smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@@H](C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)Cl 103014419 MSHZDZBASKZAEY-REOHCLBHSA-N 446.612 4.682 70 10 IJIE C/C(=C\Br)COc1c(Cl)cc(Br)cc1S(=O)(=O)Cl 2219380277 HXFNMSWAFXAKMG-GQCTYLIASA-N 438.952 4.708 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2[C@H]3CCC[C@H]23)c(Br)c1 2150091220 LXJYTGUSWQFJEP-IUCAKERBSA-N 444.572 4.564 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCC(C)=CBr 2226542960 YYKWYQYNCDPGAF-UHFFFAOYSA-N 432.561 4.617 70 10 IJIE O=C(Cc1cccc(Br)c1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 216628600 MFBRGXIZNCHDQW-MRXNPFEDSA-N 444.304 4.587 70 10 IJIE CC[C@@H]1C[C@H](C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358863 SPVOFDFENBXHGN-DZGCQCFKSA-N 427.975 4.515 70 10 IJIE NC[C@@H](c1ccc(F)cc1Cl)[C@H](O)c1cc(Br)ccc1Br 161275848 JFKCDPXEGZEGJW-SWLSCSKDSA-N 437.534 4.780 70 10 IJIE CCC[C@@H]1C[C@@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743749 KTLKLCJSFLSFRQ-HUUCEWRRSA-N 428.959 4.848 70 10 IJIE O=C(Nc1ccc2c(c1)CCN2C(=O)c1cccnc1)c1cc(-c2cccc(Cl)c2)no1 217187528 HSBATPDPSKHTGY-UHFFFAOYSA-N 444.878 4.845 70 10 IJIE CC(C)(C)C(C)(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357219 HGBMKJOQJAJNFK-UHFFFAOYSA-N 429.991 4.809 70 10 IJIE CC1(C)CC(C)(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156359244 AAUPDDPOPKDPBP-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE CCC(C)(C)CCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156363038 SEQKHXBKEFYUOL-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE C[C@H]1CCC[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2191414990 XLQCYHHUZKDSMF-DTWKUNHWSA-N 430.133 4.685 70 10 IJIE CC[C@@H]1CCCC[C@H]1NS(=O)(=O)c1cc(Br)c(C)cc1Br 159597242 FCZCUPVITYNPQA-BXUZGUMPSA-N 439.213 4.767 70 10 IJIE CCCn1ncc(Br)c1[C@@H](CSc1ccccc1Br)NC 160775098 LYJMKNYUUTXAEP-CYBMUJFWSA-N 433.213 4.871 70 10 IJIE C[C@H](CCOCc1c(Br)cccc1Br)CCS(=O)(=O)Cl 2366177959 YCQSLSGAXLWURB-SNVBAGLBSA-N 448.604 4.713 70 10 IJIE O=C(OCc1ccccc1)N1CCC(C2(CS(=O)(=O)Cl)CC3(CCC3)C2)CC1 725273116 ZINGPOAJVOHAON-UHFFFAOYSA-N 425.978 4.554 70 10 IJIE C[C@H]1C[C@@H]1CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2182710691 CICYKXCBAMMZQB-IUCAKERBSA-N 446.588 4.954 70 10 IJIE CCOc1ccc(OCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 217307346 GILUORJFALPKHS-UHFFFAOYSA-N 445.563 4.538 70 10 IJIE CC(F)(F)CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2097303166 KWVJEVCJFHAYNJ-UHFFFAOYSA-N 442.503 4.563 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2CCCC2)c(Br)c1 104924051 UGCYBXWSAJUBDM-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccccc2Br)c(Br)c1 109526886 RDKLUIVTRPHLQM-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC=CCC2)c(Br)c1 402272445 USLLUNKUCSPJCZ-SECBINFHSA-N 444.572 4.874 70 10 IJIE C[C@H]1CCC[C@@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354467 JOEGRRLEMPVQPR-DZGCQCFKSA-N 427.975 4.563 70 10 IJIE Nc1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)c(Cl)c1 217298944 NIIDNAALSVUOLP-UHFFFAOYSA-N 433.133 4.929 70 10 IJIE O=C(O)Cc1cc(NC(=O)OCC2c3ccccc3-c3ccccc32)cc([B-](F)(F)F)c1 1887512055 XNHRVHKWWKXNFM-UHFFFAOYSA-N 440.206 4.729 70 10 IJIE COc1ccc(/C=C/NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 218142766 JGCKHXSFIWDTPR-WUKNDPDISA-N 427.548 4.783 70 10 IJIE CCCC1(CNC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156356179 XUMHVWMDXWXOLP-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE COc1cc([C@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)ccc1OCc1ccccc1 217068034 VARRULGKWSCENY-YIXXDRMTSA-N 427.548 4.797 70 10 IJIE CCC1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355146 PBBWQAMZATXHBQ-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE C[C@H]1CC[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2227917806 BKNPDJOMLVIZGA-YUMQZZPRSA-N 432.561 4.564 70 10 IJIE NC[C@H](c1cccc(Cl)c1F)[C@@H](O)c1cc(Br)ccc1Br 161282469 GRUOBUDUNAYXOP-ABAIWWIYSA-N 437.534 4.780 70 10 IJIE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@@H]([B-](F)(F)F)C1 1888324818 OHRGHTFYDTYIDM-JKSUJKDBSA-N 445.270 4.754 70 10 IJIE O=C(NCCCC(=O)N1CC[C@H]([B-](F)(F)F)C1)OCC1c2ccccc2-c2ccccc21 1891517720 RWYFLSYKZXOSEH-INIZCTEOSA-N 445.270 4.755 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)/C=C/C3CCCC3)cc2)cc1 216645991 SIEDXLCDFVQEQY-CXUHLZMHSA-N 436.508 4.837 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2cccc(Br)c2Br)cc1 2148770797 QMAGICMGRNXGOW-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CCC(CC)(COc1c(Br)cccc1Br)CS(=O)(=O)Cl 115562819 XOJLZZNBAXJXJR-UHFFFAOYSA-N 448.604 4.965 70 10 IJIE O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)Nc1ccccc1C(F)(F)F 217510911 MIGBHJKSUFVAEW-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE CC(C)[C@H](C)CN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359754 XXOSSUHZECURFH-CQSZACIVSA-N 429.991 4.619 70 10 IJIE CN(C(=O)OCC1c2ccccc2-c2ccccc21)c1cc(C(=O)O)cc([B-](F)(F)F)c1 1887561418 XXXSKADMIIWPBQ-UHFFFAOYSA-N 440.206 4.825 70 10 IJIE CN(CC1(C)CCC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156364307 XCFBYHRCYPQIAI-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE O=C(CCc1cccc(Oc2ccc(F)cc2)c1)NC[C@@H]1CCCN1c1nccs1 217752510 UVJZITYJVGQKHV-IBGZPJMESA-N 425.529 4.792 70 10 IJIE CC1(C)CC[C@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2280870986 FUXVDZIJVLBDFH-AWEZNQCLSA-N 428.959 4.848 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@@H](NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1=O 217283875 ZFZXNWYHRSVBCZ-WFASDCNBSA-N 425.838 4.842 70 10 IJIE C[C@@H](CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(C)(C)C 2156359680 XPNRAISPSPLDRE-ZDUSSCGKSA-N 429.991 4.667 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC23CCC3)c(Br)c1 2189485535 GXYDWLAMYULNHT-QMMMGPOBSA-N 444.572 4.708 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2ccc(Br)cc2)c(Br)c1 59100057 MZDIVYORRCHURI-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC[C@@H](C)C[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356796 DBVISBJVFMSUIQ-KGLIPLIRSA-N 429.991 4.809 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC(F)=C2CCC2)c(Br)c1 2201557386 BMGVMJAAHNJSHQ-UHFFFAOYSA-N 448.535 4.925 70 10 IJIE CC(C)(C)OC(=O)Nc1c(Cl)c(Cl)nc(C=CCS(=O)(=O)Cl)c1Cl 1952919718 CGMOTCOUJOIZAA-UHFFFAOYSA-N 436.144 4.971 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCc2ccccc2)c(Br)c1 59093649 CNVZXTXGUYOQAI-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC1(C)CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353583 CBTBJBZLSRTKAS-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CCC[C@@H](COCc1c(Br)cccc1Br)CS(=O)(=O)Cl 2366165178 WNXFRMXYEZDFCZ-JTQLQIEISA-N 448.604 4.713 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)c3ccccc3C)cc2)cc1 216637198 AWSJRVFPSVKJML-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE O=C(NCCc1ccccc1Cl)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 217281466 GDDOJJAZSSUGKS-UHFFFAOYSA-N 425.916 4.633 70 10 IJIE O=S(=O)(Cl)c1cc(Br)cc(Cl)c1OCC/C=C/Br 2051138488 BSDWJGOCMGAKGE-HNQUOIGGSA-N 438.952 4.708 70 10 IJIE O=C(O)c1cc(CBr)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12 33556830 YHTMLUJBXDCVND-UHFFFAOYSA-N 425.234 4.864 