)n3C)CC2)cc1 1167551039 LHJOORRHQBDQHF-UHFFFAOYSA-N 407.500 -0.118 50 10 HBGE CN(NC(=O)[C@@H]1CSCC(=O)N1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1556101733 AZXLXIFTZWVSTR-NSHDSACASA-N 401.489 -0.146 50 10 HBGE CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1 1629390354 WMRKPEXQYHYRPO-KGLIPLIRSA-N 415.491 -0.279 50 10 HBGE COc1ccc(S(=O)(=O)N2CC(NC(=O)NNC(=O)[C@H]3CCO[C@@H]3C)C2)cc1 1635069380 VTOIVCUPHOHPSW-ABAIWWIYSA-N 412.468 -0.177 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1cc(B(O)O)cs1 2255880158 AFSCUWDZTAVAPT-DEOSSOPVSA-N 412.320 -0.261 50 10 HBGE Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2267022433 HJZWYOAPRRBWCF-LSDHHAIUSA-N 400.244 -0.062 50 10 HBGE C[C@@H]1CN(C(=O)c2cn(C)nc2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267070957 MGVFCOXOULAQHH-ZIAGYGMSSA-N 400.244 -0.029 50 10 HBGE C[C@@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(C)(C)NC(=O)OC(C)(C)C 2267371433 AJVKSWAHGBRVLK-SECBINFHSA-N 407.323 -0.066 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](NS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)CO1 2267382926 RLTSGFIPBIINFW-SECBINFHSA-N 406.653 -0.151 50 10 HBGE CN(Cc1ccccc1)[C@@]1(CNS(=O)(=O)c2sccc2B(O)O)CCOC1 2282064794 FKXBNXAKPFVBAH-QGZVFWFLSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2ccsc2B(O)O)[C@@H](S(C)(=O)=O)C1 2282226243 NZWGQJJXEJXOSO-QWRGUYRKSA-N 418.302 -0.810 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282705568 ZROWKJKAUSTRHB-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1B(O)O 2282730892 JFQBSSYNFXKSAI-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282738119 PTUKJLNISIEGDL-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282740135 UYCBZVPMHGOISM-NSHDSACASA-N 404.298 -0.682 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@H]1NC(=O)C(F)(F)F 2282851929 JFKPMULUGUDPEW-HTQZYQBOSA-N 415.224 -0.958 50 10 HBGE COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@H]3COCCO3)C2=O)c(OC)c1 805165521 LZMZMKUWWUOMCR-GOEBONIOSA-N 422.438 -0.450 50 10 HBGE CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1156183952 JENXRMWXPXPCHS-SJORKVTESA-N 420.514 -0.116 50 10 HBGE O=C(COc1ccc(Br)cc1)NNC(=O)c1cnn(C[C@H](O)CO)c1 1587666366 RHMRNMDJFZRNQZ-LBPRGKRZSA-N 413.228 -0.161 50 10 HBGE C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cn(C)nn3)n(C)c2)C1 1617484328 MKQWTZODNBZNQY-NSHDSACASA-N 409.472 -0.351 50 10 HBGE O=C(NC1CN(S(=O)(=O)Cc2ccsc2B(O)O)C1)OCc1ccccc1 2247945906 CEJOPDMCFGSFMU-UHFFFAOYSA-N 410.282 -0.132 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@H]1CN(C(=O)OCc2ccccc2)CC12CCC2 2281717678 QQPQQSUVOXCIFN-AWEZNQCLSA-N 413.243 -0.584 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281836931 WEKGSNADASEXTN-JGFSIVIASA-N 400.266 -0.273 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2282378142 BCSGCXUADYGVPL-QWRGUYRKSA-N 420.318 -0.615 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282743691 SBIKEEMLZXONPV-ZUZCIYMTSA-N 417.318 -0.501 50 10 HBGE Cc1cc(CNC(=O)[C@@H](F)C2(O)CN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2284034511 FRGHHMZMUOPZIP-LLVKDONJSA-N 402.253 -0.328 50 10 HBGE N#CC(=Cc1ccc(Br)cc1)C(=O)N[C@@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 2329656745 FJTFOJVKPWVKDQ-JTTNIQEDSA-N 413.224 -0.728 50 10 HBGE CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)[C@@H]1COCCO1)C2 790755054 VOUWTYFDCTVWOA-AWEZNQCLSA-N 412.468 -0.549 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1 1442186080 USPFZJILBFFUIU-LBPRGKRZSA-N 419.504 -0.943 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)CCCCc2ccccc2)n(C)c1=O 1587964513 UVTXOUGSOASTRD-UHFFFAOYSA-N 412.450 -0.006 50 10 HBGE Cn1cc(I)c(CNC(=O)c2cc(B(O)O)ccc2F)n1 1627803859 UOJZVOAJMAVXDH-UHFFFAOYSA-N 402.960 -0.226 50 10 HBGE O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)C1CCOCC1 1644340704 PMOPOJXJQRPNTJ-UHFFFAOYSA-N 413.452 -0.300 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21 1650777732 RIPKFNVVCBIYMD-MRVPVSSYSA-N 406.367 -0.910 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1c1ncc(Br)cc1B(O)O 2223678074 WTFBMVXRPTWQEZ-WDEREUQCSA-N 416.081 -0.012 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@@](=O)(=NC(=O)c2ncsc2B(O)O)C1 2267313862 QYMKCBUZXXRVFB-BGGANLFTSA-N 403.291 -0.024 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COC[C@@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2267393329 XGGWTWZASGCTTC-UWVGGRQHSA-N 406.291 -0.693 50 10 HBGE CO[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282073231 DFDKQTGVDFMADB-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NS(=O)(=O)c2ccc(B(O)O)s2)CCO1 2282083166 NBFSINPZXRIYID-GHMZBOCLSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H]2COC[C@@H]21 2282418179 GVMMVCPPUYOXLW-RYUDHWBXSA-N 418.302 -0.563 50 10 HBGE CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1c(B(O)O)cnn1C 2282701588 XHZGPRVTAZUYPG-OAHLLOKOSA-N 404.298 -0.682 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CCCN1C(=O)OC(C)(C)C 2282718056 RKFCCYUNZFOTCU-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNS(=O)(=O)c2cscc2B(O)O)C[C@@H]1O 2282734158 HZYAQONLKGKSCX-WCQGTBRESA-N 420.318 -0.630 50 10 HBGE CS(=O)(=O)N1CC[C@@H](O[C@@H]2CS(=O)(=O)C[C@H]2I)C1 2313066048 OWCRLRXQJXNUSC-IWSPIJDZSA-N 409.267 -0.363 50 10 HBGE CNC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(N)=C(C#N)[C@@H]1c1cccs1 1080323755 ZFWGRHSEKUIMIB-GFCCVEGCSA-N 402.457 -0.730 50 10 HBGE CNS(=O)(=O)c1csc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1456035845 DZLMAYBGWRYUJP-LBPRGKRZSA-N 402.498 -0.330 50 10 HBGE Cn1cc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)nn1 1470084526 WMEYTHWWNCVKJQ-UHFFFAOYSA-N 416.257 -0.046 50 10 HBGE CCCn1nc(C(=O)NNC(=O)CN2CCCCS2(=O)=O)c2ccccc2c1=O 1524478602 KUFGVSRJMAANFH-UHFFFAOYSA-N 421.479 -0.007 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)CC1 1556361806 IPAGGAKRAFMHTG-ZDUSSCGKSA-N 410.862 -0.698 50 10 HBGE O=C(COc1ccccc1CNC(=O)c1cccc(B(O)O)c1)NC[C@H]1CCCO1 1625891633 OFXMNYDZGQSJDB-GOSISDBHSA-N 412.251 -0.030 50 10 HBGE Cc1ccc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)cc1B(O)O 2264118055 ZTPAYBGVFIIPKC-UHFFFAOYSA-N 402.237 -0.610 50 10 HBGE O=C(NCC1CN(S(=O)(=O)c2c(Cl)cccc2B(O)O)C1)C(F)(F)F 2267422877 FEFIPBSDBHGGEH-UHFFFAOYSA-N 400.571 -0.681 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1sccc1B(O)O 2267607776 QQWBYZRBZCQFEU-MNOVXSKESA-N 406.291 -0.660 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1scc(C)c1B(O)O)NC(=O)OC(C)(C)C 2281890181 BHRLQBLSAGLWOT-SNVBAGLBSA-N 400.262 -0.077 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 2282074146 RYQRTOUMSUDQOF-QWRGUYRKSA-N 402.282 -0.786 50 10 HBGE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2282339532 YHDXABJQUAWIKQ-SFYZADRCSA-N 415.224 -0.816 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H](C)N1C(=O)OC(C)(C)C 2282380802 OEWSKWRRUHBUKC-PHIMTYICSA-N 419.334 -0.018 50 10 HBGE CC(C)(C)OC(=O)NCCN(CC1CC1)S(=O)(=O)Cc1ncsc1B(O)O 2282381522 UVWQCQQXLZUACZ-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 2282737220 BLTMUNJPKLQMJE-CHWSQXEVSA-N 400.262 -0.755 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cc(C)c(B(O)O)s1 2282737839 LUHJUAUEQMRPQB-GHMZBOCLSA-N 420.318 -0.351 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)Nc1ccc(Cl)cc1B(O)O 2284048584 OWRPLJVVUGBRJS-AVGNSLFASA-N 400.624 -0.701 50 10 HBGE C[C@@H](OC1CCCCCC1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765723862 DXBKXCLPFKVKEJ-GFCCVEGCSA-N 420.470 -0.291 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@]2(C)CCCc3ccccc32)n(C)c1=O 766642549 HEWDCOASVXJOMK-NRFANRHFSA-N 424.461 -0.125 50 10 HBGE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1178421029 UEWPKOHLSQILBR-UONOGXRCSA-N 400.476 -0.073 50 10 HBGE CC1=NO[C@@H](C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1445552560 QKNONCVWYHXNJB-MRXNPFEDSA-N 423.495 -0.386 50 10 HBGE C[S@](=O)C1(C(=O)NNC(=O)[C@H]2COCCO2)CCN(C(=O)OC(C)(C)C)CC1 1620975606 YVSGWPFEHKAZLE-YASQENCXSA-N 419.500 -0.303 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCCSS(C)(=O)=O)[C@@H](C)O)cc1 1650843679 PVSBPTRNTHWPNK-YPMHNXCESA-N 410.539 -0.168 50 10 HBGE CCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)c1 1683047001 WQNVWYKWPQGCDZ-UHFFFAOYSA-N 407.452 -0.172 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)CC(=O)N[C@H]1CS(=O)(=O)C[C@H]1Cl 2266365673 LCXWOCQQYDKWHW-NEPJUHHUSA-N 413.924 -0.674 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2267209191 TVKGNVDTPQVJDB-ONGXEEELSA-N 406.291 -0.754 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(S(=O)(=O)c2cccc(B(O)O)c2)C1 2282103243 OVWYMBHEWNDGDZ-CHWSQXEVSA-N 400.262 -0.985 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C)c(B(O)O)n1C 2282328213 UOMHCJBBFJPRHT-GXSJLCMTSA-N 402.282 -0.915 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H]2C[C@@H](C1)[C@@H](NC(=O)OC(C)(C)C)[C@@H]2CO)B(O)O 2282721780 XACDZMRLWRJQRC-XJFOESAGSA-N 404.294 -0.662 50 10 HBGE CN(C(=O)c1nn(C)c(Cl)c1B(O)O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F 2369667877 VDQJWWPFWHJUNT-DTWKUNHWSA-N 404.635 -0.217 50 10 HBGE CN(C)C(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cn1C 777939405 NLNXIYRLQUTZJC-UHFFFAOYSA-N 403.461 -0.439 50 10 HBGE CCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1OCC 813424412 NGJRAZRQAMNVFQ-UHFFFAOYSA-N 413.500 -0.015 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 1252843574 IIIZSTVUVNTOEX-UHFFFAOYSA-N 406.468 -0.201 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)c(I)n1 1352195623 ZLEBMRWECUWAGA-UHFFFAOYSA-N 417.163 -0.191 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)cc2)C[C@@H](C)O1 1543093849 ONUULUMCDXZZFB-JMSVASOKSA-N 424.479 -0.476 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1nnc2n1CCNC2=O 1620574227 KQYZGUFNAPZGBA-UHFFFAOYSA-N 421.845 -0.424 50 10 HBGE O=C(Cc1ccccc1S(=O)(=O)C(F)F)NNC(=O)[C@H]1CCS(=O)(=O)C1 1624584747 CHOYJRPBVOIANW-JTQLQIEISA-N 410.420 -0.193 50 10 HBGE C[C@]1(C(=O)NNC(=O)CN2CCCC2=O)C[C@H](O)CN1C(=O)OCc1ccccc1 1635877738 IYUQATGUJSQWQU-MGPUTAFESA-N 418.450 -0.082 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2267373508 DVJXNGJAQCBYQS-SNVBAGLBSA-N 403.291 -0.582 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COCC[C@@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2282375424 PCRGJTCEABRMFN-WDEREUQCSA-N 420.318 -0.303 50 10 HBGE Cc1cnc(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)c(B(O)O)c1 2282481787 AKLKTFONQUGWJM-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)ccc1B(O)O 2282736968 YAJMOLQTUCDNPB-KGLIPLIRSA-N 400.262 -0.755 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2ccc(B(O)O)s2)C1 2288540962 XKDLHVDBXFTDHM-UHFFFAOYSA-N 406.216 -0.225 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)NC(C)(C)C1=O 912848184 PGWOKJNBGYHPBF-UHFFFAOYSA-N 410.456 -0.620 50 10 HBGE Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)CN2CCCc3ccccc32)cn1 915638504 YHZZNKXGVLOCEY-UHFFFAOYSA-N 406.468 -0.701 50 10 HBGE CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1F 1168877392 LGUGGTBRDGDJDT-UHFFFAOYSA-N 409.461 -0.292 50 10 HBGE COC(=O)[C@@H]1CO[C@H](CCC(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)C1 1450225247 NSFPWRRMASADQW-FIXISWKDSA-N 403.391 -0.057 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)NCCS(=O)(=O)C1CCOCC1 1470232506 FYYCCNKLEFBAHA-UHFFFAOYSA-N 409.468 -0.199 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)CC1 1556362148 UHZXNINNEWTJHN-HOCLYGCPSA-N 407.446 -0.682 50 10 HBGE Cc1ccc(C(=O)NNC(=O)c2ccnnc2)cc1S(=O)(=O)N1CCOCC1 1626753158 ILNDOUIRILWYDD-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE O=C(NNC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21)c1cccc(S(=O)(=O)N2CCOCC2)c1 1648393771 XTQROLCGOXYBMY-CWRNSKLLSA-N 407.448 -0.306 50 10 HBGE CCCCS(=O)(=O)CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1649389620 BQUFABZOCMVUMG-UHFFFAOYSA-N 419.525 -0.022 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccsc2B(O)O)[C@@H]2C[C@H]21 2267365826 WENVUNLLKCKQMT-VXGBXAGGSA-N 402.303 -0.049 50 10 HBGE CN(C[C@@H]1CCN1C(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2267713380 BAJBXCWWIDABHV-JTQLQIEISA-N 405.307 -0.406 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)CC1(C)C 2282070889 KUUKNRHRRFNJIT-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)NCC1(F)CCN(C(=O)OCc2ccccc2)CC1 2282260475 LMMHFRBUTISVOG-UHFFFAOYSA-N 418.234 -0.029 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)n1 2282427354 PJQNBPIBCCUIIJ-HNNXBMFYSA-N 416.243 -0.650 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C1 2282715705 KCIFJZVXIQDZOM-NSHDSACASA-N 402.282 -0.976 50 10 HBGE O=C(COC(=O)C1C[C@H]2COC[C@@H](C1)C2=O)NNC(=O)[C@@H]1COc2ccccc2O1 740398420 IJNXDIGJIKYFLZ-IAYQEVDDSA-N 418.402 -0.241 50 10 HBGE Cc1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(Cl)cc1F 765724512 KINLIOJJHMJRFA-UHFFFAOYSA-N 422.804 -0.004 50 10 HBGE CC[C@@H]1CCCC[C@H]1OCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 768273967 BQECROUNNDITAX-CHWSQXEVSA-N 420.470 -0.434 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3cn(C)nn3)C2)cc1 808375574 ZWIXUSDOVYODAM-ZDUSSCGKSA-N 406.468 -0.015 50 10 HBGE CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1184205375 AUOFYAVNWSBZQC-UHFFFAOYSA-N 408.436 -0.477 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)C(F)(F)Oc1ccccc1 1479133070 WAUWNBWPZZAYCP-INIZCTEOSA-N 414.365 -0.384 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@H]1CCCCO1 1526855906 NURSCNUSWLECTC-CQSZACIVSA-N 400.457 -0.624 50 10 HBGE CCOC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)[C@@H]2C(=O)Nc3ccccc3C2=O)C1 1556767448 ONPDFXLIWWTYTH-WBMJQRKESA-N 416.434 -0.140 50 10 HBGE COc1cc([C@H](C)NC(=O)NNC(=O)[C@@H]2COCCO2)ccc1S(C)(=O)=O 1676809075 VOWUXSDYIIXJQI-GWCFXTLKSA-N 401.441 -0.095 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267202263 ABWVKHIWCXBFLL-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)CO1 2267392997 RLTSGFIPBIINFW-VIFPVBQESA-N 406.653 -0.151 50 10 HBGE CO[C@@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)N(C(=O)OC(C)(C)C)C1 2282084167 TYENXYPPDMRSHI-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE C[C@@H](OCc1ccccc1)[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(=O)O 2284411976 QRRVDVRTNIYVMW-MFKMUULPSA-N 414.270 -0.699 50 10 HBGE COc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(C(C)=O)CC2)c(OC)c1 730828749 XKTDKGGBQIPJSA-UHFFFAOYSA-N 421.454 -0.271 50 10 HBGE O=C(COCC(=O)NNC(=O)Cc1ccsc1)NNC(=O)Cc1ccsc1 734331363 DPJYVKXSRKJWDT-UHFFFAOYSA-N 410.477 -0.094 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccn(C)n3)nc2)CC1 766267464 YZRDBWBEIODUGJ-UHFFFAOYSA-N 408.488 -0.423 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1156184042 LBXJMJPGUFSMNF-HNNXBMFYSA-N 414.459 -0.495 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(Br)cc1C#N 1182609472 PKHAPZBRXQUIQL-QMMMGPOBSA-N 403.258 -0.052 50 10 HBGE O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)[C@H]1CCN1C1CCOCC1 1456039934 VDODENNZUMBAJD-OAHLLOKOSA-N 411.484 -0.849 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)nn1 1528541718 NWSZGPDZUXESSS-UHFFFAOYSA-N 406.200 -0.251 50 10 HBGE COc1cc(N2C[C@H](C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2=O)cc(OC)c1OC 1530230275 BHXBJHTZYMLZIE-ZYHUDNBSSA-N 420.422 -0.509 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)ccc1F 1530230364 DSNXMWNTAGBKLK-GFCCVEGCSA-N 400.432 -0.104 50 10 HBGE CN1CCN(CC(=O)N(C)c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CC1 1626971727 PWCBWYUSQUPOIY-UHFFFAOYSA-N 410.283 -0.171 50 10 HBGE COc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ncn1 1648592812 QIHLIMNKLBWVMZ-UHFFFAOYSA-N 407.456 -0.427 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)CC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1Cl 2266365683 LCXWOCQQYDKWHW-VXGBXAGGSA-N 413.924 -0.674 50 10 HBGE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1S(=O)(=O)c1sccc1B(O)O 2267207023 OENAKLMBBYQGNQ-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2cscc2B(O)O)CCOC1 2267419916 UDNFERJVMNKDIA-AWEZNQCLSA-N 406.291 -0.610 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267424172 WCIAEUIKYBXQIM-SNVBAGLBSA-N 408.282 -0.089 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282088311 KYXYMJYNNXEHKZ-UHFFFAOYSA-N 400.262 -0.937 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2ccoc2B(O)O)CC1 2282209869 YGTOYIPKXFXKPA-HHHXNRCGSA-N 401.250 -0.335 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2S(=O)(=O)c2cscc2B(O)O)C1 2282738538 WDUUGLIPWZGMPM-SNVBAGLBSA-N 418.302 -0.827 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)n1C 2362570725 CPENVSWWSPXDRQ-IQSLBTHBSA-N 402.282 -0.440 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C/c2ccccc2Cl)n(C)c1=O 765732776 XBBWGZIROKUIOE-BQYQJAHWSA-N 416.825 -0.052 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C/C=C/c2ccc(F)cc2)n(C)c1=O 766643073 KKYNULROUCJKOZ-ONEGZZNKSA-N 414.397 -0.176 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](O)Cc2cnn(C)c2)cc1 786685821 ANVJLZOYWDPQBC-OAHLLOKOSA-N 409.468 -0.900 50 10 HBGE CN(C)N(C(=O)c1nc2ncc(Br)cn2n1)[C@H]1CCS(=O)(=O)C1 1124467843 GXZHOHZNPRAOLO-VIFPVBQESA-N 403.262 -0.007 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H]1CC(=O)N(c2ccc(F)c(F)c2)C1 1463793874 WWPDMCWXDZCFAW-UWVGGRQHSA-N 401.391 -0.100 50 10 HBGE COCCCNC(=S)N(C)NC(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C 1624409949 OWZLUZQZYKOEMX-UHFFFAOYSA-N 408.484 -0.572 50 10 HBGE Cc1cc(CC(=O)NNC(=O)[C@H](C)N2CCN(C(=O)OC(C)(C)C)CC2=O)n[nH]1 1639996377 XEIXDOKYEVQADV-LBPRGKRZSA-N 408.459 -0.124 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2CCO[C@H]2C)cc1 1643602791 OHXOMPPSPBGAIU-FZMZJTMJSA-N 413.452 -0.286 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)c(F)c1 2282355417 FYGOKVKAGARVPZ-SANMLTNESA-N 424.281 -0.183 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(S(=O)(=O)c2ccccc2B(O)O)C1 2282717052 CMKCUXGIZADTHM-NWDGAFQWSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCc2sccc2B(O)O)CCS(=O)(=O)C1 2284052225 DDCOARFPYVHNDB-HNNXBMFYSA-N 418.302 -0.874 50 10 HBGE C[C@@H](c1nscc1B(O)O)N(C)C(=O)CCN(CCO)C(=O)OC(C)(C)C 2368525343 JEGIMJFBONDJNY-NSHDSACASA-N 401.294 -0.038 50 10 HBGE C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H]3COCCO3)n(C)c2)C1 744654553 XXDKWXCOAMLSFQ-DOMZBBRYSA-N 414.484 -0.378 50 10 HBGE Cn1cc([C@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1307739888 FKPZVVGBHFBGES-HJWYETAXSA-N 400.464 -0.142 50 10 HBGE Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c1C 1313099916 WKGGZUZCRZNYFX-CYBMUJFWSA-N 413.500 -0.108 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2Cc3c(cnn3-c3ccccc3)C2=O)ccc1=O 1539098278 VDFVVKADCPRZRR-UHFFFAOYSA-N 406.402 -0.012 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@](CO)(NS(=O)(=O)c2cscc2B(O)O)C1 2282373733 QTGRGBGODLNROR-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE C=C(CS(=O)(=O)NC[C@H]1C[C@@]2(CCN(C(=O)OC(C)(C)C)C2)CO1)B(O)O 2282376268 BAEHIKYJXAJQLI-CZUORRHYSA-N 404.294 -0.110 50 10 HBGE C[C@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@@H]1NC(=O)OC(C)(C)C 2282380240 GIHDMAAXGGXMLJ-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)[C@@H]1Cc2ccccc2O1 748276566 MSKDRTBBVQPUFH-NFAWXSAZSA-N 407.448 -0.827 50 10 HBGE O=C(Cn1cc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cn1)NC1CCCC1 1156184627 XKZDSIZTTVYBSU-KRWDZBQOSA-N 418.498 -0.044 50 10 HBGE C[C@](O)(Cn1ccccc1=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1321006848 YSDIKDFUXMUIAE-IBGZPJMESA-N 400.439 -0.547 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cn(C)nn1 1586154063 OXEPBZSOWAOZJZ-UHFFFAOYSA-N 408.440 -0.781 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br 1586766986 UHTOITMZODYYOW-UHFFFAOYSA-N 410.246 -0.480 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@]2(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1 1587512167 CIDMJUXLKTVGSK-BWACUDIHSA-N 417.484 -0.406 50 10 HBGE CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N[C@H](C)CO)cc1 1596323513 UMWHDPPFXVACJZ-SNVBAGLBSA-N 406.555 -0.182 50 10 HBGE COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)N2CCN(C)CC2)cc1 1626126446 ZQTWSSQUXSMRGT-UHFFFAOYSA-N 405.455 -0.238 50 10 HBGE O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1)N[C@@H]1CCS(=O)(=O)C1 1631028891 GDHKEUAVHNWNCD-CYBMUJFWSA-N 405.436 -0.577 50 10 HBGE CNS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Cn2nc(C)cc2C)cc1 1675272965 AHIMOFTYJHIAMP-UHFFFAOYSA-N 408.484 -0.019 50 10 HBGE CC(C)(C)OC(=O)N1CCN(c2ncc(Br)cc2B(O)O)[C@H](CO)C1 2223666136 JYFWWQSEYMUNHJ-NSHDSACASA-N 416.081 -0.058 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)N[C@@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2267336319 ZJWJVWKYWBJWMJ-HZPDHXFCSA-N 401.228 -0.481 50 10 HBGE CN([C@@H]1CC[C@H]1NC(=O)OCc1ccccc1)S(=O)(=O)c1cncc(B(O)O)c1 2267616242 PZJNYNNUFKHOMB-IAGOWNOFSA-N 419.268 -0.161 50 10 HBGE Cn1nc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2F)c(B(O)O)c1Cl 2281651581 RJIXPSWHOZORRO-DTWKUNHWSA-N 404.635 -0.169 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 2282074103 RKTLYWRMIHAMRQ-WDEREUQCSA-N 402.282 -0.928 50 10 HBGE C[C@H]1CC[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282079905 CAPOCCFSTNCEOT-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CC(C)C[C@H](CNS(=O)(=O)c1cncc(B(O)O)c1)NC(=O)OC(C)(C)C 2282101307 BUXXEOJCEIWQOT-CYBMUJFWSA-N 401.294 -0.021 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282101348 CMOUHAQDLWXXCH-CHWSQXEVSA-N 402.253 -0.008 50 10 HBGE CCn1cc(C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)nc1B(O)O 2282230251 SZLJWDHTMRCARH-FLESLCNUSA-N 402.282 -0.266 50 10 HBGE C[C@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@@H]1CNC(=O)OC(C)(C)C 2282247648 ITJILOBWOMJMDU-UWVGGRQHSA-N 400.672 -0.014 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282327959 QEHWIPXYFAKAIM-NEPJUHHUSA-N 420.318 -0.613 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)C[C@H]1CCO 2282378241 CHPBYMYNKBPSOI-LLVKDONJSA-N 420.318 -0.580 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)n1 2282425528 QTHOTJLBKYTMNX-PHIMTYICSA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2282702162 DOMOCVICCRYDKI-LLVKDONJSA-N 420.318 -0.410 50 10 HBGE C[C@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282708683 PXRXPZLPLFZBFG-IUCAKERBSA-N 414.236 -0.104 50 10 HBGE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2S(=O)(=O)c2sccc2B(O)O)C1 2282717610 MCSWKYGYYVKYLH-JTQLQIEISA-N 418.302 -0.827 50 10 HBGE C[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)c1cc(B(O)O)nn1C 2282723427 QGYFLYOEIBCRDG-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)CCC(=O)OC)c1 731041191 SXUJKGQUWCDOEN-UHFFFAOYSA-N 421.497 -0.156 50 10 HBGE CN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1 805044515 VGWRYRDYNMYRJF-NSHDSACASA-N 417.513 -0.426 50 10 HBGE O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)[C@@H]1CCc2nncn2C1 816878872 BUQKTJSPZBTKME-SECBINFHSA-N 414.394 -0.755 50 10 HBGE O=C(NCC(F)(F)F)NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1467555195 ZSBLHKPPCGQPID-SECBINFHSA-N 418.781 -0.128 50 10 HBGE COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(B(O)O)cc1 1556513376 CXKYLYXPEYPAEA-HNNXBMFYSA-N 406.244 -0.009 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CS1(=O)=O 1565030592 DJSHZFLNDOVZJD-OCCSQVGLSA-N 410.500 -0.011 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=NN4CCCN=C4N3)CC2)cc1 1587969103 VBBOCTVJYGAAJQ-UHFFFAOYSA-N 412.498 -0.762 50 10 HBGE CN(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(B(O)O)ccc1F 1630719203 ZSVLTYKCLXYWNP-SFHVURJKSA-N 401.247 -0.476 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc2c(cc1Br)OCO2 1638299969 BRXWBNRSIKPKGB-ZCFIWIBFSA-N 408.230 -0.124 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272653576 SHIRCZDPWNNHQY-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE Cn1nc(C(=O)NC[C@@]2(NC(=O)OC(C)(C)C)CCOC2)c(B(O)O)c1Cl 2281652006 YJWUJNBCXVZCSL-HNNXBMFYSA-N 402.644 -0.833 50 10 HBGE COc1ccc(S(=O)(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282367158 YJLOMZUKESFUBH-NSHDSACASA-N 402.278 -0.043 50 10 HBGE Cc1nn(C)c(C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C)c1B(O)O 2282389182 AXMVEPRDUARYQM-JNVGHINZSA-N 402.282 -0.440 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@]2(C)CCCN2C(=O)OC(C)(C)C)n1 2282414417 SGAFOCXOGIEFPH-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282700604 RMXHLGPBEVTBSG-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](CO)(NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282706195 IXEYWQYKSQWPHU-INIZCTEOSA-N 400.262 -0.983 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1ccc(Cl)c(B(O)O)c1 2359391049 FJSDVTWASYLCTQ-JHJVBQTASA-N 400.624 -0.701 50 10 HBGE CN1CCN(S(=O)(=O)N2CCN(CCCI)CC2)CC1 781328088 YVUHIVOLMJCUTO-UHFFFAOYSA-N 416.329 -0.079 50 10 HBGE O=C(NNC(=O)[C@H]1CCc2nncn2C1)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 814326796 RHCWUWDRDOVZIR-DZKIICNBSA-N 413.438 -0.225 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)N1 1131722424 DZEYETAQXFUQGU-CABCVRRESA-N 408.480 -0.346 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)N1 1469889202 QZSQTACXRHYBCB-GFCCVEGCSA-N 413.431 -0.525 50 10 HBGE CCOc1ccc(C(=O)N2CSC[C@@H]2C(=O)NNC(=O)CS(C)(=O)=O)cc1 1557734319 KOFBJMLXOQSFJU-CYBMUJFWSA-N 415.493 -0.208 50 10 HBGE NS(=O)(=O)CCOCCNC(=O)NNC(=O)c1ccccc1Br 1564892083 MLAQLIMJADTVPD-UHFFFAOYSA-N 409.262 -0.302 50 10 HBGE CN(C)C(=O)Cn1nc2n(c1=O)CCN(C(=O)NC[C@]1(C)C[C@H]1Br)C2 1565124589 BMZHNWFIDGUOCQ-BMIGLBTASA-N 415.292 -0.168 50 10 HBGE CCOC(=O)CS[C@@H](CNC(=O)NNC(=O)[C@H]1COCCO1)C(F)(F)F 1684893559 OMBRIJFAJXHUMF-BDAKNGLRSA-N 403.379 -0.041 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1ncsc1B(O)O 2255725402 WVNKUSTUGUXXAY-ZDUSSCGKSA-N 405.241 -0.410 50 10 HBGE Cc1cc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)ccc1B(O)O 2260894944 CVWRJACSUGEHHV-UHFFFAOYSA-N 402.237 -0.610 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12 2267626792 NRHTYEFLGYPYKZ-NXEZZACHSA-N 402.303 -0.120 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282069280 OAPVFAJAKNBLAC-NEPJUHHUSA-N 420.318 -0.269 50 10 HBGE CO[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282073229 DFDKQTGVDFMADB-GHMZBOCLSA-N 420.318 -0.269 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2282296476 ATJFZBWAPLSCSN-BDAKNGLRSA-N 402.644 -0.883 50 10 HBGE Cc1cc(S(=O)(=O)NC2(CNC(=O)OC(C)(C)C)COC2)ccc1B(O)O 2282354317 OWAKGLDYJIOWHH-UHFFFAOYSA-N 400.262 -0.753 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282729041 XHGRIXULPUMYCH-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE CCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 730316514 IEPIOAJXKTVKQH-BXUZGUMPSA-N 423.447 -0.172 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 745981418 UCHRCPZDJCTKFD-ZDUSSCGKSA-N 417.415 -0.977 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1(F)F 1135772306 ZWWKXLIYVLNUOK-OPRDCNLKSA-N 411.427 -0.026 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccc(B(O)O)c1 1291595511 HYTFLJQZBVBRQS-KRWDZBQOSA-N 418.280 -0.246 50 10 HBGE COc1ccc(C(=O)NCCN2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1 1543110469 SJYBEHKKKFMCTH-UHFFFAOYSA-N 411.267 -0.437 50 10 HBGE O=C(c1ccc(B(O)O)cc1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1 1557382609 CSKKSGLBOPQJCY-UHFFFAOYSA-N 403.269 -0.841 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3CN([C@H]4CCOC4)C3)CC2)cc1 1622155058 AYFPPTHYLUITBY-FQEVSTJZSA-N 415.538 -0.019 50 10 HBGE CC(C)(O)C(=O)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1 1625362517 VHOODSHLGLFSEQ-JQWIXIFHSA-N 405.860 -0.618 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@@H](CCC(N)=O)NC(=O)CCC2CCCC2)CC1 1626125619 JIEHBUNBOQEPEW-OAHLLOKOSA-N 410.519 -0.305 50 10 HBGE COCCNS(=O)(=O)c1c[nH]c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1 1642080466 UTLJREVWSMAAKS-NSHDSACASA-N 408.502 -0.955 50 10 HBGE O=C(NC[C@@]12COCCN1C(=O)COC2)NNC(=O)c1cncn1-c1ccccc1 1687345477 WOGDPIUSQRLBJL-IBGZPJMESA-N 414.422 -0.556 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267606780 CRWYCCJVVYVPII-NSHDSACASA-N 406.291 -0.658 50 10 HBGE COCCN(CCNS(=O)(=O)c1cc(B(O)O)cs1)C(=O)OC(C)(C)C 2267611473 TYEXJGLFJWLPLD-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282336949 IARVRCACQKGXQA-RYUDHWBXSA-N 420.318 -0.782 50 10 HBGE CC(C)(C)OC(=O)NC1CC(F)(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282377406 QEPSCESCMNYHEG-UHFFFAOYSA-N 423.297 -0.362 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)c1nc(NS(=O)(=O)c2cscc2B(O)O)n[nH]1 2282378028 ZSVVEVITMHGFFU-ZETCQYMHSA-N 417.278 -0.068 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1COCCN1C(=O)OC(C)(C)C 2282738505 VTZQVKCPXBBBBZ-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)Cc1ccccc1B(O)O 2282852281 NETHAQWOQUABKA-UHFFFAOYSA-N 402.278 -0.985 50 10 HBGE COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)[C@@H]1COCCO1 745978306 KGIYWJPYLXYJQE-JTQLQIEISA-N 423.241 -0.039 50 10 HBGE O=C(NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@H]1COCCO1 746000098 ZIWMCCQFDPWKNK-DGCLKSJQSA-N 401.803 -0.110 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Cn3ccnc3)CC2)cc1 766636735 TUYOIGZXQONLPN-UHFFFAOYSA-N 420.495 -0.655 50 10 HBGE O=C(NNC(=O)[C@H]1COCCN1CC(F)(F)F)[C@H]1C(=O)Nc2ccccc2C1=O 1298495349 YLOBKJQEYKMKAD-VXGBXAGGSA-N 414.340 -0.152 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CCC(=O)N1 1301441121 MMNPJIJSUGOIJJ-SNVBAGLBSA-N 408.358 -0.590 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@@]2(O)CCCOC2)c1 1470680991 LQNSIQROKOOOQK-KRWDZBQOSA-N 414.484 -0.188 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ncccn1 1630234322 RASIYTUHMJWHBL-UHFFFAOYSA-N 414.241 -0.021 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCCSS(C)(=O)=O)[C@H](C)O)cc1 1650843678 PVSBPTRNTHWPNK-WCQYABFASA-N 410.539 -0.168 50 10 HBGE O=C(N[C@@H]1C(F)(F)C12CC(NC(=O)c1cc(B(O)O)n[nH]1)C2)OCc1ccccc1 2281839376 GETJPAQRBGLUDG-XNYLIXPXSA-N 420.181 -0.088 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@](C)(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282166359 NWUAXMACTYEUCE-GFVXYOJSSA-N 400.266 -0.653 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNS(=O)(=O)c2ccc(Cl)c(B(O)O)c2)C1 2282366434 NUKRZPDJDGBKOF-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2282385435 ZVBOZFCJBHOWRG-GJZGRUSLSA-N 407.326 -0.141 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)n1 2282733016 OXKBATPLZRBJLE-JTQLQIEISA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](C(=O)O)C1 2282733225 SJNXPNDDQURAEA-JTQLQIEISA-N 420.274 -0.878 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C 2282733806 BIEVRJOSTKGGSE-MNOVXSKESA-N 402.278 -0.045 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2282741151 KCBJOOPQGPJQPT-KKBFJBPOSA-N 418.302 -0.613 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1C 2362570087 UAHKNZJRHNKPNH-CABCVRRESA-N 416.243 -0.778 50 10 HBGE CN([C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1F)S(=O)(=O)c1ccccc1B(O)O 2369652523 NUIGOEFBLXIYNQ-STQMWFEESA-N 402.253 -0.056 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)n1 807579954 XWMGMDUIXXVTAM-CYBMUJFWSA-N 401.493 -0.899 50 10 HBGE C#C[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1252433205 ZFOMTGIYFGYQEB-CQSZACIVSA-N 408.480 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1 1596825003 NUZLVKFIJNBZSG-GFCCVEGCSA-N 404.489 -0.185 50 10 HBGE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1623509847 LUZXKBYWJBWAFM-VXGBXAGGSA-N 406.505 -0.587 50 10 HBGE COCc1nocc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1641317316 UTYBJYWWUIZRLG-UHFFFAOYSA-N 410.456 -0.091 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1 2266924999 UAHZANHLUZSXKS-INIZCTEOSA-N 401.228 -0.528 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282384295 LGMFYTCPMFEBDJ-WDEREUQCSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(B(O)O)cc2)[C@H](F)C1 2282429897 YAWZKQBVWDIVIA-ZIAGYGMSSA-N 402.253 -0.008 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@](C)(O)Cn1ccccc1=O 790684069 SJZADWJVPFYCKG-FQEVSTJZSA-N 401.419 -0.159 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN(C)S1(=O)=O 857432021 WIJGVTGZVKSNIW-SNVBAGLBSA-N 403.486 -0.917 50 10 HBGE C[C@H](CO)NS(=O)(=O)c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1 1141786351 DPFZRJKRJSBNAW-OCCSQVGLSA-N 419.525 -0.548 50 10 HBGE Cc1nn(C)cc1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1306648269 LORDRANXXNGPHX-UHFFFAOYSA-N 407.500 -0.255 50 10 HBGE COC(=O)c1ccn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1 1440440660 UOCCLTDHNJHYBT-UHFFFAOYSA-N 409.424 -0.619 50 10 HBGE