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2ccccc2Br)c(Br)c1 59211509 UPAJZEYVGONCBO-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE C[C@H]1CCC[C@@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193328872 GGOXGUDWQPJWGC-ORAYPTAESA-N 427.975 4.563 70 10 IJIE Cc1cccc(Oc2ccc(S(=O)(=O)Cl)c(Cl)c2)c1I 2295354824 PTTYHMDDKKLOHV-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE CCN[C@@H](CSc1cccc(Br)c1)c1c(Br)cnn1CC 160783947 KDPCYWATMYNYER-AWEZNQCLSA-N 433.213 4.871 70 10 IJIE O=C(c1cc(Br)cc(Br)c1)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194130121 NPUBAGVDGGMBME-RNCFNFMXSA-N 425.859 4.665 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2C[C@@H]2C2CC2)c(Br)c1 2199948116 BTUNRWCFWKSEEU-PSASIEDQSA-N 444.572 4.564 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CCC[C@H]2CCCC[C@@H]21 217479283 RUOODQYQHSGOQN-ABAIWWIYSA-N 448.142 4.849 70 10 IJIE O=S(=O)(Cl)c1cc(Br)cc(Cl)c1OCCC=CBr 2051138490 BSDWJGOCMGAKGE-UHFFFAOYSA-N 438.952 4.708 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1c(Br)cccc1Br)C1CCC1 2145989632 LKIWDCJIQMFEBM-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1ccc(Br)cc1Br)C1CCC1 2145990093 QYNQFVWSJYBWOC-JTQLQIEISA-N 446.588 4.575 70 10 IJIE O=C(O[C@@H]1CCC[C@H]2C[C@H]21)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2206990282 NBQQWDZWKXDJHT-SQWLQELKSA-N 426.943 4.600 70 10 IJIE CC1CC(C)(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2279361485 RDFIWOULLPDFKA-UHFFFAOYSA-N 446.588 4.954 70 10 IJIE C[C@H](c1ccccc1)N1C[C@@H](NC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1=O 217284102 SLGGZZDAPSMBSD-BWKNWUBXSA-N 427.548 4.761 70 10 IJIE Nc1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1Cl 217298945 IWTQMSBAMGEMTQ-UHFFFAOYSA-N 433.133 4.929 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCCOCc1ccccc1 2020685666 LFVLRVSMDLHAPK-UHFFFAOYSA-N 433.751 4.535 70 10 IJIE O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)Nc1ccc(Cl)c(Cl)c1 217511248 CFFHUQQTCPPWCG-UHFFFAOYSA-N 430.339 4.952 70 10 IJIE COc1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1OC 217298810 KHDBFIRALFEEPY-UHFFFAOYSA-N 443.725 4.710 70 10 IJIE COc1ccc([C@H](C)NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217298909 GFMVOLHZHUCUPK-ZDUSSCGKSA-N 441.753 4.940 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)C=C2CCCCC2)cc1 216671498 QUASMDGFCPRGSX-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE C[C@@H]1Cc2ccccc2N1C(=O)c1cc(Br)ccc1I 217450359 REEVIMAEJLHAQN-SNVBAGLBSA-N 442.094 4.645 70 10 IJIE CC1(C)C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722858302 TZUMNWBQXDPEPK-SSDOTTSWSA-N 432.561 4.564 70 10 IJIE CC(C)[C@@H]1CCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354210 HQXQCGCOBSVCCM-INIZCTEOSA-N 427.975 4.515 70 10 IJIE O=C(NCCn1nc(-c2ccncc2)c2c1CCCC2)Nc1ccc(C(F)(F)F)cc1 217474156 WFZLKVIXEZWYRX-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE CN[C@H](Cc1ccc(F)cc1Br)c1ccc(I)cc1 161358528 SYWNMTTWVWQFQT-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE C[C@@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2228261325 XNXHJNVFILSFJX-SFYZADRCSA-N 432.561 4.564 70 10 IJIE C[Si@H](O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C 2070260803 JRQYNNFQXZXPRR-LJQANCHMSA-N 444.974 4.695 70 10 IJIE CCCC(C)(C)CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2158555778 OBYARFLQNMYQPB-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE C[C@H]1CC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355853 VJWRVPOXOSWUSR-CTYIDZIISA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)CCCCCCOc1ccc(Br)cc1Br 113537534 SIXOBZOJEIMTOS-UHFFFAOYSA-N 434.577 4.719 70 10 IJIE CCOc1cc(NC(=O)NC2CCN(Cc3ccccc3)CC2)cc(OCC)c1OCC 217275174 PJQNYBSKXYBSEX-UHFFFAOYSA-N 441.572 4.669 70 10 IJIE C=CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)F)c(OC)c1)c1ccc(C(F)(F)F)cc1 1519590354 UTTHNTKQLSRBOV-MRXNPFEDSA-N 445.434 4.810 70 10 IJIE C[C@@H]1C[C@H]1CCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191423560 IBSBDTNXCVNADT-RKDXNWHRSA-N 430.133 4.685 70 10 IJIE O=C(Nc1ccsc1-c1nc(C2CC2)no1)c1ccc(I)cc1 217286539 OHUYYSWSOCFGCG-UHFFFAOYSA-N 437.262 4.532 70 10 IJIE CCCOc1ccc(S(=O)(=O)NCc2ccc(C(=O)c3ccsc3)s2)cc1C 217293697 RJGXRJOLBDTEQM-UHFFFAOYSA-N 435.592 4.616 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1ccc(Br)cc1Br)CC1CC1 2169173828 VZADPRFSXPBOAE-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE CC(C)[C@H]1C[C@@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743341 HPIIVBAIXVSVHS-HUUCEWRRSA-N 428.959 4.704 70 10 IJIE O=C(CCCSSc1ccc([N+](=O)[O-])cn1)Oc1c(F)c(F)c(F)c(F)c1F 667980073 IOOMPQILUDRNBK-UHFFFAOYSA-N 440.371 4.811 70 10 IJIE NC[C@@H](c1cccc(Cl)c1F)[C@@H](O)c1cc(Br)ccc1Br 161282563 GRUOBUDUNAYXOP-NHYWBVRUSA-N 437.534 4.780 70 10 IJIE CC(C)(C)c1ccc(OCCCNC(=O)NCc2ccc(CO)cc2)c(Br)c1 217298767 FCYMCNNWMKAQHB-UHFFFAOYSA-N 449.389 4.507 70 10 IJIE CC[C@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156357663 KLCSLVJWBSMWFC-INIZCTEOSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@]23CCC[C@@H]2C3)c(Br)c1 2190968722 RMZUIOBQZNIKLX-OQPBUACISA-N 444.572 4.708 70 10 IJIE CC(C)[C@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200575124 DCHOPUUOUGNARM-WCBMZHEXSA-N 430.133 4.541 70 10 IJIE C[C@@H](Cc1nc(Cl)c(Cl)c(NC(=O)OC(C)(C)C)c1Cl)S(=O)(=O)Cl 1953008153 GMVYKGRPFDPRRM-LURJTMIESA-N 438.160 4.888 70 10 IJIE CC1(C)CC[C@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197309322 OCCMMTBNTSJKII-IBGZPJMESA-N 427.975 4.563 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCC2(F)CCC2)c(Br)c1 2205546624 ATDSYMRVYMNAOV-UHFFFAOYSA-N 434.096 4.531 70 10 IJIE CC[C@@H]1CC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2206133551 RKRRPQDACGCZIX-HIFRSBDPSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)CCCCCCOc1cc(Br)cc(Br)c1 2338710583 OSNUSFREXUGLLJ-UHFFFAOYSA-N 434.577 4.719 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1c(Br)cccc1Br)CC1CC1 2169172679 PJECYXFRYHYLRI-JTQLQIEISA-N 446.588 4.575 70 10 IJIE COc1ccc(Br)c(C(=O)NCc2ccc(C(=O)c3ccccc3)s2)c1 217294221 LRJRGFNIPTVSEV-UHFFFAOYSA-N 430.323 4.680 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H]2CCCCC[C@@H]2C)cc1Br 159672950 DHPCIIVLZHAFQV-HZMBPMFUSA-N 439.213 4.767 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccccc2I)cc1Cl 1927651039 FHVAPCMWSGXNRJ-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE CCOc1cc(NC(=O)NCc2cccc(Br)c2)cc(OCC)c1OCC 217275256 HPOVYJQQBGYZJT-UHFFFAOYSA-N 437.334 4.967 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cc(F)ccc2F)cc1Br 159533154 QXDQIHPQOWEIIW-UHFFFAOYSA-N 441.091 4.599 70 10 IJIE C[C@@]1(C(=O)Nc2cccc(CSC3CCOCC3)c2)CCCN1C(=O)c1ccccc1 217225967 NZDNUYKDRSSVPC-VWLOTQADSA-N 438.593 4.732 70 10 IJIE CCC(CC)CCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354462 JLQRCELXQDGMAF-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE C[C@@H]1C[C@@H]1CCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191423557 IBSBDTNXCVNADT-BDAKNGLRSA-N 430.133 4.685 70 10 IJIE C=CCC[C@@H](NC(=O)Cc1ccc(S(=O)(=O)F)cc1)c1ccc(C(F)(F)F)cc1 1435632966 BXENMLRXYOVTTM-GOSISDBHSA-N 429.435 4.730 70 10 IJIE O=C(NCCC(=O)N1CCC[C@H]([B-](F)(F)F)C1)OCC1c2ccccc2-c2ccccc21 2241641397 UBGSNOZDJRGSLB-INIZCTEOSA-N 445.270 4.755 70 10 IJIE O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1ccccc1Oc1ccccc1 