CCOC(=O)[C@@](C)(NC(=O)c1cccc(B(O)O)c1)c1ccc(S(C)(=O)=O)cc1 1467546941 LZPMZOXVPAFSIV-IBGZPJMESA-N 419.264 -0.022 50 10 HBGE O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)c1cccc(B(O)O)c1 1467773998 RNTOXICVGBRAFQ-QGZVFWFLSA-N 414.242 -0.047 50 10 HBGE Cn1c(CC(=O)NNC(=O)NC[C@]23COCCN2C(=O)COC3)nc2ccccc21 1565222436 AFYXYIFKTARMBN-LJQANCHMSA-N 416.438 -0.926 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 1611085723 FYIPYMXHKUSHDR-AAEUAGOBSA-N 400.457 -0.768 50 10 HBGE COCCOCC(=O)NC1CCC(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)CC1 1625795197 JIIKXCLPFJTLEC-GPANFISMSA-N 419.544 -0.183 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1CCC(=O)N1 1630431317 DINMPNYQRNVATB-SNVBAGLBSA-N 419.257 -0.847 50 10 HBGE O=C(C=C(Br)C(=O)NNC(=O)C(F)(F)F)NNC(=O)C(F)(F)F 1923825131 GNVDUAOJWCGFJC-UHFFFAOYSA-N 415.044 -0.315 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NC(=O)c2ncc(B(O)O)cc2F)C1 2281664137 VOVGJDJNMLADHO-HHHXNRCGSA-N 401.225 -0.242 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1cc(C)sc1B(O)O)NC(=O)OC(C)(C)C 2281889438 RSTMRKHLPWUEPC-NSHDSACASA-N 400.262 -0.077 50 10 HBGE C[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282341310 QFYLWKHFULEXSE-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE Cc1c(C(=O)N=[S@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)nn1C 2282441411 FMMLQKMNTMSGRH-BLBHWQHRSA-N 400.266 -0.686 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]2C)sc1B(O)O 2282735026 UKAIQHPHJHNRIM-IUCAKERBSA-N 414.236 -0.044 50 10 HBGE CC[C@H]1[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282737882 MPXGYKNQCJQBOH-NEPJUHHUSA-N 402.282 -0.834 50 10 HBGE COCC(=O)NNC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N 20921601 CBFJOURVYMLHTD-AYSLTRBKSA-N 410.464 -0.899 50 10 HBGE CCOc1cc(/C=N/NC(=O)CCNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1OC 169892753 MCDBTRWXTRIZQW-QGMBQPNBSA-N 421.370 -0.274 50 10 HBGE CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)[C@@H]2COCCO2)cc1 744649158 FSQCUJPBGALWSW-AWEZNQCLSA-N 401.441 -0.222 50 10 HBGE Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(=O)c1 794069008 DNEOKYZOCCSUIB-HXUWFJFHSA-N 416.434 -0.018 50 10 HBGE CC[C@]1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCNC1=O 1182815694 HIALICJIWVGLEU-KRWDZBQOSA-N 410.500 -0.623 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 1299883942 BKQIILONRKHDKI-CMPLNLGQSA-N 402.498 -0.062 50 10 HBGE COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)c2cc(B(O)O)ccc2F)C1 1467708376 XROMBEYVPVCONQ-ZDUSSCGKSA-N 402.253 -0.982 50 10 HBGE Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)ncc1C(N)=O 1566975585 SBHNPKIVBILEGQ-UHFFFAOYSA-N 405.274 -0.071 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 1630866801 GSHWRNLUFXKNOO-GOSISDBHSA-N 420.447 -0.680 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCc3cc(F)ccc32)n(C)c1=O 1630996519 KXNOJVGQAOUVEU-ZDUSSCGKSA-N 414.397 -0.550 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2Cl)C1 2195883701 PZARGZJTTCPYNQ-RCWTZXSCSA-N 419.853 -0.104 50 10 HBGE CN(CCOCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)s1 2267614119 JRHIBZQBRYIQRD-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@](C)(NC(=O)C(F)(F)F)C2)sc1B(O)O 2267625174 LFBTURQLDCSAIJ-NSHDSACASA-N 400.209 -0.432 50 10 HBGE CCc1nc(C(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C)c(B(O)O)s1 2282446431 KCHYSKVOGLNUNL-JTQLQIEISA-N 401.294 -0.315 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H]1COCCN(C(=O)OC(C)(C)C)C1 2282728758 VCUQISFISNSWKW-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)[C@@H]2COCCO2)cc1OC 744651051 WGGPPUQYGVNANP-AWEZNQCLSA-N 402.425 -0.570 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnn2cc(Br)cnc12 758046179 FXASHERQHDDOJD-ZCFIWIBFSA-N 405.234 -0.810 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)[C@H]1COCCO1 760819151 SAAKFHUITNJIJA-QWHCGFSZSA-N 414.459 -0.545 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)n(C)c1=O 765723881 FHYKJAPDHIJYIX-QWHCGFSZSA-N 414.397 -0.476 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@H]2CCCC[C@H]2C2CC2)n(C)c1=O 1137298878 FREJOSQRNPWERQ-STQMWFEESA-N 402.455 -0.203 50 10 HBGE O=C(c1cc(B(O)O)ccc1F)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 1290045392 BMXDGRDZKHSTFQ-UHFFFAOYSA-N 406.244 -0.207 50 10 HBGE CC(=O)Nc1ccc(N2C[C@@H](C(=O)NNC(=O)N3CCN(C)CC3)CC2=O)cc1 1296987772 HEAIHSLHZNSZSM-AWEZNQCLSA-N 402.455 -0.014 50 10 HBGE NS(=O)(=O)c1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1Br 1302575604 MNQYFCWHTCOFQL-UHFFFAOYSA-N 419.257 -0.520 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318349382 MSFXDMOMBBOKIO-OWCLPIDISA-N 422.507 -0.119 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)[C@H]1CCC(=O)N1)N1C(=O)c2ccccc2C1=O 1534064302 GHVQTEDKCFGBSQ-OLZOCXBDSA-N 404.448 -0.170 50 10 HBGE O=C(CCc1ccccc1N1CCOCC1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1583280586 CPMVXZRCKQMVMX-OAHLLOKOSA-N 410.496 -0.027 50 10 HBGE COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)CN3CCCC3=O)n2)cc1 1642897225 NEQUOCZQJCPEDM-UHFFFAOYSA-N 416.438 -0.016 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)C1(S(C)(=O)=O)CCOCC1 1645021912 RJRJRMSHWXMDCN-LLVKDONJSA-N 405.473 -0.263 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N2CCC(CNC(=O)OCc3ccccc3)CC2)n1 2267303715 BTIKYWYFMVGPGF-UHFFFAOYSA-N 400.244 -0.122 50 10 HBGE Cn1ncc(C(=O)N[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c1B(O)O 2267321851 AUGJFFQNXNNILG-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cc(B(O)O)nn1C 2282072802 JFSMRUPMLDTBDF-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2ccc(B(O)O)cc2)CC1 2282082267 YZCFPYASDPPKDB-UHFFFAOYSA-N 418.302 -0.226 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1B(O)O 2282362350 FCGYQHLEFSDGFB-RYUDHWBXSA-N 420.680 -0.410 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)N[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2282369593 IUANYSGXRDQDKY-QWHCGFSZSA-N 400.262 -0.755 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)n1 2282378029 ZTDGAWHPNPQCOH-CMPLNLGQSA-N 402.282 -0.928 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282706121 HYYJKUULQWWCDE-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CCNS(=O)(=O)c2sccc2B(O)O)C1 2282706538 MZTMGCJLLFKJKI-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cn1 764161095 NZRILRHTDUVDOU-UHFFFAOYSA-N 402.411 -0.474 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)C2CCC2)cc1 1182609675 WQOYVUQSBVOIFE-SNVBAGLBSA-N 403.482 -0.289 50 10 HBGE CNC(=O)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1251160554 MIGCFPBXFICYBR-LBPRGKRZSA-N 411.484 -0.060 50 10 HBGE CC1=C(C)C(=O)N(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)C1=O 1295730743 OYCXZNZKWYLZLZ-UHFFFAOYSA-N 422.301 -0.092 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)CC1(O)CCOCC1 1545424284 UHEYOOTTWUWEHK-UHFFFAOYSA-N 404.467 -0.477 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NN(C)C[C@H](C)O 1556926196 JZYAMVHKJTXHSP-AWEZNQCLSA-N 414.528 -0.021 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCC1CC(NC(=O)OC(C)(C)C)C1 2282084849 RLEXPGTXHZMUDD-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)NC1[C@@H]2CN(S(=O)(=O)c3ccc(F)cc3B(O)O)C[C@@H]12 2282360674 GFYZPIXKMRDGNA-GHMZBOCLSA-N 400.237 -0.351 50 10 HBGE COc1ccc(S(=O)(=O)NC[C@@H]2C[C@H]2NC(=O)OC(C)(C)C)cc1B(O)O 2282729274 ZUQZQIJZFNTHJQ-GXFFZTMASA-N 400.262 -0.434 50 10 HBGE C[C@@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1cc(B(O)O)nn1C 2284028761 XXTWEXFCLIKBTB-NSHDSACASA-N 404.298 -0.681 50 10 HBGE CCN(CC)CCS(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1 810063465 WEIJNPNECBCHMC-UHFFFAOYSA-N 406.368 -0.042 50 10 HBGE CN(C)CCn1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1 1135502788 SLACFAFCLDYXKL-UHFFFAOYSA-N 408.484 -0.230 50 10 HBGE C[S@@](=O)C1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)CCN(C(=O)OC(C)(C)C)CC1 1148929269 MEDNBVUPYRIPTE-GFRLJBLXSA-N 416.500 -0.439 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1C[C@H](O)CN1c1ccncn1 1468659695 LGFMBDUWANJHFZ-JSGCOSHPSA-N 406.468 -0.190 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O 1539066816 BXWBTINFWDEXAF-INIZCTEOSA-N 415.516 -0.524 50 10 HBGE O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1558950207 ILOQGFQZNLNIBA-UWVGGRQHSA-N 409.390 -0.021 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3CCC(=O)NC3)cc2)CC1 1566549601 ALEVAURPKSYCJQ-CQSZACIVSA-N 409.512 -0.018 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2267201806 UAMGRFZAMQTULC-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE Cn1ncc(C(=O)N[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c1B(O)O 2267321846 AUGJFFQNXNNILG-GFCCVEGCSA-N 414.149 -0.313 50 10 HBGE CC(C)(C)OC(=O)N=S1(=O)CC2(CN(C(=O)c3nscc3B(O)O)C2)C1 2267360907 WENZHYULHIATPK-UHFFFAOYSA-N 401.275 -0.318 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H](C(=O)O)C1 2282069705 UHMDWGZSBMXPKQ-JTQLQIEISA-N 420.274 -0.878 50 10 HBGE CC(C)(C)OC(=O)NCC1(F)CC(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282332611 DNJFNEDLLZHJFS-UHFFFAOYSA-N 423.297 -0.362 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282340361 DWSDQPXPSDWFEH-OAHLLOKOSA-N 420.318 -0.781 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C 2282358014 SAYYZUMZJVOABM-NSHDSACASA-N 402.278 -0.091 50 10 HBGE O=C(O)[C@@]1(NS(=O)(=O)c2sccc2B(O)O)CCN(Cc2ccccc2)C1 2284404365 XKUZYMWFGLCSBQ-MRXNPFEDSA-N 410.282 -0.565 50 10 HBGE Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 746002536 KSGSBIJCJVBITD-INIZCTEOSA-N 406.439 -0.326 50 10 HBGE CCn1c(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)nc2ccccc21 764816449 GNEKQELPSCGAKN-UHFFFAOYSA-N 408.422 -0.046 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 1290349718 WLNRJRNRPVCUDX-MEDUHNTESA-N 405.473 -0.406 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CC3CS(=O)(=O)C3)CC2)cc1 1465792073 RTHVBXKAMDLOEQ-UHFFFAOYSA-N 408.524 -0.305 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@H](CNC(=O)NNC(=O)[C@H]2COCCO2)C1 1635207537 ODOZYJRRKYBYBV-CHWSQXEVSA-N 402.448 -0.242 50 10 HBGE CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c1 1641309272 UWZPTZDDINYBTI-JTQLQIEISA-N 419.257 -0.603 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1ccc(Cl)c(B(O)O)n1 2217491299 BDZHRDLHNYNOTK-UHFFFAOYSA-N 409.616 -0.547 50 10 HBGE Cc1c(C(=O)NC2CC3(C2)C[C@H]3NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2282290018 LPYXLKBBOIHPFS-RDYUPDBUSA-N 412.255 -0.014 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1CCON(C(=O)OC(C)(C)C)C1 2282368257 NFVLZTXCSUIFKE-ZDUSSCGKSA-N 400.262 -0.106 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](C)(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282377246 OMMPKMKWRCGCOW-HNNXBMFYSA-N 419.334 -0.111 50 10 HBGE Cn1nc(C(=O)N=S2(=O)CCC(NC(=O)OC(C)(C)C)CC2)cc1B(O)O 2282440021 LFSOIKFMSPRSAD-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(NS(=O)(=O)c3ccc(B(O)O)s3)CO[C@H]1C2 2359281343 LDZVKHSVFJJBKT-HFBDOXOYSA-N 418.302 -0.469 50 10 HBGE CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1156184029 KUVRXMVGYLAQRD-QGZVFWFLSA-N 424.523 -0.207 50 10 HBGE CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@@H](C)OCCOC)C2)nc1 1478421711 DCENUJPGHKMJJX-GFCCVEGCSA-N 409.443 -0.171 50 10 HBGE O=C(Cn1ncc2ccccc2c1=O)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1625003470 KUIQYGIUWHYSID-MRXNPFEDSA-N 405.370 -0.005 50 10 HBGE O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3C[C@H]4CC[C@H]3O4)cc2)CCN1 1639948326 XBJCEHFCVHBPJK-VHDGCEQUSA-N 422.463 -0.864 50 10 HBGE CN1C(=O)CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1641081106 KJDNWGZVLHZZTR-HNNXBMFYSA-N 424.479 -0.521 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2CN([C@H]3CCOC3)C2)CC1 1641317179 MCKHLHDLQDHNPO-HNNXBMFYSA-N 424.527 -0.819 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCCN(CCN3CCOCC3)C2)n1 1684837192 ZKLLGZVNEJEFOV-KRWDZBQOSA-N 407.519 -0.373 50 10 HBGE CC(C)(C)OC(=O)N1CC(Nc2ncc(Br)cc2B(O)O)(C(N)=O)C1 2223671024 GQOQQSREQAZXJK-UHFFFAOYSA-N 415.053 -0.589 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCC1(F)CN(C(=O)OC(C)(C)C)C1 2267628922 QPDWTXUFJJAECM-UHFFFAOYSA-N 408.282 -0.026 50 10 HBGE O=C(N[C@@H]1CCCN(S(=O)(=O)c2cc(B(O)O)cs2)CC1)C(F)(F)F 2270595118 KMLIBZHEJFLKHZ-SECBINFHSA-N 400.209 -0.350 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)cc1 2282089220 XTFYTMGQHOJGAA-ZDUSSCGKSA-N 400.262 -0.072 50 10 HBGE COc1ccc(S(=O)(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1B(O)O 2282357510 KSLHBNKIBXAHGX-LLVKDONJSA-N 400.262 -0.337 50 10 HBGE Cc1cc(S(=O)(=O)N2CCOC[C@H](NC(=O)OC(C)(C)C)C2)sc1B(O)O 2282416774 AKJGSOWKUGAYFK-LLVKDONJSA-N 420.318 -0.349 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](CNC(=O)C(F)(F)F)C1 2282731862 XPEFPMRSQZMKQJ-SECBINFHSA-N 414.236 -0.184 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNS(=O)(=O)CCOCCCl 2312322370 ONFOFSMHTXABTL-TUAOUCFPSA-N 402.897 -0.498 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1N(S(=O)(=O)Cc1ncsc1B(O)O)C2 2359273806 ADEYGFGBISAGNG-YUSALJHKSA-N 417.318 -0.360 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 744640990 HDDNDURTVPCDKX-DZGCQCFKSA-N 413.452 -0.680 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CCN(C)C)c1 763663364 HSFASIWYTNUABK-UHFFFAOYSA-N 404.427 -0.382 50 10 HBGE Cc1cc(F)c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(F)c1 1137299173 MIMCHDVJTKNSJG-UHFFFAOYSA-N 406.349 -0.518 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1 1147395751 AMGWEVODRLAPEU-HNNXBMFYSA-N 424.473 -0.065 50 10 HBGE CNC(=O)C[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1478654749 DYFBXIXDIOZMQK-LBPRGKRZSA-N 413.504 -0.832 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)ccc1OC 1587114297 LNQATFFYMKLFQR-GFCCVEGCSA-N 412.468 -0.235 50 10 HBGE CNC(=S)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1OC 1638536518 MMRXLNYTUHOIOM-LBPRGKRZSA-N 416.525 -0.304 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1cscc1B(O)O 2267628378 LDSJYJMHEPFNEV-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)[C@@H]2COC[C@H]12 2282068571 FKXLWVWFUIRBMV-IJLUTSLNSA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H](C#N)C1 2282381396 UEJDRAYTBDJOBB-SNVBAGLBSA-N 416.290 -0.902 50 10 HBGE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@H]1NS(=O)(=O)c1sccc1B(O)O 2282708733 QMCDXAPLBLBQNQ-QJPTWQEYSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)N[C@@H]1CCC=C1B(O)O 2283961453 DNQDAOCNKKMXBB-DGCLKSJQSA-N 402.278 -0.372 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734812003 LQOMPSJCHPTIFE-XNRPHZJLSA-N 424.479 -0.268 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)Cn2ccccc2=O)c1 790465800 HWSFTRQRRPZHOE-SFHVURJKSA-N 422.463 -0.689 50 10 HBGE COc1cc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2=O)cc(OC)c1OC 1530230273 BHXBJHTZYMLZIE-JQWIXIFHSA-N 420.422 -0.509 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN(CC(F)(F)F)C1=O)N[C@@H]1CCS(=O)(=O)C1 1542285177 HDXWFVLLHWWWGA-BDAKNGLRSA-N 400.379 -0.695 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)N2CCOCC2)cc1OC 1542426917 DTEAMBWMGZAKHY-UHFFFAOYSA-N 402.429 -0.945 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H]3CCC(=O)NC3)cc2)CC1 1566549600 ALEVAURPKSYCJQ-AWEZNQCLSA-N 409.512 -0.018 50 10 HBGE O=C(NNC(=O)C1CS(=O)(=O)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 1628159609 GPOJZDCDDIDOSA-UHFFFAOYSA-N 401.466 -0.723 50 10 HBGE O=C(NC[C@@H]1CCCS(=O)(=O)C1)NNC(=O)C1CCN(c2ncccn2)CC1 1673280362 OHXRGDOFODVDFC-ZDUSSCGKSA-N 410.500 -0.152 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)Nc1cccc(B(O)O)n1 2029308149 NNSXDTGDBNNEBT-UHFFFAOYSA-N 403.225 -0.421 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N[C@H](CB(O)O)C(=O)O)C1 2124535776 YHMYIBNSIMFGHE-IYOUNJFTSA-N 408.216 -0.155 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@H]1CN(S(=O)(=O)c1sccc1B(O)O)C2 2272655827 SHIRCZDPWNNHQY-ZUZCIYMTSA-N 402.303 -0.037 50 10 HBGE CN(C)[S@](=O)(=NC(=O)[C@H]1C[C@H]1B(O)O)N1CCN(C(=O)OC(C)(C)C)CC1 2281868765 MOOIJANQYHKNCX-DMOSPCTNSA-N 404.298 -0.212 50 10 HBGE CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(B(O)O)s1 2282081933 XDHDAUDAVOGAFY-KRWDZBQOSA-N 410.326 -0.315 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2ccc(B(O)O)cc2)C1 2282085410 YEHSLENSRJQWGS-OLZOCXBDSA-N 400.262 -0.985 50 10 HBGE CN(CCOCCNS(=O)(=O)Cc1ccsc1B(O)O)C(=O)OC(C)(C)C 2282345562 HTIVTUYBVYHWRF-UHFFFAOYSA-N 422.334 -0.269 50 10 HBGE CN(CCOCCNS(=O)(=O)c1ccc(B(O)O)cc1)C(=O)OC(C)(C)C 2282715059 AJILDBVBUGCUSJ-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)c(F)c2)[C@@H]2C[C@@H]21 2282742112 XWYXQXKJIPHJAS-UONOGXRCSA-N 400.237 -0.112 50 10 HBGE Cn1nc(C(=O)NCCOC2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2362214517 SMHMCIROODOHFS-UHFFFAOYSA-N 402.644 -0.881 50 10 HBGE O=C(NNC(=O)[C@@H]1CSCN1C(=O)C1CCCC1)N[C@@H]1CCS(=O)(=O)C1 730074263 ABBMDLCLCSJYLV-NEPJUHHUSA-N 404.514 -0.404 50 10 HBGE O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNC(=O)[C@H]1COCCO1 745818400 NRZGMYUZAYMWTA-MRXNPFEDSA-N 411.503 -0.543 50 10 HBGE O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)cn2ncnc12 1440707136 XBTIBSOUYOGGDL-ZETCQYMHSA-N 402.230 -0.313 50 10 HBGE O=C(NCc1ccc(Cl)cc1)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1471097717 AGZUGPUETRRNDC-KRWDZBQOSA-N 411.846 -0.019 50 10 HBGE CN1C(=O)CN(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1=O 1522840502 YRFILAUKQZTUGA-UHFFFAOYSA-N 423.451 -0.874 50 10 HBGE COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)[C@H]3CCC(=O)N3)CC2=O)cc1OC 1530230580 IWDIEBVTADPDHL-UONOGXRCSA-N 418.450 -0.479 50 10 HBGE O=C(CN1CCC(CO)CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1540328736 JTQBFGTVIMDGNM-UHFFFAOYSA-N 424.523 -0.064 50 10 HBGE CN1CCC[C@](O)(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1 1544597970 PHDDWKPICLLQOP-SFHVURJKSA-N 412.512 -0.003 50 10 HBGE CS(=O)(=O)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 1683743927 HIQWBQQKZZXCGK-CYBMUJFWSA-N 411.488 -0.943 50 10 HBGE CC(C)(C)OC(=O)N1CCN(c2ncc(Br)cc2B(O)O)C[C@@H](O)C1 2223680048 XZTNCAIEWAMSPS-LLVKDONJSA-N 416.081 -0.058 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CN(S(=O)(=O)c3sccc3B(O)O)C[C@H]2C1 2267201532 PYJVWNDMOXUABV-GHMZBOCLSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@@H]2CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201564 QFKZBCLFMYOOBT-ADEWGFFLSA-N 402.303 -0.038 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cscc2B(O)O)C1 2267385060 HRBXNRDSOSBBPJ-HTQZYQBOSA-N 400.209 -0.495 50 10 HBGE CN1CCN(C(=O)c2scc(B(O)O)c2Cl)[C@@H](CNC(=O)C(F)(F)F)C1 2281756733 ACMQZJFYXDSCQJ-ZETCQYMHSA-N 413.614 -0.484 50 10 HBGE CC[C@H]1[C@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282091278 FMPMBXXLDFEZQH-NEPJUHHUSA-N 402.282 -0.834 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282357921 QRPLNRPNHULYQH-JTQLQIEISA-N 402.234 -0.796 50 10 HBGE CC(C)N(CCCNS(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282707709 BWTIQMNMEFBIGP-UHFFFAOYSA-N 404.298 -0.586 50 10 HBGE CC[C@@H]1[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282737885 MPXGYKNQCJQBOH-VXGBXAGGSA-N 402.282 -0.834 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1C(=O)c2ccccc2C1=O 744649075 RSOSIWIXWDBVLB-KGLIPLIRSA-N 407.448 -0.033 50 10 HBGE O=C(NNC(=O)[C@H]1Cc2ccccc2O1)[C@H]1CC(=O)N(CCN2CCOCC2)C1 748357740 GHHDAVRQTVOVOQ-DOTOQJQBSA-N 402.451 -0.682 50 10 HBGE Cc1ccc2c(CC(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c[nH]c2c1 765726709 FOJJUOCTHZBEFU-UHFFFAOYSA-N 423.433 -0.386 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1 1521821659 QUZMUQAUGURDFV-UHFFFAOYSA-N 409.424 -0.391 50 10 HBGE COc1ccc(/C=C(\C#N)C(=O)N(CC(=O)O)[C@@H]2CS(=O)(=O)C[C@H]2O)cc1OC 1866366010 FUILCWGUOLEYLP-KDHQJITESA-N 424.431 -0.318 50 10 HBGE CCc1nn(C)c(C(=O)NCC2CN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267395292 AIYWPUFASSUBJH-UHFFFAOYSA-N 400.244 -0.339 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)CC[C@@H]1NC(=O)OC(C)(C)C 2282077822 AGTUEBYYPUUPAW-PWSUYJOCSA-N 402.282 -0.976 50 10 HBGE CO[C@@H]1C[C@@H](CNS(=O)(=O)c2cscc2B(O)O)N(C(=O)OC(C)(C)C)C1 2282368360 PBZGGVDNJKCYSO-WDEREUQCSA-N 420.318 -0.269 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H](O)C1 2282368924 XZFAXNWUOULCLL-LLVKDONJSA-N 420.318 -0.661 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@@H]1NC(=O)C(F)(F)F 2282851931 JFKPMULUGUDPEW-SFYZADRCSA-N 415.224 -0.958 50 10 HBGE CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)Cc1ncsc1B(O)O 2282858487 XYRQTKXEYFFBAN-NSHDSACASA-N 419.334 -0.016 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1c1cc(B(O)O)c(Cl)cn1 2294919310 ZUDYOFLFUSWASF-MRXNPFEDSA-N 401.656 -0.493 50 10 HBGE COc1ccc(CCN2C[C@H](C(=O)NNC(=O)[C@@H]3COCCO3)CC2=O)cc1OC 744642488 QAVPJIQULIQYAQ-PBHICJAKSA-N 421.450 -0.342 50 10 HBGE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1303883067 PLXCZOHABCIZDO-LSDHHAIUSA-N 402.517 -0.507 50 10 HBGE COCCCN(CC(=O)NNC(=O)c1ccc(C#N)cc1)[C@H]1CCS(=O)(=O)C1 1307567534 RMLLMGYJNIFGSZ-INIZCTEOSA-N 408.480 -0.155 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318349380 MSFXDMOMBBOKIO-BZUAXINKSA-N 422.507 -0.119 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)CN1Cc2c(cnn2-c2ccccc2)C1=O 1352194621 KCDLWNZCDRLICQ-UHFFFAOYSA-N 422.401 -0.002 50 10 HBGE O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)CN1CCCC1=O 1471222160 JVDYBEISKWORDM-UHFFFAOYSA-N 408.480 -0.071 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)N1 1543096960 YFZUBLGAJXOMAZ-DGCLKSJQSA-N 408.842 -0.007 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)c2ccc(B(O)O)cc2)CC1 1623573713 SKPXFLRCFCOXIG-UHFFFAOYSA-N 407.257 -0.492 50 10 HBGE O=C(NNc1cc(Br)ncn1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 1644110876 SUSGRRDFURHRQL-BDAKNGLRSA-N 418.273 -0.282 50 10 HBGE Cn1cc(B(O)O)cc1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2267340676 HPRBCJOENLCHQD-MRXNPFEDSA-N 401.228 -0.528 50 10 HBGE C[C@H](CCCNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267393396 YELUYAWYSOMTKN-SNVBAGLBSA-N 407.323 -0.064 50 10 HBGE Cc1c(C(=O)N[C@@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2281848649 FIGIKRLGJOHKLP-HNNXBMFYSA-N 416.243 -0.824 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@](C)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282420602 BNMXDWZCOLWQAQ-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCCO1 2282732545 ICXBKOKROYKIAV-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNS(=O)(=O)c1ccc(B(O)O)s1 2334264234 UJKKEEIKFJHAMB-AXFHLTTASA-N 402.303 -0.038 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)N1CCN(S(=O)(=O)Cc2ccon2)CC1 743593846 ZHTHTWMBJVLZEU-UHFFFAOYSA-N 408.440 -0.500 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]3OCCNC(=O)[C@@H]32)cc1OC 1308023753 NOLKZFNFPJCDBW-RHSMWYFYSA-N 406.439 -0.556 50 10 HBGE CCOC(=O)[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(C)=O 1446966573 YUFJKXIVDPDBNN-LLVKDONJSA-N 413.290 -0.029 50 10 HBGE Cn1c(NNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)nc2ccccc2c1=O 1465160514 BRHILAOMDINGMS-ZDUSSCGKSA-N 400.370 -0.298 50 10 HBGE C[C@@H](CN(C)CCCN(C)C)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 1478957303 MYCRPQYNQKSBLA-AWEZNQCLSA-N 403.491 -0.122 50 10 HBGE O=Cc1cn(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nc1-c1ccccc1 1542285236 IFDKUSFKUKFCQK-CQSZACIVSA-N 405.436 -0.120 50 10 HBGE C[C@@](F)(CN1C(=O)c2ccccc2C1=O)CS(=O)(=O)Nc1cccc(B(O)O)n1 2108229312 SURZMIHDRIWOBX-QGZVFWFLSA-N 421.215 -0.473 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C 2267618385 FJXMDOKEIOTOHQ-CQSZACIVSA-N 408.307 -0.710 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C 2281727442 QWDAAJBETXMLMV-MHZLTWQESA-N 403.270 -0.962 50 10 HBGE Cc1c(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)nn(C)c1B(O)O 2282293873 PBLBYGSMXWAWMU-JGFSIVIASA-N 400.266 -0.686 50 10 HBGE Cn1cc(C(=O)N=[S@@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1 2282392549 YGDRAPKOFWQKLW-MHZLTWQESA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NS(=O)(=O)c2cscc2B(O)O)CCO1 2282728844 VXGHRWDNNFCVQV-GHMZBOCLSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N1CCC(CNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2282741846 TWWAQFJUPABIHF-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE O=C(CCOc1ccccc1)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 729350076 VPEKIPOHWVYCCU-INIZCTEOSA-N 404.467 -0.216 50 10 HBGE O=C(NNC(=O)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)[C@@H]1COCCO1 771219528 JBCRCTFFXMIXFI-DOMZBBRYSA-N 418.406 -0.860 50 10 HBGE NS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)s1 1156184067 LMEKAZNHNGBOGB-GFCCVEGCSA-N 402.498 -0.661 50 10 HBGE CC(C)C(=O)NNC(=O)CSc1ccc(S(=O)(=O)N2CCOCC2)cn1 1458855826 CLVIXVYOEFDRFD-UHFFFAOYSA-N 402.498 -0.002 50 10 HBGE Cn1cc([C@@H]2[C@@H](CNC(=O)NNC(=O)c3cn(C)nn3)CC(=O)N2C(C)(C)C)cn1 1470794298 PJUXUOVUSGGZSV-ABAIWWIYSA-N 417.474 -0.119 50 10 HBGE CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1471977166 IGQYANWWIDOMJP-HZPDHXFCSA-N 416.544 -0.019 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC[C@H]1CC[C@@H](C(N)=O)O1 1617996166 ZBKDSKNHZYWAFT-NEPJUHHUSA-N 411.484 -0.138 50 10 HBGE CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)C2CCCC2)c1 1624692225 FKJNRYBLQZTZME-UHFFFAOYSA-N 403.482 -0.294 50 10 HBGE O=C(COc1ccc(Br)cn1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1626650018 JPEYGKQGGIYXSV-SECBINFHSA-N 407.246 -0.260 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)CNS(=O)(=O)c1ccc(F)cc1 1627568389 HJMVLVQNPVLCLS-UHFFFAOYSA-N 414.440 -0.257 50 10 HBGE O=C(Cn1nc(Br)c(Br)n1)NNC(=O)[C@H]1COCCO1 1630358243 MZTFDEFGCYGBCS-RXMQYKEDSA-N 413.026 -0.634 50 10 HBGE COC(=O)c1ccc(NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)cc1F 1640717827 MBOIZBBOJYSIRI-RBSFLKMASA-N 405.386 -0.021 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3nccn3c2)CC1 1648592430 BXIYPOJGWOOGRX-UHFFFAOYSA-N 416.467 -0.183 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CN(c3ccncn3)C2)c1 1683575898 HCVVIYUPEPSPDB-UHFFFAOYSA-N 419.467 -0.440 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)Cc2ccsc2B(O)O)COC1 2267366606 IOFQHPADFCMPFO-UHFFFAOYSA-N 406.291 -0.859 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2COC[C@@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2267393330 XGGWTWZASGCTTC-VHSXEESVSA-N 406.291 -0.693 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267607035 HLOOITWDRRDDNN-AWEZNQCLSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NS(=O)(=O)c1ccccc1B(O)O 2282094823 VUGFNDLTACGKGU-CHWSQXEVSA-N 400.262 -0.673 50 10 HBGE COCC1(NS(=O)(=O)c2ccccc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282098189 PGHVRYUYDNLXJB-UHFFFAOYSA-N 400.262 -0.719 50 10 HBGE Cn1nc(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282295968 SYWXBPSPNOSILX-HVKUJSFDSA-N 420.684 -0.342 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)CO1 2282703362 VMWUVHUFESVTRL-CMPLNLGQSA-N 420.318 -0.364 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCC1(O)CC(NC(=O)OC(C)(C)C)C1 2282722428 GQXSGUNQDSKUHB-UHFFFAOYSA-N 420.318 -0.567 50 10 HBGE O=C(NC[C@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cc(B(O)O)ccc1O 2282968320 SXAKQGZYIKQOEP-INIZCTEOSA-N 414.223 -0.161 50 10 HBGE CC(=O)NNC(=O)C[S@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 586304758 XKBKIVLSZNDZFT-HVKUJSFDSA-N 414.509 -0.174 50 10 HBGE CN(Cc1ccc(B(O)O)cc1)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 704370552 FUFGXTAAQRMTOS-UHFFFAOYSA-N 402.237 -0.576 50 10 HBGE CCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1 730319373 XYGYPULFXDOZMK-JTQLQIEISA-N 400.482 -0.004 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2COCCO2)s1 744652666 LZQKTJJNJXTGAQ-NWDGAFQWSA-N 403.482 -0.228 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 1116020754 VDDQDGPNJMMISU-ARFHVFGLSA-N 422.507 -0.119 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1306513847 GGUWONGEXBAURI-WRWGMCAJSA-N 404.489 -0.426 50 10 HBGE O=C(NNC(=O)N1CCOCC1)c1sccc1S(=O)(=O)N1CCC(O)CC1 1583741532 VENGNZDHVZLHSU-UHFFFAOYSA-N 418.497 -0.420 50 10 HBGE Cn1ccn2c(CCNC(=O)NNC(=O)Cn3ccc4ccccc43)nnc2c1=O 1638474026 FVSGAGGRZJEGSF-UHFFFAOYSA-N 408.422 -0.044 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnn2cccc(Br)c12 1641246815 KZUJYXXHRQAFSC-SSDOTTSWSA-N 404.246 -0.205 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCC2(S(=O)(=O)NC(C)(C)C)CCC2)ccc1=O 1687592888 CXTXPKXARCQTFV-UHFFFAOYSA-N 413.500 -0.030 50 10 HBGE C=C(CS(=O)(=O)NCCC1(OC)CN(C(=O)OCc2ccccc2)C1)B(O)O 2255754622 CKHCQCWKUHCAAN-UHFFFAOYSA-N 412.273 -0.098 50 10 HBGE Cn1nc(C(=O)N[C@H]2C[C@H](F)CN(C(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281660818 RVMMNCNJYDUSAO-IUCAKERBSA-N 404.635 -0.169 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@H](C)C1(O)CN(C(=O)OC(C)(C)C)C1 2282360741 HDCQVISVZXAZLV-SNVBAGLBSA-N 420.318 -0.615 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)sc1B(O)O 2282741419 NJXPKLUFRCTZSA-QWRGUYRKSA-N 420.318 -0.758 50 10 HBGE O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)[C@@H]1COCCO1 775283279 SGIRRAGMFSIAMS-LBPRGKRZSA-N 419.481 -0.804 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2OCCN(C)C2=O)c1 1135229551 XWRHIMPWLRTTKW-CQSZACIVSA-N 412.468 -0.665 50 10 HBGE CC(C)[C@H](NC(N)=O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1137300298 LXTHTXMYKZFUOP-INIZCTEOSA-N 404.471 -0.715 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O 1152015557 YRPCVEJOKBYVES-UHFFFAOYSA-N 410.452 -0.440 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 1452254111 GERUVAVSOOLRLE-WCQYABFASA-N 413.452 -0.301 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1CCCCS1(=O)=O 1540331118 KDSOCMBLNGISNW-UHFFFAOYSA-N 417.513 -0.525 50 10 HBGE O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)[C@@H]1CCC(=O)N1 1557664274 NYAOAPWHGCAMAJ-JTQLQIEISA-N 409.251 -0.302 50 10 HBGE CCN(OC)C(=O)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1564974583 VFQJQAQEUPBOQV-UHFFFAOYSA-N 401.445 -0.709 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(B(O)O)c1 1587251993 XVXHEBFYLJEPSY-UHFFFAOYSA-N 404.253 -0.683 50 10 HBGE Cc1c(C(=O)N(C)[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2267022747 LBVOISWRUAWAFC-CABCVRRESA-N 400.244 -0.062 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@H]1NC(=O)C(F)(F)F 2267613485 CSTBVQDFVREESC-JGVFFNPUSA-N 400.209 -0.495 50 10 HBGE COCCN(CCNS(=O)(=O)c1ccccc1B(O)O)C(=O)OC(C)(C)C 2282097132 AYRXTXCYZODTHG-UHFFFAOYSA-N 402.278 -0.472 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282383974 GVIGNKMCUPSJLP-QWRGUYRKSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)cc1F 2282420398 YOIFFQMYYSEWMC-SANMLTNESA-N 424.281 -0.183 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282741103 JQUAPQWMVHAZOM-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)[C@H]1CCCO1 817215923 APKLZTAGYISKAZ-GFCCVEGCSA-N 403.482 -0.362 50 10 HBGE O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccc(B(O)O)cc1 1291595343 GXFRPZZUHOVLFC-QGZVFWFLSA-N 418.280 -0.246 50 10 HBGE C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1(S(C)(=O)=O)CC1 1322567104 GOWSYVQURIEZOG-LBPRGKRZSA-N 410.500 -0.011 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN2CCOC[C@]2(CO)C1 1460846430 FMSSKHHBUXBYGH-GOSISDBHSA-N 412.874 -0.512 50 10 HBGE CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)CS(C)(=O)=O 1470661177 LYVCZNCTWPFHPA-ZDUSSCGKSA-N 401.510 -0.341 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCn2ncnc21 1566278794 RQIWMQGTGUDHDI-INIZCTEOSA-N 411.466 -0.239 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)[C@@H]1C[C@H](O)CN1c1ccncn1 1623534494 QFNDVYJTVSYULN-JQWIXIFHSA-N 409.244 -0.022 50 10 HBGE O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@H]1CCC(=O)N1 1633924833 FCXWUFJCDMNFOZ-SNVBAGLBSA-N 404.242 -0.351 50 10 HBGE Cn1cc(C(=O)NNC(=O)N[C@H]2CCCN(CCN3CCOCC3)C2)ccc1=O 1687426097 AVGCHGSXBXYFII-INIZCTEOSA-N 406.487 -0.874 50 10 HBGE O=C(CN1C(=O)c2ccccc2C1=O)NNS(=O)(=O)c1cccc(C(=O)O)c1 1858081614 VLGQILDZDNTEEZ-UHFFFAOYSA-N 403.372 -0.010 50 10 HBGE O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1sncc1B(O)O 2255585791 JVBSAGPLZDPNTQ-CYBMUJFWSA-N 405.241 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2S(=O)(=O)Cc1ncsc1B(O)O 2267392672 ZIKPRQOCPDDGSX-UWVGGRQHSA-N 403.291 -0.654 50 10 HBGE CCC(CC)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282064970 HONNQMXFGNNVSY-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C)c(B(O)O)n1C 2282328214 UOMHCJBBFJPRHT-KOLCDFICSA-N 402.282 -0.915 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1 2282362365 FGZKQNITSGMKRY-LLVKDONJSA-N 402.282 -0.975 50 10 HBGE O=C(N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(Cl)c(B(O)O)c1)C(F)(F)F 2282380333 HPXUYRDVILTRIX-JGVFFNPUSA-N 412.582 -0.444 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282734658 OJHXQQOTMDYVLW-JTQLQIEISA-N 406.216 -0.068 50 10 HBGE CCOC(=O)c1ccc(N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)nc1 746002711 LNKBQFXTTATOHQ-AWEZNQCLSA-N 407.427 -0.464 50 10 HBGE COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)[C@H]1COCCO1 756249520 WGBLVXXKVQYESF-MRXNPFEDSA-N 421.454 -0.349 50 10 HBGE COCCn1cc(N2C[C@@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cn1 1124467493 BVGBYDIOUTXOTA-UONOGXRCSA-N 413.500 -0.625 50 10 HBGE COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CS(=O)(=O)C[C@@H]1OC 1252878343 QQJRNYRIZDTPEM-JQWIXIFHSA-N 403.482 -0.070 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)N[C@@H]1CCS(=O)(=O)C1 1464442712 IKYGKZVCNZIICB-ZYHUDNBSSA-N 401.466 -0.535 50 10 HBGE CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3cccc(B(O)O)c3)cn2)CC1 1565660596 ABQVFEDRFKUSIN-UHFFFAOYSA-N 404.257 -0.905 50 10 HBGE CC(C)C(=O)N[C@@H](CO)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1568937674 XDBKJNSCNNDDDZ-STQMWFEESA-N 400.476 -0.086 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 1641667035 KFHJCYPQYWXTEM-NSHDSACASA-N 421.472 -0.582 50 10 HBGE CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)[C@@H]2COCCO2)CCOCC1 1682756690 QITKIZOFMAQUCX-LBPRGKRZSA-N 402.448 -0.194 50 10 HBGE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)N2CCC(Cl)CC2)C1 2240604099 PGYPHVCYOJURFF-WPRPVWTQSA-N 420.841 -0.211 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@@]1(C)CCCN(C(=O)OCc2ccccc2)C1 2266957628 NXJQPJGMUDQEMX-SFHVURJKSA-N 401.232 -0.584 50 10 HBGE O=C(NC[C@@H]1CCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1)C(F)(F)F 2267610782 JWZJWAOJMXTNNF-QMMMGPOBSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2ccoc2B(O)O)CC1 2282209870 YGTOYIPKXFXKPA-MHZLTWQESA-N 401.250 -0.335 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC/C=C/CNC(=O)OC(C)(C)C 2282356688 YXQHJMKEISZIDP-AATRIKPKSA-N 400.262 -0.266 50 10 HBGE Cn1cc(I)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n1 1135990296 LJNCPSODDCESHE-ZCFIWIBFSA-N 412.209 -0.780 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)CN1CCOC2(CCS(=O)(=O)CC2)C1 1198731471 HJRRJIMPPCPGQA-UHFFFAOYSA-N 409.508 -0.035 50 10 HBGE O=C(NNC(=O)[C@H](C[C@@H]1COCCO1)C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 1442180916 GZLPRSXCBUOMNA-AEJSXWLSSA-N 403.379 -0.512 50 10 HBGE CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)[C@H]1CCC(=O)N1 1454058507 FAYLOHSYJKHZBH-XCLFUZPHSA-N 413.434 -0.199 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 1539401385 BZYHNSLIQQAWGS-PRXAMGSTSA-N 419.500 -0.017 50 10 HBGE O=C(CN1CC[C@@H](c2ccccc2)NC1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1583281156 OMNNZGJVGQGEPT-KBPBESRZSA-N 409.468 -0.340 50 10 HBGE COc1ccc(NC(=S)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)cn1 1651321926 ACINZIXSIRWRDT-UHFFFAOYSA-N 411.469 -0.448 50 10 HBGE Cn1ncc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 1654138211 ACCQCGASINJLCL-UHFFFAOYSA-N 422.467 -0.770 50 10 HBGE Cc1c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nnn1-c1ccc(F)c(F)c1 1654294592 BPNRKQYQUUSGCQ-ZETCQYMHSA-N 402.383 -0.447 50 10 HBGE C[C@@H](NS(=O)(=O)c1cscc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2267413210 XPIFOIQVGSBMCD-SECBINFHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NC(=O)c2ncc(B(O)O)cc2F)C1 2281664138 VOVGJDJNMLADHO-MHZLTWQESA-N 401.225 -0.242 50 10 HBGE CCC1(NC(=O)OC(C)(C)C)CC(NS(=O)(=O)c2cc(B(O)O)nn2C)C1 2282077674 YWTPYODVTQMARM-UHFFFAOYSA-N 402.282 -0.786 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2ccccc2B(O)O)CCOC1 2282420693 CXEPEIVPLPFLNY-INIZCTEOSA-N 400.262 -0.672 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1CCO 2282719252 JFVKBDFFQSMKPM-LLVKDONJSA-N 420.318 -0.580 50 10 HBGE COc1ccc2c(c1)C=C(S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2 758150608 NRKLKBPPAKNGFT-JTQLQIEISA-N 403.482 -0.129 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 1163146937 YDMPNVQZSJCZJN-YPMHNXCESA-N 417.509 -0.116 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCc3nn[nH]n3)cc2)CC1 1295261149 NFHBEWPOTXANQK-UHFFFAOYSA-N 408.488 -0.398 50 10 HBGE CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cn(C)nn1 1557479756 YHHJWPJFKUAVCX-ZDUSSCGKSA-N 406.468 -0.107 50 10 HBGE O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(B(O)O)ccc1F 1624085266 BEQMARYNRZYMBP-UHFFFAOYSA-N 408.216 -0.221 50 10 HBGE C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)cc1 1635372269 QUOUMHGUJGBQRI-KRWDZBQOSA-N 420.491 -0.388 50 10 HBGE COc1ccccc1CC(=O)NNC(=O)[C@@H]1[C@@H](c2cnn(C)c2)N(C)C(=O)[C@@H]1O 1641946936 SNKQMQSMGVHYMX-BRWVUGGUSA-N 401.423 -0.691 50 10 HBGE Cc1c(C(=O)N[C@H]2CCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2267016848 JADKXNNUZUBKJT-HNNXBMFYSA-N 400.244 -0.061 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](NC(=O)OCc2ccccc2)C1 2278539895 NWYCBYNBPPNUAL-AWEZNQCLSA-N 422.272 -0.821 50 10 HBGE CN(C[C@@H]1CCCN1S(=O)(=O)c1cc(B(O)O)nn1C)C(=O)OC(C)(C)C 2282082548 KDCUOWYFTLYTAS-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282102949 MWBFMHKZEUNEMP-SMDDNHRTSA-N 400.262 -0.816 50 10 HBGE CC(C)(C)OC(=O)NCCC1CC(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282378044 ZZBVFVZAJMVQGU-UHFFFAOYSA-N 419.334 -0.064 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)CC1(C)C 2282706024 GVTAJRZHBYSFBW-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)CNC(=O)c2cscc2B(O)O)C1 2288538842 AUXKBCYCEJFJLN-UHFFFAOYSA-N 406.216 -0.225 50 10 HBGE Cc1ccc(B(O)O)c(NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1 2360548554 FPRIGBMLNKCDOQ-CYBMUJFWSA-N 400.262 -0.449 50 10 HBGE Cn1nc(Br)c(Br)c1CNC(=O)c1n[nH]cc1B(O)O 2364437866 YFXWGTPLOSKHHZ-UHFFFAOYSA-N 406.831 -0.722 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCCOC1 730070187 XSIAGJWMIZULFH-AWEZNQCLSA-N 412.468 -0.170 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)/C=C\c2ccnc(Cl)c2)n(C)c1=O 761952877 KWDHECVVFLQBMS-ARJAWSKDSA-N 417.813 -0.657 50 10 HBGE Cc1ccc(NC(=S)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 764512274 AKHTUEUIZHZIOS-UHFFFAOYSA-N 419.442 -0.101 50 10 HBGE Cc1ccc(C(F)(F)C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 780645499 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CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1sccc1B(O)O 2255882101 JEADPLZVRXQNFC-XMMPIXPASA-N 412.320 -0.261 50 10 HBGE CN1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](CNC(=O)OC(C)(C)C)C1 2282359023 HXDRKBAUMQXJMU-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282717565 LIGBKBJWOYAUMR-AAEUAGOBSA-N 400.262 -0.816 50 10 HBGE O=C(NNC(=O)[C@@H]1CSCN1C(=O)C1CCCC1)N[C@H]1CCS(=O)(=O)C1 730074270 ABBMDLCLCSJYLV-RYUDHWBXSA-N 404.514 -0.404 50 10 HBGE O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)C1CCN(c2ncccn2)CC1 1136718570 XLBIQGJRAFUPBX-ZDUSSCGKSA-N 413.525 -0.239 50 10 HBGE COc1cc(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)cc(OC)c1OC 1290033877 OYFQVLDKAHDEAG-UHFFFAOYSA-N 402.425 -0.465 50 10 HBGE CC(C)[C@H](NC(=O)c1cc(B(O)O)ccc1F)C(=O)N(C)Cc1nnc2n1CCC2 1297322976 PJGQHYMMCTWUHM-KRWDZBQOSA-N 417.250 -0.544 50 10 HBGE CN1C(=O)C(=O)N(CC(=O)NNC(=O)COc2ccccc2Br)C1=O 1536590204 MMIVUSOFJUJYBF-UHFFFAOYSA-N 413.184 -0.604 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1=O 1585643137 DZMXSXNWSRIPPL-UHFFFAOYSA-N 420.447 -0.519 50 10 HBGE CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)N=S(C)(C)=O)c2)CC1 1617831981 VDVCMRVUDSUIKZ-UHFFFAOYSA-N 417.513 -0.295 50 10 HBGE Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)cnc21 1646040250 YBFKLGIGIWOBSR-ZDUSSCGKSA-N 402.411 -0.952 50 10 HBGE COc1ccc(OCC(=O)NNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)cc1 1684252561 UGDMCOIJEDELLB-MRXNPFEDSA-N 401.441 -0.392 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267623884 POUNJZDPWZEFAL-ONGXEEELSA-N 406.291 -0.754 50 10 HBGE Cn1nc(C(=O)N2CCOC[C@@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281656874 RCUQVKXUOWYMPP-VIFPVBQESA-N 402.644 -0.881 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2281914471 VEICXFFBSRNWPT-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 2282071753 WBGXNIXPSXTOBG-NWDGAFQWSA-N 402.282 -0.786 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1C[C@H]1CNC(=O)OC(C)(C)C 2282362167 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COC(=O)C1CC2(C1)C[C@H](NC(=O)NNC(=O)C1CCOCC1)CCS2(=O)=O 1251484674 KSGPXUKZMRGCMU-UIORMTCPSA-N 417.484 -0.358 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)c2ccccc2C1=O 1532340145 CWAOZIYXEGQPIV-CYBMUJFWSA-N 402.436 -0.006 50 10 HBGE CC(C)OCCS(=O)(=O)N1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1566183267 STMWGAQWRVTSST-UHFFFAOYSA-N 402.253 -0.982 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cnn2c(-c3cccnc3)ccnc12 1624585995 XXUCUTBTYMMXRT-GFCCVEGCSA-N 400.420 -0.013 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/Cn3cncn3)cc2)CC1 1636676950 ARUNQWPQUUBSLN-NSCUHMNNSA-N 405.484 -0.086 50 10 HBGE C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@]12COCCN1C(=O)COC2 1683460476 YUQOWCWBKOQHPX-SGTLLEGYSA-N 410.402 -0.449 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1cc(C)c(B(O)O)s1)NC(=O)OC(C)(C)C 2281718536 CMILITUHVCZINK-SNVBAGLBSA-N 400.262 -0.077 50 10 HBGE CN(CCCCCNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282722670 KGYBDFFUHXWBDU-UHFFFAOYSA-N 404.298 -0.585 50 10 HBGE O=C(O)C[C@@H](COCc1ccccc1)NS(=O)(=O)Cc1ccsc1B(O)O 2284410128 RJCYXDDJGFPLDX-AWEZNQCLSA-N 413.282 -0.093 50 10 HBGE CC(C)(C)OC(=O)N1CC(c2nc(=NC(=O)c3ncsc3B(O)O)s[nH]2)C1 2296443882 DROQMNXAIYAYIX-UHFFFAOYSA-N 411.274 -0.317 50 10 HBGE Cn1cnc(B(O)O)c1C(=O)N=[S@](C)(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2362456401 OBIDAAFWTZOSFL-FLESLCNUSA-N 400.266 -0.653 50 10 HBGE COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)[C@H]1COCCO1)CC2 765731615 ACPCJKPLRGGFRC-QGZVFWFLSA-N 421.450 -0.069 50 10 HBGE CCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 814698574 KBWWASJAFKCTHX-UHFFFAOYSA-N 408.440 -0.606 50 10 HBGE CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H]1CCC(=O)N1 1301441893 QQMPBDULNQCNIZ-UONOGXRCSA-N 408.480 -0.271 50 10 HBGE CO[C@@H]1C[C@H](C(=O)NNC(=O)[C@H]2CCC(=O)N2)N(C(=O)OCc2ccccc2)C1 1438037215 PYBWKBICDZOKHM-RBSFLKMASA-N 404.423 -0.162 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)[C@H]2CCC(=O)N2)CN(C(=O)OC(C)(C)C)CCO1 1454062697 MCWPQMNCEASWEW-PIGZYNQJSA-N 400.432 -0.935 50 10 HBGE CCOC(=O)CNC(=O)[C@H]1COCCN1CC(=O)NNC(=O)Cc1ccccc1C 1459879473 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Cn1ncc(B(O)O)c1C(=O)N=[S@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1 2282259806 VHFYLWGNXROJAF-BLBHWQHRSA-N 400.266 -0.747 50 10 HBGE Cc1nc(S(=O)(=O)N(C)CC2(NC(=O)OC(C)(C)C)CC2)c(B(O)O)n1C 2282335455 PTHOGVYRXLAMPW-UHFFFAOYSA-N 402.282 -0.914 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2C[C@H]2CNC(=O)OC(C)(C)C)cc1B(O)O 2282367648 FFOCINDIILWDHG-GWCFXTLKSA-N 400.262 -0.434 50 10 HBGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282715395 GHGKUYGIWRKXNA-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)C1 735446358 RNRJVBUHFCAAGY-GFCCVEGCSA-N 410.456 -0.113 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@]2(C)CCCc3ccccc32)n(C)c1=O 766642550 HEWDCOASVXJOMK-OAQYLSRUSA-N 424.461 -0.125 50 10 HBGE NC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)O1 1149649484 FWEYNKNETOJPJU-JKSUJKDBSA-N 423.901 -0.362 50 10 HBGE COCCO[C@@H](C)C(=O)NNC(=O)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 1312899350 BVHZREHRQOYVQG-NWDGAFQWSA-N 401.441 -0.397 50 10 HBGE CO[C@@]1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCSC1 1457671963 STQYESHAKFOMGZ-INIZCTEOSA-N 415.541 -0.017 50 10 HBGE O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H]2CO)cc1)c1cc(B(O)O)ccc1F 1623750862 WUBGAPZZIGHVJF-AWEZNQCLSA-N 422.243 -0.097 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(B(O)O)cc2)c1 1623860983 YDDYSNNALGRYGK-UHFFFAOYSA-N 419.268 -0.528 50 10 HBGE CN(C)CCn1c(O)nc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc21 1624585652 PEVVQYFWABENCN-GFCCVEGCSA-N 409.468 -0.501 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1CCCCC(=O)C1=O 1628171551 VJCWUCVLAUWMME-UHFFFAOYSA-N 409.468 -0.369 50 10 HBGE Cc1cn(C)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1638057312 CQYWXLUAFXOYPE-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCCS(=O)(=O)NCc1cccc(B(O)O)c1 2089784369 IWYOQZUYHZJUJN-UHFFFAOYSA-N 416.264 -0.138 50 10 HBGE CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282378716 JTRJPGAUAAXECW-NSHDSACASA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)NCCN(CC(F)F)S(=O)(=O)c1cncc(B(O)O)c1 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O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 16145928 VLNZMNYAWNEXRM-GFCCVEGCSA-N 423.472 -0.069 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)n3cnc(C#N)n3)CC2)cc1 798980201 HQCCRAXGDYOZGT-MRXNPFEDSA-N 410.482 -0.016 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@H]1CCc2nncn2C1 816879155 IQIFEQZRTNAIPX-NSHDSACASA-N 410.431 -0.504 50 10 HBGE O=C(NCc1nnc2n1CCNC2=O)NNC(=O)c1ccc(Br)cc1 1246804023 SLPRUGOUVPKDMB-UHFFFAOYSA-N 408.216 -0.072 50 10 HBGE CCN1C(=O)CO[C@H](C(=O)NNC(=O)COc2ccccc2O)[C@H]1c1nccn1C 1293107329 ITUMXFIWZYXGJS-IRXDYDNUSA-N 417.422 -0.360 50 10 HBGE COC(=O)C[C@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccc(F)cc1 1460604490 PZOKNZFVDUEJQX-ZDUSSCGKSA-N 401.416 -0.751 50 10 HBGE CNC(=S)N(C)NC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 1625904885 TZUZQIHMJYXVAG-UHFFFAOYSA-N 416.525 -0.274 50 10 HBGE O=C(NNC(=O)C1CCN(C(=O)c2cccnc2)CC1)N[C@H]1CCS(=O)(=O)C1 1626649609 CYQULINDWUKJEE-AWEZNQCLSA-N 409.468 -0.549 50 10 HBGE Cc1cc(CC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)n[nH]1 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C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1sccc1B(O)O 2267199331 KUTQWOLOTJPYDN-APPZFPTMSA-N 400.209 -0.352 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C 2267385008 HFMZEOYRRXCQBI-SNVBAGLBSA-N 408.307 -0.758 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)n1 2282377227 OITGDUZRRDCUFE-CMPLNLGQSA-N 402.282 -0.928 50 10 HBGE C[C@@H]1[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCCN1C(=O)OC(C)(C)C 2282719269 JMPVKZJMWCNPFK-GHMZBOCLSA-N 402.282 -0.834 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@H](O)C[C@@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282735531 BWBIHJZQQJXEKT-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE Cc1cn([C@@H]2C[C@@H](O)[C@@H](CNC(=O)CI)O2)c(=O)[nH]c1=O 25999097 NWGXFMGORNLEMS-MRTMQBJTSA-N 409.180 -0.955 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1ccc(B(O)O)cc1 704308956 AVYQLIMAZBCQDO-UHFFFAOYSA-N 402.237 -0.528 50 10 HBGE O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)ccc1Br 745979526 UUMILYSTHGCXKO-JTQLQIEISA-N 409.214 -0.128 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@H]2COCCO2)CC1)NCc1ccccc1 746003670 QYDKMJIBLAIDFI-MRXNPFEDSA-N 405.455 -0.923 50 10 HBGE Cn1c(=O)c2ccc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)nc2n(C)c1=O 748131074 KVFXKWHCKXAXBN-UHFFFAOYSA-N 403.420 -0.207 50 10 HBGE COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)[C@H]2COCCO2)C1=O 771263819 JDEWETAKBDFHLI-AUUYWEPGSA-N 420.422 -0.667 50 10 HBGE COCc1nc(Cl)cc(NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)n1 807235960 UQSPHNAHPAUSOC-UHFFFAOYSA-N 407.818 -0.078 50 10 HBGE O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@H]1CCC(=O)N1 1530230607 JSOVRORMNQNIGU-GFCCVEGCSA-N 411.436 -0.562 50 10 HBGE CN1C[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)NC1=O 1566281561 OBTGLTBUIWBICH-HNNXBMFYSA-N 408.890 -0.371 50 10 HBGE NC(=O)C[C@H](NC(=O)Cc1cccc(F)c1)C(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2 1640905693 MOSUGBQCPIIYNR-APIJFGDWSA-N 406.414 -0.557 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cn3c(n2)CCC3)CC1 1648592678 LAKOLPPBOFKPRI-UHFFFAOYSA-N 405.484 -0.083 50 10 HBGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)Cc1ncsc1B(O)O 2267626191 CWDBZYJKSVNTAK-NXEZZACHSA-N 405.307 -0.360 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC(NC(=O)C(F)(F)F)CC2)sc1B(O)O 2270585678 CVLWMLHOHZLXRI-UHFFFAOYSA-N 400.209 -0.432 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)[C@H](C)[C@@H]1NC(=O)C(F)(F)F 2282071799 WLLWKDYDCONOPH-SOCHQFKDSA-N 414.236 -0.106 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@@]1(C)CNC(=O)OC(C)(C)C 2282072179 BCGJDQKPEQPVCR-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccccc2B(O)O)[C@H](O)C1 2282090950 SFRKXMKPYIRQBV-QWHCGFSZSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282102948 MWBFMHKZEUNEMP-RISCZKNCSA-N 400.262 -0.816 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 2282714928 YQOMPJVDWXIPEX-NSHDSACASA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CC([C@H](F)CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282716566 VYTQFZGYJIMXEE-CQSZACIVSA-N 402.253 -0.150 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]1NS(=O)(=O)c1c(F)cc(F)cc1B(O)O 2282733512 XAHJGBFWBDLLPT-VXGBXAGGSA-N 406.216 -0.021 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CCNS(=O)(=O)c2cscc2B(O)O)C1 2282733772 AWNUHFABUKVIGZ-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282857323 GSNPCQXRNBKIHF-CMPLNLGQSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)Cc1ncsc1B(O)O 2359283276 YHYMZXUTUDREMA-FOGDFJRCSA-N 417.318 -0.502 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n(C)c1=O 1135409910 LCCNPAXUNKNAOV-UHFFFAOYSA-N 421.479 -0.027 50 10 HBGE CO[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)[C@H]1CCOC1 1182816475 SESJGONYTHVRIP-ZFWWWQNUSA-N 413.500 -0.488 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 1301696946 HLXATDOCGDCZJI-SDDRHHMPSA-N 419.525 -0.525 50 10 HBGE CN1C(=O)CO[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H]1c1cccnc1 1358007298 XNOKRUXLCFQLPS-CVEARBPZSA-N 417.447 -0.381 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 1437641093 SDNOQNRXODZZNL-GMXVVIOVSA-N 408.484 -0.127 50 10 HBGE CNS(=O)(=O)c1csc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1456035842 DZLMAYBGWRYUJP-GFCCVEGCSA-N 402.498 -0.330 50 10 HBGE O=C(NCCN1CCC2(C1)OCCO2)NNC(=O)c1nn(-c2ccccc2)cc1O 1471409785 NAQDKCFRFNKJEL-UHFFFAOYSA-N 416.438 -0.029 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2267609728 VGFJNWHIYPDABY-APPZFPTMSA-N 400.209 -0.495 50 10 HBGE Cn1nc(C(=O)N2C[C@H](F)C[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281660309 ODDXPYMEAKNWHE-BDAKNGLRSA-N 404.635 -0.169 50 10 HBGE CCn1cc(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)nc1B(O)O 2282228865 DVTAOBIYUYFGRZ-HOCLYGCPSA-N 416.243 -0.604 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282339867 YILGRPMMMAUKMJ-VXGBXAGGSA-N 420.318 -0.471 50 10 HBGE C[C@H]1C[C@@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCN1C(=O)OC(C)(C)C 2282377107 MQZVMNGKCUURLT-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)CC[C@H]1NC(=O)OC(C)(C)C 2282380238 GIHDMAAXGGXMLJ-GHMZBOCLSA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)NCC1CCS(=O)(=NC(=O)c2cc(B(O)O)n[nH]2)CC1 2282382757 PKLWTCOGNPGULN-UHFFFAOYSA-N 400.266 -0.368 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CN(C(=O)OC(C)(C)C)C1 2282705925 FENXVYWSJXZKSD-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE C=C(CS(=O)(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C2(CCOCC2)C1)B(O)O 2282729464 NMMDVDAGIQUDLH-CYBMUJFWSA-N 404.294 -0.110 50 10 HBGE O=C(Cc1ccccc1)NN=Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 263632650 AMXHZYWDUXDUDV-QNDFHXLGSA-N 416.430 -0.442 50 10 HBGE C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)ccc1F 816876208 QPUYMLYNXPGIPR-LBPRGKRZSA-N 422.442 -0.095 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccn3nnnc23)cc1 1160386033 YPBHMMGUIRJJOE-UHFFFAOYSA-N 403.424 -0.486 50 10 HBGE O=C(NNC(=O)c1cn(C2CC2)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1 1182149016 ICCLGQOYKOKWOH-UHFFFAOYSA-N 420.451 -0.291 50 10 HBGE CN(C)S(=O)(=O)CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1463574998 UUMQANQAEPOUOC-UHFFFAOYSA-N 411.528 -0.372 50 10 HBGE CC1CCC(NC(=O)CN2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)CC1 1542878880 ZKMPMGHSHATBMX-UHFFFAOYSA-N 405.279 -0.042 50 10 HBGE O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@H]1CCC(=O)N1 1623367776 BMOUZQQOXFBHMY-SNVBAGLBSA-N 409.196 -0.529 50 10 HBGE O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1638870979 NJNBGZQEDIOZOI-CQSZACIVSA-N 407.471 -0.358 50 10 HBGE Cc1oc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1S(=O)(=O)N(C)C 1645054014 NPGCANFANNPLEY-CYBMUJFWSA-N 414.484 -0.147 50 10 HBGE CC(C)(C)OC(=O)NC[C@H](Oc1ncc(Br)cc1B(O)O)C(=O)O 2217180984 MTCIOZZWSYFDJR-VIFPVBQESA-N 405.010 -0.119 50 10 HBGE CC(C)(C)OC(=O)N1CC(NC(=O)c2cc(B(O)O)c(Cl)s2)(C(N)=O)C1 2267076590 LXIUBTUGOMOQJK-UHFFFAOYSA-N 403.653 -0.714 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N[C@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)n1 2281887702 UXILFLAHQXOKBA-HOTGVXAUSA-N 416.243 -0.604 50 10 HBGE CC[C@@H]1CCCC[C@@H]1OCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 768273972 BQECROUNNDITAX-OLZOCXBDSA-N 420.470 -0.434 50 10 HBGE CCn1nccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 769863788 XKGIYNVNDZWVEL-UHFFFAOYSA-N 415.497 -0.158 50 10 HBGE COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816882906 PEFRLWIJZXUYTM-NSHDSACASA-N 402.411 -0.565 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1 1159212576 BDLMVQQQEDMFFJ-UHFFFAOYSA-N 401.470 -0.085 50 10 HBGE NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNC(=O)CC(F)(F)F)CC2=O)c1 1163247687 KOQQYJSMASONTN-MRVPVSSYSA-N 408.358 -0.213 50 10 HBGE CCO[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CN(C)C 1255186573 MPSSZOSZLQFQMB-LBPRGKRZSA-N 400.505 -0.110 50 10 HBGE C[C@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 1452256120 IUSNSHPALBNNMM-DWZYQQQCSA-N 415.443 -0.478 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCO[C@@H](CS(C)(=O)=O)C1 1473841092 CQSIZRVEVHFSKI-GFCCVEGCSA-N 419.887 -0.145 50 10 HBGE Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)CN3CCCC3=O)cc12 1635877459 CARSQBIDDMWBMY-SNVBAGLBSA-N 406.468 -0.169 50 10 HBGE CCOC(Cn1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cn1)OCC 1641364136 XKXRNJBPZFUGRM-UHFFFAOYSA-N 404.427 -0.132 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2cc(B(O)O)sn2)C1 2267062760 SQWDQTHOUPCNIN-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267388110 SSXFPMFIKSSCHN-QWRGUYRKSA-N 406.291 -0.612 50 10 HBGE CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1nn(C)cc1B(O)O 2282363953 RNLGROGMMWQGMD-OAHLLOKOSA-N 404.298 -0.682 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cnc(B(O)O)s1)[C@H](O)C(F)(F)F 2284130292 SFKZGPVDVCZVDK-SFYZADRCSA-N 413.183 -0.744 50 10 HBGE CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 753162016 YWGYBXCDFBBWFS-AWEZNQCLSA-N 421.520 -0.873 50 10 HBGE O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1cccnn1 1288359931 ATSLDSKXTKRQCB-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(C)C[C@H](O)CN2C)c1 1289966632 FLTLVVAKEVSTPX-KSSFIOAISA-N 412.512 -0.067 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)c1 1351144704 QEBJGNOTBBUDBL-UHFFFAOYSA-N 408.436 -0.017 50 10 HBGE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)c2C1 1456037988 LMYXGKJFMCWRMR-RHSMWYFYSA-N 418.498 -0.404 50 10 HBGE N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C[C@H]3CCCS3(=O)=O)CC2)c1 1460646858 XPXMIGZKHIQXQR-QGZVFWFLSA-N 419.507 -0.486 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@]2(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1 1587512168 CIDMJUXLKTVGSK-NVGCLXPQSA-N 417.484 -0.406 50 10 HBGE Cn1cc(/C=C/C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)c(=O)n(C)c1=O 1645022234 YYNJUKNYHRJIPN-NNNHXZLVSA-N 407.427 -0.746 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCCNC(=O)OCc1ccccc1 2255778278 PLFGFVCVOSETJV-UHFFFAOYSA-N 408.241 -0.420 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282073843 IAQFMQPXCHVOTK-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(B(O)O)n1C 2282865765 YPWNXEJUTJTSIR-GXSJLCMTSA-N 402.282 -0.915 50 10 HBGE O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)ccc1O 2282978738 QPIHKNWGJFOSDB-MRXNPFEDSA-N 414.223 -0.161 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCc1cc(B(O)O)ccc1F 704310646 PZZMVVHQRQSJBL-UHFFFAOYSA-N 420.227 -0.389 50 10 HBGE O=C(O)c1ccc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 745979389 OCDCWYSLTKABED-VIFPVBQESA-N 409.214 -0.128 50 10 HBGE O=C(NNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1)[C@H]1COCCO1 746002595 LBMODZKYUDXYDC-GFCCVEGCSA-N 418.497 -0.353 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC[C@@H](C(N)=O)O3)cc2)CC1 1151459458 OTICUQDQPMSORB-LSDHHAIUSA-N 411.484 -0.901 50 10 HBGE CO[C@@H]1COC[C@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1252315192 LUUXHBRWRVSZQI-ZIAGYGMSSA-N 414.488 -0.942 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H]3CC(=O)NC3=O)CC2)cc1 1294590665 OMCKQISIENAGOM-INIZCTEOSA-N 401.467 -0.687 50 10 HBGE COc1ccc(NC(=S)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cn1 1303284057 MPQPAMWKINLYFZ-VMFDRLBMSA-N 419.463 -0.041 50 10 HBGE CN(CCNC(=O)NNC(=O)c1ccc(=O)n(C)c1)S(=O)(=O)c1cccs1 1478253460 YOOMGALWPKZFNJ-UHFFFAOYSA-N 413.481 -0.289 50 10 HBGE CC(C)(C)OC(=O)N1CC(ONS(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2267381980 DCABIMGSDHMISX-UHFFFAOYSA-N 406.653 -0.151 50 10 HBGE Cc1ccnc(C(=O)NC[C@H]2CN(C(=O)OCc3ccccc3)CCO2)c1B(O)O 2281882308 AQZKHRWXLNRUAU-INIZCTEOSA-N 413.239 -0.163 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(F)cc1B(O)O 2282417912 KXTQZDYNXCIRFW-NWDGAFQWSA-N 400.237 -0.112 50 10 HBGE CN(C(=O)OC(C)(C)C)C1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)CC1 2282702355 GZICJAIJRVSKKJ-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE Cc1cnc2nc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)nn2c1 1446961632 OVLSPYNSRDWOBH-UHFFFAOYSA-N 403.262 -0.127 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2(C(=O)OC(C)(C)C)CCS(=O)(=O)CC2)cn1 1522791058 NLEXIDZQTMNJKH-UHFFFAOYSA-N 400.457 -0.282 50 10 HBGE Cn1cc(C(=O)NNC(=O)CS(=O)(=O)c2cccc(Br)c2)nn1 1584428042 QTAATMJMAZZEQR-UHFFFAOYSA-N 402.230 -0.188 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@@](F)(C(=O)NNC(=O)[C@H]2COCCO2)C1 1634838628 UZRCLWNIYYWYDE-DIFFPNOSSA-N 403.407 -0.475 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)NCC1CCC1 1644031172 SXTJCRKFMUGEKW-JTQLQIEISA-N 402.546 -0.001 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)sc1B(O)O 2267393331 XGGWTWZASGCTTC-ZJUUUORDSA-N 406.291 -0.693 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C 2282143966 REFFUSRPAFOJOO-JGFSIVIASA-N 402.282 -0.266 50 10 HBGE C[C@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282362566 HROYEZWAUIYKPN-CMPLNLGQSA-N 402.282 -0.976 50 10 HBGE CCc1nc(C(=O)NCCN(C[C@H](C)O)C(=O)OC(C)(C)C)c(B(O)O)s1 2282450902 ILLOHDBWVXODFQ-JTQLQIEISA-N 401.294 -0.267 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCCC1(NC(=O)OC(C)(C)C)CCC1 2282508037 PVPWDXOSWAZJIL-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE Cc1cc(S(=O)(=O)N[C@]2(CO)CCN(C(=O)OC(C)(C)C)C2)sc1B(O)O 2282725407 AWEFULNZMPELHB-OAHLLOKOSA-N 420.318 -0.613 50 10 HBGE O=C(N[C@H]1COCCN(C(=O)OCc2ccccc2)C1)c1ccc(B(O)O)cc1O 2282793324 ZNYMJXSVAZCCRL-MRXNPFEDSA-N 414.223 -0.161 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ncc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284060642 PSYZFGCAYIRLGO-DTWKUNHWSA-N 413.183 -0.744 50 10 HBGE O=C(O)[C@]1(NS(=O)(=O)c2sccc2B(O)O)CCN(Cc2ccccc2)C1 2284404364 XKUZYMWFGLCSBQ-INIZCTEOSA-N 410.282 -0.565 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(F)cc1B(O)O 2365422125 QHOJHVWXERLMJS-NSHDSACASA-N 406.241 -0.677 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cnn(C)c1 735444696 POYKQVNMWOJQPH-UHFFFAOYSA-N 407.452 -0.176 50 10 HBGE CSCC[C@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 744653342 WJBVBPDTSFLPBH-SYQHCUMBSA-N 413.496 -0.154 50 10 HBGE C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816886054 OARSEBNZUSHLGS-ZDUSSCGKSA-N 402.436 -0.787 50 10 HBGE 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CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267607036 HLOOITWDRRDDNN-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1S(=O)(=O)c1cscc1B(O)O 2267623646 LDSJYJMHEPFNEV-NXEZZACHSA-N 406.291 -0.924 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@H]1COCCN1Cc1ccccc1 2282341670 WDQLRNHBSYDOPF-INIZCTEOSA-N 410.326 -0.252 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2ccc(B(O)O)c(F)c2)COC1 2282428183 BVIVYPDJHIJYPS-UHFFFAOYSA-N 404.225 -0.923 50 10 HBGE CN(C[C@H]1CCCN1S(=O)(=O)c1c(B(O)O)cnn1C)C(=O)OC(C)(C)C 2282506245 POCMVWDSVCRSAJ-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NCc1cnc(NC(=O)OC(C)(C)C)s1 2282698720 DLZUDGKRGRAAFF-UHFFFAOYSA-N 417.278 -0.618 50 10 HBGE O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1)[C@@H]1COCCO1 746002840 NGVIFIPKMUQAEA-HNNXBMFYSA-N 412.468 -0.461 50 10 HBGE O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)[C@H]1CCc2nncn2C1 814334349 FPTPBHBCDPSPLO-LBPRGKRZSA-N 411.422 -0.143 50 10 HBGE Cn1ncc2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cnc21 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O=C(NNC(=O)c1nn2c(c1Br)CCC2)N[C@@H]1CCS(=O)(=O)C1 1597432970 UVNAWJPJHRMLFI-SSDOTTSWSA-N 406.262 -0.277 50 10 HBGE Cc1c(Br)cnc(O)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1625563954 NNRVDBQINWVDDZ-SSDOTTSWSA-N 407.246 -0.011 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(c2ncc(Br)cc2B(O)O)C1 2223677485 OMGBRXRUYMHCBG-MNOVXSKESA-N 416.081 -0.012 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CS(=O)(=O)C[C@H]1Oc1cc(B(O)O)c(Cl)cn1 2277609370 DXQCJIDKAZAYHV-WDEREUQCSA-N 406.653 -0.516 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282409117 MUOWQQPLJZZDCB-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282714776 WQZVPVCJECVESW-ZIAGYGMSSA-N 416.330 -0.004 50 10 HBGE CCNC(=O)COc1ccc(CNC(=O)NNC(=O)[C@@H]2COCCO2)cc1OC 745462287 LAQSGAPIPODRDL-HNNXBMFYSA-N 410.427 -0.544 50 10 HBGE CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)Cc2cn3ccccc3n2)C1=O 752022287 CGKOIAYTAFZKEA-BUXKBTBVSA-N 413.438 -0.072 50 10 HBGE O=C(C[C@@H]1NC(=O)NC1=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 764751422 AJPXGTUHFYHSSD-AWEZNQCLSA-N 422.873 -0.797 50 10 HBGE Cn1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(=O)n(C)c1=O 809246021 OVZCNXPBLIONPK-YVMONPNESA-N 420.809 -0.245 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)[C@H]1COc3ccccc3O1)CS(=O)(=O)CC2 1135312348 HUMUAFBHDPUYAF-CQSZACIVSA-N 406.420 -0.508 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCCN(CCN2CCOCC2)C1 1245971283 KOYSEICXAYRIQI-CVEARBPZSA-N 401.508 -0.835 50 10 HBGE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)NNC(=O)c1ccc(Cl)cc1 1440568623 BRLCYPTYWSBIPC-UHFFFAOYSA-N 404.876 -0.065 50 10 HBGE CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)c2ccc(B(O)O)cc2)CC1 1443845242 GWBLSBWWKWNSPF-UHFFFAOYSA-N 417.296 -0.768 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(CCN(C)C)C(=O)C2)cc1OC 1473607583 XRHCJGYVUJZQSN-UHFFFAOYSA-N 407.471 -0.829 50 10 HBGE O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)Cn1c(O)nnc1O 1587985716 NAGNISOTGFEXLR-UHFFFAOYSA-N 423.861 -0.692 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1OCC[C@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1624585807 RQMQWTDQXGUTQE-UTUOFQBUSA-N 405.473 -0.502 50 10 HBGE CCS(=O)(=O)NC1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC1 1656407029 IOINBSPQQWBRCJ-UHFFFAOYSA-N 403.530 -0.455 50 10 HBGE Cc1cc(B(O)O)c(CNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)s1 2221899229 HXGKYIALLVBASB-UHFFFAOYSA-N 422.293 -0.158 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(CNS(=O)(=O)c2sccc2B(O)O)C1 2267201256 LUEWPEJIXURQJN-BMIGLBTASA-N 402.303 -0.037 50 10 HBGE C[C@H](CCCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282082228 INDPWVUKFNALLC-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](O)(CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282327976 QJKDXHAKOMLMBU-OAHLLOKOSA-N 420.318 -0.781 50 10 HBGE Cc1cc(S(=O)(=O)N2CCOC[C@@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282359954 VLZNSMWNHUPYEW-NSHDSACASA-N 420.318 -0.349 50 10 HBGE CC(C)(C)OC(=O)NC1(CO)CCN(S(=O)(=O)c2sccc2B(O)O)CC1 2282698647 CUNZIKARWDENIR-UHFFFAOYSA-N 420.318 -0.532 50 10 HBGE O=S(=O)(c1sccc1B(O)O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2282701461 APHYCQMBPKOBPQ-HOTGVXAUSA-N 408.310 -0.298 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CN(S(=O)(=O)c2ccc(B(O)O)cc2)CCO1 2282707815 DJMVDPDNKBDIGW-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@](O)(CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2282714653 VFFPWGBBHDZNCO-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282720964 IYUDCRWLMZZRKR-GFCCVEGCSA-N 400.262 -0.337 50 10 HBGE Cc1cc(S(=O)(=O)N[C@H]2COC[C@H]2CNC(=O)OC(C)(C)C)sc1B(O)O 2282729606 PKYLYUHTQRBJGE-MNOVXSKESA-N 420.318 -0.446 50 10 HBGE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N(C)[C@H](C)c1nscc1B(O)O 2283945951 HPDYGCDZGHLZMI-KOLCDFICSA-N 403.266 -0.186 50 10 HBGE C=C(CS(=O)(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC)B(O)O 2289593420 QNTLSGHMWQYLSI-LBPRGKRZSA-N 408.282 -0.289 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NS(=O)(=O)c1ccc(F)c(B(O)O)c1 2359274244 LRCWVGQPVLPZIK-QCZZGDTMSA-N 400.237 -0.208 50 10 HBGE CC(C)[C@H](NC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)C(F)(F)F 787495078 PASVQVOSIGHQJA-JTQLQIEISA-N 419.364 -0.649 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NN(C)C[C@@H](C)O)ccc2F)CC1 1160985205 FJPGCVGMEJTEIP-GFCCVEGCSA-N 416.475 -0.364 50 10 HBGE C[C@@H](CO)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1299926571 VVKDODZQFFPRSJ-JSGCOSHPSA-N 407.514 -0.888 50 10 HBGE Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)ccc1=O 1598521588 WGXWVDALHOLOIQ-UHFFFAOYSA-N 406.420 -0.845 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@@](F)(C(=O)NNC(=O)[C@H]2CCC(=O)N2)C1 1630431511 HMQFJLXHOKIQGP-QGHHPUGFSA-N 400.407 -0.612 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1csnc1B(O)O)OCc1ccccc1 2255581724 QRFRILDXLOLPPU-UONOGXRCSA-N 405.241 -0.363 50 10 HBGE CN(CCOCCNS(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2267383333 XTGGEPKWKAKWPJ-UHFFFAOYSA-N 408.307 -0.410 50 10 HBGE Cn1nc(C(=O)N2CCOC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2281656873 RCUQVKXUOWYMPP-SECBINFHSA-N 402.644 -0.881 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 2282082931 FNVSRKMSSQYKBS-CYBMUJFWSA-N 402.278 -0.426 50 10 HBGE CC(C)(C)OC(=O)N1CCOCCN1S(=O)(=O)c1ccc(F)cc1B(O)O 2282367148 YGYBPOKPTDHOCH-UHFFFAOYSA-N 404.225 -0.322 50 10 HBGE C[C@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282707119 VCAWLGKURDMPOF-WPRPVWTQSA-N 414.236 -0.104 50 10 HBGE C[C@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1nn(C)cc1B(O)O 2284034829 FBHXAXQZIFQDRN-LLVKDONJSA-N 404.298 -0.681 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N2CCC(NC(=O)OCc3ccccc3)CC2)n1C 2337396123 IZLXBSNTMHZBQA-UHFFFAOYSA-N 400.244 -0.061 50 10 HBGE C[C@@H](NS(=O)(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(B(O)O)cc1 704374917 XIKZTIMJNLNSCX-GFCCVEGCSA-N 402.237 -0.357 50 10 HBGE CO[C@@]1(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CCS(=O)(=O)C1 1136529369 XPASKKOKIVUGLM-HNNXBMFYSA-N 403.482 -0.226 50 10 HBGE Cc1ccnn1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1160403362 DVWVDVHMPCAZDW-UHFFFAOYSA-N 407.452 -0.326 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC3(C)COC3)CC2)cc1 1182932181 ZDFKAQNHIWXENE-UHFFFAOYSA-N 424.523 -0.125 50 10 HBGE O=C1C[C@@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1 1248484213 CRASMPNNBPSNNP-CYBMUJFWSA-N 423.495 -0.059 50 10 HBGE O=C(Cc1ccccn1)NNC(=O)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1443728426 JTOLQHRLQUFTNZ-AWEZNQCLSA-N 412.855 -0.236 50 10 HBGE COc1ccc(NC(=O)c2cc(B(O)O)ccc2F)c(N2CCN(C(C)=O)CC2)n1 1631713199 FOVSSGDAPBJZQB-UHFFFAOYSA-N 416.218 -0.170 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C#N)c(Br)c1 1638300159 FXOVBFDACTYKRI-MRVPVSSYSA-N 419.257 -0.215 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cn1nc(C(F)(F)F)c2c1CCOC2 1641247478 ZMLNWMRZFJRLIC-SSDOTTSWSA-N 413.378 -0.940 50 10 HBGE COCCCS(=O)(=O)NCC(=O)NNc1nc(Br)cn2ccnc12 1641345628 XCBLGIIEZFYBLU-UHFFFAOYSA-N 421.277 -0.109 50 10 HBGE Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)c1B(O)O 2267022432 HJZWYOAPRRBWCF-HUUCEWRRSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282705567 ZROWKJKAUSTRHB-PWSUYJOCSA-N 420.318 -0.676 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C 2282733805 BIEVRJOSTKGGSE-GHMZBOCLSA-N 402.278 -0.045 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1B(O)O 2282733851 CJRLXBTYHSZWMH-LLVKDONJSA-N 406.241 -0.988 50 10 HBGE Cc1c(C(=O)N/N=C2/C(=O)N(CC(=O)O)c3ccccc32)nnn1-c1nonc1N 3637611 KLPIAYMPVWEGGD-LDADJPATSA-N 411.338 -0.894 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2nccn2Cc2ccccc2)n(C)c1=O 764819169 SWOPJHYMCAYDQV-UHFFFAOYSA-N 420.433 -0.171 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CCCN3C)CC2)cc1 766635857 HESMJHSDAANRLV-KRWDZBQOSA-N 423.539 -0.457 50 10 HBGE CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)[C@@H]2COCCO2)cc1 769475523 RHJSJJGLHWQCSG-ZDUSSCGKSA-N 401.366 -0.192 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1cnc2c(cnn2C)c1=O 795169775 XDLRXHVMXODJML-UHFFFAOYSA-N 405.440 -0.476 50 10 HBGE CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1287238504 OUELGVNOTIMTLS-IMJJTQAJSA-N 404.467 -0.045 50 10 HBGE Cc1nc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3cnn(C)c3)CC2)cn1C 1566296122 FDVLDLBHRQFMIF-OVCLIPMQSA-N 403.468 -0.098 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)nn1 1586153791 JHLVFDVWJHOWGH-UHFFFAOYSA-N 407.184 -0.365 50 10 HBGE Cn1cc([C@@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 1654356138 GAMHUMMJCLYWLP-PEGYKEAPSA-N 420.451 -0.105 50 10 HBGE Cn1cc([C@H]2C[S@@](=O)CCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1 1658523841 FVCHJQAVIFZLTL-HOLBHBGLSA-N 420.451 -0.105 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@@](C)(=O)=NC(=O)c2ncsc2B(O)O)C1 2266893304 HKGHXDIHKYEBSW-AREMUKBSSA-N 403.291 -0.072 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 2267610885 LEWMPXQVUKCGPN-KRWDZBQOSA-N 422.272 -0.821 50 10 HBGE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267719505 CVSPELOLHCVGLO-TXEJJXNPSA-N 402.303 -0.049 50 10 HBGE COCC[C@@H](CNS(=O)(=O)c1ccccc1B(O)O)NC(=O)OC(C)(C)C 2282103376 PVXAPTJBXAOUTI-LBPRGKRZSA-N 402.278 -0.426 50 10 HBGE Cc1nc(S(=O)(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)c(B(O)O)n1C 2282861236 LUEWTURDKYZIJY-UHFFFAOYSA-N 402.282 -0.866 50 10 HBGE N#C/C(=C/N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(=O)N(CCO)CCO 217121342 KUHLQOQTYBIBTL-VKAVYKQESA-N 402.451 -0.246 50 10 HBGE C[C@@H](C(N)=O)N(C(=O)[C@@H](N)Cc1ccccc1)[C@@H](CCCNC(=N)N)C(=O)CCl 642805912 ZVEUDSTZFJGUFE-QEJZJMRPSA-N 424.933 -0.301 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(N3CCCC3)nc2)n(C)c1=O 764811844 BSNDJJPEWOCCTI-UHFFFAOYSA-N 410.438 -0.421 50 10 HBGE Cn1nc(Br)cc1C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 782251256 CISCGUCHRUKLRO-UHFFFAOYSA-N 423.231 -0.920 50 10 HBGE CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)[C@H]1CCc3nncn3C1)C2=O 816885534 CAADYZKZZWSVAI-MLZJXEJWSA-N 417.470 -0.121 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(B(O)O)ccc1F 1135239089 JBQMPXFHQCDSFG-UHFFFAOYSA-N 408.220 -0.818 50 10 HBGE O=C(COc1ccccc1O)NNC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1 1464955477 WETHMRMGESMSPQ-AWEZNQCLSA-N 405.382 -0.223 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCCS2(=O)=O)c1 1623994217 SNTMFKTVGIQJBR-UHFFFAOYSA-N 418.497 -0.877 50 10 HBGE CCc1nn(C)c(C(=O)N[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2267019770 TVYVZKCQBUNCHQ-GJZGRUSLSA-N 400.244 -0.151 50 10 HBGE CN([C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)c1cscc1B(O)O 2267617774 QIISNWGONSHNCN-DDFAGTSDSA-N 402.303 -0.086 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267712624 GQJYMXUFCVKCRB-VHSXEESVSA-N 405.307 -0.312 50 10 HBGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1c(B(O)O)cnn1C 2282072794 JFAPXKOVLKKIMK-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2282166357 NWUAXMACTYEUCE-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CCC1 2282714002 LYSKQQKKWPDSPW-GFCCVEGCSA-N 402.282 -0.928 50 10 HBGE C[C@@H]1CC[C@H](CNC(=O)C(F)(F)F)N(S(=O)(=O)c2cscc2B(O)O)C1 2282725028 VBIOGPIVBWSRHE-RKDXNWHRSA-N 414.236 -0.104 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 744645368 RINWDYGVDGYWOO-WFASDCNBSA-N 415.443 -0.211 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccn(-c3ccccc3)n2)n(C)c1=O 766710485 BZLIKEJIXINEIB-UHFFFAOYSA-N 406.406 -0.230 50 10 HBGE Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)ccc1=O 1134637242 LMVUNZIPKTUNHA-FQEVSTJZSA-N 409.402 -0.460 50 10 HBGE COC(=O)[C@H]1C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1 1470899012 YFSLUTDQTNUYKS-JOCQHMNTSA-N 412.468 -0.102 50 10 HBGE COc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1 1624022678 FKYVYWBHOADBEO-UHFFFAOYSA-N 404.253 -0.478 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)[C@@H](O)C1 2267615380 BPUYTRWTXMEJAM-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE Cn1cc(C(=O)N=[S@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1 2281905528 BSQIUMRQMXGZKQ-GFVXYOJSSA-N 400.266 -0.653 50 10 HBGE C[C@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286860825 LRHISOZKNANIQF-CMPLNLGQSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NC(=O)c2cnsc2B(O)O)C1 2337398762 VADYPVDZYGBMEY-ZJJDNZPOSA-N 403.291 -0.024 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2362309754 TYRDOAXHEDCIIE-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(C(=O)N2CCOCC2)cc1 1125626933 SHFZOXDCJGRLIQ-UHFFFAOYSA-N 400.391 -0.057 50 10 HBGE COCCCNC(=S)N(C)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1F 1135649475 FPMYYXYHYVOOLU-ZDUSSCGKSA-N 413.475 -0.327 50 10 HBGE CC(C)(C)OC(=O)N1CC(n2cc(C(=O)NNC(=O)CN3CCCC3=O)nn2)C1 1152023761 RUQPIMMZPVEAED-UHFFFAOYSA-N 407.431 -0.547 50 10 HBGE O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 1318896301 ANYXZVYRUBSBPJ-BZUAXINKSA-N 422.507 -0.119 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=CCS(=O)(=O)C3)cc2)CC1 1446382826 AMAMEVJTTQAISZ-UHFFFAOYSA-N 414.509 -0.579 50 10 HBGE COC(=O)C1CC2(C1)C[C@H](NC(=O)NNC(=O)[C@H]1CCCO1)CCS2(=O)=O 1471538405 IWASFPOMOHWTBU-YZUGKSJVSA-N 403.457 -0.605 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN(C)Cc2nnc3n2CCNC3=O)cc1C 1473788538 NMVBDOOBWUOUET-UHFFFAOYSA-N 405.484 -0.153 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(N2CCOCC2)CC1 1566278578 IVHFLSYWXOXABR-UHFFFAOYSA-N 415.494 -0.543 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NS(=O)(=O)c1cscc1B(O)O 2267623881 POUNJZDPWZEFAL-GXSJLCMTSA-N 406.291 -0.754 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@H]1CNS(=O)(=O)c1ccc(B(O)O)cc1F 2282721657 UXRUEJUCDWMLPQ-LBPRGKRZSA-N 400.237 -0.041 50 10 HBGE Cc1csc(CNC(=O)[C@H](F)C2(O)CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2284054781 IYKPLMZNRGABOK-LBPRGKRZSA-N 402.253 -0.328 50 10 HBGE CC[C@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)C(=O)N1CCOCC1 792989778 MMIWNILZJHLFMU-HNNXBMFYSA-N 421.454 -0.119 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1 816873604 KUGKHDFKYUJAFE-WDEREUQCSA-N 410.431 -0.506 50 10 HBGE COC[C@]1(C(=O)NNC(=O)N2CCOCC2)CN(C(=O)OC(C)(C)C)CCO1 1464550093 SLIKKCWULUHLBD-KRWDZBQOSA-N 402.448 -0.288 50 10 HBGE CC[C@H](CO)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1545423887 FAMVTHJTHDXTHH-OAHLLOKOSA-N 412.512 -0.533 50 10 HBGE O=C(CCCc1nn[nH]n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566278366 AEFVVBJJLAFHLR-UHFFFAOYSA-N 400.443 -0.872 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COC2CCN(C)CC2)cc1 1654129006 CRPQCHVGSZLPNM-UHFFFAOYSA-N 412.512 -0.126 50 10 HBGE O=C(NC[C@H]1CCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1)C(F)(F)F 2267204230 BIGHSWCELQJXCJ-MRVPVSSYSA-N 400.209 -0.493 50 10 HBGE O=C(NC[C@@H]1CCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1)C(F)(F)F 2267204231 BIGHSWCELQJXCJ-QMMMGPOBSA-N 400.209 -0.493 50 10 HBGE CC(C)(C)OC(=O)N1CC(C2CN(S(=O)(=O)c3cscc3B(O)O)C2)C1 2267382032 DVIUBWZLPSXAQP-UHFFFAOYSA-N 402.303 -0.085 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NS(=O)(=O)c3sccc3B(O)O)[C@H]2C1 2267611886 WQQXCIDJFZNJKE-JBLDHEPKSA-N 402.303 -0.038 50 10 HBGE Cn1nc(C(=O)N[C@@H]2COC[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281655916 CWKCYVGBQVXJDK-RKDXNWHRSA-N 402.644 -0.977 50 10 HBGE C[C@H]1C[C@H](CNS(=O)(=O)c2c(B(O)O)cnn2C)CN1C(=O)OC(C)(C)C 2282081821 GARBAHUYYXXRCC-WDEREUQCSA-N 402.282 -0.976 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)CC1 2282085243 WBENGASMVBOTEV-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@H]2CC[C@H]1N(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282855148 ADEYGFGBISAGNG-MVWJERBFSA-N 417.318 -0.360 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@H]2CC[C@H]1N(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282855149 ADEYGFGBISAGNG-WCQGTBRESA-N 417.318 -0.360 50 10 HBGE Cc1nc(B(O)O)c(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)n1C 2362566699 NCNXGWRBCQXKCU-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1 804867094 GSJLTBXHMMAIDE-CYBMUJFWSA-N 423.499 -0.142 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@]3(C)C[C@@H](O)CN3C)cc2)CC1 1151459744 XMLSGBUKJHMPCM-CRAIPNDOSA-N 411.528 -0.479 50 10 HBGE C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCN(C)CC1 1479599071 VNGWCVWGGGKKFJ-HNNXBMFYSA-N 404.519 -0.341 50 10 HBGE CC(C)[C@H](C(=O)NNC(=O)CN1CCN(C)CC1)N1C(=O)c2ccccc2C1=O 1865759047 FOFWLWWFGHHRGB-QGZVFWFLSA-N 401.467 -0.298 50 10 HBGE CO[C@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282153587 WEOUCBIRCTYWSP-IUCAKERBSA-N 402.644 -0.883 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282363467 OAQVGMFLZCAFBC-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 2282737222 BLTMUNJPKLQMJE-QWHCGFSZSA-N 400.262 -0.755 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](C(=O)N=c2nc(B(O)O)[nH]s2)(C(F)(F)F)C1 2283947082 WEXFFNAHHOTXSA-LBPRGKRZSA-N 410.183 -0.232 50 10 HBGE COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734812000 LQOMPSJCHPTIFE-DUVNUKRYSA-N 424.479 -0.268 50 10 HBGE O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)[C@H]1COCCO1 744642815 FIIOMWWJGKCGMP-VXGBXAGGSA-N 403.482 -0.146 50 10 HBGE CCCc1nc(C)c(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)s1 765729823 HMCLRIYKJDOUEH-UHFFFAOYSA-N 419.467 -0.388 50 10 HBGE Cn1cc(-c2ccc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2)cn1 1344414598 BAHOEBIXMQXYLA-UHFFFAOYSA-N 420.433 -0.016 50 10 HBGE Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c1 1440580712 DCRYVQSFIHSOAO-KZNAEPCWSA-N 415.450 -0.246 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CC1 1463793770 VNXRWMSAJICXKA-LBPRGKRZSA-N 404.489 -0.879 50 10 HBGE COC1(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CS(=O)(=O)C1 1522791702 SATLCEWSHRCQGQ-UHFFFAOYSA-N 405.473 -0.406 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)[C@@H]2COCCO2)CN(C(=O)OC(C)(C)C)CCO1 1587237800 BJIQILWXUHPGHW-YVEFUNNKSA-N 403.432 -0.798 50 10 HBGE CO[C@@]1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCS(=O)(=O)C1 1597886620 SXDIJWCEFXJPAL-NSHDSACASA-N 419.319 -0.984 50 10 HBGE CC(C)NC(=O)c1cnn2c1C[C@H](CNC(=O)c1cc(B(O)O)ccc1F)CC2 1640391815 WZIZTEODWHLCRE-GFCCVEGCSA-N 402.235 -0.167 50 10 HBGE O=C(CCN1C(=O)CCNC1=S)NNC(=O)[C@@H]1C(=O)Nc2ccccc2C1=O 1641456730 SBISFGYHLIEBOB-ZDUSSCGKSA-N 403.420 -0.918 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)c1cc(Cl)c(B(O)O)s1 2255758357 JOPHRKBWINZAEE-SSDOTTSWSA-N 414.698 -0.755 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2281914077 AZISNEYTEAANLI-FLESLCNUSA-N 400.266 -0.512 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=[S@](C)(=O)CC1CN(C(=O)OC(C)(C)C)C1 2282251836 QWVWQFHRVAKZBH-HHHXNRCGSA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H](NS(=O)(=O)c2cscc2B(O)O)C1 2282368874 XJRWBAYWDMTZRQ-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE Cc1c(C(=O)NC2CC3(C2)C[C@H]3NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2282437314 GQYFNVNUQOVBJX-RDYUPDBUSA-N 412.255 -0.014 50 10 HBGE CN(CCCCN(C)S(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2282737340 DCPAMGZLKYPWSF-UHFFFAOYSA-N 404.298 -0.633 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1cnsc1B(O)O)OCc1ccccc1 2315645463 ORWMGWJEJBGGEB-ZIAGYGMSSA-N 405.241 -0.363 50 10 HBGE C[C@@H](NC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cc(B(O)O)cs1 2360551052 KBOPFBJCLQJMOW-MWLCHTKSSA-N 420.318 -0.457 50 10 HBGE CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2ccc(OC)cc2OC)CC1 755974370 MYXNTLATKAVOSI-UHFFFAOYSA-N 416.456 -0.043 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1ccc(S(N)(=O)=O)nc1 762738346 SSQPSKQCGBHRRK-UHFFFAOYSA-N 402.230 -0.095 50 10 HBGE C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3cnn(C)c3)CC2)C[C@@H](C)O1 1290837070 KGDMMBBZGYXHSI-GMLBEDANSA-N 422.511 -0.175 50 10 HBGE CN1C(=C(C#N)C(=O)CCC(=O)N2CC(NS(N)(=O)=O)C2)N(C)c2ccccc21 1586438426 VQJYUADMAURMIM-UHFFFAOYSA-N 418.479 -0.339 50 10 HBGE O=C(/C=C/CN1CCOCC1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1629793415 QNJCCNQJJLCHBI-QPJJXVBHSA-N 415.494 -0.520 50 10 HBGE O=C(NC[C@]12COCCN1C(=O)COC2)NNC(=O)c1nc2ccccc2s1 1675304134 SQJPJQHMWGDCIU-QGZVFWFLSA-N 405.436 -0.132 50 10 HBGE Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O 1686659217 ZBTIZOONFJXTCW-NSHDSACASA-N 407.452 -0.298 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NC(=O)c2ncc(B(O)O)cc2Cl)s[nH]1 2281871668 HEVMKMXKOIOJOA-UHFFFAOYSA-N 413.652 -0.035 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@H]1CNCCN1Cc1ccccc1 2282357213 HAJZZKPHFSXWBS-OAHLLOKOSA-N 409.342 -0.511 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NC(=O)c2cc(B(O)O)sn2)CC1 2282427923 XKVIPOXEKJSLMZ-MHZLTWQESA-N 418.306 -0.471 50 10 HBGE CC(C)(C)OC(=O)N1CCCO[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282700763 SLKXBNJPWPWKPN-LBPRGKRZSA-N 420.318 -0.268 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccccc1B(O)O 2282709024 UUIQTDCAYQTGOY-QWHCGFSZSA-N 416.330 -0.004 50 10 HBGE Cc1ccsc1[C@H]1C[C@H]1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 747974962 IBBLLUMCJXTCDC-WDEREUQCSA-N 416.463 -0.245 50 10 HBGE CN(CC(=O)NNC(=O)c1cc(Br)cn1C)[C@H]1CCS(=O)(=O)C1 914531817 GENMSKRIAOGXGW-JTQLQIEISA-N 407.290 -0.333 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c1 1534064198 CIHPDHSTMGORTK-ZDUSSCGKSA-N 412.468 -0.235 50 10 HBGE COC(=O)[C@H]1C[C@@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231658128 APIOVTYZFCDBCX-HUUCEWRRSA-N 401.184 -0.512 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2cscc2B(O)O)[C@@H](O)C1 2267382073 FMJBQUSDDZMEQZ-QWRGUYRKSA-N 406.291 -0.924 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)n1C 2267711710 OXHSERJNEQLWKQ-UONOGXRCSA-N 422.272 -0.856 50 10 HBGE C[C@@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)nn2C)CN1C(=O)OC(C)(C)C 2282087223 UAGMUKVFOBUQLJ-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2CNC(=O)OC(C)(C)C)cc1B(O)O 2282367649 FFOCINDIILWDHG-GXFFZTMASA-N 400.262 -0.434 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(O)CCCN(S(=O)(=O)c2cscc2B(O)O)C1 2282373684 PWXZAYXEWJDXCU-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE C[C@@]1(NC(=O)C(F)(F)F)CCN(S(=O)(=O)c2ccc(B(O)O)cc2Cl)C1 2282425531 QVEYVUDULQVCHQ-GFCCVEGCSA-N 414.598 -0.149 50 10 HBGE C[C@@H]1C[C@@H](NS(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282508578 YCPRYRQKILROEL-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2282712760 VPEYFZSNHADKMV-LLVKDONJSA-N 419.334 -0.743 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NCC1(F)CN(C(=O)OC(C)(C)C)C1 2282733603 YJCZHJXKGJKPRG-UHFFFAOYSA-N 402.253 -0.088 50 10 HBGE Cc1c(C(=O)N/N=C2\C(=O)N(CC(=O)O)c3ccccc32)nnn1-c1nonc1N 3637612 KLPIAYMPVWEGGD-PDGQHHTCSA-N 411.338 -0.894 50 10 HBGE CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)[C@H]3COCCO3)cc2)CC1 745464603 ZHWQDMCJRSEMLU-MRXNPFEDSA-N 405.455 -0.680 50 10 HBGE Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)N2CCOCC2)C1 745991696 DOOUPIFVBAILIC-ZDUSSCGKSA-N 415.472 -0.235 50 10 HBGE Cn1cc(C#N)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 751208005 LWIAGCAIVLPXIO-UHFFFAOYSA-N 417.447 -0.008 50 10 HBGE COC(=O)[C@]1(N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)CCOC1 1196263120 NBZACMFISDMICZ-FQEVSTJZSA-N 415.450 -0.731 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1Cc2ccc(Br)cc2C(=O)O1 1454277249 KAQVBALAJBCEAA-JTQLQIEISA-N 405.226 -0.277 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)c1cnn2c1S(=O)(=O)N(C)CC2 1538856535 SNZQLICFCKAUOP-UHFFFAOYSA-N 409.424 -0.634 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@H]1NC(=O)C(F)(F)F 2267387985 QVLROGCHIGKSDM-IONNQARKSA-N 400.209 -0.495 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(S(=O)(=O)c2sccc2B(O)O)CCO1 2282085759 CTSSFNHKQAFVIZ-JQWIXIFHSA-N 420.318 -0.269 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@H]1CON(C(=O)OC(C)(C)C)C1 2282356822 AUVUWIFMINZTLS-LLVKDONJSA-N 402.234 -0.796 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2nn(C)cc2B(O)O)C1 2282373696 PZCBKWRDXRYCSQ-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC(CCCNC(=O)OC(C)(C)C)C1 2282702555 KFKUBLWBYGGMSS-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)c1ccc(B(O)O)c(F)c1)C2 2282741308 MGJZUYQVOVDEAN-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE COC(=O)/C=C/c1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 747602500 SRIUACPNHJMGEN-RPTYSRGTSA-N 402.450 -0.383 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)cc1F 793352080 FMQLFUVGADRIHE-SECBINFHSA-N 408.429 -0.335 50 10 HBGE Cc1ccc(C(=O)NNC(=O)[C@H]2CCC(=O)N2)cc1S(=O)(=O)N1CCOCC1 1131507647 CKVOERJCXQCCOH-CYBMUJFWSA-N 410.452 -0.944 50 10 HBGE CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(Cl)c1 1135771375 JIYUYWIUORMAGK-QMMMGPOBSA-N 409.873 -0.093 50 10 HBGE CCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(=O)n(C)c3)cc2S1(=O)=O 1439795074 LPIXSJVBMWQMJU-UHFFFAOYSA-N 404.404 -0.376 50 10 HBGE CO[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCOC1 1445568629 XLZVRTIEEZPLAX-WMZOPIPTSA-N 404.467 -0.357 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)N1 1461838129 PBYIMSMQCVRZJX-RKDXNWHRSA-N 420.900 -0.019 50 10 HBGE CCOC(=O)c1ncn(C2CCN(C(=O)c3cc(B(O)O)ccc3F)CC2)c1N 1466859598 JHYODGDRBMZYCL-UHFFFAOYSA-N 404.207 -0.062 50 10 HBGE C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@H](C)S(C)(=O)=O 1624128186 SWYKYKMQSNDZCB-ZJUUUORDSA-N 405.336 -0.118 50 10 HBGE Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cnc21 1646040249 YBFKLGIGIWOBSR-CYBMUJFWSA-N 402.411 -0.952 50 10 HBGE NC(=O)C1CCN(c2ccc(CNC(=O)NNC(=O)[C@H]3COCCO3)cc2)CC1 1684169037 ILUCYCQTCCVQIR-MRXNPFEDSA-N 405.455 -0.366 50 10 HBGE Cc1cc(B(O)O)ccc1S(=O)(=O)NC1CN(C(=O)OCc2ccccc2)C1 2255890226 MTYBLRMPJQSZHG-UHFFFAOYSA-N 404.253 -0.026 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2CN(S(=O)(=O)c3cc(B(O)O)cs3)C[C@H]2C1 2267201927 VPLPNNAGAIJIOY-PHIMTYICSA-N 402.303 -0.085 50 10 HBGE C[C@@H](CCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)Cc1ncsc1B(O)O 2267372354 NCAGFEPICBOISC-JTQLQIEISA-N 407.323 -0.112 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N[C@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2281909618 RZYDNTXQBABSBP-HOTGVXAUSA-N 416.243 -0.604 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COCCN1S(=O)(=O)Cc1ccsc1B(O)O 2282352493 PAMPHTQSZFBBKO-LBPRGKRZSA-N 420.318 -0.517 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282383972 GVIGNKMCUPSJLP-GHMZBOCLSA-N 419.334 -0.064 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2282384871 RXCJOENZENURSA-PWSUYJOCSA-N 417.318 -0.406 50 10 HBGE O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(B(O)O)s1 2282716474 VBHXATUYGRENGT-HNNXBMFYSA-N 410.326 -0.003 50 10 HBGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765726870 HBVIEXVTRRHRQV-FLIBITNWSA-N 414.397 -0.176 50 10 HBGE Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1 794064386 CQKBMGRDJGMTQL-FQEVSTJZSA-N 416.434 -0.018 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CN(C(=O)NNC(=O)[C@H]3COCCO3)CCO2)C1 814371256 LQJJRBVXBXSEOW-GFCCVEGCSA-N 400.432 -0.536 50 10 HBGE Cc1[nH]nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1I 1135990036 GQLGCOVXNHTWKU-ZCFIWIBFSA-N 412.209 -0.482 50 10 HBGE COC(=O)[C@@H]1CCCN(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O 1136529052 JWNVZCPMEBTRTO-OAHLLOKOSA-N 424.479 -0.018 50 10 HBGE Cn1cc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)nn1 1531950545 QOKVOFUOXDXIBX-UHFFFAOYSA-N 412.403 -0.950 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)N1 1533744214 GKEBMOCAKPUDGH-CYBMUJFWSA-N 412.443 -0.348 50 10 HBGE CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)c1 1681326021 RIUQKQIOMSMQPH-UHFFFAOYSA-N 407.452 -0.220 50 10 HBGE CC(C)(C)OC(=O)NC1[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]12 2267377054 FGMXKMMXLTWKNY-RKDXNWHRSA-N 403.291 -0.892 50 10 HBGE O=C(NCC1CN(S(=O)(=O)c2ccc(B(O)O)cc2Cl)C1)C(F)(F)F 2267386353 SGBXRPYUUARQTJ-UHFFFAOYSA-N 400.571 -0.681 50 10 HBGE Cc1nn(C)c(C(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)c1B(O)O 2267397221 CMJAWWUISVIVLY-LJQANCHMSA-N 400.244 -0.061 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2281919934 LEIFDUBMWNFFQV-HHHXNRCGSA-N 402.282 -0.312 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@H]1CO 2282709576 YBNKVEOLROTUAL-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE O=C(O)[C@H](COCc1ccccc1)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2284400908 CLIREPXPSHKWNT-AWEZNQCLSA-N 413.644 -0.032 50 10 HBGE C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)C1 745999442 XQBJPJQMEBXYBY-PMPSAXMXSA-N 411.503 -0.545 50 10 HBGE CN(NC(=O)C1=CCS(=O)(=O)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1138054030 UTHBGYAJSHAIKA-UHFFFAOYSA-N 402.473 -0.023 50 10 HBGE CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)[C@@H]1COCCO1 1354837555 XZSXEBYIZJFQRE-YPMHNXCESA-N 400.457 -0.458 50 10 HBGE C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCC(=O)N1 1465791349 CXXYDACEJYZPMK-ZBFHGGJFSA-N 401.467 -0.494 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc(CO)n1 1566278837 UAISUGMDOPJARH-UHFFFAOYSA-N 403.464 -0.146 50 10 HBGE CN1C(=O)[C@H](O)[C@H](C(=O)NNc2cc(Br)ncn2)[C@H]1c1cnn(C)c1 1633908986 JXMWHTQNDNOUKM-IJLUTSLNSA-N 410.232 -0.394 50 10 HBGE CON(C)C(=O)[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1683125684 YDXMGDAOSBTEDM-LBPRGKRZSA-N 415.472 -0.646 50 10 HBGE CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)C(F)(F)F)N1C(=O)c2ccccc2C1=O 1923918183 VPROAFSQPLFUEP-JTQLQIEISA-N 421.353 -0.204 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)Cc1cccc(B(O)O)c1 2282348746 OWGFPCHJAZGWCL-INIZCTEOSA-N 402.278 -0.939 50 10 HBGE CN1CCN(S(=O)(=O)c2cscc2B(O)O)[C@@H](CNC(=O)OC(C)(C)C)C1 2282359024 HXDRKBAUMQXJMU-NSHDSACASA-N 419.334 -0.743 50 10 HBGE 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O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1464441693 FFDOPINSVSQQBG-CYBMUJFWSA-N 405.436 -0.572 50 10 HBGE O=C(NCC[C@@H]1CCCS1(=O)=O)NNC(=O)c1csc(N2CCOCC2)n1 1471204372 PCEUNFWELXGLDH-NSHDSACASA-N 417.513 -0.109 50 10 HBGE CS(=O)(=O)c1ccc(CCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 1543753137 OWQKBKMVHHHBHZ-GFCCVEGCSA-N 403.482 -0.460 50 10 HBGE CCn1nc(C(=O)NNC(=O)NCCC2CS(=O)(=O)C2)c2ccccc2c1=O 1564573409 LGRDAYGLAVFJCQ-UHFFFAOYSA-N 407.452 -0.205 50 10 HBGE C[C@]1(C(=O)N2CCN(CC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)C[C@@H]1Br 1629842284 YZTAKFZUVFPRRG-HUBLWGQQSA-N 422.345 -0.393 50 10 HBGE COCCOCC(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C 1635057208 MRMZYLCUWHTQBZ-UHFFFAOYSA-N 402.455 -0.012 50 10 HBGE CCS(=O)(=O)c1cnc(O)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1 1648397465 XDIMHAJYCACRND-RYUDHWBXSA-N 414.484 -0.159 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267615167 YVBXKUXZCBSJHQ-ZJUUUORDSA-N 406.291 -0.612 50 10 HBGE 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414.236 -0.184 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(B(O)O)cs2)[C@H](S(C)(=O)=O)C1 2282388044 LUZPWMUQEGOOFT-CMPLNLGQSA-N 418.302 -0.810 50 10 HBGE COCC1(NS(=O)(=O)Cc2ccsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282737953 NLTNBHNZNJJEQZ-UHFFFAOYSA-N 420.318 -0.517 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282849693 FRDZNWSCHBVSGA-JGVFFNPUSA-N 415.224 -0.958 50 10 HBGE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1 805044151 HRWHKUKCFYZRBF-NSHDSACASA-N 417.513 -0.378 50 10 HBGE Cn1cc(C(=O)NNC(=O)NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)nn1 1253263563 SPDMYOVZHCQSQD-LLVKDONJSA-N 409.447 -0.072 50 10 HBGE O=C(Cn1ccc(Br)cc1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1292039395 XZJFRZJJPBBIFQ-VIFPVBQESA-N 407.246 -0.872 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1558926939 BVCRSGLEBCXKIA-GARJFASQSA-N 410.468 -0.333 50 10 HBGE C[C@@]1(NNC(=O)N[C@@H]2CCCN(CCN3CCOCC3)C2)CCS(=O)(=O)C1 1565265769 WRWZJVOSHDKYLC-NVXWUHKLSA-N 403.549 -0.836 50 10 HBGE Cc1c(C(=O)N(C)[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)nn(C)c1B(O)O 2267357543 ARDKDORBPOQBOI-LSDHHAIUSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[S@@](=O)(=NC(=O)c2nscc2B(O)O)C1 2267361924 KEFPTTVWDULGKC-BGGANLFTSA-N 403.291 -0.024 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ncsc2B(O)O)[C@H]2C[C@H]21 2267624976 IDKVSFGLWUTYTK-MNOVXSKESA-N 403.291 -0.654 50 10 HBGE CC(C)(C)OC(=O)NC[C@]12C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2288262445 ZQTFGYWVZYOYBO-BONVTDFDSA-N 417.318 -0.501 50 10 HBGE CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1 59883954 DDGKLOUMCMVULT-JYMRLUDQSA-N 409.476 -0.296 50 10 HBGE COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC(=O)N2C)cc1 734812002 LQOMPSJCHPTIFE-JGGQBBKZSA-N 424.479 -0.268 50 10 HBGE O=C(CN1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1)NCc1ccccc1 746003668 QYDKMJIBLAIDFI-INIZCTEOSA-N 405.455 -0.923 50 10 HBGE CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)NNC(=O)[C@H]1COCCO1 746004642 WUTFQFKWOYCVID-OAHLLOKOSA-N 415.468 -0.053 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccc3c(n2)CCCC3)n(C)c1=O 750628992 ZFPYDDBPBMVQEK-UHFFFAOYSA-N 411.422 -0.831 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)Cc2ccc(Cl)c(F)c2)n(C)c1=O 790557722 MEXQHGPYRYKUTE-UHFFFAOYSA-N 422.804 -0.384 50 10 HBGE O=C(N=c1cc[nH]cc1)NNC(=O)[C@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 1448300580 MMOWZHSKSXJPSF-GDBMZVCRSA-N 401.398 0.000 50 10 HBGE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(CC(=O)NNC(=O)c1ccc(F)cc1)C2 1460921641 BHXNSJSSIXEUMV-AWEZNQCLSA-N 403.418 -0.541 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCCO1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1468454569 WTOFXSQFXCIESA-STQMWFEESA-N 405.860 -0.304 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@]3(C)CCOC3=O)nc2)CC1 1639048102 RMRDBXTUOWSBNO-MRXNPFEDSA-N 412.472 -0.651 50 10 HBGE CCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@@H](C)OCCOC)c1 1683042638 VLSXKHSYSYMHNU-GFCCVEGCSA-N 402.473 -0.133 50 10 HBGE C[C@H](CCNS(=O)(=O)Cc1ncsc1B(O)O)N(C)C(=O)OC(C)(C)C 2267715005 QNQDPYMSBYHMIB-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CC[C@@](C)(CNC(=O)OC(C)(C)C)C1 2282076560 JZFBNCYUFMMORF-HNNXBMFYSA-N 402.282 -0.975 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1 2282241451 RYWKICUDIRCQFG-JGFSIVIASA-N 400.266 -0.653 50 10 HBGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2282334079 WYPFWWPNKMQQET-MNOVXSKESA-N 419.334 -0.255 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCCCCNC(=O)OC(C)(C)C 2282355819 LKIKWAIQGIJSRI-UHFFFAOYSA-N 402.278 -0.042 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(S(=O)(=O)Cc3ncsc3B(O)O)[C@H]2C1 2282737900 MXACTGAELMINHJ-JQWIXIFHSA-N 417.318 -0.406 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282741665 QSDCZFGXMYUNKB-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE CO[C@H]1CN(S(=O)(=O)Cc2ccsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2282849606 DPOONAIVBGJWTI-NEPJUHHUSA-N 420.318 -0.518 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@](C)(O)Cn2ccccc2=O)c2ccccc2c1=O 790463729 XDUGAERRSYLWEH-HXUWFJFHSA-N 411.418 -0.210 50 10 HBGE O=C(NNC(=O)[C@H]1COCCN1CC(F)(F)F)[C@@H]1C(=O)Nc2ccccc2C1=O 1298495346 YLOBKJQEYKMKAD-NEPJUHHUSA-N 414.340 -0.152 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccn2ncc(Br)c12 1610347007 GJVIZTXWYWOXRP-SSDOTTSWSA-N 404.246 -0.205 