218251634 XLURTXNHFWMUSL-FQEVSTJZSA-N 427.460 4.768 70 10 IJIE C[C@H]1CC[C@@H](N(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156352497 SBOHURWUCSOGRW-DZGCQCFKSA-N 427.975 4.515 70 10 IJIE CCC[C@H](COCc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2362255140 UMXPFYCSCAROMW-SNVBAGLBSA-N 448.604 4.713 70 10 IJIE O=S(=O)(Cl)c1cccc(Oc2ccc(Br)cc2Br)c1 387969253 WFZOFTNABQIKRK-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE CC(C)C1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCC1 2156351883 MIRADDXNHUWKAO-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)Nc2ccccc2CNC(=O)C(F)(F)F)cc1 216815574 ZNFIETWYZJIIQC-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE Cc1c(N)cc(CNC(=O)OCC2c3ccccc3-c3ccccc32)cc1[B-](F)(F)F 1887522100 BHXLWAQLHSASTM-UHFFFAOYSA-N 425.239 4.670 70 10 IJIE CC(C)CC(C)(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156352867 VXFPCELIQAIYSI-UHFFFAOYSA-N 429.991 4.809 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2cc(Br)cc(Br)c2)cc1 2338709182 RKTXQXUJCPJCHU-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE O=C(NCCn1nc(C(F)(F)F)c2c1CCCC2)NC(c1ccccc1)c1ccccc1 217549162 QNIWDGVOPRINJZ-UHFFFAOYSA-N 442.485 4.870 70 10 IJIE CC1(CNC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCCC1 2156355198 PJDYLMSEODSCGI-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE C[C@@H]1CCCCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355815 UYVVUTGJRUPDEH-CQSZACIVSA-N 427.975 4.659 70 10 IJIE O=C(CCc1cccc(Oc2ccc(F)cc2)c1)NC[C@H]1CCCN1c1nccs1 217752582 UVJZITYJVGQKHV-LJQANCHMSA-N 425.529 4.792 70 10 IJIE C[C@@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2228261323 XNXHJNVFILSFJX-HTQZYQBOSA-N 432.561 4.564 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@@H]2CCCCC[C@@H]2C)cc1Br 159672804 DHPCIIVLZHAFQV-IINYFYTJSA-N 439.213 4.767 70 10 IJIE CCC(CC)(CC)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359394 WOHXSJXNRWEPPT-UHFFFAOYSA-N 429.991 4.953 70 10 IJIE O=C(c1cc(Br)cc(Br)c1)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 2194130122 NPUBAGVDGGMBME-TVQRCGJNSA-N 425.859 4.665 70 10 IJIE CC(C)=C(Br)COc1cc(F)c(S(=O)(=O)Cl)cc1Br 2340159276 FVRSSYSGVRNHPP-UHFFFAOYSA-N 436.524 4.583 70 10 IJIE C[C@H](c1ccccc1)N1C[C@@H](NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1=O 217284823 PALPUQYVLMJGSF-DOMZBBRYSA-N 425.838 4.842 70 10 IJIE C[C@H](CC(C)(C)C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359055 USXSKCHRWSPEAR-CYBMUJFWSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)c3ccccc3C)c2)cc1 216687236 GGKUOQUDGIXDEW-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)Nc1nc2c(s1)C(=O)CCC2 216726268 QVCWQBOKLKSUAT-UHFFFAOYSA-N 435.336 4.774 70 10 IJIE O=C(NCc1ccccc1OC(F)(F)F)c1cnn(-c2ccccc2)c1C(F)(F)F 217164798 MUCXKFIJDCICTG-UHFFFAOYSA-N 429.320 4.720 70 10 IJIE C[C@@H](COCc1ccccc1)COc1ccc(Br)cc1S(=O)(=O)Cl 719543520 NRKUERHLFGVIHS-ZDUSSCGKSA-N 433.751 4.608 70 10 IJIE COCCCN1C(=O)c2ccc(NC(=O)Nc3ccc(Nc4ccccc4)cc3)cc2C1=O 217280886 RGKHAJODWNNDHC-UHFFFAOYSA-N 444.491 4.707 70 10 IJIE O=C(c1cc2c(cc1Cl)OCCO2)c1cc(Br)ccc1Br 159756966 XRDQJRISYGFCDD-UHFFFAOYSA-N 432.495 4.867 70 10 IJIE CC1(C)CC[C@@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353663 COWUWMWYIBBJIT-CQSZACIVSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OCc2cncc(Br)c2)cc1Cl 166851864 ZGZYQIYQSBZDHO-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE CCC1CC(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2176856373 SFTVDVWGTBWQIK-UHFFFAOYSA-N 446.588 4.954 70 10 IJIE CC[C@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2236503479 OMNHDJKVYQZEJO-IUCAKERBSA-N 430.133 4.685 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)C=C3CCCCC3)cc2)cc1 216646330 FITQEMTXFZFNGL-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE CCCN[C@H](CSc1ccccc1Br)c1c(Br)cnn1C 160777582 XUSKBZQZCIAJPC-CYBMUJFWSA-N 433.213 4.778 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)Cc3ccccc3C)c2)cc1 216688990 KKDCFXMZDNWQPN-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE COc1cc(/C=C/C(=O)Nc2ccccc2-c2cn3ccsc3n2)cc(OC)c1OC 218545926 ABGMUCOYPUVJRB-CMDGGOBGSA-N 435.505 4.741 70 10 IJIE C[C@H]1C[C@H]1CCCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182894058 NLPGILJZQMXSCA-DZGCQCFKSA-N 428.959 4.848 70 10 IJIE Cc1ccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c(F)c1 159551034 XRTQFXXNAXFVJY-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE CC[C@H]1CC[C@H](NS(=O)(=O)c2cc(Br)c(C)cc2Br)[C@@H]1C 159668062 RVVGBQUKBXRSMX-SUNKGSAMSA-N 439.213 4.623 70 10 IJIE O=C(c1c(Cl)cccc1S(=O)(=O)Cl)N(CCC(F)(F)F)Cc1ccccc1 2152196818 OAFNIPURPYNSFZ-UHFFFAOYSA-N 440.270 4.862 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)Cc3ccccc3C)cc2)cc1 216639050 DTNHHONCSQMOKO-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCOc1cc(NC(=O)N2CCN(c3cccc(C)c3)CC2)cc(OCC)c1OCC 217275065 LJEBCJIJTLQTGP-UHFFFAOYSA-N 427.545 4.545 70 10 IJIE NC[C@@H](c1ccc(F)cc1Cl)[C@@H](O)c1cc(Br)ccc1Br 161276080 JFKCDPXEGZEGJW-WFASDCNBSA-N 437.534 4.780 70 10 IJIE C[C@@H]1C[C@H]1CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2182710692 CICYKXCBAMMZQB-RKDXNWHRSA-N 446.588 4.954 70 10 IJIE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 1879740627 RTNDVMHCSLDWRA-KBUNVGBDSA-N 431.888 4.727 70 10 IJIE C=CCCCCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191429629 BBJSSXJBYWNIDG-UHFFFAOYSA-N 430.133 4.995 70 10 IJIE NC[C@@H](c1c(F)cccc1Cl)[C@H](O)c1cc(Br)ccc1Br 161264014 RCQHZYCACHZBJG-ZUZCIYMTSA-N 437.534 4.780 70 10 IJIE CN(CCC(C)(C)C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358465 PTDWXVRSNNXIKE-UHFFFAOYSA-N 429.991 4.763 70 10 IJIE C[C@H]1CC[C@H](COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2157879047 QPPZXQBXPRQCIC-IUCAKERBSA-N 446.588 4.954 70 10 IJIE CCC[C@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2338859168 DGNFDHGDCLOUNR-SECBINFHSA-N 434.577 4.575 70 10 IJIE Cc1ncc(Br)cc1Oc1ccc(S(=O)(=O)Cl)cc1Br 2280025885 GVAOHQXJVMIREV-UHFFFAOYSA-N 441.528 4.635 70 10 IJIE O=C(NCCn1nc(-c2ccncc2)c2c1CCCC2)Nc1ccc(Cl)c(Cl)c1 217474262 HFKXBACSIHKOBN-UHFFFAOYSA-N 430.339 4.952 70 10 IJIE CN(c1ncc([B-](F)(F)F)cc1Br)[C@@H]1CC(C)(C)[C@H]1OCc1ccccc1 2116131451 YATCNMMJWXPEDG-SJORKVTESA-N 442.108 4.719 70 10 IJIE COc1ccc(S(=O)(=O)F)cc1Nc1ncc(-c2cccc(Br)c2)o1 136988594 PXHMLYOXURSMFE-UHFFFAOYSA-N 427.251 4.515 70 10 IJIE C[C@H](CCOc1cc(Br)cc(Br)c1)CCS(=O)(=O)Cl 2338709762 MUGICAVFIPYSHR-SECBINFHSA-N 434.577 4.575 70 10 IJIE CN[C@H](Cc1cc(Br)ccc1F)c1cccc(I)c1 160367839 ULJXRQUPOUPMNB-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE CCOC(=O)c1ccsc1NC(=O)c1cc(Br)ccc1Br 160201807 HSAXPJUNBBIHEL-UHFFFAOYSA-N 433.121 4.702 70 10 IJIE C[C@@H]1CC[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2227917791 BKNPDJOMLVIZGA-HTQZYQBOSA-N 432.561 4.564 70 10 IJIE CCC1(COc2c(Br)cc(S(=O)(=O)F)cc2Br)CCC1 2191431425 PTZLTTNEZZQSBY-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE Cc1cc(-c2cnc([C@@H](C)Nc3nccc(N4C(=O)OC[C@@H]4C(C)C)n3)nc2)ccc1F 218482128 JDCYIMQAIKEACU-DNVCBOLYSA-N 436.491 4.535 70 10 IJIE COc1cccc(-c2cc(C(=O)Nc3ccccc3-c3cn4ccsc4n3)n(C)n2)c1 218564089 UQMNIWHLCHWMKG-UHFFFAOYSA-N 429.505 4.724 70 10 IJIE CN[C@@H](Cc1cc(F)ccc1Br)c1ccccc1I 161503966 ZGRXMPCVQBGPSI-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE Cc1ccc(N2C[C@@H](C(=O)Nc3ccccc3-c3cn4ccsc4n3)CC2=O)cc1C 218547932 OUXIPLBGKACKBL-KRWDZBQOSA-N 430.533 4.671 70 10 IJIE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 1879730049 IXYKTFWWJBSPGO-KBUNVGBDSA-N 431.888 4.727 70 10 IJIE COc1cc(Cl)c([C@H](N)c2cc(Br)ccc2Br)cc1OC 159811246 COSVTMIZJSJKPH-OAHLLOKOSA-N 435.543 4.930 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)F)c1OCCCOCc1ccccc1 2076807975 STLOAPMEWSLSFO-UHFFFAOYSA-N 431.323 4.655 70 10 IJIE O=C(c1cc(Br)ccc1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194127700 AWEJHKFPURAUBU-OQPBUACISA-N 425.859 4.665 70 10 IJIE CC(C)C[C@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 2382180112 AIVXRRPLCYXEAC-SNVBAGLBSA-N 448.604 4.821 70 10 IJIE NC[C@H](c1ccc(F)cc1Cl)[C@@H](O)c1cc(Br)ccc1Br 161275966 JFKCDPXEGZEGJW-DOMZBBRYSA-N 437.534 4.780 70 10 IJIE O=C(OC[C@@H]1CC12CCC2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2367060433 SBKVGIRVASPCIO-AWEZNQCLSA-N 426.943 4.602 70 10 IJIE CC(C)(C)OC(=O)Nc1cc([C@@H](CS(=O)(=O)Cl)C2CC2)ccc1Br 1952683432 WCIAMSRGYKELJV-LBPRGKRZSA-N 438.771 4.858 70 10 IJIE C[C@@H]1CCC[C@@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193328870 GGOXGUDWQPJWGC-BFUOFWGJSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1cc(Br)cc(Br)c1)CC1CC1 2364225773 BUHKXLXOPNODGH-JTQLQIEISA-N 446.588 4.575 70 10 IJIE CCc1cccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159540206 ZIIYFTAFVZYMEH-UHFFFAOYSA-N 433.165 4.883 70 10 IJIE C[C@H]1C[C@@H]1CCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191423559 IBSBDTNXCVNADT-IUCAKERBSA-N 430.133 4.685 70 10 IJIE CC(C)(C)OC(=O)Nc1c(Br)cccc1C(C)(C)CS(=O)(=O)Cl 1952809752 QCNXUPRNVPYCAS-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE CCC[C@@H](C)CN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356062 XAHHRVPDZBMXPV-CQSZACIVSA-N 429.991 4.763 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H]2CCCCC[C@H]2C)cc1Br 159673195 DHPCIIVLZHAFQV-YGRLFVJLSA-N 439.213 4.767 70 10 IJIE O=C(c1ccsc1)c1ccc(CNS(=O)(=O)c2cc(Cl)ccc2Cl)s1 217293688 VYNWIGIXIGVZNX-UHFFFAOYSA-N 432.375 4.826 70 10 IJIE Cc1c(CNC(=O)OCC2c3ccccc3-c3ccccc32)cc([B-](F)(F)F)c(C)c1N 1887561500 XVYDXMYVPJVLMJ-UHFFFAOYSA-N 439.266 4.979 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1cc(Br)cc(Br)c1)C1CCC1 2364044696 FBANQKPVJJYFNL-JTQLQIEISA-N 446.588 4.575 70 10 IJIE CCC[C@@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 114771144 USNJTRVRFMACNY-VIFPVBQESA-N 434.577 4.575 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)NCc2ccccc2NC(=O)C(F)(F)F)cc1 216815638 ACRZXKVCIJCIQM-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE O=c1c2ccccc2nc(SCc2noc(-c3ccccc3)n2)n1-c1ccc(F)cc1 216817325 GBMHTILOXGILEJ-UHFFFAOYSA-N 430.464 4.867 70 10 IJIE C[C@@H](COc1c(Br)cc(S(=O)(=O)F)cc1Br)C1CCC1 2191435405 WCMVOVLECYQWLP-QMMMGPOBSA-N 430.133 4.685 70 10 IJIE O=C(O[C@@H]1CCCC[C@@H]1F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197117934 KGSZIHDPKVEMDB-LSDHHAIUSA-N 432.922 4.692 70 10 IJIE Cc1cc(I)ccc1NC(=O)N[C@H](C)Oc1ccc(Cl)cc1 217294855 XPRFFEZTTJSGFW-NSHDSACASA-N 430.673 4.800 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCCC2CCC2)c(Br)c1 398758063 URADFUAIUDMWIX-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE O=C(NC1(C(=O)N2CC[C@@H]([B-](F)(F)F)C2)CC1)OCC1c2ccccc2-c2ccccc21 1891517008 KXFODDXFGGHQKM-OAHLLOKOSA-N 443.254 4.508 70 10 IJIE CSC1CC(COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2287635114 MAVQLKBKSJZZPS-UHFFFAOYSA-N 446.999 4.553 70 10 IJIE CCCCOC(=O)c1ccccc1NC(=O)Nc1ccc2c(c1)C(=O)N(C(C)(C)C)C2=O 217280378 NDCVEZGQSXWQBE-UHFFFAOYSA-N 437.496 4.682 70 10 IJIE CCC(C)=CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2338441488 AHEDLXRCSVGCDD-UHFFFAOYSA-N 432.561 4.874 70 10 IJIE CC1(C)CC(N)CC(C)(C)N1C(=O)NCCCOc1ccc(Br)cc1Cl 217298995 PXHJLFJZNKJGEM-UHFFFAOYSA-N 446.817 4.561 70 10 IJIE CC(C)[C@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200575122 DCHOPUUOUGNARM-PSASIEDQSA-N 430.133 4.541 70 10 IJIE C#Cc1cccc(N(Cc2ccccc2)C(=O)c2ccc(S(=O)(=O)F)cc2Cl)c1 1358273367 DBUKJEHHWNTFHT-UHFFFAOYSA-N 427.884 4.827 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(Br)c(C(=O)N2CC[C@@H]([B-](F)(F)F)C2)c1 2319674732 NUGDDIAIUFMYTP-SNVBAGLBSA-N 436.057 4.860 70 10 IJIE CN(CCN(Cc1ccccc1)c1ncc(Cl)cc1[B-](F)(F)F)Cc1ccccc1 1961719166 ZCNIDQSZXVFHIW-UHFFFAOYSA-N 432.706 4.928 70 10 IJIE O=C(c1ccc(Br)cc1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194128194 CRXHHODNEBDOSG-AMIZOPFISA-N 425.859 4.665 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)CCc3ccccc3)c2)cc1 216683856 NKIAFRXKBUBDGZ-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE C[C@@H]1CCC[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2149833829 YMEYKYYUVGEWBW-BDAKNGLRSA-N 446.588 4.954 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CCC[C@@H]2CCCC[C@H]21 217479365 RUOODQYQHSGOQN-XHDPSFHLSA-N 448.142 4.849 70 10 IJIE Cc1cccc(Oc2ccc(S(=O)(=O)N3CCC4(CC3)OC(=O)c3ccccc34)cc2)c1 217551476 QNRGFHWLCXPEEL-UHFFFAOYSA-N 449.528 4.638 70 10 IJIE CC1(CCCOc2c(Br)cc(S(=O)(=O)F)cc2Br)CC1 2191414022 METBRVPSWULVNA-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE O=S(=O)(Cl)c1ccccc1Oc1cc(I)ccc1Cl 2272681350 JEYRKTORIKKFRT-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE CCCn1ncc(Br)c1[C@@H](CSc1ccc(Br)cc1)NC 160693311 GSBDISUUXRSAIS-CQSZACIVSA-N 433.213 4.871 70 10 IJIE C[C@@H]1CC[C@@H](COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2157879048 QPPZXQBXPRQCIC-RKDXNWHRSA-N 446.588 4.954 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)ccc1C(=O)N1CC[C@H]([B-](F)(F)F)C1 2319676466 FDWMMQVWIYTJDS-JTQLQIEISA-N 436.057 4.860 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)NC2CCC(C)(C)CC2)cc1Br 159663156 MJLPRWZVUKPYQX-UHFFFAOYSA-N 439.213 4.767 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)Cc3cccc(C)c3)cc2)cc1 216639750 HHOBTNUWARMCGR-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE Cc1ccccc1Oc1ccc(S(=O)(=O)N2CCC[C@@]3(C2)OC(=O)c2ccccc23)cc1 217629411 WAJIGPABNFQNGW-VWLOTQADSA-N 449.528 4.638 70 10 IJIE Brc1cnc(-c2nc(C3CC3)c(CNC3CC3)s2)c(Br)c1 159591464 UCOSPNVIHGKQMX-UHFFFAOYSA-N 429.181 4.860 70 10 IJIE NC(=S)c1ccc(Cl)c(NC(=O)c2cc(Br)ccc2Br)c1 159967464 IHPLGNCCPZUDCO-UHFFFAOYSA-N 448.567 4.752 70 10 IJIE Cc1cc(Br)cc(S(=O)(=O)Cl)c1OCCCOCc1ccccc1 310428129 SAQAKZKUXMYUAJ-UHFFFAOYSA-N 433.751 4.671 70 10 IJIE C=CCCC[C@@H](NC(=O)c1cc(Cl)c(S(=O)(=O)F)cc1OC)c1ccccc1 1598380095 XNOQUAOQDAWQKT-QGZVFWFLSA-N 425.909 4.834 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OCc2ccc(Br)cn2)cc1Cl 166851729 DICGPIOYMPMVHC-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1ccc(Oc2ccccc2)cc1 218274178 WJARTGRFIQCUHJ-JOCHJYFZSA-N 427.460 4.768 70 10 IJIE CC[C@@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2236500474 CMQXEEVXFHMCTH-RKDXNWHRSA-N 446.588 4.954 70 10 IJIE CC(C)[C@H](COCc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2362255947 YQYVONWBFLYXRU-LLVKDONJSA-N 448.604 4.569 70 10 IJIE C[C@H](c1ccccc1)N1C[C@@H](NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1=O 217283874 ZFZXNWYHRSVBCZ-DOMZBBRYSA-N 425.838 4.842 70 10 IJIE Cc1ccc(OCCCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 217297711 XWMMFUSKKBGZGM-UHFFFAOYSA-N 443.591 4.881 70 10 IJIE CC[C@@H]1CC[C@@H]1N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2161927339 