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N(C)[C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1 2267425223 NCLLTFCIYLXZAI-LSDHHAIUSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2cncc(B(O)O)c2)CC1 2282102098 JHJFZQOWZRHNJG-UHFFFAOYSA-N 419.290 -0.831 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)CCN(CCO)C(=O)OC(C)(C)C 2368525342 JEGIMJFBONDJNY-LLVKDONJSA-N 401.294 -0.038 50 10 HBGE CCn1cnc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 753069305 SMDQGZYGBNTISI-UHFFFAOYSA-N 415.497 -0.158 50 10 HBGE Cc1nn(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(=O)o1 1465797221 VSSKSKAFGYGELE-UHFFFAOYSA-N 422.873 -0.237 50 10 HBGE Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)nn1 1528541735 OZAFMDSHCZNYFQ-LLVKDONJSA-N 410.431 -0.184 50 10 HBGE O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)c1cc(B(O)O)ccc1F 1627734710 AXFKPVWRSJUVKY-UHFFFAOYSA-N 405.279 -0.040 50 10 HBGE COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=O)CS(C)(=O)=O 1634355314 IRNHYQPAJHHUCU-GFCCVEGCSA-N 417.509 -0.261 50 10 HBGE O=C(NC[C@H]1COCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 1637902702 HSYAETARDAYBPR-ZDUSSCGKSA-N 414.440 -0.976 50 10 HBGE Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnn(CCN2CCOCC2)c1 764406748 DVUFRUIIGQQGMC-UHFFFAOYSA-N 414.466 -0.148 50 10 HBGE C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)[C@H]1CCc2nncn2C1 816873603 KUGKHDFKYUJAFE-QWRGUYRKSA-N 410.431 -0.506 50 10 HBGE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NNC(=O)Cc1cn2ccccc2n1 1525023093 IYUNBVHWDUZDRI-UHFFFAOYSA-N 402.455 -0.166 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)c1 1538534907 QVJYRTXFYKCBCC-ZUMXRPEOSA-N 423.447 -0.582 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(c3cnn(C)c3)=NO2)c1 1623993249 JMIFMLJCYGUNQK-HNNXBMFYSA-N 420.451 -0.375 50 10 HBGE C[C@H](O)CN(C)NC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1629362855 VICKTGJLZIQFME-JSGCOSHPSA-N 407.514 -0.888 50 10 HBGE C[C@@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CS1(=O)=O 1674203351 BLESCDSRKRTIRY-PWSUYJOCSA-N 403.482 0.000 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)c1ncc(Br)cc1B(O)O 2217199441 CUDBEJNXEHADDT-JTQLQIEISA-N 404.070 -0.154 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 2282066011 PTUNGTCWWMUGIA-GHMZBOCLSA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1cccc(B(O)O)c1 2282330117 VMJPPCSEAGDLKG-KGLIPLIRSA-N 400.262 -0.922 50 10 HBGE O=C(N[C@@H]1C[C@H]2CC[C@H]1N(S(=O)(=O)c1cscc1B(O)O)C2)C(F)(F)F 2282367805 HVRWUFIHFLPJQY-SZEHBUNVSA-N 412.220 -0.352 50 10 HBGE O=S(=O)(Cc1ncsc1B(O)O)N1C[C@H]2CCN(Cc3ccccc3)[C@H]2C1 2282384365 LXMBPODAHCZFAC-ZBFHGGJFSA-N 407.326 -0.141 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NS(=O)(=O)c2sccc2B(O)O)CCO1 2282699451 KFCOVCNFAMVQRE-QWRGUYRKSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CC12CC(NS(=O)(=O)Cc1ncsc1B(O)O)C2 2282741562 PKUPERFLFSGYEA-UQACVICXSA-N 417.318 -0.312 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCCN(C(=O)OC(C)(C)C)CCC2)n1 2282741797 SPKVDYGKZXCFMD-UHFFFAOYSA-N 402.282 -0.879 50 10 HBGE COC(=O)[C@H](CC(=O)NCc1sc(C)cc1B(O)O)NC(=O)OC(C)(C)C 2284011468 NHRZDKBTJRURBH-NSHDSACASA-N 400.262 -0.191 50 10 HBGE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1cccc(B(O)O)c1 2285412547 HBDGTNTXDYNVJB-LBPRGKRZSA-N 402.278 -0.737 50 10 HBGE O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1COCCOC1 813817637 GQHAESJFWUXFQP-UHFFFAOYSA-N 412.468 -0.170 50 10 HBGE COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccnnc1 1162155092 ZSVWUBJFYKVBME-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc(B(O)O)ccc1F 1453076374 QJFJMZAJPDHVGW-UHFFFAOYSA-N 406.244 -0.330 50 10 HBGE Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)[C@H]3CCN3C3CCOCC3)cc2=O)n1 1456039207 STEWEDVDZAZODC-OAHLLOKOSA-N 415.454 -0.413 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)CS(=O)(=O)CC2 1532226978 QAOUQFSMMXSSIC-UHFFFAOYSA-N 413.500 -0.406 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)C1 1568935712 FBCHBKORHRGHLQ-LBPRGKRZSA-N 419.500 -0.158 50 10 HBGE Cc1nc(S(=O)(=O)NCC(=O)NNc2cc(Br)ncn2)cn1C 1633904718 LNKZJHAEPDGLNC-UHFFFAOYSA-N 404.250 -0.297 50 10 HBGE Cc1c(C(=O)N(C)[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)nn1C 2267022750 LBVOISWRUAWAFC-GJZGRUSLSA-N 400.244 -0.062 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@](CO)(NS(=O)(=O)c2cc(B(O)O)cs2)C1 2267610570 HEONGPHFGFYYTE-CQSZACIVSA-N 406.291 -0.922 50 10 HBGE CC(C)[C@@H](CNS(=O)(=O)Cc1ncsc1B(O)O)NC(=O)OC(C)(C)C 2267626753 NJBQNPDVRJDGIE-SNVBAGLBSA-N 407.323 -0.208 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2282074144 RYQRTOUMSUDQOF-GHMZBOCLSA-N 402.282 -0.786 50 10 HBGE Cc1cc(S(=O)(=O)NCCOCCN(C)C(=O)OC(C)(C)C)sc1B(O)O 2282353344 GQUUSFGLINPRRC-UHFFFAOYSA-N 422.334 -0.102 50 10 HBGE C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)C1=O 790325953 UHWCWOZVYLLQCM-ZFWWWQNUSA-N 400.391 -0.317 50 10 HBGE C/C=C\[C@H](O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1463715058 AIJJBHJUROPDOD-YPQKKHBXSA-N 411.480 -0.276 50 10 HBGE CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1 1471977167 IGQYANWWIDOMJP-JKSUJKDBSA-N 416.544 -0.019 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)c1cncn1-c1ccccc1)c1cccc(F)n1 1540402805 AELSYYBMQUXXKI-AWEZNQCLSA-N 412.381 -0.042 50 10 HBGE CN(C)N(C(=O)CSc1ccc(S(N)(=O)=O)cc1)[C@H]1CCS(=O)(=O)C1 1570070768 BLKKQRMFMCJQEP-NSHDSACASA-N 407.539 -0.082 50 10 HBGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1624175831 OAPLFWOEWXQVPB-NSHDSACASA-N 408.461 -0.207 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)CS(C)(=O)=O)cc1 1642619537 MEJIVXVSBAOZHL-UHFFFAOYSA-N 419.525 -0.158 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2ccc(B(O)O)s2)CCOC1 2267203281 OFNQIHRZZNLTOQ-AWEZNQCLSA-N 406.291 -0.610 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626561 KFUAAWMAKUFQGA-ZJUUUORDSA-N 405.307 -0.454 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1sccc1B(O)O 2281753072 DKHCGJYGNCUTFO-UHFFFAOYSA-N 402.278 -0.284 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(NS(=O)(=O)c3sccc3B(O)O)CO[C@H]1C2 2282084107 NDMFBGJOELNVRO-ZETOZRRWSA-N 418.302 -0.469 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@@H](NC(=O)C(F)(F)F)[C@H]2C)sc1B(O)O 2282361315 PATZPVNTZPGEPD-RKDXNWHRSA-N 414.236 -0.044 50 10 HBGE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1c(Cl)cccc1B(O)O 2282424823 HMYIEKJXDUQCQA-JTQLQIEISA-N 422.696 -0.474 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NS(=O)(=O)c2sccc2B(O)O)CCO1 2282699447 KFCOVCNFAMVQRE-GHMZBOCLSA-N 420.318 -0.222 50 10 HBGE Cc1cc(S(=O)(=O)N2CCC[C@H](NC(=O)C(F)(F)F)CC2)sc1B(O)O 2286112319 NLAUABHRKGLBFC-VIFPVBQESA-N 414.236 -0.042 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N(C)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)n1C 2337401949 QOXRPMFWZGWARC-OAHLLOKOSA-N 400.244 -0.109 50 10 HBGE CN(C)S(=O)(=O)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 785011987 IHVSXYTVTNGZOJ-UHFFFAOYSA-N 418.497 -0.877 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)n(C)c1=O 802762875 OXTAYZMCFUKYHS-BDAKNGLRSA-N 416.360 -0.440 50 10 HBGE Cn1ncc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1 807567138 LMDMEZCDHVOLEE-UHFFFAOYSA-N 407.456 -0.256 50 10 HBGE COc1ccc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1S(=O)(=O)NC1CC1 1157836956 ROZBUEWPJNYQBY-UHFFFAOYSA-N 420.447 -0.091 50 10 HBGE COc1cccc(S(C)(=O)=O)c1NNC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 1342713973 RTGODEVMTOYCGS-CMDGGOBGSA-N 408.436 -0.347 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3c(O)ncnc3O)CC2)cc1 1629797686 WSJOYPGJIYMHPQ-UHFFFAOYSA-N 414.466 -0.296 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@@H]2CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201566 QFKZBCLFMYOOBT-YUSALJHKSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNS(=O)(=O)c1ccc(B(O)O)s1 2267208521 YSWAWZCTNHPFIL-GARJFASQSA-N 402.303 -0.038 50 10 HBGE CN(C)[S@@](=O)(=NC(=O)C1(B(O)O)CC1)N1CCN(C(=O)OC(C)(C)C)CC1 2282295763 QIHYQTBZZRARJF-MHZLTWQESA-N 404.298 -0.068 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282363453 HDCVQSVTMZJJSY-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282380402 IRAUIHSTVCOBHA-QWRGUYRKSA-N 417.318 -0.406 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)c2cccc(B(O)O)c2)C1 2282704172 HFAYZSLBDVQGLD-ZIAGYGMSSA-N 400.262 -0.985 50 10 HBGE C[C@H]1[C@@H](C)N(S(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282719475 MRNREYBQZNHMHS-WDEREUQCSA-N 402.282 -0.882 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)[C@@H](F)C1 2282736484 RHLUIXQXKIFHPG-UWVGGRQHSA-N 423.297 -0.410 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(S(=O)(=O)Cc3ncsc3B(O)O)[C@@H]2C1 2282737899 MXACTGAELMINHJ-CMPLNLGQSA-N 417.318 -0.406 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 1290349522 SULXODPHUIEFSP-VXGBXAGGSA-N 404.489 -0.880 50 10 HBGE CCOC(=O)C[C@@H](O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 1446382906 AROUEOXWUHQHJU-OAHLLOKOSA-N 414.484 -0.620 50 10 HBGE CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NN(C)C[C@@H](C)O 1556926197 JZYAMVHKJTXHSP-CQSZACIVSA-N 414.528 -0.021 50 10 HBGE C[C@H](NC(=O)Cn1cnnn1)C(=O)NNc1ccccc1I 1589724058 XGSGPYWKVDBOOV-QMMMGPOBSA-N 415.195 -0.074 50 10 HBGE CN(C)c1ccc(NC(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1 1637742471 ANHNJUAETDPSRJ-SFHVURJKSA-N 406.443 -0.284 50 10 HBGE CC(C)(C)OC(=O)NCc1nnc(NS(=O)(=O)c2cscc2B(O)O)o1 2267416485 PYLAWLZIOQFLSG-UHFFFAOYSA-N 404.235 -0.364 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CO)CCCN(S(=O)(=O)c2sccc2B(O)O)C1 2282069168 MMSKGZDQTKMPMS-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](F)CN1S(=O)(=O)c1ccccc1B(O)O 2282091043 DHTXDNRREUPZEE-NWDGAFQWSA-N 402.253 -0.008 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H](C)C1(O)CN(C(=O)OC(C)(C)C)C1 2282360740 HDCQVISVZXAZLV-JTQLQIEISA-N 420.318 -0.615 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)n1 2282371605 LXOMFPQXTZLMIC-NSHDSACASA-N 402.282 -0.976 50 10 HBGE CN(CCOCCN(C)S(=O)(=O)c1cscc1B(O)O)C(=O)OC(C)(C)C 2282378408 FYMPZXVAEXAXQV-UHFFFAOYSA-N 422.334 -0.068 50 10 HBGE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282407639 AODTWUGQHDJQSA-OAHLLOKOSA-N 422.696 -0.426 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC1(C(=O)O)CN(C(=O)OC(C)(C)C)C1 2282727362 HTKXWYJUWZYUMG-UHFFFAOYSA-N 420.274 -0.911 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COCCN2S(=O)(=O)c2cscc2B(O)O)C1 2282728612 UBEAGNJFTYNTCA-UHFFFAOYSA-N 418.302 -0.562 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@@H](B(O)O)C2)S(=O)(=O)C(C)(C)C1 2368347307 BKRWNBSMFHLWQU-VXGBXAGGSA-N 404.294 -0.126 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 758043417 HJYXZKWBJFYCGM-DTWKUNHWSA-N 404.395 -0.597 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CC3)cc2)CC1 763562133 LBGMZTJSEQDONW-UHFFFAOYSA-N 409.468 -0.881 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)CC1 764144058 TXTAFDDJEIUZJI-UHFFFAOYSA-N 423.495 -0.491 50 10 HBGE CN(NC(=O)CS(=O)(=O)N(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 776201154 FZOATUDZFXTRBB-UHFFFAOYSA-N 407.493 -0.487 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H](F)Cc2ccccc2)n(C)c1=O 777993273 FONGFOJLSPFARL-LBPRGKRZSA-N 402.386 -0.838 50 10 HBGE CS(=O)(=O)NC[C@@H]1COCCN1CC(=O)NNC(=O)c1cccc(Cl)c1 1460567021 PJMDKYHVXPEYTH-CYBMUJFWSA-N 404.876 -0.649 50 10 HBGE CN(C)S(=O)(=O)N1CC(NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1 1470965223 PIVOJGQBFVAGLF-UHFFFAOYSA-N 409.266 -0.788 50 10 HBGE O=C(NNC(=O)[C@@H]1C[C@H]2C=C[C@H]1O2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1654138389 JGDBGOUWQGXVCG-FVQBIDKESA-N 407.448 -0.188 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NCCc1cccc(B(O)O)c1 2121790142 RQRCTLNYDSNRAX-UHFFFAOYSA-N 416.264 -0.485 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267212900 YXBNYNGOSIYCTO-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE O=C(N[C@@H]1[C@H]2C[C@H]1N(S(=O)(=O)c1cncc(B(O)O)c1)C2)OCc1ccccc1 2267214586 SGHXWQFMRPWNJT-IAOVAPTHSA-N 417.252 -0.551 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(B(O)O)n1C 2267711709 OXHSERJNEQLWKQ-KGLIPLIRSA-N 422.272 -0.856 50 10 HBGE Cn1ncc(B(O)O)c1C(=O)N=S1(=O)CCC(NC(=O)OC(C)(C)C)CC1 2281634079 MSHUZXPHQJMREC-UHFFFAOYSA-N 400.266 -0.605 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)n1 2282251254 JJXBVNUSNDSTEO-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNC(=O)c1cc(B(O)O)c(Cl)s1 2282383740 DAVHHEXYLUWNSK-QXEWZRGKSA-N 420.680 -0.848 50 10 HBGE CCN(C(=O)OC(C)(C)C)[C@@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282713717 IVKRGDNAPTVQMS-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE Cn1ncc(CNC(=O)OC(C)(C)C)c1NS(=O)(=O)c1cscc1B(O)O 2282734882 RPHLMXCFYGACSZ-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE O=C(O)C1(COCc2ccccc2)CN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2284402565 OFKMLDONYJOCIY-UHFFFAOYSA-N 411.266 -0.280 50 10 HBGE CN(C)S(=O)(=O)N1CCCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1 810091195 KKECHBNMWJINCC-UHFFFAOYSA-N 417.919 -0.085 50 10 HBGE O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@H]1CCCO1 814344221 BDOFPYBOZWHYSS-CQSZACIVSA-N 413.452 -0.157 50 10 HBGE COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NNC(=O)[C@H]2CCC(=O)N2)cc1OC 1131723238 NXKGVLHCWOLVDH-BFUOFWGJSA-N 406.439 -0.433 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)Cn1c(O)nnc1O 1137304494 XIFWIAVVOPFCRG-UHFFFAOYSA-N 423.861 -0.692 50 10 HBGE COC(=O)[C@@]1(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)CCOC1 1473657783 LCFCZDRVHAEUID-OAQYLSRUSA-N 418.494 -0.365 50 10 HBGE Cc1cccc(CS(=O)(=O)CCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 1626650293 NYULQWWCKGDAMS-CQSZACIVSA-N 417.509 -0.183 50 10 HBGE O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCCCO1 1628548399 XLBLOWPNGWMZBN-LXTVHRRPSA-N 415.512 -0.187 50 10 HBGE CN(NC(=O)[C@@H]1CCS(=O)(=O)N1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1638030109 GHDBYTXDAVCSEQ-NSHDSACASA-N 405.477 -0.686 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(F)CCOCC2)CC1 1648592404 APZHQOCIJHENNM-UHFFFAOYSA-N 401.464 -0.021 50 10 HBGE CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N[C@H](CB(O)O)C(=O)O)C1 2124535777 YHMYIBNSIMFGHE-PMUMKWKESA-N 408.216 -0.155 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2cc(B(O)O)cs2)C1 2267611684 VCMNSDOOBGWCGQ-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE Cc1cc(B(O)O)cnc1C(=O)N[C@@H]1CCOC[C@@H]1NC(=O)OCc1ccccc1 2285207435 XYUOZOSBELBQQI-SJORKVTESA-N 413.239 -0.116 50 10 HBGE CN1C(=O)/C(=N\NC(=O)C(=O)N/N=C2\C(=O)N(C)c3ccccc32)c2ccccc21 105474585 HKQPSHLUABZXGD-BMJUYKDLSA-N 404.386 -0.020 50 10 HBGE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)N1Cc2ccc(B(O)O)cc2C1 707894538 SBLFHZMAMJRZPA-UHFFFAOYSA-N 400.221 -0.692 50 10 HBGE COc1cc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)ncn1 763651234 YKASKLBKWHPBFQ-UHFFFAOYSA-N 419.467 -0.161 50 10 HBGE CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 793400058 HNPOJZCFPGUBPF-AWEZNQCLSA-N 402.425 -0.265 50 10 HBGE CC[C@@]1(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCNC1=O 1151459485 PVLPSLLMQNMYRR-GOSISDBHSA-N 409.512 -0.018 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1 1160732761 CZTHRXRTPCSCEQ-VIFPVBQESA-N 406.411 -0.500 50 10 HBGE CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(=O)n(C)c2)cc1 1179629682 ZFYWZDVNMKQOQR-UHFFFAOYSA-N 408.436 -0.927 50 10 HBGE Cn1cc(C(=O)NNC(=O)NCCOCCOCC(=O)OC(C)(C)C)ccc1=O 1251525364 CVUCNANMWYKJMF-UHFFFAOYSA-N 412.443 -0.296 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCc3nnnn3CC2)c1 1538534879 PPPYOIGMGVSBTA-NSHDSACASA-N 407.456 -0.663 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](CNS(C)(=O)=O)C1 1560125540 DSVCARJIJVVIGJ-NSHDSACASA-N 418.903 -0.019 50 10 HBGE O=C(NNC(=O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F)c1ccc(-n2cnnn2)cc1 1624704133 WQDCGFOFDGIVDT-WDEREUQCSA-N 418.357 -0.354 50 10 HBGE COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@]23COCCN2C(=O)COC3)c1 1637742736 FMYGNORFSZSKHY-SFHVURJKSA-N 408.411 -0.724 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccnnc1 1639362783 DLTMZZAWUOHDLY-UHFFFAOYSA-N 405.436 -0.119 50 10 HBGE Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCCSS(C)(=O)=O)[C@H](C)O)cc1 1650843676 PVSBPTRNTHWPNK-AAEUAGOBSA-N 410.539 -0.168 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NS(=O)(=O)c2sccc2B(O)O)C1 2267209478 XGXNHKSFNZTWHQ-UVJXUPGXSA-N 424.331 -0.118 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](C)(NS(=O)(=O)Cc2ncsc2B(O)O)C1 2267391843 SNQMSXDKDCCPPJ-AWEZNQCLSA-N 405.307 -0.358 50 10 HBGE CC(C)(C)OC(=O)NCCSSCCNC(=O)c1ncc(B(O)O)cn1 2267432387 IEPHVJCXPAUDDW-UHFFFAOYSA-N 402.307 -0.208 50 10 HBGE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1sccc1B(O)O 2267606705 BNZJMIZXECDLBZ-YUMQZZPRSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267611165 PAMRLQCWBKDJKH-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE CC[C@H]1[C@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282070001 XPQWVMXICUYPDW-MNOVXSKESA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C[C@H]1O 2282074130 RUBOYFLKYLYFJJ-YUSALJHKSA-N 420.318 -0.630 50 10 HBGE CCn1cc(C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C)nc1B(O)O 2282228303 AQJAJYZKKWYYBT-MHZLTWQESA-N 402.282 -0.312 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282356939 CFKWJMAWQNFSQC-ZJUUUORDSA-N 423.297 -0.410 50 10 HBGE C=C(CS(=O)(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F)B(O)O 2282362125 BDJAKCQLLSBATM-SFYZADRCSA-N 412.117 -0.042 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282699824 MGPPCKSQKKIPBX-GHMZBOCLSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282738602 XJFBRZJJQFYGEH-WDEREUQCSA-N 400.237 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(Cl)cc1B(O)O 2360548330 CGUZTOSZNMOIGP-GFCCVEGCSA-N 420.680 -0.104 50 10 HBGE O=C(/C=C\c1ccco1)NCC(=O)NNC1=c2cc(Br)ccc2=NC1=O 38172458 UQDIPSPOAJFWGC-XQRVVYSFSA-N 417.219 -0.240 50 10 HBGE CN(C)CCN(/C=C(/C#N)C(=O)N(C)C1CCN(C)CC1)[C@@H]1CCS(=O)(=O)C1 216905810 GWQYIGDCMXCHDM-HRYDCMBCSA-N 411.572 -0.003 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cc2c(cc1Cl)OCCO2 728510753 SFUBMKDXRPDWEC-ZETCQYMHSA-N 413.861 -0.642 50 10 HBGE COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)cc1 746004915 YOAKCQRGXSKQKS-QGZVFWFLSA-N 420.466 -0.072 50 10 HBGE O=C(NNC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1 1650650622 VDHGIRHMKMUJHL-HUUCEWRRSA-N 419.463 -0.005 50 10 HBGE CC(C)NS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1 1653588753 MSHJRBZJTKAFCX-UHFFFAOYSA-N 408.484 -0.820 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC)cc1OC 1682618215 LSGCEKZSHCQJMC-RISCZKNCSA-N 401.441 -0.150 50 10 HBGE COc1ccc(N2CCCC2=O)cc1S(=O)(=O)N1CCN(CC(=O)NN)CC1 1858634018 XXNTUWJAZRHQMV-UHFFFAOYSA-N 411.484 -0.882 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1cc(B(O)O)cs1 2267610887 LFJWIXWNMRIOHB-LLVKDONJSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)NCc1nc(=NS(=O)(=O)c2ccc(B(O)O)cc2)s[nH]1 2282088425 MFFAKWCEPRAFJX-UHFFFAOYSA-N 414.274 -0.535 50 10 HBGE Cc1cc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H](O)C2)sc1B(O)O 2282371217 GZUAMHLARNCAJJ-LLVKDONJSA-N 420.318 -0.661 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C 2282709782 ZNVBEMQRMSQAHK-NSHDSACASA-N 402.282 -0.976 50 10 HBGE CN(CC(C)(C)CNC(=O)OC(C)(C)C)S(=O)(=O)c1nn(C)cc1B(O)O 2282740759 FCOOAPZYRXLADE-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE COc1ccc(CN2CCCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2=O)cc1 767329584 BAXDEUVARCCDFB-INIZCTEOSA-N 406.439 -0.114 50 10 HBGE CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1 816878566 UQQKTWCFABNTLK-JTQLQIEISA-N 410.431 -0.261 50 10 HBGE CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1471977164 IGQYANWWIDOMJP-CVEARBPZSA-N 416.544 -0.019 50 10 HBGE Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(=O)n1 1540368052 NYEUJXRMNUZQSH-UHFFFAOYSA-N 407.452 -0.428 50 10 HBGE Cc1cccc(C(=O)NNC(=O)CN2CCN(C[C@H]3CCCS3(=O)=O)CC2)c1 1620502088 VIKAMPCYTWOUCB-QGZVFWFLSA-N 408.524 -0.049 50 10 HBGE COC(=O)[C@H]1CCCN(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1=O 1636285400 ILNOCGFFHJMXGG-AWEZNQCLSA-N 412.468 -0.208 50 10 HBGE O=C(N[C@H]1COCC[C@@H]1NC(=O)c1nscc1B(O)O)OCc1ccccc1 2255739928 RLGHTPUYEXSDKR-KBPBESRZSA-N 405.241 -0.363 50 10 HBGE Cc1nc(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c(B(O)O)s1 2266898570 ZTSREQSZMGLQCW-KGLIPLIRSA-N 419.268 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@H](CO)C1 2267619438 RSAFSBBVYGXECL-JTQLQIEISA-N 406.291 -0.970 50 10 HBGE CS[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2281656485 LLCSBZGIDVWOIC-DTWKUNHWSA-N 418.712 -0.166 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(F)c(B(O)O)c1 2282342062 BNZJACSWKDDUBH-WDEREUQCSA-N 400.237 -0.112 50 10 HBGE CCO[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1NS(=O)(=O)c1cc(B(O)O)cs1 2282704222 HUKSYWTWDUWYKM-WZRBSPASSA-N 420.318 -0.223 50 10 HBGE CC(C)(C)OC(=O)NC1(C(=O)N=c2nc(B(O)O)[nH]s2)CC2(CC(F)C2)C1 2289353335 ZZHHBBCMOSDJEB-UHFFFAOYSA-N 400.241 -0.246 50 10 HBGE COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1cnn[nH]1)CC2 765426977 KESPBWGCDFFGDU-UHFFFAOYSA-N 402.411 -0.052 50 10 HBGE COCc1ccccc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766634179 FGMZWIWGHRJRJC-UHFFFAOYSA-N 400.395 -0.959 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)c1ccc(S(N)(=O)=O)cn1 769738282 JBRPFVVUTWYBOP-UHFFFAOYSA-N 402.230 -0.095 50 10 HBGE CN1CCN(C(=O)NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2C2CC2)CC1 807381385 QFUWIELORCMZKP-KRWDZBQOSA-N 414.466 -0.550 50 10 HBGE C[S@@](=O)C1(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)CCN(C(=O)OC(C)(C)C)CC1 1148929270 MEDNBVUPYRIPTE-NQNZVUTLSA-N 416.500 -0.439 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)CS(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1301696947 HLXATDOCGDCZJI-TUAOUCFPSA-N 419.525 -0.525 50 10 HBGE CCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CN(C)CCN2C)c2ccccc2c1=O 1471601617 MIBQZMZBWUSWMZ-XJKSGUPXSA-N 415.498 -0.005 50 10 HBGE CC(C)(C)OC(=O)N1CC2(COC2)[C@](F)(C(=O)NNC(=O)[C@@H]2COCCO2)C1 1634838627 UZRCLWNIYYWYDE-APPDUMDISA-N 403.407 -0.475 50 10 HBGE Cn1nnc(Br)c1C(=O)N[C@H]1CS(=O)(=O)C[C@H]1Br 2057676306 XQMSSMHNNINMAR-UHNVWZDZSA-N 402.068 -0.132 50 10 HBGE Cn1cc(C(=O)N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c(B(O)O)n1 2267400735 XCFZSOZSNSNTCS-HNNXBMFYSA-N 400.244 -0.122 50 10 HBGE Cc1nsc(B(O)O)c1C(=O)N[C@@H]1COCCN(C(=O)OCc2ccccc2)C1 2267439654 VBEZFQDOPQXGRU-AWEZNQCLSA-N 419.268 -0.101 50 10 HBGE Cc1ccnc(C(=O)NC[C@@H]2CN(C(=O)OCc3ccccc3)CCO2)c1B(O)O 2281882309 AQZKHRWXLNRUAU-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE C[C@H]1C[C@H](NS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282380629 LYSOHGMNIKWJAB-QWRGUYRKSA-N 419.334 -0.112 50 10 HBGE C[C@H](O)CN(CCNS(=O)(=O)Cc1ccsc1B(O)O)C(=O)OC(C)(C)C 2282865111 PQXJWKWPSVJINQ-NSHDSACASA-N 422.334 -0.535 50 10 HBGE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1nscc1B(O)O 2283956442 KIROANUCHMMRSY-LDYMZIIASA-N 401.250 -0.544 50 10 HBGE C[C@@H](CCNC(=O)OC(C)(C)C)CCNS(=O)(=O)c1cc(B(O)O)nn1C 2284044250 XXTWEXFCLIKBTB-NSHDSACASA-N 404.298 -0.681 50 10 HBGE COc1ccc(N2CCN(CCNC(=O)NNC(=O)[C@@H]3COCCO3)CC2)cc1 745783969 JNRPZFOXJHWOIE-KRWDZBQOSA-N 407.471 -0.437 50 10 HBGE C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)C1 745999439 XQBJPJQMEBXYBY-BZUAXINKSA-N 411.503 -0.545 50 10 HBGE COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(Cl)c1 751267443 IZXVGPOSFSBFMW-VIFPVBQESA-N 410.857 -0.129 50 10 HBGE CN(CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)[C@@H]1CCS(=O)(=O)C1 794070399 URBSQCPHWAEHEK-CQSZACIVSA-N 412.468 -0.821 50 10 HBGE Cc1ccc(-n2nnc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)cc1 920293164 LJWYNHMAXQIFPX-CYBMUJFWSA-N 406.468 -0.056 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 1354835833 LGDHJEJWTOEBEQ-NSHDSACASA-N 412.449 -0.526 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCCCO3)CC2)cn1C 1436513382 XDNVJOPHWOHVLI-AWEZNQCLSA-N 413.500 -0.154 50 10 HBGE COC(=O)C[C@@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccc(F)cc1 1460604481 PZOKNZFVDUEJQX-CYBMUJFWSA-N 401.416 -0.751 50 10 HBGE COCCOCC(=O)NNC(=O)c1cn(C)nc1CN1C(=O)c2ccccc2C1=O 1586773982 ZPWBOHQZOCGTIO-UHFFFAOYSA-N 415.406 -0.360 50 10 HBGE O=C(NNC(=O)C1(n2cnnn2)CC1)c1cccc(S(=O)(=O)N2CCCCC2)c1 1586781329 XBJGLFRSPRAZLL-UHFFFAOYSA-N 419.467 -0.202 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 1641247126 PLYLGERBXYQAOC-QJPTWQEYSA-N 407.489 -0.402 50 10 HBGE O=C(N1CCCC[C@H]1CNS(=O)(=O)c1cc(B(O)O)cs1)C(F)(F)F 2267202246 ZUYMADGGZFKUQZ-VIFPVBQESA-N 400.209 -0.350 50 10 HBGE C[C@H](CCNC(=O)OC(C)(C)C)N(C)S(=O)(=O)Cc1ncsc1B(O)O 2267393408 YHCNNFLFKTXDHZ-SNVBAGLBSA-N 407.323 -0.112 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2sccc2B(O)O)C1 2267471960 LUWMZISBFOZJOA-JTQLQIEISA-N 406.291 -0.658 50 10 HBGE CN(C[C@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CCO1)C(=O)OC(C)(C)C 2282074830 OQCVMJCPJBMDNS-LBPRGKRZSA-N 420.318 -0.316 50 10 HBGE COc1ccc(S(=O)(=O)NCC(C)(C)NC(=O)OC(C)(C)C)cc1B(O)O 2282732694 KFURSNKGGPUBRM-UHFFFAOYSA-N 402.278 -0.043 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](CNS(=O)(=O)Cc2ccsc2B(O)O)C1 2282847598 BCSQDAGDCFVCOA-RYUDHWBXSA-N 420.318 -0.925 50 10 HBGE Cc1cc(B(O)O)c(CNC(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)s1 2360552101 WVTQRKQHFZAVQA-LLVKDONJSA-N 420.318 -0.710 50 10 HBGE O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)[C@H]1COCCO1 746003356 PRBWJHVBMWSDAD-CQSZACIVSA-N 416.431 -0.712 50 10 HBGE CN(CC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1)S(=O)(=O)c1cccnc1 1156183959 JKJSKASRVFMDFC-OAHLLOKOSA-N 411.484 -0.897 50 10 HBGE COc1cc(CNC(=O)c2cc(B(O)O)ccc2F)ccc1OCC(=O)N(C)C 1544224611 BXBIPIAKEVDFEN-UHFFFAOYSA-N 404.203 -0.089 50 10 HBGE COC(=O)c1cnn(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 1608453410 MZLUAMLMRRIODY-UHFFFAOYSA-N 423.451 -0.554 50 10 HBGE CN(C)CCSc1nc(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cs1 1628912455 RIAWPZVXQXAPCK-SNVBAGLBSA-N 406.555 -0.079 50 10 HBGE Cc1cc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)sc1B(O)O 2023673752 BAOHOFNHWGKVGX-UHFFFAOYSA-N 408.266 -0.548 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2sncc2B(O)O)C1 2267444809 WITOOTYIKCTFHS-SANMLTNESA-N 403.291 -0.072 50 10 HBGE CO[C@@H]1C[C@@H](CNS(=O)(=O)c2cc(B(O)O)cs2)N(C(=O)OC(C)(C)C)C1 2282073817 HVZMAUAMXUXQDC-NWDGAFQWSA-N 420.318 -0.269 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2c(B(O)O)cnn2C)C[C@@H](C)N1C(=O)OC(C)(C)C 2282077941 BMRUOZVHIJCTIV-PHIMTYICSA-N 402.282 -0.882 50 10 HBGE CCn1cc(B(O)O)cc1C(=O)NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1 2282284846 PBLOWJQHAMIVKZ-QGZVFWFLSA-N 415.255 -0.045 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@](F)(CNC(=O)c2cc(B(O)O)sn2)C1 2282440906 XRVUYEKUTILRFF-HNNXBMFYSA-N 403.241 -0.472 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)n1 2282728665 GRPUVGLUGFAMOK-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NS(=O)(=O)c2cscc2B(O)O)CCO1 2282728847 VXGHRWDNNFCVQV-WDEREUQCSA-N 420.318 -0.222 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(B(O)O)c(F)cc2Cl)[C@H](O)C1 2285948450 CIHXYBFOMQDOGV-QWHCGFSZSA-N 402.615 -0.131 50 10 HBGE CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)[C@@H]1COCCO1 744644841 LWEWLNFHWSCIGX-KBPBESRZSA-N 424.479 -0.153 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3cnc([N+](=O)[O-])n3)CC2)cc1 766648813 LHFJVXQRUMGSTJ-UHFFFAOYSA-N 416.442 -0.540 50 10 HBGE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@H]3COCCO3)CC2)cc1 778295913 XYTIKORUYOZVOW-JTGQJZMRSA-N 418.450 -0.537 50 10 HBGE Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H]1COCCO1 805165373 GUGVFLAERBPEPH-LBPRGKRZSA-N 420.875 -0.327 50 10 HBGE COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)CC2)cc1 1131722429 FBLRVIMVTHCJIW-HNNXBMFYSA-N 424.479 -0.478 50 10 HBGE O=C(COc1ccccc1CNC(=O)c1ccc(B(O)O)cc1)NC[C@@H]1CCCO1 1141770331 OBZYKOAUBYVSSN-SFHVURJKSA-N 412.251 -0.030 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](NC(N)=O)C(C)C)CC2)cc1 1149628823 BZKNAPSTPPVGFL-SFHVURJKSA-N 404.515 -0.047 50 10 HBGE CSCC[C@H](NC(N)=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1 1152745844 NBOYYPRBWDUQEZ-VIFPVBQESA-N 417.351 -0.397 50 10 HBGE Cn1ncc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1I 1290349722 WMTROLQFCMPYTC-LURJTMIESA-N 412.209 -0.780 50 10 HBGE Cn1cc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1 1355621247 IBBOGXDHUYLTFI-UHFFFAOYSA-N 406.468 -0.007 50 10 HBGE CS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)cc1Br 1623368896 ZHCHXULMIKWOMQ-VIFPVBQESA-N 404.242 -0.108 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1 1647996680 COCMWURSXSOZAI-UHFFFAOYSA-N 417.509 -0.404 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CC[C@@H]3[C@@H]2CCCN3CCO)cc1OC 1655020001 NLSQTAFGSZGGMA-JKSUJKDBSA-N 406.483 -0.004 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NS(=O)(=O)c1sccc1B(O)O 2267201921 VNZARNSMAXNYPZ-MNOVXSKESA-N 406.291 -0.612 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1cccc(B(O)O)c1 2282065132 JRCQNSIPHQWCDC-KBPBESRZSA-N 400.262 -0.673 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2cccc(B(O)O)c2)[C@H](O)C1 2282091242 FGTVAYCGNVNETF-ZIAGYGMSSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc(F)cc1B(O)O)C2 2282727141 WPDBQBKYVWREJJ-QLJPJBMISA-N 400.237 -0.207 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2OCCN(S(=O)(=O)c3cscc3B(O)O)[C@@H]2C1 2282733297 SZCBPUJZKMSYCO-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE O=C(NNC(=O)[C@@H]1COCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 756295962 VLJPUKFBXSJXCU-HNNXBMFYSA-N 418.454 -0.292 50 10 HBGE COc1c(F)cc(CC(=O)NNC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)cc1S(N)(=O)=O 1165461832 CDILRHYQXVKTAZ-CKYFFXLPSA-N 401.416 -0.261 50 10 HBGE CC(C)C(=O)NNC(=O)CN1CCN(C(=O)OC(C)(C)C)[C@H]2CS(=O)(=O)C[C@H]21 1176744883 PYISKBSZSPJKFE-OLZOCXBDSA-N 418.516 -0.492 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1cccc(Cl)n1 1300836360 MXXQIIRDEXRMNV-NXEZZACHSA-N 400.844 -0.468 50 10 HBGE CS(=O)(=O)c1cccnc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1456178010 IRASXGWYBFQRQI-UHFFFAOYSA-N 404.452 -0.047 50 10 HBGE COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](CNS(C)(=O)=O)C1 1560125539 DSVCARJIJVVIGJ-LLVKDONJSA-N 418.903 -0.019 50 10 HBGE CS(=O)(=O)CC1(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)COC1 1610360355 HBNHFMRNXHUXME-UHFFFAOYSA-N 403.482 -0.368 50 10 HBGE Cc1cc(N2CCC[C@@H](N3CCN(CC(=O)NNC(=O)C(C)C)CC3)C2=O)n(C)n1 1642688907 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CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CS(=O)(=O)C2)c1 1540250417 HOKDXSNAJHJWKD-UHFFFAOYSA-N 417.509 -0.087 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1586340293 ZHBJLYBWALERJK-FIXIBIHLSA-N 408.455 -0.761 50 10 HBGE CS[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2281656486 LLCSBZGIDVWOIC-IUCAKERBSA-N 418.712 -0.166 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)[C@@H](O)C1 2282088744 QXBUIVYUZPZKAK-KBPBESRZSA-N 400.262 -0.985 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)[C@H]2COC[C@@H]12 2282373180 JDAYJGVZBXICGX-WCQGTBRESA-N 418.302 -0.660 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H](C)[C@H]1NC(=O)C(F)(F)F 2282699713 LTDSEGNPZWJSOO-XLDPMVHQSA-N 414.236 -0.106 50 10 HBGE CC(C)(C)OC(=O)NCC1(O)CN(C(=O)c2cc(F)c(B(O)O)cc2Cl)C1 2282990405 RJWBEJCLSLLUSD-UHFFFAOYSA-N 402.615 -0.130 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1scc(C)c1B(O)O)NC(=O)OC(C)(C)C 2284010907 IDKSWCDKEYZKSC-SNVBAGLBSA-N 400.262 -0.191 50 10 HBGE CC[C@@H](C)n1nc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1C 778379045 GOTJDUVXGFMPNO-SNVBAGLBSA-N 416.442 -0.629 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)CN1CCCC2(CC2)S1(=O)=O 1125690226 GEVSWAWIBLXHJU-UHFFFAOYSA-N 400.482 -0.417 50 10 HBGE COc1ccc(C(=O)NNC(=O)CN2CCN(c3n[nH]c(C)n3)CC2)cc1OC 1308037082 YJQIVFCBEDVYJT-UHFFFAOYSA-N 403.443 -0.286 50 10 HBGE Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)OCC(F)(F)F 1454155890 ZTMWPZKWYVPJKW-UHFFFAOYSA-N 414.362 -0.021 50 10 HBGE CN(C)S(=O)(=O)Cc1ccc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1 1471310993 JVDSZUGMZDHZPP-INIZCTEOSA-N 418.541 -0.041 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1csc(I)n1 1539402005 PJCDIVRDTATVJC-RXMQYKEDSA-N 415.234 -0.057 50 10 HBGE CN(C)S(=O)(=O)NCC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1 1566603513 QZZBFEGHBZNNNS-UHFFFAOYSA-N 404.392 -0.181 50 10 HBGE CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1586340295 ZHBJLYBWALERJK-YIKOMLBNSA-N 408.455 -0.761 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 1630862164 ASSHMWIAVTTWJK-BLLLJJGKSA-N 415.468 -0.092 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@]2(CC(=O)NN2C(=O)c2cc(B(O)O)ccc2F)C1 1645106879 WVESINVZSLCJOD-GOSISDBHSA-N 407.207 -0.238 50 10 HBGE Cn1cc(C(=O)NC[C@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)cn1 1647977797 LQGIALGXUDJIIK-QGZVFWFLSA-N 409.450 -0.053 50 10 HBGE Cn1nnc(Br)c1C(=O)N[C@@H]1CS(=O)(=O)C[C@H]1Br 2057676305 XQMSSMHNNINMAR-RFZPGFLSSA-N 402.068 -0.132 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1sccc1B(O)O 2267202865 IWYYITYXLUZSOE-VHSXEESVSA-N 406.291 -0.924 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 2267625326 NRHTYEFLGYPYKZ-DDFAGTSDSA-N 402.303 -0.120 50 10 HBGE Cc1nc(S(=O)(=O)N[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282343266 DAHRZIIHVOWREN-WDEREUQCSA-N 402.282 -0.868 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](CNS(=O)(=O)c2sccc2B(O)O)CO1 2282702626 LIVSKMXDJCKOHU-QWRGUYRKSA-N 420.318 -0.364 50 10 HBGE CON([C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cncc(B(O)O)c1 2282709915 GUWYXOREPRUHCT-GFCCVEGCSA-N 401.250 -0.677 50 10 HBGE Cc1cc(S(=O)(=O)N2C[C@H](O)C[C@@H](NC(=O)OC(C)(C)C)C2)sc1B(O)O 2282726197 OJEMQQOTUKGJKY-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCC2(NC(=O)OC(C)(C)C)CCC2)n1 2282728309 QPAHVQUCVLJCTK-UHFFFAOYSA-N 402.282 -0.784 50 10 HBGE C[C@H](NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cc(B(O)O)cs1 2360531301 KBOPFBJCLQJMOW-ONGXEEELSA-N 420.318 -0.457 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)[C@@H]1COCCO1 744645365 RINWDYGVDGYWOO-DOMZBBRYSA-N 415.443 -0.211 50 10 HBGE O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(F)c(N2CCOCC2)c(F)c1 1290349201 OVTZUVKJFZBSED-SNVBAGLBSA-N 403.407 -0.003 50 10 HBGE CN1C[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)NC1=O 1545432947 SVMNZNMMMLOIIS-OAHLLOKOSA-N 408.890 -0.371 50 10 HBGE C[C@@]1(NNC(=O)N[C@H]2CCCN(CCN3CCOCC3)C2)CCS(=O)(=O)C1 1565265768 WRWZJVOSHDKYLC-DOTOQJQBSA-N 403.549 -0.836 50 10 HBGE CC[C@H](CC(F)(F)F)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1566278777 QZHXBWOYKKIRSI-MRVPVSSYSA-N 404.349 -0.440 50 10 HBGE CN(C)S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1635244370 DYOCGOHNGJBLRC-GFCCVEGCSA-N 421.520 -0.481 50 10 HBGE CCO[C@@H]1COC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1635245534 JAJKFCDBVLACSZ-ZIAGYGMSSA-N 400.457 -0.315 50 10 HBGE COCc1n[nH]c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1 1682512957 OJBZTTFIUSDFMK-UHFFFAOYSA-N 416.486 -0.006 50 10 HBGE COC(=O)[C@@H](CCNC(=O)c1cc(B(O)O)sc1C)NC(=O)OC(C)(C)C 2281906408 NPRJCPYRRRZZRX-LLVKDONJSA-N 400.262 -0.077 50 10 HBGE Cn1nc(C(=O)N=[S@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2281914163 SAWSBVPJIXRAJJ-HHHXNRCGSA-N 400.266 -0.795 50 10 HBGE Cc1nc(S(=O)(=O)N[C@H]2C[C@H](C)N(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282741829 SYWBQLLBMNROKM-ONGXEEELSA-N 402.282 -0.915 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)Nc1cc(Cl)ccc1B(O)O 2284131173 SPXLEWFEXTZICL-XQQFMLRXSA-N 400.624 -0.701 50 10 HBGE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(B(O)O)cc1 2285302355 YDHPTDSEBILTGT-GFCCVEGCSA-N 402.278 -0.737 50 10 HBGE COc1cc(I)nc(I)c1B(O)O 238366071 PEOBKOYUUCKEKP-UHFFFAOYSA-N 404.738 -0.021 50 10 HBGE Cn1nc(SCC(=O)NN=Cc2nccn2Cc2ccccc2)c(=O)n(C)c1=O 734092887 GPAVRGLOXMCZNG-UHFFFAOYSA-N 413.463 -0.034 50 10 HBGE COc1ccc(C(=O)NNC(=O)[C@@H]2COCCO2)cc1S(=O)(=O)N1CCCC1 744641801 MPYBTAMWLZFDNF-AWEZNQCLSA-N 413.452 -0.344 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 758043421 HJYXZKWBJFYCGM-RKDXNWHRSA-N 404.395 -0.597 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2CCOc3ccccc32)n(C)c1=O 766635361 BROWTLIUTOPEDO-GFCCVEGCSA-N 412.406 -0.853 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCC(=O)NNC(=O)CNC(=O)c2cccnc2)C1 776979117 GEEDMGOBLLCSSG-UHFFFAOYSA-N 421.454 -0.015 50 10 HBGE Cn1cc([C@@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1 1440330808 ZUHIGPNLUXSTFA-OAHLLOKOSA-N 407.452 -0.301 50 10 HBGE Cn1cc(C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)nn1 1528541572 JKVJGDBOUPJXSB-UHFFFAOYSA-N 417.451 -0.563 50 10 HBGE COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCO[C@@H]3C)cc2S1(=O)=O 1530203502 DJLMOXJLXNEMHN-PWSUYJOCSA-N 411.436 -0.337 50 10 HBGE C[C@@H](O)CN(C)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 1570114761 RTPPZRAWGNSZDO-OAHLLOKOSA-N 412.512 -0.357 50 10 HBGE Cn1cc(C(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)nn1 1587243540 CBHJWASZTCMBDM-UHFFFAOYSA-N 416.257 -0.046 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C[C@@]23CCCC[C@H]2C3(F)F)n(C)c1=O 1629793450 RTCMQAPYVKEEIQ-QGHHPUGFSA-N 424.408 -0.203 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)CS(=O)(=O)c1cccc(Br)c1 1635874142 OPDQCLWDOWNVRV-UHFFFAOYSA-N 418.269 -0.007 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN(C)C[C@H](O)CNC(=O)OC(C)(C)C)n1 1654508476 LOCLGJRLRSFXMZ-GFCCVEGCSA-N 415.516 -0.041 50 10 HBGE Cn1nccc1CN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 1660651879 NYJRZUSAMSFXFX-UHFFFAOYSA-N 401.427 -0.093 50 10 HBGE CS(=O)(=O)CC[C@H](C(=O)NNC(=O)C(F)(F)F)N1C(=O)c2ccccc2C1=O 1923918184 VPROAFSQPLFUEP-SNVBAGLBSA-N 421.353 -0.204 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)c3cc(B(O)O)cs3)[C@H]2C1 2267208280 XBTUODWUTTUGTR-VXGBXAGGSA-N 402.303 -0.181 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCCC(C)(C)NC(=O)OC(C)(C)C)n1 2282377743 WBEQVOPHHCYEPJ-UHFFFAOYSA-N 404.298 -0.538 50 10 HBGE Cc1c(C(=O)N=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C)c(B(O)O)nn1C 2282436681 BAVCZMQAKNRCHH-MHZLTWQESA-N 402.282 -0.487 50 10 HBGE C[C@H](CCN(C)C(=O)OC(C)(C)C)N(C)S(=O)(=O)c1cc(B(O)O)nn1C 2282709627 YQBUSOUVKQYNTI-LLVKDONJSA-N 404.298 -0.634 50 10 HBGE C[C@@H]1C[C@@H](CNS(=O)(=O)Cc2ncsc2B(O)O)CN1C(=O)OC(C)(C)C 2282732636 JIYDNASDFVJBQK-MNOVXSKESA-N 419.334 -0.112 50 10 HBGE Cn1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)c2ccccc21 10736497 KZWMNJBEERTRDY-UHFFFAOYSA-N 409.406 -0.613 50 10 HBGE COc1ccc(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c(OC)c1 729951573 PBWAXZRQHUFJJJ-UHFFFAOYSA-N 406.420 -0.038 50 10 HBGE COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)c(OC)c1 746002760 LVZZGWZMBVFJGJ-INIZCTEOSA-N 422.438 -0.382 50 10 HBGE CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1 748213621 LVMZNLLTKKDKIQ-OAHLLOKOSA-N 411.461 -0.092 50 10 HBGE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)c1ccc(C#N)cc1 749561256 PUBBLNSQWTZUIN-MUIFIZLQSA-N 414.418 -0.256 50 10 HBGE O=C(NNC(=O)[C@@H]1CCN(c2ccc(F)c(F)c2)C1=O)N[C@H]1CCS(=O)(=O)C1 919888756 REIRJDIVVFOYET-ONGXEEELSA-N 416.406 -0.165 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 1149617800 TXWNPEHVWJQHCE-NWDGAFQWSA-N 403.457 -0.840 50 10 HBGE CN(CC(=O)NNC(=O)c1ccccc1Cl)Cc1nnc2n1CCN(C)C2=O 1308068196 LAMVBQSZRRKGOD-UHFFFAOYSA-N 405.846 -0.090 50 10 HBGE Cc1ccc(OCC(=O)NNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)cc1C 1463678331 APJZVPQHSIUGLF-UHFFFAOYSA-N 407.452 -0.026 50 10 HBGE O=C1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)N1 1624249084 KOSAAFVWLPLANR-OAHLLOKOSA-N 402.432 -0.185 50 10 HBGE O=C(CCN1C(=O)CCNC1=S)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1641456729 SBISFGYHLIEBOB-CYBMUJFWSA-N 403.420 -0.918 50 10 HBGE Cn1cc(S(=O)(=O)NC[C@H](Br)CBr)c(=O)n(C)c1=O 2116352950 CKRMDNKQRTYMBM-ZCFIWIBFSA-N 419.095 -0.479 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)Nc1ncccc1B(O)O 2180984030 SRICJSBGOFQKRZ-NSHDSACASA-N 401.250 -0.972 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](CNS(=O)(=O)c3cc(B(O)O)cs3)[C@@H]2C1 2267472865 XBTUODWUTTUGTR-ZSBIGDGJSA-N 402.303 -0.181 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCCCOCCNC(=O)OC(C)(C)C 2282360916 JPHKCTYBGYGWDE-UHFFFAOYSA-N 422.334 -0.054 50 10 HBGE Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2Br)c1 756080064 KLJIJRMKOWVXOE-UHFFFAOYSA-N 416.257 -0.078 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1 817213982 PTDAKASHPGILRH-CABCVRRESA-N 401.423 -0.137 50 10 HBGE CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NNC(=O)c1cc(Br)cn1C 1587536337 ZFKHWRXENBSPLQ-JTQLQIEISA-N 416.276 -0.045 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2[nH]ccc2-c2ccccc2)n(C)c1=O 1622153810 VGEZUEDIZYGSJR-UHFFFAOYSA-N 421.417 -0.110 50 10 HBGE Cn1nc(I)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1628911706 DUTJSEWHZNEHLQ-LURJTMIESA-N 412.209 -0.780 50 10 HBGE Cc1ccnc(C(=O)N[C@@H]2CCOC[C@@H]2NC(=O)OCc2ccccc2)c1B(O)O 2281889960 YTCWXKBJDNFILE-CVEARBPZSA-N 413.239 -0.116 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]1(O)CCCN(S(=O)(=O)c2cc(B(O)O)cs2)C1 2282069919 WRNFTZRBCBWXJA-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE Cc1cc(S(=O)(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C)ccc1B(O)O 2282357647 MVPBJPYITGGNCP-AREMUKBSSA-N 420.318 -0.014 50 10 HBGE COc1ccc(S(=O)(=O)NCCN(OC)C(=O)OC(C)(C)C)cc1B(O)O 2282359064 IQUKJUIBNMIPLA-UHFFFAOYSA-N 404.250 -0.548 50 10 HBGE COc1ccc(S(=O)(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282363395 GUTRNOHTDKKNHG-LLVKDONJSA-N 400.262 -0.337 50 10 HBGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1S(=O)(=O)c1nn(C)cc1B(O)O 2282368615 SRAHXSACBHMWTE-MNOVXSKESA-N 402.282 -0.882 50 10 HBGE Cn1nc(B(O)O)c(C(=O)N=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C)n1 2282463647 CLEAUZKDQMCEQL-HHHXNRCGSA-N 403.270 -0.962 50 10 HBGE Cc1cc(S(=O)(=O)NCCN(CC(=O)O)Cc2ccccc2)sc1B(O)O 2284412308 UNUKPSAFXZBBON-UHFFFAOYSA-N 412.298 -0.399 50 10 HBGE N#CC(=CNCCN1C(=O)CSC1=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1 2324879953 QAKBZUSAXWDNND-UHFFFAOYSA-N 409.449 -0.035 50 10 HBGE CC(C)(C)OC(=O)N1CC(OCCCNS(=O)(=O)c2sccc2B(O)O)C1 2362309441 PQMNPWJGLMVTQO-UHFFFAOYSA-N 420.318 -0.268 50 10 HBGE O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(C2CCOCC2)C1=O 747502505 NSRMSOFYQAGVRF-LBPRGKRZSA-N 409.468 -0.412 50 10 HBGE COc1ccc2c(c1)C=C(S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2 758150610 NRKLKBPPAKNGFT-SNVBAGLBSA-N 403.482 -0.129 50 10 HBGE O=C(NNC(=O)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1)N[C@H]1CCS(=O)(=O)C1 919887553 AHUXICJLWHAIFH-SKDRFNHKSA-N 416.406 -0.165 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@H]1CCC(=O)N1 1454060173 JHEGYUXEWVKFDH-OLZOCXBDSA-N 408.480 -0.027 50 10 HBGE CCOC(=O)[C@H]1CCCN(CC(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)C1 1556767445 ONPDFXLIWWTYTH-BLLLJJGKSA-N 416.434 -0.140 50 10 HBGE CN1C(=O)CO[C@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)[C@H]1c1cccnc1 1558458237 CSAIKXIPFNNIBD-JQHSSLGASA-N 417.466 -0.619 50 10 HBGE CC(C)(C)OC(=O)NC1CCN(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CC1 1623509490 IZRCMOMPJVBLGP-LBPRGKRZSA-N 418.516 -0.442 50 10 HBGE N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)cc1 1645053478 GXBSJWCZJRHKTR-QGZVFWFLSA-N 420.491 -0.126 50 10 HBGE CC(C)(C)OC(=O)NC1CC(O)(CNS(=O)(=O)c2cscc2B(O)O)C1 2267417581 DAZQFRYOIMRHRZ-UHFFFAOYSA-N 406.291 -0.876 50 10 HBGE CC[C@@H](CN(CC)S(=O)(=O)c1cc(B(O)O)nn1C)NC(=O)OC(C)(C)C 2282086540 NIWSRJKCTDBJTI-NSHDSACASA-N 404.298 -0.586 50 10 HBGE COc1ccc(S(=O)(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282356380 UNUFVQCDLOXAPW-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)n1 2282371361 ITYHHKYRCLBAGY-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC(=O)c1ncc(B(O)O)cn1 2282435843 DUMPWQYVDVAQSG-HHHXNRCGSA-N 400.266 -0.301 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2282709208 VPWBRJOPCFTJER-LLVKDONJSA-N 402.282 -0.976 50 10 HBGE O=S(=O)(c1ccc(B(O)O)s1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 2282716156 QBGNFBUWSJYABM-LSDHHAIUSA-N 408.310 -0.298 50 10 HBGE Cc1sc(C)c(S(=O)(=O)N2CC[C@@](C)(NC(=O)C(F)(F)F)C2)c1B(O)O 2282741999 WDSHZDCKOFNWDN-GFCCVEGCSA-N 414.236 -0.124 50 10 HBGE C[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C)c1nscc1B(O)O 2284054255 ZXJFKRCWRKKLHN-PSASIEDQSA-N 400.266 -0.841 50 10 HBGE CCOc1cc(/C=N/NC(=O)Cn2cnc3c(=O)n(C)c(=O)n(C)c32)ccc1O 12318699 GLFWXWBZBMRTDP-DNTJNYDQSA-N 400.395 -0.312 50 10 HBGE COC(=O)/C=C/c1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 747602498 SRIUACPNHJMGEN-NTYUQYKDSA-N 402.450 -0.383 50 10 HBGE COC[C@@]1(C(=O)NNC(=O)N2CCOCC2)CN(C(=O)OC(C)(C)C)CCO1 1464550094 SLIKKCWULUHLBD-QGZVFWFLSA-N 402.448 -0.288 50 10 HBGE CC1=NS(=O)(=O)N(C)C=C1C(=O)NNC(=O)c1csc(N2CCOCC2)n1 1538401270 FZJITEZBVSWKFW-UHFFFAOYSA-N 414.469 -0.724 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)CCCCOc1ccc(S(C)(=O)=O)cc1 1634355431 KJHIBSCENZZCLY-UHFFFAOYSA-N 406.482 -0.169 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NS(=O)(=O)c2sccc2B(O)O)C1 2267199948 SGCYRDODANQPIZ-GHMZBOCLSA-N 406.291 -0.924 50 10 HBGE O=C(NCC1CCN(S(=O)(=O)c2ccc(B(O)O)s2)CC1)C(F)(F)F 2267205754 WERBRONWHKFURU-UHFFFAOYSA-N 400.209 -0.493 50 10 HBGE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1ccc(B(O)O)s1 2267209906 CHPVYVNQGNBJTR-UWVGGRQHSA-N 406.291 -0.660 50 10 HBGE COC(=O)[C@H](CCNC(=O)c1nc(C)sc1B(O)O)NC(=O)OC(C)(C)C 2281643233 HQRLSOHRGFGTMM-VIFPVBQESA-N 401.250 -0.682 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N[C@H]1CCOC[C@H]1NC(=O)OCc1ccccc1 2281909620 RZYDNTXQBABSBP-JKSUJKDBSA-N 416.243 -0.604 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(B(O)O)c2)[C@@H]2C[C@@H]21 2282346187 UFZRZPZSTSCFPM-UONOGXRCSA-N 400.237 -0.112 50 10 HBGE CN(CC1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282355947 NQTSSJGMHFESQM-UHFFFAOYSA-N 402.253 -0.007 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N1CCC[C@@H](NC(=O)C(F)(F)F)[C@H]1C 2282723265 PGBSAONMJJIOHJ-VXNVDRBHSA-N 414.236 -0.044 50 10 HBGE CC(C)N(CCN(C)C(=O)OC(C)(C)C)S(=O)(=O)c1nn(C)cc1B(O)O 2282741886 UNKWJBXBCQHKIL-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE Cc1csc(CNC(=O)[C@@H](F)C2(O)CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2284054780 IYKPLMZNRGABOK-GFCCVEGCSA-N 402.253 -0.328 50 10 HBGE CSc1ccc(N2C[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2=O)cc1 758047519 XXPDRCMFNHDIEE-MNOVXSKESA-N 414.509 -0.154 50 10 HBGE C#CC[C@@H](COC)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 1253780448 ZOTHCOILRDSPCR-AWEZNQCLSA-N 410.500 -0.318 50 10 HBGE CN(C)c1ncc(Br)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n1 1440706102 UGHGURFHIANVKA-ZETCQYMHSA-N 406.262 -0.499 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3OCCN(C)C3=O)CC2)cc1 1587968236 BNCYGHDAIBENBO-GOSISDBHSA-N 403.483 -0.883 50 10 HBGE O=C(Cc1csc([C@@H]2CCS(=O)(=O)C2)n1)NNC(=O)CN1CCCC1=O 1635878053 PFWMWMQXSKQXOG-SNVBAGLBSA-N 400.482 -0.643 50 10 HBGE C[C@H]1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CS1(=O)=O 1636726115 SEVHZDUHBAXGKQ-WDEREUQCSA-N 407.452 -0.157 50 10 HBGE CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cnnn3C)c2)CC1 1648815657 AALIYTYUBBBFQJ-UHFFFAOYSA-N 407.456 -0.575 50 10 HBGE CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2nc[nH]c3ncnc2-3)CC1=O 1651588233 CTJHDUQKMCXWEW-NEPJUHHUSA-N 400.443 -0.602 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N[C@H]1COCCN(C(=O)OCc2ccccc2)C1 2281840977 CMXVQBIIAOAKDT-OAHLLOKOSA-N 416.243 -0.824 50 10 HBGE CCCC1(NS(=O)(=O)c2nn(C)cc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282370797 AOKRBPRTPSBKMD-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(Cl)c(B(O)O)c1 2282375459 PNXHAFVPIXXQJQ-SNVBAGLBSA-N 422.696 -0.474 50 10 HBGE C[C@H](NS(=O)(=O)c1ccc(B(O)O)cc1)C1(O)CN(C(=O)OC(C)(C)C)C1 2282425323 OEPPMEQDDXSHHA-NSHDSACASA-N 400.262 -0.985 50 10 HBGE C[C@@H]1CCN(S(=O)(=O)c2sccc2B(O)O)[C@H](C)[C@H]1NC(=O)C(F)(F)F 2282711896 IUYSLSNKMZEIHS-MRTMQBJTSA-N 414.236 -0.106 50 10 HBGE O=C(C=Cc1ccccc1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 2297565472 XRJZDZLQWAVFHA-UHFFFAOYSA-N 416.467 -0.755 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 25996341 ZKEYHCNOGBHRIG-SNAWJCMRSA-N 410.228 -0.341 50 10 HBGE CCC[C@@H]1C[C@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CCO1 779934785 FFIXFBLQWOXTKD-VXGBXAGGSA-N 406.443 -0.824 50 10 HBGE C[C@H](NC(=O)Cn1cnnn1)C(=O)NNC(=O)c1ccc(Br)s1 1463646410 IMHGWBFQVYJGNP-LURJTMIESA-N 402.234 -0.537 50 10 HBGE C[C@H](C(=O)NNC(=O)[C@@H]1COCCO1)N1CCN(C(=O)OC(C)(C)C)CC1=O 1533477175 SWIQOLVUWXQJOP-NEPJUHHUSA-N 400.432 -0.983 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CN3CCN2C[C@@H]3C)c1 1540250307 CIVAAXLWIVLPEZ-WMLDXEAASA-N 423.539 -0.134 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@]1(C)CC1(Br)Br 1610346996 GDYHWEHVYVEWHS-SVGQVSJJSA-N 421.111 -0.032 50 10 HBGE O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@@H]1CCC(=O)N1 1623368869 YCADCWWAFFXMEG-NSHDSACASA-N 408.212 -0.415 50 10 HBGE CO[C@@H]1C[C@H](C(=O)NNC(=O)CS(C)(=O)=O)N(C(=O)OCc2ccccc2)C1 1630866866 JEQAVQYCZBOICW-ZIAGYGMSSA-N 413.452 -0.396 50 10 HBGE CCc1sc(C(=O)NNC(=O)CN2CCN3[C@@H](CNS3(=O)=O)C2)cc1C 1644632797 HAGVIXJPFWJLKS-NSHDSACASA-N 401.514 -0.786 50 10 HBGE Cc1nc(S(=O)(=O)N(C)C(C)(C)CNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282343996 SLZKDHUGVNQAGK-UHFFFAOYSA-N 404.298 -0.668 50 10 HBGE COCCN(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)cs1 2282704965 RKGDONLEVMKXLI-UHFFFAOYSA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1CC=C(CNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2282736890 XATYKSGJQYFEPY-UHFFFAOYSA-N 417.318 -0.191 50 10 HBGE CC[C@]1(NS(=O)(=O)c2nn(C)cc2B(O)O)CCN(C(=O)OC(C)(C)C)C1 2282740049 SZCCDCFSPQLDDJ-HNNXBMFYSA-N 402.282 -0.832 50 10 HBGE CN(CC(C)(C)N(C)S(=O)(=O)c1nn(C)cc1B(O)O)C(=O)OC(C)(C)C 2288931458 PCTYCODAWJBFKP-UHFFFAOYSA-N 404.298 -0.634 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)c1csnc1B(O)O)C(=O)O 2289801673 FXGCKBSPQWFKFI-SNVBAGLBSA-N 401.250 -0.299 50 10 HBGE COc1cc(N2CCN(C(=O)NNC(=O)[C@H]3COCCO3)CC2)cc(OC)c1OC 759272554 FOUDFIDUZLORNX-MRXNPFEDSA-N 424.454 -0.009 50 10 HBGE CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)O1 793037941 MWAJRVVKJDKFNE-CABCVRRESA-N 421.454 -0.121 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@]1(C)CCS(=O)(=O)N1 1289976240 WFGXHRWSBGCGLY-HNNXBMFYSA-N 417.513 -0.479 50 10 HBGE CS(=O)(=O)c1ccc(CCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 1543753139 OWQKBKMVHHHBHZ-LBPRGKRZSA-N 403.482 -0.460 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ncsc2B(O)O)C1 2282339747 ZXGFTYHPZKIIGM-GHMZBOCLSA-N 419.334 -0.064 50 10 HBGE Cc1ccc(S(=O)(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)c(B(O)O)c1 2282354216 NRNKDEPUFKVLAP-GFCCVEGCSA-N 402.278 -0.819 50 10 HBGE CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cc(B(O)O)nn1C 2282507216 DIYOTJHWPMYCDR-HNNXBMFYSA-N 404.298 -0.682 50 10 HBGE Cc1nc(B(O)O)c(C(=O)N=[S@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)n1C 2362566680 MYRPVULBNPAOFL-JGFSIVIASA-N 400.266 -0.686 50 10 HBGE CO[C@@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2365478584 XVEKQJXPUYHFRJ-NSHDSACASA-N 422.696 -0.162 50 10 HBGE COc1cc(/C=N/NC(=O)[C@@H](C)Sc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1O 169890767 CUOJNQTUQZAYOE-SVSQBPIJSA-N 410.368 -0.289 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CSCC(=O)Nc1ccc(F)cc1 758043033 DEMDPKYIAJUYGU-SECBINFHSA-N 406.461 -0.418 50 10 HBGE C[C@@H](CC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(F)c1 765726648 DFOWVBNFHYJFRQ-NSHDSACASA-N 416.413 -0.086 50 10 HBGE CN(NC(=O)[C@H](O)Cc1cnn(C)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 787269034 KFNYKTYGKYFPGZ-CQSZACIVSA-N 410.475 -0.041 50 10 HBGE CS(=O)(=O)c1nc(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c2ccccn12 1156184708 YVRAXUVCIBWQIY-CQSZACIVSA-N 421.479 -0.248 50 10 HBGE COCCn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1 1306181482 CNULEWZKSJZFEY-UHFFFAOYSA-N 422.467 -0.216 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1 1452256127 IUSNSHPALBNNMM-FDEJFUCISA-N 415.443 -0.478 50 10 HBGE CSCC[C@@H](C(=O)NNC(=O)c1cn(C)nn1)N1C(=O)c2ccccc2C1=O 1532340147 CWAOZIYXEGQPIV-ZDUSSCGKSA-N 402.436 -0.006 50 10 HBGE CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2(CS(C)(=O)=O)COC2)CC1 1634093053 SKOHSELMBOKPBG-UHFFFAOYSA-N 419.500 -0.158 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2267372141 JXVDQFPUMBZOPK-WDEREUQCSA-N 406.291 -0.861 50 10 HBGE COC1(CCNC(=O)c2sncc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2267436690 BKKQLFPUTLKFRO-UHFFFAOYSA-N 419.268 -0.020 50 10 HBGE CN([C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)S(=O)(=O)c1sccc1B(O)O 2267609515 RMEIUEZTPBSAKH-PEGIJTEDSA-N 402.303 -0.086 50 10 HBGE Cn1ncc(C(=O)N=[S@](C)(=O)CC2CN(C(=O)OC(C)(C)C)C2)c1B(O)O 2281597341 FZPDZYZYWCSKFB-HHHXNRCGSA-N 400.266 -0.795 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2ccccc2B(O)O)[C@H](F)C1 2282101876 IGAJPHJPSCSBKL-CHWSQXEVSA-N 402.253 -0.008 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CNS(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282360805 HYAICVOGIXMBLO-UHFFFAOYSA-N 420.680 -0.720 50 10 HBGE CC(C)(C)OC(=O)N[C@]1(CNS(=O)(=O)c2cccc(B(O)O)c2)CCOC1 2282709597 YKNFDNXXQPHHJC-INIZCTEOSA-N 400.262 -0.672 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2ccccc2B(O)O)C1 2282717051 CMKCUXGIZADTHM-NEPJUHHUSA-N 400.262 -0.985 50 10 HBGE CCC1(CNS(=O)(=O)c2c(B(O)O)cnn2C)CN(C(=O)OC(C)(C)C)C1 2282718947 FIIJQYKEIOJIDF-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282719576 OAFGCUAZFCWYOV-QWHCGFSZSA-N 400.262 -0.985 50 10 HBGE C[C@@H]1[C@H](NS(=O)(=O)c2nn(C)cc2B(O)O)CCCN1C(=O)OC(C)(C)C 2282741386 NBJNUQQCQNHBAJ-ZYHUDNBSSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1sccc1B(O)O 2334272858 CBNOBXLQBMSQKG-NHCYSSNCSA-N 402.303 -0.038 50 10 HBGE CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1 745978488 KWYXMGSAMJQASM-AWEZNQCLSA-N 422.481 -0.775 50 10 HBGE Cn1ccnc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1=O 745997605 DCSLPZPGRMSUQL-UHFFFAOYSA-N 419.467 -0.865 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCCc3nn[nH]n3)CC2)cc1 1465792136 SVVUNTJBBNNMIC-UHFFFAOYSA-N 400.487 -0.204 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2ccc(B(O)O)s2)C1 2267207063 OYCBPZVVRNMGMY-UHFFFAOYSA-N 406.291 -0.922 50 10 HBGE C[C@H](NS(=O)(=O)c1cscc1B(O)O)C1(O)CN(C(=O)OC(C)(C)C)C1 2267413211 XPIFOIQVGSBMCD-VIFPVBQESA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267623882 POUNJZDPWZEFAL-KOLCDFICSA-N 406.291 -0.754 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 2282080430 JMKPAKBHGNAIPS-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NC(=O)c2cc(B(O)O)n[nH]2)C(C)(C)C1 2282390618 NOGJGUKWPJSXEY-MHZLTWQESA-N 400.266 -0.273 50 10 HBGE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NC(=O)c2csnc2B(O)O)CC1 2282456483 IVMWPCLVAWVULL-HHHXNRCGSA-N 418.306 -0.471 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282707122 VDIWLQVVQUFDMF-KBPBESRZSA-N 400.262 -0.673 50 10 HBGE O=C(NNC(=O)c1cc(Br)cn2ncnc12)N[C@@H]1CCS(=O)(=O)C1 1142193185 JPHZOPRLWAGPGG-MRVPVSSYSA-N 417.245 -0.377 50 10 HBGE COc1ccc(CC(=O)NN(C)C[C@H](C)O)cc1S(=O)(=O)N1CCOCC1 1450945942 NZHSWWUTMXISTH-ZDUSSCGKSA-N 401.485 -0.398 50 10 HBGE CCCCS(=O)(=O)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 1566279001 ZQPVCCKPHLXILX-UHFFFAOYSA-N 424.523 -0.193 50 10 HBGE COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCO[C@@H]2C)cc1OC 1570690722 ZYUBUGJHUMVGNW-ZYHUDNBSSA-N 401.441 -0.446 50 10 HBGE O=C(NC[C@@H](NC(=O)c1c[nH]nc1B(O)O)C(F)(F)F)OCc1ccccc1 2255788489 QCGADRCVJJGGQX-LLVKDONJSA-N 400.122 -0.323 50 10 HBGE CN(C[C@H]1COCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1sccc1B(O)O 2282702306 GLLMJLHTXCWMSZ-NSHDSACASA-N 420.318 -0.316 50 10 HBGE CC(C)(C)OC(=O)N1CC=C[C@@H](NS(=O)(=O)c2ccc(F)cc2B(O)O)C1 2282725988 KOCHVLBHPKVTBT-GFCCVEGCSA-N 400.237 -0.041 50 10 HBGE C[C@@H](NS(=O)(=O)c1c(B(O)O)cnn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286860830 LRHISOZKNANIQF-ZYHUDNBSSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCc1sc(Cl)cc1B(O)O 2343823720 WAOXUKQPZOAUBQ-MRVPVSSYSA-N 405.669 -0.534 50 10 HBGE CN(Cc1cccc(B(O)O)c1)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 707708706 QSBBYUIAOGFJAB-UHFFFAOYSA-N 402.237 -0.576 50 10 HBGE CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2COCCO2)cc1 744644309 HXISPDGZHNSFJI-CQSZACIVSA-N 401.441 -0.684 50 10 HBGE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC(=O)NNC(=O)c1cccc(C#N)c1 749556352 AVQUEWPFXJVGEH-JHNDHUHGSA-N 414.418 -0.256 50 10 HBGE C[C@H]1CCCN1S(=O)(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1 769863197 RZUQPHHIMPVDKO-HNNXBMFYSA-N 409.512 -0.206 50 10 HBGE CCCN1C[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1=O 1566278661 MPCPDRCBMVXFNU-KRWDZBQOSA-N 415.494 -0.150 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(CCO)c2)c1 1586780817 PBNMUXKJFMYOQC-UHFFFAOYSA-N 409.468 -0.019 50 10 HBGE CCNS(=O)(=O)c1cccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1 1673503604 SJWKPNPLDSOXLG-OAHLLOKOSA-N 404.514 -0.134 50 10 HBGE C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1CN(C)CCN1C 1687863514 KVXGESLDZTYXDM-GDBMZVCRSA-N 404.519 -0.342 50 10 HBGE Cn1nc(B(O)O)c(C(=O)NCCN(OCc2ccccc2)C(=O)OC(C)(C)C)n1 2243413480 HBHGEQJLMRIMAP-UHFFFAOYSA-N 419.247 -0.406 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(B(O)O)s1 2267424348 YXBNYNGOSIYCTO-UWVGGRQHSA-N 406.291 -0.924 50 10 HBGE CC(C)(C)OC(=O)NCC1CC([S@@](C)(=O)=NC(=O)c2c[nH]nc2B(O)O)C1 2281877439 PXNWKXKMPOGRLG-FVOZGUDWSA-N 400.266 -0.369 50 10 HBGE CN([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1c(B(O)O)cnn1C 2282076051 CIDGQMKVALMRRQ-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1cc(B(O)O)nn1C 2282082108 YBUWRDIAQOLDAG-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC(=O)c1ncncc1B(O)O 2282221672 AMTOUIMLRWNTSO-MHZLTWQESA-N 400.266 -0.301 50 10 HBGE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)c1ccc(B(O)O)c(F)c1 2282355522 HMPQCGZMLAXSJL-UHFFFAOYSA-N 406.241 -0.987 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C 2282360579 FFLHYBDDSVRVII-NSHDSACASA-N 402.278 -0.043 50 10 HBGE C=C(CS(=O)(=O)NC[C@@H]1C[C@@]2(CCN(C(=O)OC(C)(C)C)C2)CO1)B(O)O 2282376269 BAEHIKYJXAJQLI-XJKSGUPXSA-N 404.294 -0.110 50 10 HBGE CN(CC(C)(C)CNC(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282699239 IJBVDSLRERXYAF-UHFFFAOYSA-N 404.298 -0.729 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@](CO)(NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282704948 RGRVSNYEWRZHHL-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](NS(=O)(=O)c2sccc2B(O)O)C1 2282708056 HPLRSXYNSDMVGC-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCC1CCN(C(=O)C(F)(F)F)CC1 2282742056 XCZDHEWFYDCKGP-UHFFFAOYSA-N 414.236 -0.184 50 10 HBGE C[C@@H](NC(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(B(O)O)cs1 2284041953 UOQBDZQBVVVYHV-BXKDBHETSA-N 402.253 -0.075 50 10 HBGE O=C(O)[C@@H](COCc1ccccc1)NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2284394805 CLIREPXPSHKWNT-CQSZACIVSA-N 413.644 -0.032 50 10 HBGE Cn1ncc2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cnc21 11558755 LLEJFRMQWVMMJJ-UHFFFAOYSA-N 418.797 -0.212 50 10 HBGE CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1 59883951 DDGKLOUMCMVULT-NPVNMOQSSA-N 409.476 -0.296 50 10 HBGE O=C(NNC(=O)N1CCN(c2cccnn2)CC1)c1csc(N2CCOCC2)n1 725859224 AECRYYUWGAPNLN-UHFFFAOYSA-N 418.483 -0.054 50 10 HBGE O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 748276561 MSKDRTBBVQPUFH-GUTXKFCHSA-N 407.448 -0.827 50 10 HBGE CN(C)S(=O)(=O)c1ccccc1NNC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 795168249 LASSJSXDSUYYII-KTKRTIGZSA-N 407.452 -0.509 50 10 HBGE CC(C)(C)OC(=O)N1CC2(CN(C(=O)NNC(=O)[C@@H]3COCCO3)CCO2)C1 814371257 LQJJRBVXBXSEOW-LBPRGKRZSA-N 400.432 -0.536 50 10 HBGE N#C[C@H]1C[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1354836674 RSLFMSJLDVHBMO-GDBMZVCRSA-N 406.464 -0.053 50 10 HBGE Cn1cc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cn1 1540607044 VKSATKJMXLLLCS-UHFFFAOYSA-N 402.527 -0.502 50 10 HBGE O=C(NCCCN1CCOCC1)C1CCN(C(=O)c2cc(B(O)O)ccc2F)CC1 1586683410 CVSVTRHFSXGVDN-UHFFFAOYSA-N 421.278 -0.804 50 10 HBGE O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1625003413 IUVSLDRLMDHSAT-NOZJJQNGSA-N 411.461 -0.495 50 10 HBGE O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)[C@@H]1CCN1C1CCOCC1 1645054097 PFWVYKKODAKJGW-HNNXBMFYSA-N 409.512 -0.077 50 10 HBGE Cc1sc(C)c(S(=O)(=O)NC[C@@H](CO)NC(=O)OC(C)(C)C)c1B(O)O 2267627411 YLWUFSYHOCFLQC-JTQLQIEISA-N 408.307 -0.791 50 10 HBGE Cn1nc(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)c(B(O)O)c1Cl 2282295970 SYWXBPSPNOSILX-UQTVHIPJSA-N 420.684 -0.342 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(NS(=O)(=O)c3cscc3B(O)O)CO[C@H]1C2 2282413958 LXZDTHMXXZVKBB-PGUXBMHVSA-N 418.302 -0.469 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)c1scc(B(O)O)c1Cl 2282474822 GHPOUPLBOPNOKN-ATZCPNFKSA-N 420.680 -0.848 50 10 HBGE C[C@H](NS(=O)(=O)c1cc(B(O)O)nn1C)[C@H]1CCCN1C(=O)OC(C)(C)C 2286910047 ZHDUTLSPOGMMNJ-WDEREUQCSA-N 402.282 -0.834 50 10 HBGE Cn1cc(C[C@H](O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1 786690446 UXPNNYFVCYKILQ-INIZCTEOSA-N 421.479 -0.431 50 10 HBGE CN(C)S(=O)(=O)N[C@H](CNC(=O)NNC(=O)Cc1ccccn1)C1CCCC1 1230509708 BDCGWAUEFHLZHZ-OAHLLOKOSA-N 412.516 -0.091 50 10 HBGE CC(=O)NCC(C)(C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1 1641317081 GYLNQJQTFYXGFF-UHFFFAOYSA-N 412.516 -0.377 50 10 HBGE O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CCCN(CC(F)(F)F)C1=O 1650867585 LQHMGEPOHLDBEE-NSHDSACASA-N 401.345 -0.240 50 10 HBGE O=C(CN1CCC[C@H](CNC(=O)C(F)(F)F)C1)N[C@H]1CS(=O)(=O)C[C@H]1Cl 2195884419 ZRHQVGKFSVPKFZ-MXWKQRLJSA-N 419.853 -0.103 50 10 HBGE Cc1sc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)c(B(O)O)c1C 2221896004 SFUWCZDGVKABSP-UHFFFAOYSA-N 422.293 -0.240 50 10 HBGE CC[C@@](C)(CNC(=O)OC(C)(C)C)N(C)S(=O)(=O)c1c(B(O)O)cnn1C 2282082162 YJACQECVJVTDOA-HNNXBMFYSA-N 404.298 -0.586 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282706119 HYYJKUULQWWCDE-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@@H]1CCCCN1C(=O)OC(C)(C)C 2282714315 QHFHFZWBSXCEPW-NSHDSACASA-N 402.282 -0.832 50 10 HBGE Cc1cc(S(=O)(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C)ccc1B(O)O 2282733567 XQKAJZLTIJTRAH-LBPRGKRZSA-N 402.278 -0.819 50 10 HBGE COC(=O)[C@@H](CC(=O)NCc1sc(C)cc1B(O)O)NC(=O)OC(C)(C)C 2283989465 NHRZDKBTJRURBH-LLVKDONJSA-N 400.262 -0.191 50 10 HBGE COCCCNC(=S)N(C)NC(=O)CNc1ccc(S(N)(=O)=O)cc1F 1135835800 VVLIPRWEUYSWJM-UHFFFAOYSA-N 407.493 -0.241 50 10 HBGE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 1463574479 BJZGFWPMWGRANS-YOEHRIQHSA-N 417.393 -0.167 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NNC(=O)c1cn(C)nn1 1470083334 IXZKLHWBOGKPLI-MKHNBGRSSA-N 414.344 -0.438 50 10 HBGE Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1608469545 IELULPTWUDRHRR-LBPRGKRZSA-N 417.871 -0.132 50 10 HBGE C/C=C\[C@H](O)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 1635501121 VHUJWKOJRIXUNH-QGZUEGPWSA-N 410.496 -0.614 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)[C@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F 1635877712 HZUDCOTUDBKLKV-DZGCQCFKSA-N 406.414 -0.900 50 10 HBGE CN(C(=O)OC(C)(C)C)C1(CNS(=O)(=O)Cc2ncsc2B(O)O)CC1 2267390627 HCBOQCZOOVMOGN-UHFFFAOYSA-N 405.307 -0.358 50 10 HBGE COc1cc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)ccc1B(O)O 2273861492 KMOVXBCQQYEJPV-UHFFFAOYSA-N 418.236 -0.909 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 2282064696 DIXHJURHRCIUGS-XYPYZODXSA-N 402.282 -0.786 50 10 HBGE CCn1cc(C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C)nc1B(O)O 2282230250 SZLJWDHTMRCARH-BLBHWQHRSA-N 402.282 -0.266 50 10 HBGE O=C(O)C1(COCc2ccccc2)CN(S(=O)(=O)c2sccc2B(O)O)C1 2284408353 VMXPEFHHSYYHSK-UHFFFAOYSA-N 411.266 -0.280 50 10 HBGE CS(=O)(=O)N1CCN(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)O)cc2)CC1 216951433 NJQVZVSXAUJOHC-QXMHVHEDSA-N 414.465 -0.144 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NN(C)C[C@@H](C)O 1141853663 WUZWRDBRDMCCAE-OCCSQVGLSA-N 401.485 -0.428 50 10 HBGE COC(=O)[C@@H]1CS(=O)(=O)CCN1CC(=O)NNC(=O)c1ccccc1Cl 1308131698 IWASPZADAXZRHG-LBPRGKRZSA-N 403.844 -0.627 50 10 HBGE Cn1nnnc1CCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 1313404520 RYVMNBXJOVNYGX-UHFFFAOYSA-N 415.502 -0.315 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)cc2)C[C@@H](C)O1 1543093851 ONUULUMCDXZZFB-TYNCELHUSA-N 424.479 -0.476 50 10 HBGE