CSJXSWAYIMPPAA-ZBFHGGJFSA-N 427.975 4.515 70 10 IJIE C=CCC(CC=C)OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2360216336 FXWOHCALLZSTOU-UHFFFAOYSA-N 426.943 4.932 70 10 IJIE CC(C)(C)OC(=O)N(Cc1ccccc1)[C@H]1CC=C(OS(=O)(=O)C(F)(F)F)CC1 145275793 AOZIGOGGDWQFNF-HNNXBMFYSA-N 435.464 4.726 70 10 IJIE C[C@H]1CC[C@@H](COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191422417 UDACGCCIOPVSPF-DTWKUNHWSA-N 430.133 4.685 70 10 IJIE CCCCN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156354209 HQJPHGXAEVELRE-UHFFFAOYSA-N 427.975 4.659 70 10 IJIE C[C@@H](N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1(C)CC1 2156359115 VGDBJVDGMHJPMD-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE C[C@@]1([B-](F)(F)F)CCN(Cc2ccc(I)c(Br)c2)C1 2325259942 GKWSXKIQSMBIEJ-GFCCVEGCSA-N 446.865 4.867 70 10 IJIE CN[C@@H](Cc1cc(Br)ccc1F)c1ccc(I)cc1 160282682 PPDYZWDPDGNLFQ-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE O=C(O[C@H]1CCC[C@@H]2C[C@H]12)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2358292359 NBQQWDZWKXDJHT-YCPHGPKFSA-N 426.943 4.600 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC2(F)CCCC2)c(Br)c1 2191422515 VHCUKIGZJGZJSW-UHFFFAOYSA-N 434.096 4.531 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OC[C@@H]2CC=CCC2)c(Br)c1 2191435083 RNPTYZAVQZAHTM-SECBINFHSA-N 428.117 4.605 70 10 IJIE Nc1ccc2c(c1)N(C(=O)c1cc(Br)ccc1Br)CCS2 159575403 QLFQHKXLGHQIGU-UHFFFAOYSA-N 428.149 4.546 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2cccc(C)c2)cc1 216659055 HDJZDAHSLCTGAZ-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1 1462272416 XNLZDSVJVWPRBN-DHZHZOJOSA-N 435.370 4.566 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)Cc3cccc(C)c3)c2)cc1 216689705 MMCAVJFANDLPGU-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCOc1cc(C(=O)Nc2ccc(NC(=O)C(F)(F)F)cc2)cc(OCC)c1OCC 216753414 KDAFFFXTOQZSJM-UHFFFAOYSA-N 440.418 4.636 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1c(Br)cccc1Br)C1CCC1 2145989631 LKIWDCJIQMFEBM-JTQLQIEISA-N 446.588 4.575 70 10 IJIE Cc1ccc(-c2ccc(S(=O)(=O)N3CCC[C@]4(C3)OC(=O)c3ccccc34)cc2)cc1 217629705 HDQVWHZBKPRTLN-RUZDIDTESA-N 433.529 4.512 70 10 IJIE CC[C@H](C)C[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356795 DBVISBJVFMSUIQ-KBPBESRZSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)/C=C/c3ccccc3)c2)cc1 216692863 BKWGDQYHPUBGSE-LFIBNONCSA-N 444.487 4.804 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cccc(C)c2C)cc1Br 159541236 WPHOPGFGJMHAAD-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE C[C@@H]1CC[C@@](C)(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2193328651 DAHVLSUXFXKAKI-BFUOFWGJSA-N 427.975 4.563 70 10 IJIE COc1cccc([C@@H]2C[C@H]2C(=O)N2CC3(CCCC3)c3cc4c(cc3[C@@H]2C)OCCO4)c1 216964069 LCOQSYOXVNPQFB-BULFRSBZSA-N 433.548 4.985 70 10 IJIE N#CCCCCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 385273627 YAZAUIVCLJDHQF-UHFFFAOYSA-N 445.560 4.602 70 10 IJIE CC[C@@H]1[C@@H](C)CCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358048 NDKJCZBEPTWVJV-XJKSGUPXSA-N 427.975 4.515 70 10 IJIE O=C(c1cc(Br)ccc1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2194127701 AWEJHKFPURAUBU-SDBXPKJASA-N 425.859 4.665 70 10 IJIE CC[C@H]1CC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2206133553 RKRRPQDACGCZIX-ZFWWWQNUSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OC2CCN(Cc3ccccc3)CC2)cc1Cl 2272111144 RLOWEESLXWSXHQ-UHFFFAOYSA-N 434.772 4.964 70 10 IJIE Cc1cc(NC(=O)Nc2ccc3c(c2)C(=O)N(C(C)(C)C)C3=O)ccc1Br 217280594 XHSQOBXFPNQBTH-UHFFFAOYSA-N 430.302 4.796 70 10 IJIE C[C@H]1CCCC[C@H]1OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353837 DXCREIRNYSISKC-XJKSGUPXSA-N 428.959 4.990 70 10 IJIE C[C@H]1CCC[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2191414991 XLQCYHHUZKDSMF-IUCAKERBSA-N 430.133 4.685 70 10 IJIE CCC[C@@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200565126 MCPMIZMKAPQJLX-RKDXNWHRSA-N 430.133 4.685 70 10 IJIE COc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1S(=O)(=O)Cl 1858136019 XDGDRQDNLBBETI-UHFFFAOYSA-N 428.215 4.547 70 10 IJIE CCN(CC1CCC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353947 FOLLXQPELKUZGT-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE O=C(c1cccc(Br)c1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 2194130943 VWGNETZNENTUKK-ISVAXAHUSA-N 425.859 4.665 70 10 IJIE O=C(OCCC1(F)CCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2205573670 UTOBVHXNSSTDAE-UHFFFAOYSA-N 432.922 4.694 70 10 IJIE Cc1ccc(N2C[C@H](C(=O)Nc3ccccc3-c3cn4ccsc4n3)CC2=O)cc1C 218547847 OUXIPLBGKACKBL-QGZVFWFLSA-N 430.533 4.671 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OC[C@H]2C=CCCC2)c(Br)c1 2191421615 KPGIMQHXIKHRHR-VIFPVBQESA-N 428.117 4.605 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cccc(F)c2F)cc1Br 159555896 ZMDRAUUXXIBPIZ-UHFFFAOYSA-N 441.091 4.599 70 10 IJIE CCCCOC(=O)c1ccccc1NC(=O)Nc1ccccc1I 217272852 WOZUUDUXQCRPKO-UHFFFAOYSA-N 438.265 4.892 70 10 IJIE NN[C@@H](c1cc(Br)c(Br)s1)c1cscc1Br 159403765 CMVXDPJOLPNRQH-MRVPVSSYSA-N 447.015 4.650 70 10 IJIE CC(C)CN1C(=O)c2ccc(NC(=O)NC(c3ccccc3)c3ccccc3)cc2C1=O 217279504 WSVCVZRUETVOED-UHFFFAOYSA-N 427.504 4.850 70 10 IJIE Cc1ccc(-c2ccc(S(=O)(=O)N3CCC[C@@]4(C3)OC(=O)c3ccccc34)cc2)cc1 217629788 HDQVWHZBKPRTLN-VWLOTQADSA-N 433.529 4.512 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)c3cccc(C)c3)cc2)cc1 216633714 DJZKSOXEVANCHW-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE COc1ccc(Cl)cc1CNC(=O)c1cc(Br)sc1Br 217225810 OFXYRDUZVCWNAH-UHFFFAOYSA-N 439.556 4.865 70 10 IJIE O[C@@H](c1cc2c(cc1Cl)OCCO2)c1cc(Br)ccc1Br 161033631 XBSLOEXXTZWDHD-OAHLLOKOSA-N 434.511 4.718 70 10 IJIE C[C@H](COCc1ccccc1)COc1ccc(Br)cc1S(=O)(=O)Cl 719543517 NRKUERHLFGVIHS-CYBMUJFWSA-N 433.751 4.608 70 10 IJIE CC1(C)C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191420841 BGZQWHLVCOPPNH-QMMMGPOBSA-N 430.133 4.685 70 10 IJIE C[C@@H](CCOc1ccc(Br)cc1Br)CCS(=O)(=O)Cl 116049913 PWSYCRAZJAQWCA-VIFPVBQESA-N 434.577 4.575 70 10 IJIE CC(C)(C)c1ccc(OCCCNC(=O)NCCc2ccc(O)cc2)c(Br)c1 217298438 HAUDCNWGBNFSLL-UHFFFAOYSA-N 449.389 4.763 70 10 IJIE CC[C@H](C)CN(CC)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357397 IJFKNNNUZFYIEY-AWEZNQCLSA-N 429.991 4.763 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)c3cccc(C)c3)c2)cc1 216683750 IRYSMBVTVCTTET-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE O=S(=O)(F)c1cc(Br)cc(Cl)c1OCCCOCc1ccccc1 2016790136 SNXCNXDEDSROLS-UHFFFAOYSA-N 437.714 4.746 70 10 IJIE C[C@H](CS(=O)(=O)Cl)c1cc(Br)c(F)cc1NC(=O)OC(C)(C)C 1952643760 FASCCRYAHMCUAY-MRVPVSSYSA-N 430.723 4.607 70 10 IJIE CCC(C)(C)[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358527 QHQXKVXKQPHSFQ-ZDUSSCGKSA-N 429.991 4.809 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@H](NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1=O 217284821 PALPUQYVLMJGSF-SWLSCSKDSA-N 425.838 4.842 70 10 IJIE Cc1ccccc1CCNC(=O)NCCCOc1ccc(Br)cc1Cl 217299187 JEJVGOCEJHEILT-UHFFFAOYSA-N 425.754 4.722 70 10 IJIE C[C@H]1CN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C(C)(C)C1 2156359877 YLMNNSJYYQYTTP-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3cccc(F)c3)c2)cc1 216687073 HBUHENACYOJHDS-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE Cc1cc(Br)ccc1NC(=O)Nc1ccc2c(c1)C(=O)N(CC(C)C)C2=O 217279771 NJEWSRLESPAARI-UHFFFAOYSA-N 430.302 4.654 70 10 IJIE CCC1(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)CC1 1882284146 YUJVRVOWAPJTJR-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1ccc(Br)cc1Br)C1CCC1 2145990094 QYNQFVWSJYBWOC-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE COCCCN1C(=O)c2ccc(NC(=O)N(Cc3ccccc3)c3ccccc3)cc2C1=O 217280920 WAUZORCXDFBGST-UHFFFAOYSA-N 443.503 4.558 70 10 IJIE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@](C)([B-](F)(F)F)C1 1891517493 PCAWDGHAZCDPJT-WNSKOXEYSA-N 445.270 4.754 70 10 IJIE O=C1Cc2cc(C(=O)c3cc(Br)ccc3Br)c(Cl)cc2N1 159763194 GNFBNMUJPXCYKM-UHFFFAOYSA-N 429.495 4.591 70 10 IJIE C[C@H]1CC[C@@H](COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2282924945 GLNQXAKZEIQORP-DZGCQCFKSA-N 428.959 4.848 70 10 IJIE C[C@H]1[C@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1(C)C 2366254556 DSATZLHWOMRANP-SWLSCSKDSA-N 428.959 4.846 70 10 IJIE C[C@H]1CCC[C@@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354722 LPUOZMBGQNARHH-DZGCQCFKSA-N 428.959 4.990 70 10 IJIE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 1879730050 IXYKTFWWJBSPGO-KGFZYKRKSA-N 431.888 4.727 70 10 IJIE CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@@H]([B-](F)(F)F)C1 1891516985 KUHDWPUFYLMDNX-VFNWGFHPSA-N 445.270 4.754 70 10 IJIE CC[C@H](CC1CC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355200 PJRZUXWGKMAZJZ-OAHLLOKOSA-N 427.975 4.563 70 10 IJIE CCCN(CC1CC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355350 QRANWQCUAHKWSR-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE O=C(OCCCCC(F)F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2238399954 UJMXSSKHQBUGGU-UHFFFAOYSA-N 438.901 4.847 70 10 IJIE CCOc1c(C)cc(S(=O)(=O)NCc2ccc(C(=O)c3ccsc3)s2)cc1C 217293699 WRBXLWYWRMPANL-UHFFFAOYSA-N 435.592 4.535 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc([C@H](CS(=O)(=O)Cl)C2CC2)c(Br)c1 1952697631 YHLRCMHKHGBJCE-CYBMUJFWSA-N 438.771 4.858 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)cc([C@H](CS(=O)(=O)Cl)C2CC2)c1 1952837304 WJHCNLUZMNYIMA-CQSZACIVSA-N 438.771 4.858 70 10 IJIE CC[C@H]1C[C@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2369429800 WHWPHYCACPNASE-LSDHHAIUSA-N 428.959 4.848 70 10 IJIE CN(c1ncc([B-](F)(F)F)cc1Br)[C@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2116131448 YATCNMMJWXPEDG-DLBZAZTESA-N 442.108 4.719 70 10 IJIE CCCCC[C@H](C)NS(=O)(=O)c1cc(Br)c(C)cc1Br 159591383 MUYNUBZDUXPTBH-NSHDSACASA-N 427.202 4.767 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)Nc2cccc(CNC(=O)C(F)(F)F)c2)cc1 216836288 MMAXRVZARBSFPI-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE COc1cc(NC(=O)Nc2ccccc2I)c(OC)cc1Cl 217273087 UBNYGHACOPOKNU-UHFFFAOYSA-N 432.645 4.606 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(Br)c(C(=O)N2CC[C@H]([B-](F)(F)F)C2)c1 2319674731 NUGDDIAIUFMYTP-JTQLQIEISA-N 436.057 4.860 70 10 IJIE O=C(NC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccccc2Cl)C1)Nc1cccc(F)c1 216782610 DTIDOPYFOFTXAG-BEVDRBHNSA-N 429.923 4.643 70 10 IJIE CC(=O)C(N=Nc1ccccc1)=P(N=S(C)(C)=O)(c1ccccc1)c1ccccc1 263630600 WPRVBFASTKMVJD-UHFFFAOYSA-N 437.505 4.800 70 10 IJIE O=S(=O)(NC[C@@H]1CCCN1c1nccs1)c1ccc(Oc2ccccc2Cl)cc1 217801866 UILKRWBSAYZDQH-HNNXBMFYSA-N 449.985 4.536 70 10 IJIE C[C@H](COCc1ccccc1)COc1ccc(S(=O)(=O)Cl)cc1Br 719544758 SUAZLCDPGZZZJQ-CYBMUJFWSA-N 433.751 4.608 70 10 IJIE O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)C1)Nc1cccc(F)c1 216782559 DTIDOPYFOFTXAG-CWFSZBLJSA-N 429.923 4.643 70 10 IJIE C[C@H]1Cc2ccccc2N1C(=O)c1cc(Br)ccc1I 217450435 REEVIMAEJLHAQN-JTQLQIEISA-N 442.094 4.645 70 10 IJIE CCCC[C@H](CC)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193690112 GDOZMVFWPLRQRO-HNNXBMFYSA-N 429.991 4.953 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)[C@@H](C)C(C)(C)C)cc1Br 159598258 FKCVJHXNFCJVHD-JTQLQIEISA-N 427.202 4.575 70 10 IJIE Cc1nn(Cc2ccc(Cl)cc2Cl)c2sc(C(=O)N(C)Cc3cnccn3)cc12 217230948 VSVXXTHPWZKSNY-UHFFFAOYSA-N 446.363 4.824 70 10 IJIE O=C(O[C@@H]1CCCC1(F)F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197020698 XGBRNNPTCJZPPT-CYBMUJFWSA-N 436.885 4.599 70 10 IJIE CC(C)C[C@@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 2382180111 AIVXRRPLCYXEAC-JTQLQIEISA-N 448.604 4.821 70 10 IJIE C[C@H](CC1CCC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156362845 ROWNEDKDSATOJG-CYBMUJFWSA-N 427.975 4.563 70 10 IJIE COC(=O)c1cc(NC(=O)OCC2c3ccccc3-c3ccccc32)cc([B-](F)(F)F)c1 1887521655 DMQCDUIWXQMWAY-UHFFFAOYSA-N 440.206 4.889 70 10 IJIE O=C(CCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1CCCN(c2nccs2)C1 218136133 JCPKIRDLNIWEPE-QFIPXVFZSA-N 435.593 4.688 70 10 IJIE CCC(C)(CC)CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359819 BZPGATBYNYOPJH-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE CC1(C)CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156354850 MMIPGOJDTBNINF-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CCC[C@@H]1CCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357455 IUOJBMLKSFYAMW-OAHLLOKOSA-N 427.975 4.659 70 10 IJIE C[C@]1(C(=O)Nc2cccc(CSC3CCOCC3)c2)CCCN1C(=O)c1ccccc1 217225970 NZDNUYKDRSSVPC-RUZDIDTESA-N 438.593 4.732 70 10 IJIE C[C@@H]1CCCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156363253 TYVDVFFHLRBYEC-CQSZACIVSA-N 427.975 4.517 70 10 IJIE CCCN[C@@H](CSc1ccc(Br)cc1)c1c(Br)cnn1C 160695728 QDWVHDIKXQYYBV-AWEZNQCLSA-N 433.213 4.778 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)c3cccc(F)c3)cc2)cc1 216637026 NMRJGWFCFOZGRB-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE C[C@H](C(=O)Nc1ccccc1-c1cn2ccsc2n1)n1nc(-c2cccs2)ccc1=O 218559974 FYXFEFJPKDKFMO-CQSZACIVSA-N 447.545 4.548 70 10 IJIE C=CCCC[C@H](NC(=O)c1cc(Cl)c(S(=O)(=O)F)cc1OC)c1ccccc1 1598380094 XNOQUAOQDAWQKT-KRWDZBQOSA-N 425.909 4.834 70 10 IJIE O=C([C@H]1CC(=O)N(c2cccc(Br)c2)C1)N1CCCC[C@H](c2ccccc2)C1 217287228 QBFSMGSCSYAXQW-OALUTQOASA-N 441.369 4.598 70 10 IJIE O=C(c1scc(Br)c1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 1879739558 HGDGGFMOFLJNHA-KGFZYKRKSA-N 431.888 4.727 70 10 IJIE C[C@]1([B-](F)(F)F)CCN(C(=O)CCNC(=O)OCC2c3ccccc3-c3ccccc32)C1 1891516721 JDSSECHXTJQCIG-QHCPKHFHSA-N 445.270 4.755 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)CC2CCCCC2)cc1Br 159564792 HJESJADAWYNIIE-UHFFFAOYSA-N 439.213 4.721 70 10 IJIE Cc1ccc(S(=O)(=O)Nc2c(C)cc(C)cc2Br)c(Br)c1 159902339 AXSCEHXAUNBFDA-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@@](C)([B-](F)(F)F)C1 1891517491 PCAWDGHAZCDPJT-IQMFZBJNSA-N 445.270 4.754 70 10 IJIE C[C@@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@H](C)C1 2156353951 FOSAYABYYLRMHA-ZIAGYGMSSA-N 427.975 4.515 70 10 IJIE F[B-](F)(F)C1CCN(Cc2ccc(I)c(Br)c2)CC1 2325261404 ZWFMMWRRDLAEGZ-UHFFFAOYSA-N 446.865 4.867 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)[C@H](C)C(C)(C)C)cc1Br 159598414 FKCVJHXNFCJVHD-SNVBAGLBSA-N 427.202 4.575 70 10 IJIE CC(C)c1cc(S(=O)(=O)Cl)ccc1OC[C@H]1CC1(Br)Br 2233039192 MIRMGUUECFSKQY-SECBINFHSA-N 446.588 4.622 70 10 IJIE Cc1ccc(CN(C)C(=O)c2cc(Br)ccc2I)cc1 217511723 GQMXZDPLFIRQPX-UHFFFAOYSA-N 444.110 4.634 70 10 IJIE CN[C@H](Cc1cc(F)ccc1Br)c1ccccc1I 161504072 ZGRXMPCVQBGPSI-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE NC[C@@H](c1cccc(Cl)c1F)[C@H](O)c1cc(Br)ccc1Br 161282374 GRUOBUDUNAYXOP-XHDPSFHLSA-N 