Cc1cc(CC(=O)NNC(=O)[C@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)n[nH]1 1570719262 QZAAULWDCSQNKS-GOEBONIOSA-N 403.414 -0.248 50 10 HBGE CN(C)c1n[nH]c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1 1687476451 OICKBVCPSQBEMG-UHFFFAOYSA-N 415.502 -0.087 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1ccc(B(O)O)s1)NC(=O)OC(C)(C)C 2267210031 DSDTXZGHLGYYOO-SNVBAGLBSA-N 408.307 -0.364 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(S(=O)(=O)c2cscc2B(O)O)C1 2267381765 ZUUJLTMIEMEEKB-ZJUUUORDSA-N 406.291 -0.924 50 10 HBGE C[C@H](C[S@](C)(=O)=NC(=O)c1nn(C)c(Cl)c1B(O)O)NC(=O)OC(C)(C)C 2281662939 DHQPXVPWUNOPCJ-FZWUBBAYSA-N 422.700 -0.096 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(NS(=O)(=O)c3ccc(F)cc3B(O)O)[C@@H]2C1 2282366615 QPDQXCDQMBRYQQ-GHMZBOCLSA-N 400.237 -0.351 50 10 HBGE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ccsc1B(O)O 2282857852 NSHLHOQEGRXNNT-SCZZXKLOSA-N 414.236 -0.211 50 10 HBGE O=C(Cc1ccccc1)NN=Cc1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1 2297659761 AMXHZYWDUXDUDV-VLQCVTHLSA-N 416.430 -0.442 50 10 HBGE CCC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1 772063907 LYFOGGMNKDTOEF-PIGZYNQJSA-N 416.434 -0.049 50 10 HBGE O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1CCc2nncn2C1 816880697 QBZBGEMGDNBVQQ-WUTCKBNWSA-N 419.463 -0.043 50 10 HBGE C=CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)s1 1135989923 CUNCRFSMAYGZAJ-SNVBAGLBSA-N 421.522 -0.663 50 10 HBGE COC(=O)[C@H]1CN(C(=O)c2cccc(B(O)O)c2)CC12CN(C(=O)OC(C)(C)C)C2 1304079499 MJCRTWXBAILGTH-OAHLLOKOSA-N 418.255 -0.152 50 10 HBGE CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1C 1557735337 WOLDQONLGFIOIU-UHFFFAOYSA-N 405.498 -0.169 50 10 HBGE Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc(=O)n(C)c2)s1 1633442111 VUXRTCXRIBIYFO-UHFFFAOYSA-N 413.481 -0.322 50 10 HBGE O=C(NN=c1cc[nH]c2cccnc12)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 1634220918 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420.318 -0.517 50 10 HBGE O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)[C@@H]1COCCO1 744641527 CZQCWOCRUMHISE-LBPRGKRZSA-N 421.269 -0.073 50 10 HBGE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1 790325112 ICGRHIVBJQHQIO-RCBQFDQVSA-N 421.479 -0.193 50 10 HBGE C=CCNC(=S)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 798304768 KMWVLEWWQCIECY-YNEHKIRRSA-N 402.542 -0.223 50 10 HBGE O=C(Cn1nc2n(c1=O)CCCC2)NNc1ccc(S(=O)(=O)NC2CC2)cc1 1464675281 MRZGGGQAYMEUTJ-UHFFFAOYSA-N 406.468 -0.035 50 10 HBGE O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1 1566241127 DEXDNBXORXVSLO-INIZCTEOSA-N 413.409 -0.117 50 10 HBGE O=C(NNC(=O)C1(CC(=O)N2CCOCC2)CCCC1)N[C@@H]1CCS(=O)(=O)C1 1626649862 IDLOGWBDIVQMSQ-CYBMUJFWSA-N 416.500 -0.687 50 10 HBGE COCCOCC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 1642238761 AJTYNPPOKKGGKN-HXUWFJFHSA-N 416.434 -0.062 50 10 HBGE COCCn1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cn1 1650833672 CSXFFWAIPNXBCC-UHFFFAOYSA-N 423.499 -0.383 50 10 HBGE O=C(CN1CCC(CNC(=O)C(F)(F)F)CC1)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 2195882510 ANJPNNPUARNKSQ-QWRGUYRKSA-N 419.853 -0.103 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NS(=O)(=O)Cc2ccsc2B(O)O)C1 2267366649 IXYHAGZAFHEWML-NHYWBVRUSA-N 402.303 -0.143 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=NS(=O)(=O)c2cscc2B(O)O)CC1 2267387733 NBGJLZBBCIWNOV-UHFFFAOYSA-N 424.331 -0.165 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NC[C@@](C)(CO)NC(=O)OC(C)(C)C 2267618384 FJXMDOKEIOTOHQ-AWEZNQCLSA-N 408.307 -0.710 50 10 HBGE Cc1c(C(=O)N=[S@@]2(=O)CC[C@H](NC(=O)OC(C)(C)C)C2)nn(C)c1B(O)O 2282293871 PBLBYGSMXWAWMU-FLESLCNUSA-N 400.266 -0.686 50 10 HBGE CCn1cc(B(O)O)c(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)n1 2282427355 PJQNBPIBCCUIIJ-OAHLLOKOSA-N 416.243 -0.650 50 10 HBGE Cc1nc(C(=O)N(CCNC(=O)OC(C)(C)C)CCN(C)C)c(B(O)O)s1 2282442046 NJSXCKPPYBEFML-UHFFFAOYSA-N 400.310 -0.340 50 10 HBGE COc1ccc(C(=O)NCC(=O)NN=C2C(=O)N(CC(N)=O)c3ccccc32)cc1 254768639 AOONUTLGHAFXGO-UHFFFAOYSA-N 409.402 -0.223 50 10 HBGE Cc1ncsc1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 729611269 NOTPAYZWQAECLU-UHFFFAOYSA-N 418.483 -0.076 50 10 HBGE COc1ccc(N2CCN(CCCNC(=O)NNC(=O)[C@H]3COCCO3)CC2)cc1 745348965 FVAOPTMDDKHRSX-GOSISDBHSA-N 421.498 -0.047 50 10 HBGE O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)CN1CC(=O)NC1=O 766659678 FFRKNKWJKPBKHT-UHFFFAOYSA-N 422.873 -0.843 50 10 HBGE COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1cccc(B(O)O)c1 1297549976 HEEZAULNTKMGFM-OAHLLOKOSA-N 406.244 -0.009 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)C1CCOCC1 1471482899 KAQBTDOOBMWCOF-LBPRGKRZSA-N 407.489 -0.112 50 10 HBGE CN1CCO[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1=O 1628159876 RAFLEEWKYDTFBF-HNNXBMFYSA-N 424.479 -0.521 50 10 HBGE CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)N=S(C)(C)=O)CC1 1654452681 XLOHAWYUXUBVNQ-LBPRGKRZSA-N 411.550 -0.842 50 10 HBGE Cn1nc(C(=O)N=[S@@](C)(=O)CCNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2266914409 WUGPZKYBCAPMJI-SANMLTNESA-N 408.673 -0.484 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NS(=O)(=O)c1cscc1B(O)O 2267388111 SSXFPMFIKSSCHN-WDEREUQCSA-N 406.291 -0.612 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)Cc2ncsc2B(O)O)CCC1 2267390985 MDJQTKVYVZQKNA-UHFFFAOYSA-N 405.307 -0.310 50 10 HBGE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(S(=O)(=O)Cc1ccsc1B(O)O)C2 2267717214 ZEMSRHWDIILWGQ-XHDPSFHLSA-N 402.303 -0.143 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NS(=O)(=O)c2cc(B(O)O)cs2)CCO1 2282068233 AHWIJOFSWBFRKP-RYUDHWBXSA-N 420.318 -0.222 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CC[C@@](C)(CNC(=O)OC(C)(C)C)C1 2282082757 KWOKFFPTOQPGOM-HNNXBMFYSA-N 402.282 -0.975 50 10 HBGE Cc1cc(S(=O)(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)sc1B(O)O 2282354906 XKUJATFSSBSXKV-GHMZBOCLSA-N 420.318 -0.615 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)n1 2282365862 FYSYNXRHEKXHMS-GHMZBOCLSA-N 402.282 -0.930 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CN(S(=O)(=O)c2cc(B(O)O)cs2)CC[C@@H]1CO 2282709578 YBNKVEOLROTUAL-ZYHUDNBSSA-N 420.318 -0.676 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2362083989 HXHOFWIMRPWPJL-JTQLQIEISA-N 404.298 -0.682 50 10 HBGE COCc1nc(Cl)cc(NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)n1 753979780 VGMVTSGMVQSFPO-UHFFFAOYSA-N 405.802 -0.021 50 10 HBGE COc1cc(OC)c(S(=O)(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(OC)c1 793448406 RZRFYSBWSFRGCX-JTQLQIEISA-N 411.440 -0.124 50 10 HBGE CO[C@@H]1COC[C@@H]1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1229753546 TWDPQKOWXCIVOM-UONOGXRCSA-N 400.457 -0.640 50 10 HBGE CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCOCC2)c1 1353727483 ARTGVCYKFRNVIF-UHFFFAOYSA-N 404.466 -0.555 50 10 HBGE COCCN(CC(=O)NNC(=O)CNC(=O)c1cccnc1)C(=O)OC(C)(C)C 1457688388 RQPQPDHZHQIUCC-UHFFFAOYSA-N 409.443 -0.158 50 10 HBGE O=C(NNC(=O)[C@H]1CCCCO1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1468454566 WTOFXSQFXCIESA-CHWSQXEVSA-N 405.860 -0.304 50 10 HBGE Cc1nnc(NNC(=O)N[C@H]2CC(=O)N(C3CN(C(=O)OC(C)(C)C)C3)C2)n1C 1479500274 UWHLBIUGIDDANL-NSHDSACASA-N 408.463 -0.030 50 10 HBGE COCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(O)CC2)cc1 1597677701 XEAWSFYOAMQMIK-UHFFFAOYSA-N 414.484 -0.188 50 10 HBGE CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)CC1 1635371265 ADIXIJSWGJLAOJ-XUJLQICISA-N 416.544 -0.115 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C#N)c(Br)c1 1638300160 FXOVBFDACTYKRI-QMMMGPOBSA-N 419.257 -0.215 50 10 HBGE O=C1CN(c2ccnc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)c2)CCN1 1645053998 NEAHLXWCIUMQNO-INIZCTEOSA-N 402.455 -0.968 50 10 HBGE COC(=O)[C@H]1CC[C@@H](C(=O)OC)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1 1654261630 NLWIUUUJBCXBJM-GJZGRUSLSA-N 402.407 -0.254 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CCOc2ncccc2B(O)O)C1 2240280462 JOUMYNPGOWEOCI-LBPRGKRZSA-N 400.262 -0.436 50 10 HBGE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)Cc1ccsc1B(O)O 2282327708 MEUSGKRHEUCVSP-WCBMZHEXSA-N 414.236 -0.211 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)N2CCCC[C@H]2CNC(=O)OC(C)(C)C)n1 2282377271 OSYJNXKYMPYLLS-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CN(C)Cc1c(C(=O)NN=Cc2ccc([N+](=O)[O-])cc2)nnn1-c1nonc1N 254817383 SXIYRAFAQLUWTH-UHFFFAOYSA-N 400.359 -0.034 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N1Cc2ccc(B(O)O)cc2C1 707896000 YCNXFZHLLRJLKT-UHFFFAOYSA-N 414.248 -0.302 50 10 HBGE C#CCO[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1124302306 CYVDGQDTHPUWQP-OAHLLOKOSA-N 423.491 -0.174 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCCS(N)(=O)=O)CC2)cc1 1149629204 GXQJQKIKMWPEGW-UHFFFAOYSA-N 411.528 -0.671 50 10 HBGE CN(CC(=O)NNC(=O)[C@@H]1CCN1C1CCOCC1)S(=O)(=O)c1cccnc1 1156183958 JKJSKASRVFMDFC-HNNXBMFYSA-N 411.484 -0.897 50 10 HBGE O=C(CN1CCOCC1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1 1294602656 IYSHXQKFWWIJGG-UHFFFAOYSA-N 409.918 -0.063 50 10 HBGE O=C(NNC(=O)C1CN([C@@H]2CCOC2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 1463537242 RQOCIFYUJMFNSW-MRXNPFEDSA-N 422.507 -0.047 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O 1652258186 LVPHQACEWBYKRU-RYUDHWBXSA-N 404.489 -0.043 50 10 HBGE CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)S(=O)(=O)c1cc(B(O)O)nn1C 2282076184 DPZGQXIOTOOICE-LLVKDONJSA-N 402.282 -0.880 50 10 HBGE CC(C)(C)OC(=O)N[C@@]1(CO)CCCN(S(=O)(=O)c2ccc(B(O)O)s2)C1 2282077181 RWRCLXZKCVVTIH-HNNXBMFYSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(S(=O)(=O)c3ccc(F)cc3B(O)O)C[C@@H]21 2282363309 GFYZPIXKMRDGNA-GNXNZQSNSA-N 400.237 -0.351 50 10 HBGE CN(C(=O)OC(C)(C)C)[C@H]1CCCN(S(=O)(=O)c2c(B(O)O)cnn2C)C1 2282506102 NIEVIGPEWKGVKR-NSHDSACASA-N 402.282 -0.880 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1B(O)O 2282741753 SAAUUQTWVBZBJN-WDEREUQCSA-N 402.278 -0.045 50 10 HBGE Cc1csc(CNC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1B(O)O 2360534099 WPBUGCXLCNQUCZ-JTQLQIEISA-N 420.318 -0.710 50 10 HBGE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)Nc1cccc(B(O)O)c1F 2360551511 PNZQRUACFMCQDH-LLVKDONJSA-N 404.225 -0.618 50 10 HBGE Cc1ccc(B(O)O)cc1NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360570893 AWKOMDOTZJUICX-ZDUSSCGKSA-N 400.262 -0.449 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)Cn1nc2n(c1=O)CCCCC2 1178354139 RUZRKBOCOWIQEP-GFCCVEGCSA-N 408.459 -0.072 50 10 HBGE CC(C)[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)CS(C)(=O)=O 1470661247 MROHPUBSAIWHTR-AWEZNQCLSA-N 402.448 -0.159 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)N1 1533744215 GKEBMOCAKPUDGH-ZDUSSCGKSA-N 412.443 -0.348 50 10 HBGE O=C1CC[C@@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CN1 1587968381 DOCKSOOYPREJPJ-HNNXBMFYSA-N 401.467 -0.492 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1 1630866915 LFSLTBZRTGOOFK-LLVKDONJSA-N 417.871 -0.241 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C2[C@H]3CCCCCC[C@H]23)n(C)c1=O 1630996558 MGPIWLBBSQQWBB-RYUDHWBXSA-N 402.455 -0.203 50 10 HBGE C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(F)(F)n1cc(-c2ccccc2)nn1 1638300422 PMBBYTZLIPDVFA-SECBINFHSA-N 402.383 -0.421 50 10 HBGE O=C1C[C@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1 1683908126 VYHUCIVLWCULJW-ZDUSSCGKSA-N 423.495 -0.059 50 10 HBGE CC(C)(C)OC(=O)N1CC(C[S@](C)(=O)=NC(=O)c2csnc2B(O)O)C1 2267050862 IQNZHIZNFCWXRE-SANMLTNESA-N 403.291 -0.072 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2sccc2B(O)O)C[C@H]1CO 2282083186 NFUMEMOHZZLQFW-CMPLNLGQSA-N 420.318 -0.676 50 10 HBGE CC(=O)NNC(=O)C[S@](=O)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2 586298670 GGXVFMQNWWMTPG-AREMUKBSSA-N 400.482 -0.420 50 10 HBGE CSc1ccc(N2C[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2=O)cc1 758047517 XXPDRCMFNHDIEE-GHMZBOCLSA-N 414.509 -0.154 50 10 HBGE O=C(Cn1c(=O)cnc2ccccc21)NNC(=O)[C@H]1C(=O)Nc2ccccc2C1=O 1159494634 KLFZJBFONAWXDP-QGZVFWFLSA-N 405.370 -0.005 50 10 HBGE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NNc1nccc(N2CCOCC2)n1 1160976472 VQCHHYKDDZTJOY-AWEZNQCLSA-N 411.422 -0.103 50 10 HBGE COCCO[C@H](C)C(=O)NNC(=O)NCC1(N2CCOCC2)CCN(C)CC1 1251864698 CAHMXYJFEOGYRI-OAHLLOKOSA-N 401.508 -0.835 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(C)C[C@H](O)CN2C)c1 1289966630 FLTLVVAKEVSTPX-KBXCAEBGSA-N 412.512 -0.067 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=CCS(=O)(=O)C3)CC2)cc1 1587968163 AHDQDADXRMEOPP-UHFFFAOYSA-N 406.508 -0.385 50 10 HBGE CS(=O)(=O)N1CCC(N(CC(F)F)C(=O)c2cc(B(O)O)ccc2F)CC1 1617697693 PXMTUBUJAHDCKU-UHFFFAOYSA-N 408.207 -0.363 50 10 HBGE O=C1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)N1 1624249083 KOSAAFVWLPLANR-HNNXBMFYSA-N 402.432 -0.185 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)c1c(Cl)cccc1B(O)O 2267389435 OJDGSROSEYFTRT-SECBINFHSA-N 408.669 -0.816 50 10 HBGE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1S(=O)(=O)c1sccc1B(O)O 2267606704 BNZJMIZXECDLBZ-SFYZADRCSA-N 400.209 -0.352 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCC2(C)CC(NC(=O)OC(C)(C)C)C2)n1 2282740856 GOUTVGKELZUSCF-UHFFFAOYSA-N 402.282 -0.928 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@H](C)CCNC(=O)OC(C)(C)C)c(B(O)O)n1C 2282865101 PLUGNMKBTAWSQR-SNVBAGLBSA-N 404.298 -0.668 50 10 HBGE CC(C)N1C(=O)C(=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c2ccccc21 764816376 FVHHAWYASPOUFA-UHFFFAOYSA-N 423.433 -0.291 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CS(=O)(=O)N(C)C)c1 784977169 ZYDORUHEYHXSFO-UHFFFAOYSA-N 420.513 -0.631 50 10 HBGE CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)c1 1131508450 PWEWBRWDMNVRSO-ZDUSSCGKSA-N 400.432 -0.106 50 10 HBGE CCn1nc(C(=O)NNC(=O)C[C@]2(C)CCS(=O)(=O)N2)c2ccccc2c1=O 1540305449 UGBSAVBEHRWJFY-KRWDZBQOSA-N 407.452 -0.351 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(B(O)O)cc3)CC2)cc1 1545426581 ZBVSYHVZQSWHNK-UHFFFAOYSA-N 410.283 -0.746 50 10 HBGE O=C(NNC(=O)C1CN([C@@H]2CCOC2)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1 1641062338 SLZBISULMCGDQE-MRXNPFEDSA-N 422.507 -0.047 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1[C@@H]2C[C@H]2CN1S(=O)(=O)c1cc(B(O)O)cs1 2267201565 QFKZBCLFMYOOBT-MVWJERBFSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NS(=O)(=O)c2cscc2B(O)O)C1 2267617715 PDIBCBCPWHDIAK-VWLOTQADSA-N 424.331 -0.166 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2271974900 HJOAKIZKERMBIN-NXEZZACHSA-N 405.307 -0.454 50 10 HBGE Cc1c(C(=O)N2CC3(CC(NC(=O)OCc4ccccc4)C3)C2)c(B(O)O)nn1C 2281837852 LXNBUOYPAIPBNB-UHFFFAOYSA-N 412.255 -0.061 50 10 HBGE C[C@@H](C[S@](C)(=O)=NS(=O)(=O)c1cncc(B(O)O)c1)NC(=O)OC(C)(C)C 2282095188 ZYLFXAHVXXITOB-ZHZWEUQESA-N 421.306 -0.539 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](NS(=O)(=O)c3sccc3B(O)O)[C@H]2C1 2282703485 WYPIKRBZRFLUAQ-USWWRNFRSA-N 418.302 -0.660 50 10 HBGE CC(C)(C)OC(=O)N1CC(O)(CCNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282724595 ZHCQXLJSBMLIEA-UHFFFAOYSA-N 400.262 -0.983 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)N[C@@H]1COCC[C@@H]1NC(=O)OC(C)(C)C 2282742562 DTLJJMLKPBUFJK-WDEREUQCSA-N 420.318 -0.303 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NC[C@@]2(C)CCCN2C(=O)OC(C)(C)C)n1 2282743703 SGAFOCXOGIEFPH-OAHLLOKOSA-N 402.282 -0.832 50 10 HBGE CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COCCO2)cc1 745777843 NTCIZHDNUVNNCA-OAHLLOKOSA-N 414.484 -0.039 50 10 HBGE COc1ccc(C(=O)CCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OC 758037308 ZIZCNFUADMUFMX-SNVBAGLBSA-N 401.441 -0.248 50 10 HBGE CN(C)C(=O)N1CCN(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1 793220927 HZWRJYHRZJGSCL-UHFFFAOYSA-N 406.443 -0.047 50 10 HBGE CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1156184268 OUQZWKYUWPNEKF-INIZCTEOSA-N 410.496 -0.001 50 10 HBGE COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCO[C@H]2C)cc1OC 1299885112 LRNNQZHCEXLJIG-AAEUAGOBSA-N 415.468 -0.055 50 10 HBGE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CS(C)(=O)=O)c(OC)c1 1630863168 ZWSUXVLAUPVLFW-ZDUSSCGKSA-N 413.452 -0.500 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1cscc1B(O)O 2267624928 HDUBRTMCLHGREI-SNVBAGLBSA-N 406.291 -0.658 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H]2COC[C@@H]21 2282070931 LGDTYFINKXBSJQ-RYUDHWBXSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NS(=O)(=O)c2ccc(B(O)O)cc2)C1 2282086205 JCQICGUJDQZVEV-STQMWFEESA-N 402.253 -0.008 50 10 HBGE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)c1c(Cl)cccc1B(O)O 2282424824 HMYIEKJXDUQCQA-SNVBAGLBSA-N 422.696 -0.474 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCCN(C(=O)OC(C)(C)C)CCC1 2282706729 PRAYJFZHELNPRC-UHFFFAOYSA-N 402.282 -0.879 50 10 HBGE COc1ccc(C=C(C#N)C(=O)N(CC(=O)O)[C@@H]2CS(=O)(=O)C[C@@H]2O)cc1OC 2324522896 FUILCWGUOLEYLP-KGLIPLIRSA-N 424.431 -0.318 50 10 HBGE O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)c1 762475587 RUVZJYABTKEGSO-SNVBAGLBSA-N 409.214 -0.128 50 10 HBGE C[C@@H](COc1ccccc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765730556 LQWAQIBFOUNRQD-LBPRGKRZSA-N 414.422 -0.704 50 10 HBGE COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3OCCN(C)C3=O)n[nH]2)cc1OC 1153183150 YTNIWYHMUHZHCU-HNNXBMFYSA-N 403.395 -0.288 50 10 HBGE C[C@@H]1C=C[C@@H]2C(=O)N(CC(F)(F)F)C(=O)[C@@H]2[C@@H]1C(=O)NNC(=O)[C@@H]1COCCO1 1445052242 QSXACELBSPKPRQ-IIRVCBMXSA-N 419.356 -0.465 50 10 HBGE COCCOCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 1557860659 XGIUOTIUEKJBDA-UHFFFAOYSA-N 406.486 -0.824 50 10 HBGE CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CS(=O)(=O)C2)c1 1623860489 KILKUPSTNJULQA-UHFFFAOYSA-N 403.482 -0.477 50 10 HBGE CN(C)[S@](=O)(=NC(=O)C1(B(O)O)CC1)N1CCN(C(=O)OC(C)(C)C)CC1 2282295762 QIHYQTBZZRARJF-HHHXNRCGSA-N 404.298 -0.068 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](OCCNS(=O)(=O)c2cscc2B(O)O)C1 2282378816 LEJUBFAFCDYCEO-LLVKDONJSA-N 420.318 -0.268 50 10 HBGE CCc1nn(C)c(C(=O)N=[S@](C)(=O)CCNC(=O)OC(C)(C)C)c1B(O)O 2282393384 KCQPWCTVEBQMBL-HHHXNRCGSA-N 402.282 -0.575 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C 2282437645 VKHCXXQECMRWOX-JNVGHINZSA-N 402.282 -0.440 50 10 HBGE O=C(O)CN(CCNS(=O)(=O)Cc1ccsc1B(O)O)Cc1ccccc1 2284399351 JKHKYTSPYKNUJF-UHFFFAOYSA-N 412.298 -0.566 50 10 HBGE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1=O 750661031 ACSPCBNIHDVLCX-MDZLAQPJSA-N 408.484 -0.067 50 10 HBGE COc1ccc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)c(OC)c1 753067373 AJWXJYAAYVUFKS-LLVKDONJSA-N 400.457 -0.071 50 10 HBGE Cc1nc2ccc(C(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2n1C 793672480 BMYSIAPVKQQPLU-UHFFFAOYSA-N 424.421 -0.910 50 10 HBGE O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCO1 817215421 XVAKIPZLFLBVJL-REWJHTLYSA-N 401.485 -0.578 50 10 HBGE O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)[C@@H]1CCC(=O)N1 1287237717 GRUFQRFMQFCNQI-NSHDSACASA-N 418.269 -0.210 50 10 HBGE Cn1cc([C@@H]2C[S@](=O)CCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)cn1 1307739873 FKPZVVGBHFBGES-DEXQXJORSA-N 400.464 -0.142 50 10 HBGE Cn1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1 1329620517 LOGZNTSUADTCMR-UHFFFAOYSA-N 407.456 -0.256 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@]2(CC(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)=NO2)C1 1454061121 JWQRBMYKLOHUSW-VOJFVSQTSA-N 409.443 -0.042 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCCO3)c2)CCN1 1523619250 JUZNIYHJVLCWIG-CQSZACIVSA-N 410.452 -0.863 50 10 HBGE CNC(=O)[C@H](CNC(=O)NNC(=O)[C@@H]1COCCO1)Cc1ccc(OC)c(F)c1 1673913098 LKKQYJANMXMFRM-WFASDCNBSA-N 412.418 -0.515 50 10 HBGE O=C(Cc1c[nH]c2ccccc12)NNC(=O)NC[C@]12COCCN1C(=O)COC2 1684746722 PRTSZZKORBXMDS-LJQANCHMSA-N 401.423 -0.331 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2CN(S(=O)(=O)Cc3ccsc3B(O)O)C[C@H]12 2267373210 AFIXMSVPBXGKLU-QWRGUYRKSA-N 402.303 -0.287 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2282077165 RONNUODYEANGKA-LLVKDONJSA-N 402.282 -0.832 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2282079644 YXBVRRNLVCRCEM-ZYHUDNBSSA-N 402.282 -0.928 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1 2282241448 RYWKICUDIRCQFG-BLBHWQHRSA-N 400.266 -0.653 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N(CCNC(=O)OC(C)(C)C)OC 2282416507 XAKKUKLZRZZCPL-UHFFFAOYSA-N 404.250 -0.548 50 10 HBGE CN([C@@]1(CNC(=O)OC(C)(C)C)CCOC1)S(=O)(=O)c1ccc(B(O)O)s1 2282712366 OVAWWINIDXNJFV-OAHLLOKOSA-N 420.318 -0.268 50 10 HBGE C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NS(=O)(=O)Cc1ncsc1B(O)O 2282858062 RGVNILWYNOWDFH-JTQLQIEISA-N 419.334 -0.112 50 10 HBGE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ncc(B(O)O)s1)[C@H](O)C(C)(C)C 2284063379 QLEXHKCNHAWOJM-RYUDHWBXSA-N 401.294 -0.261 50 10 HBGE CC(C)(C)OC(=O)NC[C@]1(Oc2ccc(B(O)O)cn2)CCCS(=O)(=O)C1 2368395199 TYKYRRUPHOSZDQ-MRXNPFEDSA-N 400.262 -0.388 50 10 HBGE O=C(NCC1CC1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 731617450 KXKMUUIUWKADSY-MGPQQGTHSA-N 400.501 -0.164 50 10 HBGE C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)[C@@H]2COCCO2)CC1 746004898 YNDHCDOXGULSGG-BBRMVZONSA-N 423.445 -0.074 50 10 HBGE O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)[C@H]1COCCO1 752179860 AWHHDKYFPGOYAB-MRVPVSSYSA-N 412.877 -0.574 50 10 HBGE COCCN(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)cc(OC)c1OC 1297761077 UFJLOYKVBHMFEW-UHFFFAOYSA-N 417.484 -0.052 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc(N(C)C)cn2)CC1 1306648158 FLRZZSDSGSRJJA-UHFFFAOYSA-N 420.499 -0.369 50 10 HBGE O=C(NNC(=O)[C@H](O)[C@](O)(c1ccccc1)C(F)(F)F)[C@@H]1CCS(=O)(=O)C1 1440705211 PJMUFNMWAVQTQL-OLUVUFQESA-N 410.370 -0.621 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\CN3CCOCC3)cc2)CC1 1446388631 RQBUXSSFZQEESF-IHWYPQMZSA-N 423.539 -0.046 50 10 HBGE COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NN(C)[C@@H](C)CO 1452346360 DQHKRWXXLYNKSA-JSGCOSHPSA-N 401.485 -0.428 50 10 HBGE Cn1cc(Br)cc1C(=O)NNC(=O)NC[C@]12COCCN1C(=O)OC2 1683539278 GVEHPABHORPVMN-CQSZACIVSA-N 416.232 -0.047 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NS(=O)(=O)c3cscc3B(O)O)[C@H]2C1 2267387106 DMPAICDSWDNXKQ-NHCYSSNCSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)Cc2ccsc2B(O)O)COC1 2267412256 KHEXBBRFWQYMSV-UHFFFAOYSA-N 406.291 -0.859 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2267626405 HTYPSXSLDVZXDB-NXEZZACHSA-N 405.307 -0.502 50 10 HBGE Cn1nc(C(=O)N[C@H]2COC[C@H]2CNC(=O)OC(C)(C)C)c(B(O)O)c1Cl 2281655911 CWKCYVGBQVXJDK-BDAKNGLRSA-N 402.644 -0.977 50 10 HBGE C[C@H](CCCN(C)C(=O)OC(C)(C)C)NS(=O)(=O)c1c(B(O)O)cnn1C 2282077160 ROASUNPCRINZHY-LLVKDONJSA-N 404.298 -0.586 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)N1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 2282078132 DSZZYRVUVIBILC-UHFFFAOYSA-N 402.282 -0.880 50 10 HBGE 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CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282363303 GDUAFCZWUZLODH-NWDGAFQWSA-N 420.680 -0.410 50 10 HBGE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)c2sccc2B(O)O)CCOCC1 2282699332 JBCFDACHTCKALT-UHFFFAOYSA-N 420.318 -0.220 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NC[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C 2282713095 ZVWMLWVDUDOXQA-SNVBAGLBSA-N 402.282 -0.976 50 10 HBGE O=S(=O)(Cc1ccsc1B(O)O)NC[C@]1(O)CCN(Cc2ccccc2)C1 2282857769 MPIPXJGFEGGXIP-QGZVFWFLSA-N 410.326 -0.516 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1ccccc1B(O)O 2282863192 OJEWGGURVNFEIH-KGLIPLIRSA-N 400.262 -0.922 50 10 HBGE CO[C@H](CNC(=O)OC(C)(C)C)CNS(=O)(=O)c1cc(B(O)O)ccc1C 2365421410 HTRZOWIWRLRAGE-CYBMUJFWSA-N 402.278 -0.507 50 10 HBGE Cc1ccc(F)cc1NC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 755380476 DQTRFYFYFICTMB-UHFFFAOYSA-N 403.374 -0.266 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)N1 1131723556 XYCBARIEVXLJFX-BXUZGUMPSA-N 412.443 -0.348 50 10 HBGE Cc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n[nH]1 1299908008 RQCMLMTWRARUAO-UHFFFAOYSA-N 407.452 -0.257 50 10 HBGE C#CCN1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1 1479314262 SYRHSFDGJXFLPA-HNNXBMFYSA-N 407.496 -0.022 50 10 HBGE CN(CC(=O)NNC(=O)CSc1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 1557376482 GBOJUFZMZKHGQR-LLVKDONJSA-N 416.481 -0.047 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 1587515915 CEWYYVLPLNYJTH-UHFFFAOYSA-N 408.480 -0.700 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F 1682008387 IQJNASJNVCNGRR-MWLCHTKSSA-N 406.411 -0.002 50 10 HBGE Cn1nnc(B(O)O)c1C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(F)(F)F 2266959811 USYGUCVYUCVJQS-JTQLQIEISA-N 415.137 -0.918 50 10 HBGE Cc1c(C(=O)N(C)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c(B(O)O)nn1C 2267027843 CKWAXTXYOPPABY-HNNXBMFYSA-N 400.244 -0.109 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C(CNS(=O)(=O)c3sccc3B(O)O)[C@H]2C1 2267470640 AFKUUDKYVUWLND-GHMZBOCLSA-N 402.303 -0.181 50 10 HBGE O=S(=O)(NC[C@@]1(O)CCCN(Cc2ccccc2)C1)c1cc(B(O)O)cs1 2282065611 NMVGYQBBNXHKPZ-KRWDZBQOSA-N 410.326 -0.267 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(B(O)O)cc2F)[C@@H]2C[C@@H]21 2282739109 DHCIOZMUUCHFHE-QWHCGFSZSA-N 400.237 -0.112 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(C#N)cn2C)CC1 751391449 JUFUJBMXSLPRJR-UHFFFAOYSA-N 403.468 -0.015 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=S)Nc2cccc(F)c2F)n(C)c1=O 1253546202 GQMCHOAHSOGJSK-UHFFFAOYSA-N 423.405 -0.270 50 10 HBGE CCOC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)[C@H]2C(=O)Nc3ccccc3C2=O)C1 1556767447 ONPDFXLIWWTYTH-MLGOLLRUSA-N 416.434 -0.140 50 10 HBGE COC(=O)c1ccsc1N1CC[C@H](NC(=O)c2cc(B(O)O)ccc2F)C1=O 1587731330 AGEKMOLTTZNGNP-ZDUSSCGKSA-N 406.200 -0.111 50 10 HBGE O=C(NNC(=O)C1(CC(=O)N2CCOCC2)CCCC1)[C@H]1CCS(=O)(=O)C1 1623509137 FIQHZGQMSDDGDQ-ZDUSSCGKSA-N 401.485 -0.622 50 10 HBGE CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CS(C)(=O)=O)c1 1634355133 DRVPNCZFYCPNGN-UHFFFAOYSA-N 421.497 -0.469 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3cccnn23)CC1 1650831085 AKRWMXAVWYIOJM-UHFFFAOYSA-N 416.467 -0.183 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O 1652258190 LVPHQACEWBYKRU-VXGBXAGGSA-N 404.489 -0.043 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCO[C@H]2CCOC2)c1 1684327619 UVYJFBYVYFVNHL-ZDUSSCGKSA-N 400.457 -0.314 50 10 HBGE C[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)CC[C@@H]1NC(=O)C(F)(F)F 2267387983 QVLROGCHIGKSDM-APPZFPTMSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NC(=O)c2n[nH]cc2B(O)O)C1 2281836927 WEKGSNADASEXTN-FLESLCNUSA-N 400.266 -0.273 50 10 HBGE Cc1c(C(=O)N=[S@@]2(=O)CC[C@@H](NC(=O)OC(C)(C)C)C2)nn(C)c1B(O)O 2282293872 PBLBYGSMXWAWMU-GFVXYOJSSA-N 400.266 -0.686 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1nn(C)c(Cl)c1B(O)O 2282296477 ATJFZBWAPLSCSN-DTWKUNHWSA-N 402.644 -0.883 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)Cc1ccsc1B(O)O 2282335612 RSUVAPYUNLXDDJ-NWDGAFQWSA-N 420.318 -0.518 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)sc1B(O)O 2282378096 AKCUYSFUIWEOJM-OAHLLOKOSA-N 410.326 -0.084 50 10 HBGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC(=O)c1nccnc1B(O)O 2283065347 MYAGCVIHFANHEK-HHHXNRCGSA-N 400.266 -0.301 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)C(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C 2283950176 IGKBPHDBVQAHKD-PSASIEDQSA-N 400.266 -0.889 50 10 HBGE O=C(O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)cc1Br 747618496 WMYBREZKNLDFHS-JTQLQIEISA-N 409.214 -0.128 50 10 HBGE O=C(c1cccnc1OCCO)N1CCN(S(=O)(=O)CBr)CC1 1137882076 KUNPLEDIJWWJIC-UHFFFAOYSA-N 408.274 -0.107 50 10 HBGE C=C(CN(C)C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1538973393 YQWUEAJTUZSCKC-UHFFFAOYSA-N 424.523 -0.095 50 10 HBGE CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)CN2CCCC2=O)cc1 1632320933 JZSAVSCPZMZVIM-UHFFFAOYSA-N 412.468 -0.015 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNS(=O)(=O)Cc1ncsc1B(O)O 2267371984 IFCXLYICPMBACK-VHSXEESVSA-N 405.307 -0.597 50 10 HBGE CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1csnc1B(O)O 2281885519 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742643784 DDFMOOUNTWCISN-CZPYZCIJSA-N 403.391 -0.373 50 10 HBGE NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COCCO2)c1 799535826 ZIWFIGQLKXJFFF-JTQLQIEISA-N 408.230 -0.727 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 1464440436 BBVWOJPTPXSYHW-VXGBXAGGSA-N 419.504 -0.945 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN3CCC(CO)CC3)CC2)cc1 1629797641 VCAHJEMTWPHGDA-UHFFFAOYSA-N 417.554 -0.036 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnn3ncccc23)CC1 1650831205 JANLPTSMLDUSCG-UHFFFAOYSA-N 416.467 -0.183 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626765 NKDHZFDLSVLIDQ-NXEZZACHSA-N 405.307 -0.312 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2ccc(B(O)O)s2)[C@@H](S(C)(=O)=O)C1 2281618060 DPLJJSWIDGOZKS-ONGXEEELSA-N 418.302 -0.810 50 10 HBGE C[C@H](NC(=O)OC(C)(C)C)c1nc(NS(=O)(=O)c2sccc2B(O)O)n[nH]1 2282078639 LLYXVBHMYFUUKB-ZETCQYMHSA-N 417.278 -0.068 50 10 HBGE C[C@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@H]1CNC(=O)OC(C)(C)C 2282247649 ITJILOBWOMJMDU-VHSXEESVSA-N 400.672 -0.014 50 10 HBGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NS(=O)(=O)c1ccc(B(O)O)cc1F 2282420397 YOIFFQMYYSEWMC-AREMUKBSSA-N 424.281 -0.183 50 10 HBGE Cn1nc(B(O)O)cc1S(=O)(=O)NCCCC1CN(C(=O)OC(C)(C)C)C1 2282708693 QCLODCYJAAVCKX-UHFFFAOYSA-N 402.282 -0.975 50 10 HBGE Cn1cc(B(O)O)c(S(=O)(=O)NCCCN(C(=O)OC(C)(C)C)C2CC2)n1 2282730803 HXXWTAYPHAADAJ-UHFFFAOYSA-N 402.282 -0.832 50 10 HBGE Cn1cc(C(N)=O)cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1 755428128 NKNRMZUCGGHSAC-UHFFFAOYSA-N 407.452 -0.098 50 10 HBGE O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1COCCO1 780396870 UPUDFIBSHVQBAS-JTQLQIEISA-N 418.371 -0.295 50 10 HBGE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 1290349521 SULXODPHUIEFSP-RYUDHWBXSA-N 404.489 -0.880 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)[C@@H]3CCC(=O)N3)C2)s1 1461838068 PAGHNNZDWDSKLE-RYUDHWBXSA-N 414.509 -0.117 50 10 HBGE CS(=O)(=O)[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 1684806471 KQEOLJRWBOTGJB-MGCOHNPYSA-N 403.486 -0.501 50 10 HBGE CC(C)(C)OC(=O)N1CCSC[C@@H](NS(=O)(=O)c2ccccc2B(O)O)C1 2282104310 YCHYESDRWFJDKV-LBPRGKRZSA-N 416.330 -0.003 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)N1CC(N(C)C(=O)OC(C)(C)C)C1 2282736373 PGXNAKYOLVQMEN-UHFFFAOYSA-N 400.262 -0.385 50 10 HBGE O=C(c1ccc(I)cc1-n1cnnn1)N1CC[C@H](B(O)O)C1 864231770 RYRSAHILLZWNHB-QMMMGPOBSA-N 412.984 -0.044 50 10 HBGE CN1CC[C@](Cc2ccccc2)(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)C1=O 1292038883 OGJRUARMYORLSV-KSSFIOAISA-N 408.480 -0.405 50 10 HBGE O=C(CCc1ccccc1N1CCOCC1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 1583280585 CPMVXZRCKQMVMX-HNNXBMFYSA-N 410.496 -0.027 50 10 HBGE CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)c1 1596923198 LCAQBKHGUOLVMH-CQSZACIVSA-N 412.468 -0.222 50 10 HBGE CS(=O)(=O)CC(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Br 1642619519 LPVCRMKINKOSBJ-UHFFFAOYSA-N 413.271 -0.342 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C 1643603308 ZEJZSMBDINMVGC-UTUOFQBUSA-N 407.489 -0.113 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3cn(C)cn3)nc2)CC1 1673463807 JIKJDBSYOOYWNL-UHFFFAOYSA-N 422.515 -0.380 50 10 HBGE C[C@H]1CN(S(=O)(=O)c2sccc2B(O)O)CC[C@H]1NC(=O)C(F)(F)F 2267200151 UEUYXEVZRXSYLA-IONNQARKSA-N 400.209 -0.495 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](F)CN1S(=O)(=O)Cc1ncsc1B(O)O 2282356936 CFKWJMAWQNFSQC-NXEZZACHSA-N 423.297 -0.410 50 10 HBGE C[C@@H]1CN(S(=O)(=O)Cc2ncsc2B(O)O)C[C@@H](C)N1C(=O)OC(C)(C)C 2282380801 OEWSKWRRUHBUKC-GHMZBOCLSA-N 419.334 -0.018 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](F)CN1S(=O)(=O)c1ccc(B(O)O)cc1 2282714926 YPTHNTBYXJKFRJ-QWHCGFSZSA-N 402.253 -0.008 50 10 HBGE COc1ccc(S(=O)(=O)NC2(C)CN(C(=O)OC(C)(C)C)C2)cc1B(O)O 2282736371 PGIXGQVFBZDQGB-UHFFFAOYSA-N 400.262 -0.337 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NS(=O)(=O)Cc1ccsc1B(O)O 2334266908 JSQIXGAZPPUAOX-SRVKXCTJSA-N 402.303 -0.145 50 10 HBGE O=C(NNC(=O)N1CCN2C(=O)OCC[C@@H]2C1)C1CCN(c2ncccn2)CC1 763499626 UGEBPWWPJWQNGA-CQSZACIVSA-N 403.443 -0.040 50 10 HBGE C[C@](O)(Cn1ccccc1=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1 790918651 CARLGAXWLJVPMT-AWEZNQCLSA-N 422.301 -0.574 50 10 HBGE Cn1c(CC(=O)NNC(=O)NCCS(=O)(=O)N2CCCC2)nc2ccccc21 1313347271 SHASOWUTTXRHJC-UHFFFAOYSA-N 408.484 -0.128 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)CNC(=O)c1cccs1)CS(=O)(=O)CC2 1536533660 SAKSIOPTARCFEK-UHFFFAOYSA-N 411.465 -0.857 50 10 HBGE C[C@]1(C(=O)NNC(=O)[C@@H]2CCC(=O)N2)C[C@@H](O)CN1C(=O)OCc1ccccc1 1630431260 BWBRVIVJQIKWHT-BIENJYKASA-N 404.423 -0.426 50 10 HBGE Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN3CC(=O)N(C)C3=O)CC2)cc1 1635505261 QBFOYERSHVDGAF-UHFFFAOYSA-N 416.482 -0.846 50 10 HBGE CC(C)(C)OC(=O)N1CC(n2nncc2C(=O)NNC(=O)CN2CCCC2=O)C1 1643804068 CIKNIMKXFSNDPV-UHFFFAOYSA-N 407.431 -0.547 50 10 HBGE COC(=O)[C@@H]1C[C@H](Oc2ncc(B(O)O)cn2)CN1C(=O)OCc1ccccc1 2231654201 APIOVTYZFCDBCX-GJZGRUSLSA-N 401.184 -0.512 50 10 HBGE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NS(=O)(=O)c1cscc1B(O)O 2267389477 PBRLYINFPOOMHH-WDEREUQCSA-N 406.291 -0.660 50 10 HBGE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)c1cscc1B(O)O 2267625101 JWORKVFDVAXXJI-VXNVDRBHSA-N 400.209 -0.352 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2282384294 LGMFYTCPMFEBDJ-QWRGUYRKSA-N 419.334 -0.064 50 10 HBGE CN(Cc1ccc(B(O)O)s1)C(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360532869 QORAUZBKRFLBOP-NSHDSACASA-N 420.318 -0.676 50 10 HBGE Nc1nonc1-n1nnc(C(=O)NN=Cc2cccc(O)c2)c1CN1CCOCC1 254751299 WPULDKYASRDLDV-UHFFFAOYSA-N 413.398 -0.466 50 10 HBGE CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1 816885129 RBCINKCRKKVUQP-GFCCVEGCSA-N 406.468 -0.092 50 10 HBGE Cn1cc([C@@H]2[C@@H](CNC(=O)NNC(=O)C(=O)NC3CC3)CC(=O)N2C(C)(C)C)cn1 1253006452 VKRFGXNSWSXYNT-ABAIWWIYSA-N 419.486 -0.283 50 10 HBGE O=C1CSC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)N1 1544597550 LBHDODLXNJYVBC-LBPRGKRZSA-N 400.482 -0.618 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2CNS(=O)(=O)c1cc(B(O)O)cs1 2267612721 NLULUNNPKALXCX-USWWRNFRSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2267624681 CJPOTPBCZKUWCF-UHFFFAOYSA-N 403.291 -0.652 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)N1C[C@H](NC(=O)OC(C)(C)C)CC1(C)C 2282070890 KUUKNRHRRFNJIT-SNVBAGLBSA-N 402.282 -0.834 50 10 HBGE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CCNC(=O)C2CC(B(O)O)C2)C1 2282489294 QSPMOXYYNRYOOL-WXRRBKDZSA-N 404.294 -0.220 50 10 HBGE CC(C)(C)OC(=O)N1CC(CCO)(CNS(=O)(=O)c2cc(B(O)O)cs2)C1 2282700216 PDTOYGBIXHBXOX-UHFFFAOYSA-N 420.318 -0.674 50 10 HBGE O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(B(O)O)cs1 2282701656 YAGPPIWEXXPEOO-INIZCTEOSA-N 410.326 -0.003 50 10 HBGE CC(C)(C)OC(=O)N1CCC[C@@](CO)(NS(=O)(=O)c2cc(B(O)O)cs2)C1 2282704949 RGRVSNYEWRZHHL-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNS(=O)(=O)c1ccc(F)cc1B(O)O 2282728713 HBHQWLRFUYTUOM-QWRGUYRKSA-N 402.253 -0.055 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)c1scc(B(O)O)c1Cl 2359262596 GHPOUPLBOPNOKN-KKZNHRDASA-N 420.680 -0.848 50 10 HBGE 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CCON(C)C(=O)CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 1478921037 ATRXDVFYFFJSSA-UHFFFAOYSA-N 400.461 -0.358 50 10 HBGE Cc1cn2nc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2c(=O)[nH]1 1637456343 SFPHGMIBPRWWPC-UHFFFAOYSA-N 418.273 -0.229 50 10 HBGE CN(C)CC#CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1639130143 PGKZNDLCLVHVQZ-UHFFFAOYSA-N 407.496 -0.020 50 10 HBGE CC(=O)NCC(=O)N1CCCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1 1659723219 MPAXYMYMDILODL-UHFFFAOYSA-N 409.874 -0.229 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NS(=O)(=O)c2ccc(B(O)O)s2)C1 2267207727 TZIOTRBVJBIJSM-UWVGGRQHSA-N 406.291 -0.924 50 10 HBGE Cc1sc(B(O)O)cc1S(=O)(=O)NCC1(NC(=O)OC(C)(C)C)COC1 2267382031 DVCKMFBGAVAUQA-UHFFFAOYSA-N 406.291 -0.692 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@H]1CNS(=O)(=O)c1cc(B(O)O)cs1 2267609052 KSHNQGLCCAQNQZ-MVWJERBFSA-N 402.303 -0.038 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H]1NS(=O)(=O)Cc1ncsc1B(O)O 2267626560 KFUAAWMAKUFQGA-VHSXEESVSA-N 405.307 -0.454 50 10 HBGE CN(C[C@H](O)COCc1ccccc1)S(=O)(=O)Cc1ncsc1B(O)O 2267627495 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402.498 -0.004 50 10 HBGE CCOc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)N(C)C)cc1OC 1228763459 BBRHJLBIKWNHHU-UHFFFAOYSA-N 403.461 -0.566 50 10 HBGE CO[C@]1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CCS(=O)(=O)C1 1479381620 OKQVRJGCHSUWKE-LBPRGKRZSA-N 409.262 -0.075 50 10 HBGE CN1CCN(C(=O)NNC(=O)[C@H](CCC(N)=O)NC(=O)CCC2CCCC2)CC1 1626125618 JIEHBUNBOQEPEW-HNNXBMFYSA-N 410.519 -0.305 50 10 HBGE CC(C)(C)OC(=O)CN1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1=O 1628913125 XAJPHBPORIZYOQ-NEPJUHHUSA-N 417.484 -0.851 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC3(O)CCC3)CC2)cc1 1629793482 SWRMTVKVOAJOOB-UHFFFAOYSA-N 424.523 -0.246 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C 1643603306 ZEJZSMBDINMVGC-SRVKXCTJSA-N 407.489 -0.113 50 10 HBGE CC[C@H]1[C@@H](NS(=O)(=O)c2cc(B(O)O)nn2C)CCN1C(=O)OC(C)(C)C 2282070002 XPQWVMXICUYPDW-QWRGUYRKSA-N 402.282 -0.834 50 10 HBGE COc1ccc(S(=O)(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1B(O)O 2282365488 ADRKHXDMBZHKFJ-PHIMTYICSA-N 400.262 -0.291 50 10 HBGE C=C(CS(=O)(=O)NCC(C)(C)N1CCN(C(=O)OC(C)(C)C)CC1)B(O)O 2282721397 QIVJCJSHHPXPPU-UHFFFAOYSA-N 405.326 -0.195 50 10 HBGE CO[C@H]1CN(S(=O)(=O)c2cc(B(O)O)sc2C)C[C@H]1NC(=O)OC(C)(C)C 2282726101 MTKWBDPRGVZIAV-MNOVXSKESA-N 420.318 -0.351 50 10 HBGE CN(CCOCCNS(=O)(=O)Cc1ncsc1B(O)O)C(=O)OC(C)(C)C 2282738238 RQPXETGNPBZUAR-UHFFFAOYSA-N 423.322 -0.874 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNS(=O)(=O)CCOCCCl 2312322371 ONFOFSMHTXABTL-UTUOFQBUSA-N 402.897 -0.498 50 10 HBGE O=C(NNC(=O)[C@H]1COCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 755354248 OJVWHFJEVVGUFI-CQSZACIVSA-N 414.440 -0.724 50 10 HBGE Cn1cc(C[C@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1 786689674 WFVYVALBVFJKLX-INIZCTEOSA-N 421.479 -0.431 50 10 HBGE O=C(NNC(=O)[C@H]1CCN(c2ccc(F)c(F)c2)C1=O)N[C@H]1CCS(=O)(=O)C1 919888753 REIRJDIVVFOYET-GXSJLCMTSA-N 416.406 -0.165 50 10 HBGE CS(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 1334937592 UCGDNLONHGRGGV-AAEUAGOBSA-N 415.493 -0.431 50 10 HBGE O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1ccc(B(O)O)cc1 1540818211 PFQFDVPOFNXZKL-UHFFFAOYSA-N 418.280 -0.542 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)[C@@H]2[C@H]3CCCCCC[C@H]32)n(C)c1=O 1630996557 MGPIWLBBSQQWBB-IMRBUKKESA-N 402.455 -0.203 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 2282079109 RPMVCERQAGNJMU-MNOVXSKESA-N 402.282 -0.928 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(B(O)O)s2)C[C@@H]1CO 2282086620 OHZIQMFWNLUDFE-GHMZBOCLSA-N 420.318 -0.676 50 10 HBGE COCC[C@H](CNS(=O)(=O)c1ccccc1B(O)O)NC(=O)OC(C)(C)C 2282103375 PVXAPTJBXAOUTI-GFCCVEGCSA-N 402.278 -0.426 50 10 HBGE CCC1(CNS(=O)(=O)Cc2ncsc2B(O)O)CN(C(=O)OC(C)(C)C)C1 2282741160 KFBZRXPCJIHNFU-UHFFFAOYSA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1C[C@@](F)(CNS(=O)(=O)Cc2ncsc2B(O)O)C1 2282741629 QEPSCESCMNYHEG-KMHCFJFGSA-N 423.297 -0.362 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2362081075 OKVGZQIVMMYUCD-LLVKDONJSA-N 404.298 -0.682 50 10 HBGE O=C(NCCCN1CCN(Cc2ccccc2)CC1)NNC(=O)[C@@H]1COCCO1 745502845 FLDVRXFNXPGOIK-SFHVURJKSA-N 405.499 -0.060 50 10 HBGE CN(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cncn1C 1135502777 SEFVPIZXHMRTOH-HNNXBMFYSA-N 408.484 -0.266 50 10 HBGE CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 1135535034 NRWWQMFKMLXCHQ-LBPRGKRZSA-N 421.479 -0.151 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2c(Br)cnn2c1 1306513686 ABXICOJHRVDMEK-ZETCQYMHSA-N 404.246 -0.205 50 10 HBGE Cn1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1 1326740910 KWDORDMUKJQIMF-UHFFFAOYSA-N 407.456 -0.256 50 10 HBGE CN1CC[C@H](C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)[C@H](c2cnn(C)c2)C1 1635374935 KMMCDPHUOYRWOC-BZSNNMDCSA-N 404.515 -0.144 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(C(=O)OC(C)(C)C)CCSCC1 1638300687 VOXFIBWBYCYWAN-JTQLQIEISA-N 409.530 -0.073 50 10 HBGE Cc1csc(CC(=O)NNC(=O)CN(CCO)CCNC(=O)OC(C)(C)C)n1 1645224009 NEMPRFXHQDTKGL-UHFFFAOYSA-N 415.516 -0.040 50 10 HBGE Cc1nc(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)c(B(O)O)s1 2266896963 FKDSQSPYZPUVEE-CQSZACIVSA-N 419.268 -0.101 50 10 HBGE C[C@@H]1CN(C(=O)c2nn(C)nc2B(O)O)C[C@@H](C)N1C(=O)OCc1ccccc1 2267040709 YWPUBURSUOYZRC-CHWSQXEVSA-N 401.232 -0.634 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1cc(B(O)O)cs1 2267199519 NREJUAAMWNHFOC-NSHDSACASA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1cscc1B(O)O)C2 2272653164 LICJYEPEAMBUEX-MEBBXXQBSA-N 402.303 -0.037 50 10 HBGE Cn1cc(B(O)O)c(C(=O)N=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)n1 2282238829 MGWQSCZQMSYTCN-MHZLTWQESA-N 402.282 -0.357 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NCCCN(C)C(=O)OC(C)(C)C 2282721956 ZPPNFGJKNADSNQ-UHFFFAOYSA-N 402.278 -0.090 50 10 HBGE C[C@H](NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C)c1cscc1B(O)O 2360534513 YHHBXCYONKEGOZ-CABZTGNLSA-N 420.318 -0.457 50 10 HBGE COc1cc(NC(=O)NNC(=O)[C@H]2COCCO2)ccc1S(=O)(=O)N(C)C 757777633 XMPOSAXFRSWOCO-GFCCVEGCSA-N 402.429 -0.486 50 10 HBGE CCOC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 1135362098 VHENELGBCKKYNB-CYBMUJFWSA-N 415.450 -0.030 50 10 HBGE O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCS1(=O)=O 1137298962 IJUIKNZOJRDMLT-HNNXBMFYSA-N 408.480 -0.831 50 10 HBGE COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)CS(C)(=O)=O)CC1=O 1149616764 AHPJUJBPEPODPL-SECBINFHSA-N 403.844 -0.107 50 10 HBGE CC(=O)Nc1ccc(N2C[C@@H](C(=O)NNC(=O)CN3CCCC3=O)CC2=O)cc1 1587515855 ACODWITYMHKHDL-ZDUSSCGKSA-N 401.423 -0.232 50 10 HBGE C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCS1(=O)=O 1627449254 VEAVLURXBLSOOW-AVGNSLFASA-N 419.500 -0.017 50 10 HBGE COc1nccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 1650649804 HURDHSZRIZHXKU-UHFFFAOYSA-N 421.435 -0.419 50 10 HBGE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)CCOCCCl)C1 1877123060 GWGMTYNFXDDKEK-RKDXNWHRSA-N 409.814 -0.574 50 10 HBGE CC(C)(C)OC(=O)NCCCOCCNS(=O)(=O)c1cc(B(O)O)cs1 2267200825 HZAZPCUSXGGBNI-UHFFFAOYSA-N 408.307 -0.362 50 10 HBGE CO[C@H]1C[C@@H](CNS(=O)(=O)c2ccc(B(O)O)s2)N(C(=O)OC(C)(C)C)C1 2282084166 TYENXYPPDMRSHI-QWRGUYRKSA-N 420.318 -0.269 50 10 HBGE CC(C)(C)OC(=O)N1CCN(C(=O)C2(B(O)O)CCC2)[C@@H]2CS(=O)(=O)C[C@@H]21 2282165204 AOKQJDAZLURWAB-NEPJUHHUSA-N 402.278 -0.372 50 10 HBGE CC[C@@]1(NC(=O)c2c(B(O)O)nnn2C)CCCN(C(=O)OCc2ccccc2)C1 2282267829 MVRXXIPYTGZNDY-LJQANCHMSA-N 415.259 -0.194 50 10 HBGE Cc1nc(S(=O)(=O)N2C[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(B(O)O)n1C 2282344395 KSYXPHHZJCEWBH-MWLCHTKSSA-N 402.282 -0.915 50 10 HBGE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)c1ccc(B(O)O)cc1Cl 2282366153 JTJYSMJNBZOWIQ-HNNXBMFYSA-N 422.696 -0.426 50 10 HBGE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)c2c(Cl)cccc2B(O)O)COC1 2282369678 KBQRBVNNEKBIGX-UHFFFAOYSA-N 420.680 -0.408 50 10 HBGE Cn1ncc(CNC(=O)OC(C)(C)C)c1NS(=O)(=O)c1ccc(B(O)O)s1 2282702421 IFMBSSLDQVPRCZ-UHFFFAOYSA-N 416.290 -0.013 50 10 HBGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NS(=O)(=O)c2cscc2B(O)O)CCO1 2282728846 VXGHRWDNNFCVQV-QWRGUYRKSA-N 420.318 -0.222 50 10 HBGE CN(C[C@H]1CN(S(=O)(=O)c2cscc2B(O)O)CCO1)C(=O)OC(C)(C)C 2282733155 RFVADHMWEXSEON-NSHDSACASA-N 420.318 -0.316 50 10 HBGE C[C@H](C1CN(C(=O)OC(C)(C)C)C1)N(C)S(=O)(=O)Cc1ncsc1B(O)O 2282735856 HKTBMSFGLCGNAZ-SNVBAGLBSA-N 419.334 -0.160 50 10 HBGE Cc1cc(S(=O)(=O)N2CC[C@@H](NC(=O)C(F)(F)F)[C@H](C)C2)sc1B(O)O 2282738640 XPUWYCHLMBYVQW-RKDXNWHRSA-N 414.236 -0.186 50 10 HBGE COc1cc(CNC(=O)NNC(=O)[C@@H]2COCCO2)ccc1OCC(=O)N(C)C 745625827 WSRTZOYUPCOVPX-HNNXBMFYSA-N 410.427 -0.592 50 10 HBGE O=C(NCCNC(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1COCCO1 745793397 PPMUJLYMZXXFCR-LBPRGKRZSA-N 415.244 -0.075 50 10 HBGE CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)ccc1OC 751549627 WDMVKEDLDPUPJS-CQSZACIVSA-N 401.441 -0.554 50 10 HBGE COCc1ccsc1C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 778903055 RAMBJYASHLRPKQ-UHFFFAOYSA-N 406.424 -0.897 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)[C@H]3COCCO3)C2)cc1 915052343 QDUPQXREOYETAR-GDBMZVCRSA-N 411.480 -0.041 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)[C@H]1CCC(=O)N1 1287239077 SOXMWDAFYIGGFD-CQSZACIVSA-N 410.452 -0.944 50 10 HBGE CC(=O)N[C@@](C)(C(=O)NNC(=O)[C@@H]1COCCO1)c1ccc(S(C)(=O)=O)cc1 1294209191 SEDSUTGYOCWFAO-WMLDXEAASA-N 413.452 -0.996 50 10 HBGE Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccnn3)CC2)cn1C 1462492390 IXHQZLJXJQJXGT-UHFFFAOYSA-N 407.456 -0.620 50 10 HBGE O=C(CN1CCCC1=O)NNC(=O)c1ccc(-n2cc(Br)cn2)nn1 1471222265 MVCAMIYTQVEARK-UHFFFAOYSA-N 408.216 -0.192 50 10 HBGE Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1CCCOCC1 1682924825 XXELKDIGMZJBFC-UHFFFAOYSA-N 412.516 -0.046 50 10 HBGE C[C@H](c1nscc1B(O)O)N(C)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 2066517831 GSJNKCYKRNAPKA-SNVBAGLBSA-N 423.281 -0.558 50 10 HBGE Cn1nc(C(=O)N[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)cc1B(O)O 2267077591 YINWUBIZCWCZLU-LBPRGKRZSA-N 414.149 -0.313 50 10 HBGE C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1S(=O)(=O)Cc1ncsc1B(O)O 2267392747 NMBHWYTYVHVPPR-UWVGGRQHSA-N 405.307 -0.360 50 10 HBGE CN(CCCNC(=O)OC(C)(C)C)CCCNC(=O)c1ncsc1B(O)O 2282235242 RUOKXUKMRJLLBM-UHFFFAOYSA-N 400.310 -0.211 50 10 HBGE COC1(CCNC(=O)c2ccncc2B(O)O)CN(C(=O)OCc2ccccc2)C1 2282258019 AXIITRLGCSCYHN-UHFFFAOYSA-N 413.239 -0.081 50 10 HBGE COc1ccc(S(=O)(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)cc1B(O)O 2282355143 BQZHNFXIBNPCDC-LLVKDONJSA-N 402.278 -0.091 50 10 HBGE C=C(CS(=O)(=O)N1CCC[C@@]2(CN(C(=O)OC(C)(C)C)CCO2)C1)B(O)O 2282363632 PDTLBGJOSFGXND-MRXNPFEDSA-N 404.294 -0.014 50 10 HBGE Cc1cc(S(=O)(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)sc1B(O)O 2282372233 VUTUIYQSWGFHPW-KRWDZBQOSA-N 410.326 -0.348 50 10 HBGE CN([C@@H](CNC(=O)OC(C)(C)C)C1CC1)S(=O)(=O)c1cc(B(O)O)nn1C 2282709872 GKSOZPYZMVKEDJ-NSHDSACASA-N 402.282 -0.976 50 10 HBGE O=C(NNS(=O)(=O)c1cc2c(cc1Cl)OCCO2)[C@@H]1CCS(=O)(=O)C1 726765324 ZMGMXRJONIGTPT-MRVPVSSYSA-N 410.857 -0.145 50 10 HBGE O=C(NCCNC(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1COCCO1 745713276 CQTAEOKLOMUAOH-GFCCVEGCSA-N 415.244 -0.075 50 10 HBGE CCN1CCN(c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)CC1 746164595 YEUKBTUJMGVWRC-HNNXBMFYSA-N 409.512 -0.040 50 10 HBGE COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)N2CCN(C)CC2)cc1OC 1139084965 PJKRYXOPVJAXNU-UHFFFAOYSA-N 414.484 -0.144 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CC3CS(=O)(=O)C3)cc2)CC1 1151459142 BCEFVWYDTZXRCZ-UHFFFAOYSA-N 416.525 -0.500 50 10 HBGE CNC(=S)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 1298980110 BIZWKPQOCDQDRM-LBPRGKRZSA-N 422.554 -0.765 50 10 HBGE C[C@H]1OCC[C@H]1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 1452254108 GERUVAVSOOLRLE-DGCLKSJQSA-N 413.452 -0.301 50 10 HBGE CN1CCN(c2cc(C(=O)NNC(=O)[C@@H]3CCN3C3CCOCC3)ccn2)CC1 1456036616 GYMYPIBYQDMUCS-KRWDZBQOSA-N 402.499 -0.152 50 10 HBGE O=C(NNC(=O)c1cccnn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 1537026761 MHVZTBLXONXWBZ-UHFFFAOYSA-N 409.399 -0.289 50 10 HBGE CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCc3nc[nH]c3C2)CC1 1610947948 LLSZSEOTLXMYEM-CYBMUJFWSA-N 419.511 -0.011 50 10 HBGE CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)N=S(C)(C)=O)CC1 1654452680 XLOHAWYUXUBVNQ-GFCCVEGCSA-N 411.550 -0.842 50 10 HBGE O=C(CN1C[C@H]2C[C@H]1CN2C(=O)C(F)(F)F)N[C@H]1CS(=O)(=O)C[C@@H]1Cl 1884253449 KZVFDWUDZQBLSE-JXUBOQSCSA-N 403.810 -0.646 50 10 HBGE O=C(NC1CN(S(=O)(=O)c2ccc(B(O)O)cc2F)C1)OCc1ccccc1 2255756543 HIQVOPMWHFGGGC-UHFFFAOYSA-N 408.216 -0.195 50 10 HBGE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(S(=O)(=O)Cc3ncsc3B(O)O)C[C@@H]21 2267393866 FGMXKMMXLTWKNY-DOFRTFSJSA-N 403.291 -0.892 50 10 HBGE CC(C)(C)OC(=O)NCc1nnc(NS(=O)(=O)c2cc(B(O)O)cs2)o1 2267612265 GSPSEYAKVXMLNZ-UHFFFAOYSA-N 404.235 -0.364 50 10 HBGE Cn1ncc(B(O)O)c1S(=O)(=O)NC[C@@H]1CCCCN1C(=O)OC(C)(C)C 2282079157 SIDITGUEPYIOTF-NSHDSACASA-N 402.282 -0.832 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NS(=O)(=O)c2c(Cl)cccc2B(O)O)C1 2282369736 KUIQDSVZHDFHII-NEPJUHHUSA-N 420.680 -0.722 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)c2cc(B(O)O)c(F)cc2Cl)C1 2285948449 CIHXYBFOMQDOGV-OLZOCXBDSA-N 402.615 -0.131 50 10 HBGE Cc1nc(NC(=O)[C@H](CP(C)(C)=O)NC(=O)OC(C)(C)C)ncc1B(O)O 2360611906 LBWPDQHFDIZSCJ-NSHDSACASA-N 400.181 -0.081 50 10 HBGE CN(Cc1ccccc1B(O)O)S(=O)(=O)CCCN1C(=O)c2ccccc2C1=O 704304326 AUNJXCBGTRWDRK-UHFFFAOYSA-N 416.264 -0.186 50 10 HBGE CN(Cc1csc(B(O)O)c1)S(=O)(=O)CCN1C(=O)c2ccccc2C1=O 704370858 AFOPXVSXWWNWKF-UHFFFAOYSA-N 408.266 -0.514 50 10 HBGE O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)N1CCc2cccc(B(O)O)c21 712242885 DOPCMRXPFUEDPW-UHFFFAOYSA-N 414.248 -0.255 50 10 HBGE COc1ccccc1OCC(=O)NNC(=O)NCCCN1CCCS1(=O)=O 726276818 NRNKMBMNAINQRL-UHFFFAOYSA-N 400.457 -0.170 50 10 HBGE COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COCCO2)ccc1Br 745979026 YCNFGWZRBTZJKH-LLVKDONJSA-N 423.241 -0.039 50 10 HBGE C[C@H](COc1ccccc1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 765730531 LQWAQIBFOUNRQD-GFCCVEGCSA-N 414.422 -0.704 50 10 HBGE CCn1cnc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1 767851737 SZRXZQLUHZUBTF-UHFFFAOYSA-N 401.308 -0.109 50 10 HBGE CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)c1 1178420201 GJOSNQXDCJEZNR-HNNXBMFYSA-N 413.500 -0.284 50 10 HBGE C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)C2CCC2)cc1 1182609674 WQOYVUQSBVOIFE-JTQLQIEISA-N 403.482 -0.289 50 10 HBGE Cn1nc2c(c1C(=O)NNC(=O)Cn1cnc3ccccc31)CS(=O)(=O)CC2 1306191449 RUABQBLZBIUTNQ-UHFFFAOYSA-N 402.436 -0.298 50 10 HBGE CCn1cc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1 1446390542 YAZMATSIOMWNRO-UHFFFAOYSA-N 407.500 -0.080 50 10 HBGE Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)[C@H]3CCC(=O)N3)C2)s1 1461838080 PAGHNNZDWDSKLE-VXGBXAGGSA-N 414.509 -0.117 50 10 HBGE CN(CCOc1ccc(S(N)(=O)=O)cc1F)C(=O)c1cc(B(O)O)ccc1F 1638978272 YPDMRFLDEXMCBH-UHFFFAOYSA-N 414.195 -0.557 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2C(NS(=O)(=O)Cc3ccsc3B(O)O)[C@@H]2C1 2267375213 DJILXOIMHKQGHW-GHMZBOCLSA-N 402.303 -0.287 50 10 HBGE C[C@H]1[C@H](C)N(S(=O)(=O)c2c(B(O)O)cnn2C)CCN1C(=O)OC(C)(C)C 2282067107 XCJIZFATTFOGNB-QWRGUYRKSA-N 402.282 -0.882 50 10 HBGE CO[C@@H]1CN(C(=O)c2nn(C)c(Cl)c2B(O)O)C[C@@H]1NC(=O)OC(C)(C)C 2282153586 WEOUCBIRCTYWSP-DTWKUNHWSA-N 402.644 -0.883 50 10 HBGE Cc1nn(C)c(B(O)O)c1C(=O)N=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C 2282437647 VKHCXXQECMRWOX-RWXBIINUSA-N 402.282 -0.440 50 10 HBGE CC(C)(C)OC(=O)N1CCOC[C@H](NS(=O)(=O)Cc2ccsc2B(O)O)C1 2282857564 JWLUPESWLAIPHD-GFCCVEGCSA-N 420.318 -0.517 50 10 HBGE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cnc(B(O)O)s1)[C@@H](O)C(F)(F)F 2284130289 SFKZGPVDVCZVDK-HTQZYQBOSA-N 413.183 -0.744 50 10 HBGE C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1 793306471 ZUWJTXLSJQQJMU-AUUYWEPGSA-N 416.434 -0.247 50 10 HBGE C[C@@H]1[C@H](C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)[C@@H]1c1ccccc1 797743464 QVHPJMZUMYUBIJ-CQDKDKBSSA-N 410.434 -0.369 50 10 HBGE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)COc1ccccc1O 805836765 WCQDVQAMICHEGV-GFCCVEGCSA-N 400.457 -0.085 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)N[C@@H](C2CC2)C(F)(F)F)n(C)c1=O 808866658 CGBCEQSZADREHF-JTQLQIEISA-N 417.348 -0.895 50 10 HBGE C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCN(C)CC1 1256497160 TZBXVFCGZVDDAR-ZDUSSCGKSA-N 411.532 -0.440 50 10 HBGE CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnn(CCO)c3)cc2)CC1 1295261289 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414.236 -0.044 50 10 HBGE O=C(NC[C@@H]1CN(C(=O)OCc2ccccc2)CCO1)c1cc(B(O)O)ccc1O 2282968321 SXAKQGZYIKQOEP-MRXNPFEDSA-N 414.223 -0.161 50 10 HBGE N#CC(=Cc1ccc(Br)cc1)C(=O)N[C@@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O 2329656747 FJTFOJVKPWVKDQ-SRTKAIALSA-N 413.224 -0.728 50 10 HBGE C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)[C@@H]3COCCO3)CC2)C1 745999440 XQBJPJQMEBXYBY-OAGGEKHMSA-N 411.503 -0.545 50 10 HBGE O=C(NNC(=O)c1cc(F)cc(N2CCOCC2)c1)N[C@H]1CCS(=O)(=O)C1 1442182029 KCBGVGYJPHDBHE-ZDUSSCGKSA-N 400.432 -0.207 50 10 HBGE CC(C)(C)OC(=O)NCCOCC(=O)NNC(=O)[C@H]1CCN1C1CCOCC1 1456035785 DRCFSGKPHBBCCM-CQSZACIVSA-N 400.476 -0.072 50 10 HBGE CS(=O)(=O)N1CCC(CC(=O)NNC(=O)[C@@H]2CCN2C2CCOCC2)CC1 1456039707 UQCMLZPFQHDRJK-HNNXBMFYSA-N 402.517 -0.551 50 10 HBGE CCOC(=O)[C@@H]1CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC12COC2 1473774585 IHONBIUSZNODJT-AWEZNQCLSA-N 421.450 -0.024 50 10 HBGE COc1cc2nc(C(=O)NNC(=O)N3CCN(C)CC3)c(=O)n(C)c2cc1OC 1639494609 QZEFTTAOVQTSIM-UHFFFAOYSA-N 404.427 -0.448 50 10 HBGE 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406.443 -0.427 50 10 HBGE O=C(N[C@@H]1COCC[C@H]1NC(=O)c1sncc1B(O)O)OCc1ccccc1 2255687261 DQBFFWRUUMZMMN-ZIAGYGMSSA-N 405.241 -0.363 50 10 HBGE C[C@H]1CN(C(=O)c2cc(B(O)O)n(C)n2)C[C@@H](C)N1C(=O)OCc1ccccc1 2267426858 KHMMRKYMMRKVDU-OKILXGFUSA-N 400.244 -0.029 50 10 HBGE CC(C)(C)OC(=O)N1CCN(CCNS(=O)(=O)c2cc(B(O)O)cs2)CC1 2282074054 JNCRMOHHDLRBKH-UHFFFAOYSA-N 419.334 -0.741 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@@H](NS(=O)(=O)c2c(F)cc(F)cc2B(O)O)C1 2282363537 OJHXQQOTMDYVLW-SNVBAGLBSA-N 406.216 -0.068 50 10 HBGE CC(C)(C)OC(=O)N1CCO[C@@H](CNS(=O)(=O)c2cccc(B(O)O)c2)C1 2282708153 IQQDYPJIQVGPQU-ZDUSSCGKSA-N 400.262 -0.719 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cscc2B(O)O)[C@](C)(CO)C1 2282731795 WMMNRECYROJEKO-HNNXBMFYSA-N 420.318 -0.580 50 10 HBGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1S(=O)(=O)c1nn(C)cc1B(O)O 2282740938 HRZHEIQANUVHPP-NSHDSACASA-N 402.282 -0.880 50 10 HBGE CN(Cc1sccc1B(O)O)C(=O)[C@@H](CS(C)(=O)=O)NC(=O)OC(C)(C)C 2360550973 IYUTZDJMYYLWDB-LLVKDONJSA-N 420.318 -0.676 50 10 HBGE O=C(NN=Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1ccncc1 254808469 JLTKHQOIUGCLNI-OGJJZOIMSA-N 403.391 -0.976 50 10 HBGE Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)C(C)(C)c2cccs2)n(C)c1=O 766635493 IMMLSHPCIJOMFJ-UHFFFAOYSA-N 404.452 -0.380 50 10 HBGE C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)n1cnc(C#N)n1 798982352 ILMZRGZHAVZWQB-CYBMUJFWSA-N 418.483 -0.210 50 10 HBGE O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn2c(=O)cc[nH]c12 1147901825 FELKSOVFIBBPPJ-UHFFFAOYSA-N 418.435 -0.200 50 10 HBGE O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)[C@H]1CCN1C1CCOCC1 1156184043 LBXJMJPGUFSMNF-OAHLLOKOSA-N 414.459 -0.495 50 10 HBGE CN(C)S(=O)(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1556570412 YLLHOEYYVWKIBY-LLVKDONJSA-N 407.493 -0.823 50 10 HBGE CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(C(=O)c2ccc(B(O)O)cc2)C1 1631480516 WAHPWDVOYNAKJF-HNNXBMFYSA-N 419.287 -0.141 50 10 HBGE CNC(=O)c1cc(O[C@H]2CCCN(C(=O)c3cc(B(O)O)ccc3F)C2)ccn1 1637009358 SCNCYPCVRMMCTH-AWEZNQCLSA-N 401.203 -0.056 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1c1ncc(Br)cc1B(O)O 2223678071 WTFBMVXRPTWQEZ-GHMZBOCLSA-N 416.081 -0.012 50 10 HBGE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)N2CCC(Cl)CC2)C1 2240604097 PGYPHVCYOJURFF-SCZZXKLOSA-N 420.841 -0.211 50 10 HBGE CN(C1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12)S(=O)(=O)c1sccc1B(O)O 2267611327 RMEIUEZTPBSAKH-NXEZZACHSA-N 402.303 -0.086 50 10 HBGE O=C(NCC1CN(C(=O)OCc2ccccc2)C1)c1cc(B(O)O)c(O)cc1O 2267812451 AWEMFBLRNIWBCX-UHFFFAOYSA-N 400.196 -0.224 50 10 HBGE CCON(C1CN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1ccccc1B(O)O 2282090205 MDEQUJURZHZWGE-UHFFFAOYSA-N 400.262 -0.072 50 10 HBGE CCn1ncc(B(O)O)c1C(=O)N=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C 2282143960 REFFUSRPAFOJOO-BLBHWQHRSA-N 402.282 -0.266 50 10 HBGE Cn1cc(C(=O)N=[S@@]2(=O)CC[C@H](CNC(=O)OC(C)(C)C)C2)nc1B(O)O 2282245663 FQIYMKFMCFBHHM-GFVXYOJSSA-N 400.266 -0.747 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282705887 DMCLTBSTSVBZDA-SMDDNHRTSA-N 400.262 -0.816 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@](O)(CCNS(=O)(=O)c2cscc2B(O)O)C1 2282733773 AWNUHFABUKVIGZ-OAHLLOKOSA-N 420.318 -0.532 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@]2(NS(=O)(=O)Cc3ncsc3B(O)O)C[C@H]2C1 2282861182 LDDLVPDQAJUJKS-BONVTDFDSA-N 417.318 -0.358 50 10 HBGE Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 742060747 RKJKNXUJCFWBQL-NHYWBVRUSA-N 421.479 -0.145 50 10 HBGE Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(c2nccn(C)c2=O)CC1 745999380 ZJVPZWMTHRNMPP-UHFFFAOYSA-N 410.438 -0.087 50 10 HBGE CC[C@H](OC1CCCCC1)C(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 766642404 FMQXOHZUHCUENZ-ZDUSSCGKSA-N 420.470 -0.291 50 10 HBGE CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1 816874631 HKXWHPGPQZZHMK-CYBMUJFWSA-N 406.468 -0.012 50 10 HBGE O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)c2)CCN1 1452934219 LDKTUKZMSPEMHQ-BPLDGKMQSA-N 422.463 -0.864 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)N1 1461838088 PAWFEFNUGOPKPO-JTQLQIEISA-N 400.482 -0.038 50 10 HBGE O=C(NNC(=O)c1cccn2nnnc12)c1cccc(S(=O)(=O)N2CCCC2)c1 1540328798 MASRBHKLQHUAAS-UHFFFAOYSA-N 415.435 -0.016 50 10 HBGE CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCN2C2CCOCC2)CC1 1558458514 IIRFRPVAHQTFMV-OAHLLOKOSA-N 402.517 -0.551 50 10 HBGE O=C(CN1CCCc2ccccc21)NNC(=O)[C@H](CO)NC(=O)c1cccc(F)n1 1624317960 MLYDZOOUVWZCTF-HNNXBMFYSA-N 415.425 -0.088 50 10 HBGE O=C(NCCCN1CCOCC1)C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1628565435 VVBXMGKPMRZFAI-UHFFFAOYSA-N 403.288 -0.943 50 10 HBGE CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2CCO[C@H]2C)cc1 1643602793 OHXOMPPSPBGAIU-SMDDNHRTSA-N 413.452 -0.286 50 10 HBGE CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2cc(B(O)O)cs2)[C@H](CO)C1 2267607963 ROMMUGZBYYZNMN-NSHDSACASA-N 406.291 -0.970 50 10 HBGE Cc1ccc(B(O)O)c(C(=O)N[C@H]2COCCN(C(=O)OCc3ccccc3)C2)n1 2281652051 ZBVRONLUZLYVJS-MRXNPFEDSA-N 413.239 -0.163 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1S(=O)(=O)Cc1ncsc1B(O)O 2282339533 YHDXABJQUAWIKQ-YUMQZZPRSA-N 415.224 -0.816 50 10 HBGE O=S(=O)(c1ccc(B(O)O)cc1Cl)N(Cc1ccccc1)CC1(O)CNC1 2282721046 KGUOLBMOYJIUFV-UHFFFAOYSA-N 410.688 -0.455 50 10 HBGE COc1ccc(B(O)O)cc1S(=O)(=O)NC(C)(C)CNC(=O)OC(C)(C)C 2282736310 OFAFCWXKTWRSQT-UHFFFAOYSA-N 402.278 -0.043 50 10 HBGE O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CN1CCCc2ccccc21 742472586 RJBYVIWVMVHXAJ-LTDCPUDJSA-N 412.446 -0.251 50 10 HBGE COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@H]3COCCO3)C2=O)cc1 744645041 OECFLQQINYCDBU-FZKQIMNGSA-N 406.395 -0.975 50 10 HBGE O=C(NNC(=O)[C@H]1CCCO1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1 817214453 QYBHMDHOHWMJLS-KWCYVHTRSA-N 417.871 -0.210 50 10 HBGE Cn1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)nn1 1131111547 OVPPCVTWQCAGOQ-UHFFFAOYSA-N 406.468 -0.007 50 10 HBGE COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3OCCN(C)C3=O)n[nH]2)cc1OC 1153183151 YTNIWYHMUHZHCU-OAHLLOKOSA-N 403.395 -0.288 50 10 HBGE O=C(Cc1cccnc1)NNC(=O)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1 1293155269 ZBTSMOOXVHTRBP-CQSZACIVSA-N 412.855 -0.236 50 10 HBGE CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(CC3CC3)C2)c1 1313205489 OGRMKAKZDARSBU-AWEZNQCLSA-N 423.495 -0.108 50 10 HBGE C[C@@H]1OCC[C@H]1C(=O)NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C 1457880199 NAQZPSZCCHQEKH-WDEREUQCSA-N 404.427 -0.437 50 10 HBGE O=C(CN1CCC(CO)CC1)NNc1ccccc1S(=O)(=O)N1CCOCC1 1465413050 GPBISONBNAUJCS-UHFFFAOYSA-N 412.512 -0.145 50 10 HBGE O=C(Nc1ccc(S(=O)(=O)N2CCC[C@@H]2CO)cc1)c1cc(B(O)O)ccc1F 1623750863 WUBGAPZZIGHVJF-CQSZACIVSA-N 422.243 -0.097 50 10 HBGE O=C(N[C@@H]1COCC[C@@H]1NC(=O)c1sncc1B(O)O)OCc1ccccc1 2255687260 DQBFFWRUUMZMMN-UONOGXRCSA-N 405.241 -0.363 50 10 HBGE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNS(=O)(=O)c1cscc1B(O)O 2267625725 UUUKXOXDHHOMRN-UHFFFAOYSA-N 402.263 -0.602 50 10 HBGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)[C@H](C)CCN1S(=O)(=O)c1ccc(B(O)O)s1 2282071798 WLLWKDYDCONOPH-FYBVGQRMSA-N 414.236 -0.106 50 10 HBGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2cc(B(O)O)nn2C)C1 2282084464 WBTITBWXPFHLPG-MNOVXSKESA-N 402.282 -0.976 50 10 HBGE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(S(=O)(=O)Cc2ccsc2B(O)O)C1 2282327241 FDRRIHYJGOKUTL-SCZZXKLOSA-N 414.236 -0.353 50 10 HBGE CC(C)(C)OC(=O)N1CCC12CN(S(=O)(=O)c1ccc(B(O)O)cc1F)C2 2282374067 WBTNKTGDHGGVNM-UHFFFAOYSA-N 400.237 -0.111 50 10 HBGE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(S(=O)(=O)Cc1ncsc1B(O)O)C2 2282380938 PSZVGQZIURMDPW-UWVGGRQHSA-N 417.318 -0.502 50 10 HBGE CC(C)(C)OC(=O)N1CC[C@H](NS(=O)(=O)c2sccc2B(O)O)[C@H](CO)C1 2282708741 QRCUQWKDOWUXFU-JQWIXIFHSA-N 420.318 -0.676 50 10 HBGE Cc1nc(S(=O)(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282857350 HBGUXDLCSLSBDW-LLVKDONJSA-N 402.282 -0.962 50 10 HBGE Cc1nc(S(=O)(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(B(O)O)n1C 2282862767 ICPYYFDQAKZRJB-LLVKDONJSA-N 402.282 -0.962 50 10 HBGE C[C@H](OCc1ccccc1)[C@H](NS(=O)(=O)Cc1ncsc1B(O)O)C(=O)O 2284411974 QRRVDVRTNIYVMW-GWCFXTLKSA-N 414.270 -0.699 50 10 HBGE C[C@H](OCc1ccccc1)[C@H](NS(=O)(=O)Cc1ccsc1B(O)O)C(=O)O 2284418449 YNBWDXZZZHNFPT-FZMZJTMJSA-N 413.282 -0.094 50 10 HBGE Cc1ccsc1CCCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 747974153 BMNZHPQSTLRYLE-UHFFFAOYSA-N 418.479 -0.026 50 10 HBGE CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)[C@H]3CCCO3)c2)CC1 814622179 IGESCEPYTLXTEJ-OAHLLOKOSA-N 411.484 -0.046 50 10 HBGE CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@@H]1CCc2nncn2C1 816885509 BPHOWOMBDOJCJM-CYBMUJFWSA-N 420.495 -0.363 50 10 HBGE O=C1CC[C@@H](C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)N1 1461838125 PBYIMSMQCVRZJX-DTWKUNHWSA-N 420.900 -0.019 50 10 HBGE CCN1C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1=O 1672947621 JNJMJKZLWPZKER-ZDUSSCGKSA-N 411.484 -0.433 50 10 HBGE O=C(NCC1(F)CCN(C(=O)OCc2ccccc2)CC1)c1cc(B(O)O)n[nH]1 2267028734 PHSGLPXCQMYKCP-UHFFFAOYSA-N 404.207 -0.040 50 10 HBGE CC(C)(C)OC(=O)NC1[C@@H]2CN(S(=O)(=O)Cc3ccsc3B(O)O)C[C@@H]12 2267373209 AFIXMSVPBXGKLU-GHMZBOCLSA-N 402.303 -0.287 50 10 HBGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CNS(=O)(=O)c3cscc3B(O)O)[C@@H]2C1 2267381404 USHYEMLRGJGYBC-RTCCRHLQSA-N 402.303 -0.181 50 10 HBGE CO[C@@H]1CN(S(=O)(=O)c2cscc2B(O)O)C[C@H]1NC(=O)OC(C)(C)C 2267626611 LEZUJEJNNRDCJT-GHMZBOCLSA-N 406.291 -0.660 50 10 HBGE Cc1ccc(B(O)O)cc1S(=O)(=O)NC[C@](C)(CO)NC(=O)OC(C)(C)C 2282377686 VAACEZMEXBHKAE-MRXNPFEDSA-N 402.278 -0.771 50 10 HBGE O=C(O)C[C@H](COCc1ccccc1)NS(=O)(=O)Cc1ncsc1B(O)O 2284409841 OARULQQQSVKWBH-GFCCVEGCSA-N 414.270 -0.698 50 10 HBGE CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1ncsc1B(O)O)C(=O)O 2289799366 WZPACBCLJAWMMC-VIFPVBQESA-N 401.250 -0.299 50 10 HBGE Nc1nonc1-n1nnc(C(=O)NN=Cc2ccccc2O)c1CN1CCOCC1 254741888 OEBFNDADOURVTQ-UHFFFAOYSA-N 413.398 -0.466 50 10 HBGE C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1CN(C)CCN1C 1256464729 JRCRCQGCPFHXGS-OCCSQVGLSA-N 411.532 -0.442 50 10 HBGE CN1CCN(C)CC(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1 1465791534 HCVVHJGVGSVGMN-UHFFFAOYSA-N 416.526 -0.915 50 10 HBGE Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCO[C@H]2C)C1 1469404241 ZTMKJMYCENMLLN-MELADBBJSA-N 413.500 0.000 50 10 HBGE O=C1CC[C@H](C(=O)NNC(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)N1 1469609566 FWYKGNAMBZKXDY-HRCADAONSA-N 414.466 -0.806 50 10 HBGE O=C(N[C@@H](CO)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(F)n1 1540363182 LCTKVNJIVCWIDQ-FZMZJTMJSA-N 404.354 -0.701 50 10 HBGE CN1C(=O)C[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)[C@H]1c1cccc(F)c1 1543752688 JTPSNUJSHXQWAG-KCQAQPDRSA-N 412.443 -0.137 50 10 HBGE O=C(CN1C[C@H]2C[C@H]1CN2C(=O)C(F)(F)F)N[C@@H]1CS(=O)(=O)C[C@@H]1Cl 1884253450 KZVFDWUDZQBLSE-QCLAVDOMSA-N 403.810 -0.646 50 10 HBGE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(S(=O)(=O)Cc3ccsc3B(O)O)C[C@@H]21 2267369692 AFIXMSVPBXGKLU-GDNZZTSVSA-N 402.303 -0.287 50 10 HBGE CON([C@H]1CCN(C(=O)OC(C)(C)C)C1)S(=O)(=O)c1sccc1B(O)O 2267615252 ZZNNCLRMRYYMQI-JTQLQIEISA-N 406.291 -0.011 50 10 HBGE CC(C)(C)OC(=O)NCC[C@H]1CCN(S(=O)(=O)Cc2ncsc2B(O)O)C1 2282377558 SGFDDTMGMVPTKL-NSHDSACASA-N 419.334 -0.111 50 10 HBGE CC(C)(C)OC(=O)N1C[C@H]2OCCN(S(=O)(=O)c3cc(B(O)O)cs3)[C@@H]2C1 2282704446 KBMTUNLAKDCPMP-VXGBXAGGSA-N 418.302 -0.563 50 10 HBGE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc(B(O)O)cc1 2282705885 DMCLTBSTSVBZDA-FZMZJTMJSA-N 400.262 -0.816 50 10 HBGE