437.534 4.780 70 10 IJIE Cc1ccccc1CN(C)C(=O)c1cc(Br)ccc1I 217510684 DRABMBVLJBFKHX-UHFFFAOYSA-N 444.110 4.634 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@H](NC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1=O 217284101 SLGGZZDAPSMBSD-SQJMNOBHSA-N 427.548 4.761 70 10 IJIE CC[C@H]1C[C@H](C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358866 SPVOFDFENBXHGN-ZFWWWQNUSA-N 427.975 4.515 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(CC(C)C)C(C)C)cc1Br 159600167 BFMAKLNGUNYSHW-UHFFFAOYSA-N 427.202 4.575 70 10 IJIE COc1ccc(Cl)cc1NC(=O)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 217281117 DJJNPBZOJOQURC-UHFFFAOYSA-N 427.888 4.921 70 10 IJIE O=C(c1scc(Br)c1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 1879739560 HGDGGFMOFLJNHA-UPONEAKYSA-N 431.888 4.727 70 10 IJIE Nc1ccc(NC(=O)c2cc(Br)ccc2Br)c(Br)c1 159572535 CTYVGYNEZWKXJA-UHFFFAOYSA-N 448.940 4.809 70 10 IJIE CC(C)C1CC(OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2188318932 KWVIZHYZOYLVRV-UHFFFAOYSA-N 428.959 4.846 70 10 IJIE O=C(Nc1ccc(-c2csc(Nc3cccnc3)n2)cc1)c1cccc2c1OCCO2 218532020 OFOJGQZHUAMNMO-UHFFFAOYSA-N 430.489 4.972 70 10 IJIE C[C@@H](CS(=O)(=O)Cl)c1cc(Br)c(F)cc1NC(=O)OC(C)(C)C 1952643761 FASCCRYAHMCUAY-QMMMGPOBSA-N 430.723 4.607 70 10 IJIE CC1CCC(OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355016 NYXIHHUGKKZWGU-UHFFFAOYSA-N 428.959 4.990 70 10 IJIE C[C@@H]1CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@@H]1C 2156354516 JZZHHDGBNPFVTG-ZIAGYGMSSA-N 427.975 4.515 70 10 IJIE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1 1462272419 XNLZDSVJVWPRBN-FLIBITNWSA-N 435.370 4.566 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC[C@@H]3C[C@H]23)c(Br)c1 2191164424 QOXYHHXGQDDRFE-WEDXCCLWSA-N 444.572 4.564 70 10 IJIE C[C@H]1C[C@]1(C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2134420833 CLOHAENEXZWJQZ-JVXZTZIISA-N 432.561 4.564 70 10 IJIE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)Nc1nc2c(s1)C(=O)CCC2 216722635 RXJPEOSAPLALAM-UHFFFAOYSA-N 446.507 4.835 70 10 IJIE C[C@@H]1CC[C@](C)(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2193328654 DAHVLSUXFXKAKI-YJYMSZOUSA-N 427.975 4.563 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2ccc(F)cc2C)cc1Br 159539750 QUOSDNQZXPHGJC-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE O=C(CCc1cccc(OCc2ccccc2)c1)NC[C@@H]1CCCN(c2nccs2)C1 218135951 YJUFMGNELXZGDG-QFIPXVFZSA-N 435.593 4.688 70 10 IJIE CC[C@H]1CC[C@@H]1N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2161927338 CSJXSWAYIMPPAA-HOCLYGCPSA-N 427.975 4.515 70 10 IJIE CC(C)N1C(=O)c2ccc(NC(=O)N(Cc3ccccc3)Cc3ccccc3)cc2C1=O 217279216 FGVBDXAOUYAFFO-UHFFFAOYSA-N 427.504 4.925 70 10 IJIE Cc1ccccc1Oc1ccc(S(=O)(=O)N2CCC3(CC2)OC(=O)c2ccccc23)cc1 217550318 ZZHUFOYETIMUSE-UHFFFAOYSA-N 449.528 4.638 70 10 IJIE O=C(NCCn1nc(-c2ccncc2)c2c1CCCC2)C(c1ccccc1)c1ccccc1 217454270 NRJUCQLOWSISJT-UHFFFAOYSA-N 436.559 4.772 70 10 IJIE O=S(=O)(Cl)c1cc(Br)cc(Cl)c1OCc1ccncc1Cl 215765893 LMKTVIWCXFEUCO-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE Cc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)N(CC(C)C)C3=O)c(Br)c1 217279770 QCACNNQTQVJWAP-UHFFFAOYSA-N 430.302 4.654 70 10 IJIE Cc1cc(NC(=O)Nc2ccc3c(c2)C(=O)N(CC(C)C)C3=O)ccc1Br 217279772 LTINUAHQKUMPPJ-UHFFFAOYSA-N 430.302 4.654 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2cc(I)ccc2Cl)cc1 2272684831 QALCOTCPFRRORL-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccc(Br)cc2)c(Br)c1 109526776 ODCMRCBZXITALU-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE C[C@@H]1CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355060 OHRIWIQCMULOIJ-CQSZACIVSA-N 427.975 4.517 70 10 IJIE N[C@@H](c1ccccc1)c1nnc(-c2cc(Br)ccc2Br)s1 161289044 AFUAXSIWYCTOBC-ZDUSSCGKSA-N 425.149 4.778 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2cccc(F)c2)cc1 216662642 GPGMIEDSHYVFCX-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE CC(C)[C@@H](C)[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2365482400 WLURUYXJZYDWIY-KGLIPLIRSA-N 429.991 4.665 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)c2ccccc2C)cc1Br 159636388 USZJBLISHDOSAS-UHFFFAOYSA-N 433.165 4.654 70 10 IJIE CCC(CC)[C@H](C)NS(=O)(=O)c1cc(Br)c(C)cc1Br 159656495 LYOOCXAXLPIWGY-JTQLQIEISA-N 427.202 4.623 70 10 IJIE O=C(CCc1ccc(Cl)c(C(F)(F)F)c1)NC[C@H]1CCCN(c2nccs2)C1 218140476 AZXGXMGHGCIJRM-CQSZACIVSA-N 431.911 4.781 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2c(Br)cccc2Br)cc1 2150514462 RUPBPSOQIBYTEA-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE C=CCOc1ccc(Br)cc1NC(=O)c1cc(S(=O)(=O)F)ccc1Cl 1460781344 NFUSYSTYWXWVHF-UHFFFAOYSA-N 448.697 4.578 70 10 IJIE C=CCN(C(=O)c1ccc(S(=O)(=O)F)cc1Cl)c1nc(-c2ccccc2)cs1 1524295190 AUIDYFCFFSOIKM-UHFFFAOYSA-N 436.917 4.955 70 10 IJIE CC(C)(COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(F)F 2361844613 SPKHDIJXZDZUKJ-UHFFFAOYSA-N 438.901 4.703 70 10 IJIE CCCC[C@@H](CC)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193690113 GDOZMVFWPLRQRO-OAHLLOKOSA-N 429.991 4.953 70 10 IJIE O=C(O[C@H]1C[C@H]2CC[C@H]1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2240698009 GUHYQXUILGTALV-DZKIICNBSA-N 426.943 4.600 70 10 IJIE C[C@@H]1[C@@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1(C)C 2366254554 DSATZLHWOMRANP-DOMZBBRYSA-N 428.959 4.846 70 10 IJIE CCC[C@H](C)CN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356061 XAHHRVPDZBMXPV-AWEZNQCLSA-N 429.991 4.763 70 10 IJIE C[C@@H]1CC[C@H](COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191422416 UDACGCCIOPVSPF-BDAKNGLRSA-N 430.133 4.685 70 10 IJIE CC(=O)Nc1cccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)c1 217299041 WEQBTOYFZZPXRR-UHFFFAOYSA-N 440.725 4.652 70 10 IJIE C=C/C=C\CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 713679046 QGNHWCBSLQIPTK-ARJAWSKDSA-N 430.545 4.650 70 10 IJIE CC1(C)C[C@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1921416395 JDDZBHHJERDVBB-MRVPVSSYSA-N 446.588 4.954 70 10 IJIE COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)CC(c1ccccc1)c1ccccc1 217950982 YJFUELJNIZVGNL-QPPBQGQZSA-N 447.506 4.569 70 10 IJIE CC1(C)CC(COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2192299598 PCUYWEMYQJYEEX-UHFFFAOYSA-N 428.959 4.848 70 10 IJIE CC[C@@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@@H]1C 2171919272 TTWFBUOOSOIMCT-UKRRQHHQSA-N 427.975 4.515 70 10 IJIE COc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)N(C2CCCCC2)C3=O)cc1Cl 217281112 QISKHPLJBWPKHF-UHFFFAOYSA-N 427.888 4.921 70 10 IJIE CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)[C@@H]1CCC1(C)C 2156357630 KEMWLWPYTZTAGA-OAHLLOKOSA-N 427.975 4.515 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(C(=O)N2CC[C@H]([B-](F)(F)F)C2)ccc1Br 2319681265 YJKFBIFYLMUIEM-NSHDSACASA-N 436.057 4.860 70 10 IJIE CC(C)[C@@H]1C[C@@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743339 HPIIVBAIXVSVHS-CABCVRRESA-N 428.959 4.704 70 10 IJIE CCOc1cc(NC(=O)N2CCN(c3cccc(C)c3C)CC2)cc(OCC)c1OCC 217275116 DAFWDPPFJAAQRE-UHFFFAOYSA-N 441.572 4.854 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2ccccc2C)cc1 216662889 QRCJMUVJJHTZJU-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE CC(C)=C(F)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1877406971 LQWXVQQRENDWCC-UHFFFAOYSA-N 436.524 4.781 70 10 IJIE O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1cccc([N+](=O)[O-])c1 196454991 LBJRAQTYTBPUCQ-UHFFFAOYSA-N 425.424 4.574 70 10 IJIE CC[C@@H](CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(C)C 2156360446 FJZWLPXHWMHPBX-HNNXBMFYSA-N 429.991 4.667 70 10 IJIE NC[C@H](c1cccc(Cl)c1F)[C@H](O)c1cc(Br)ccc1Br 161282260 GRUOBUDUNAYXOP-IAQYHMDHSA-N 437.534 4.780 70 10 IJIE CCN[C@H](CSc1cccc(Br)c1)c1c(Br)cnn1CC 160784089 KDPCYWATMYNYER-CQSZACIVSA-N 433.213 4.871 70 10 IJIE C[C@@H](CC(C)(C)C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359056 USXSKCHRWSPEAR-ZDUSSCGKSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)Cc3ccc(C)cc3)c2)cc1 216690295 UIRRRPMWSACHDB-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CC(C)(C)OC(=O)Nc1cccc([C@H](CS(=O)(=O)Cl)C2CC2)c1Br 1952837831 CSMKMRQIZNCPIC-GFCCVEGCSA-N 438.771 4.858 70 10 IJIE C[C@H]1CCCC[C@@H]1OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353834 DXCREIRNYSISKC-BBRMVZONSA-N 428.959 4.990 70 10 IJIE CC(C)CC[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356690 CLLSIUGBJSHXDX-AWEZNQCLSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2ccc(F)cc2)cc1 216648670 KPZDBLKRYMUVQN-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE O=C(OCC1CC2(CC2)C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2192301556 AENRXZSQBSWPGZ-UHFFFAOYSA-N 426.943 4.602 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)Cc2ccc(C)cc2)cc1 216665846 ZPXHCLVHNPUYLL-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CC(C)N(CC1CC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353414 AWKAASAQMNPKTR-UHFFFAOYSA-N 427.975 4.515 70 10 IJIE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@@H]([B-](F)(F)F)C1 1888324817 OHRGHTFYDTYIDM-HZPDHXFCSA-N 445.270 4.754 70 10 IJIE C[C@@H]1CC[C@H](N(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156352498 SBOHURWUCSOGRW-HIFRSBDPSA-N 427.975 4.515 70 10 IJIE CC(=CCl)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1879287549 SWZMOHFZWZCLTG-UHFFFAOYSA-N 438.952 4.661 70 10 IJIE O=C(CCc1cccc(OCc2ccccc2)c1)NC[C@H]1CCCN(c2nccs2)C1 218136020 YJUFMGNELXZGDG-JOCHJYFZSA-N 435.593 4.688 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H](C)CCC(C)C)cc1Br 159590798 GATYWXUPCZQFPC-LLVKDONJSA-N 427.202 4.623 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)/C=C/c2ccccc2)cc1 216668350 XJPLKMJTPMENLL-SFQUDFHCSA-N 444.487 4.804 70 10 IJIE C[C@@H]1CC[C@@H](N(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156352499 SBOHURWUCSOGRW-UKRRQHHQSA-N 427.975 4.515 70 10 IJIE O=C(c1c(Br)cccc1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194134435 WKMYWFOMNHTWOQ-OQPBUACISA-N 425.859 4.665 70 10 IJIE O=C(NCCC(=O)N1CCC([B-](F)(F)F)CC1)OCC1c2ccccc2-c2ccccc21 2241641486 VJDMBOQMTYESNX-UHFFFAOYSA-N 445.270 4.755 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)F)c1OCC(Br)=C(C)C 2365689646 IGZAGBPGYRWSPD-UHFFFAOYSA-N 430.133 4.737 70 10 IJIE CCCCOC(=O)c1ccccc1NC(=O)Nc1ccc2c(c1)C(=O)N(CC(C)C)C2=O 217279556 OKMUCBKELYGUPA-UHFFFAOYSA-N 437.496 4.540 70 10 IJIE COc1ccc(OC)c(NC(=O)NCCCOc2ccc(Br)cc2Cl)c1 217298921 PMFCADZAVHAIMF-UHFFFAOYSA-N 443.725 4.710 70 10 IJIE CCC(CC)(COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2364046991 WNBOYYDWVYFLSB-UHFFFAOYSA-N 448.604 4.965 70 10 IJIE CN(C)c1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217299058 HFJTVFZLFVHLEQ-UHFFFAOYSA-N 426.742 4.759 70 10 IJIE CC(=O)c1cccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)c1 217298938 UEEALMGYBSCTOV-UHFFFAOYSA-N 425.710 4.896 70 10 IJIE CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(C)c(S(=O)(=O)F)c3)cc2)cc1 1533342925 COUPYEYWEXLJAR-UHFFFAOYSA-N 427.453 4.900 70 10 IJIE CC(C)=C(Br)COc1c(C)cc(Br)cc1S(=O)(=O)Cl 2340312403 HWULPQOMQWSJJH-UHFFFAOYSA-N 432.561 4.753 70 10 IJIE CC(C)(C)[C@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2364046600 SFSAIMFWBSBICF-SECBINFHSA-N 448.604 4.821 70 10 IJIE O=C(Nc1nc2c(s1)C(=O)CCC2)c1cc(Br)sc1Br 217225905 SEOUIBZHVDOEEY-UHFFFAOYSA-N 436.150 4.501 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)C=C3CCCCC3)c2)cc1 216696115 BDFPEPOUOJPGCU-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE C[C@H](CC1CC1)N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2158007392 UHHFWHYBJXJJIO-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE Cc1ccccc1Oc1ccc(S(=O)(=O)N2CCC[C@]3(C2)OC(=O)c2ccccc23)cc1 217629315 WAJIGPABNFQNGW-RUZDIDTESA-N 449.528 4.638 70 10 IJIE Nc1ccc2c(c1)CCC[C@@H]2NC(=O)c1cc(Br)c(Br)s1 159374398 NSYSYOWRNQFDLJ-LBPRGKRZSA-N 430.165 4.663 70 10 IJIE C[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@H](C)C1 2156353950 FOSAYABYYLRMHA-UONOGXRCSA-N 427.975 4.515 70 10 IJIE CC[C@H](OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156356419 ZUGLMCYXZGEWJY-INIZCTEOSA-N 428.959 4.990 70 10 IJIE Cc1cc(C)c(NS(=O)(=O)c2cc(Br)ccc2C)c(Br)c1 159903051 FHCRQLKWGSPSLA-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE COc1cccc([C@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)c1OCc1ccccc1 217068104 DHQRGOCBJPHRGT-ZEQKJWHPSA-N 427.548 4.797 70 10 IJIE O=C(c1ccc(Br)cc1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2194128197 CRXHHODNEBDOSG-SDBXPKJASA-N 425.859 4.665 70 10 IJIE CC(C)(C)[C@@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 115572746 FZPOHOUVORZRTB-VIFPVBQESA-N 448.604 4.821 70 10 IJIE CC(C)(C)[C@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 115572750 FZPOHOUVORZRTB-SECBINFHSA-N 448.604 4.821 70 10 IJIE O=S(=O)(Cl)c1ccccc1Oc1ccc(Br)cc1Br 2102557720 CIGDNHCIGPFSHR-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE Cc1cccc(N(C)S(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159636568 CTDKNDYXDNTBEA-UHFFFAOYSA-N 433.165 4.654 70 10 IJIE CC1(C)C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722858303 TZUMNWBQXDPEPK-ZETCQYMHSA-N 432.561 4.564 70 10 IJIE CC(C)C(C)(C)CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358896 SVGFUCPLKYYBLQ-UHFFFAOYSA-N 429.991 4.667 70 10 IJIE COc1ccc(F)cc1-c1csc(NC(=O)[C@@]2(C)CCCN2C(=O)c2ccccc2)n1 217225777 MHANMTRJDPBNSG-HSZRJFAPSA-N 439.512 4.591 70 10 IJIE CCOc1cc(NC(=O)NCc2ccccc2Br)cc(OCC)c1OCC 217275241 UJFHEDXLSTWVSC-UHFFFAOYSA-N 437.334 4.967 70 10 IJIE C[C@@H](COc1c(Br)cc(S(=O)(=O)Cl)cc1Br)C1CC1 2087903181 HULMFNDXYRXFHD-ZETCQYMHSA-N 432.561 4.564 70 10 IJIE CC=CCCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2123147747 HCTBPWAPDLOHKK-UHFFFAOYSA-N 432.561 4.874 70 10 IJIE C[C@H]1CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@@H]1C 2156354515 JZZHHDGBNPFVTG-UONOGXRCSA-N 427.975 4.515 70 10 IJIE O=C(NCCCC(=O)N1CC[C@@H]([B-](F)(F)F)C1)OCC1c2ccccc2-c2ccccc21 1891517721 RWYFLSYKZXOSEH-MRXNPFEDSA-N 445.270 4.755 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)cc(C(=O)N2CC[C@H]([B-](F)(F)F)C2)c1 2319679305 FPPNWJNWYAIDQM-NSHDSACASA-N 436.057 4.860 70 10 IJIE C[C@@H]1C[C@@H]1CCCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182894059 NLPGILJZQMXSCA-HIFRSBDPSA-N 428.959 4.848 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CC[C@H]2CCCC[C@@H]2C1 217480619 ALRVTCFXSLMPFP-VXGBXAGGSA-N 448.142 4.706 70 10 IJIE CC1(C)CC[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2281089050 RFJMJIVWLIMQNZ-QMMMGPOBSA-N 446.588 4.954 70 10 IJIE C[C@H]1CCC[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2149833831 YMEYKYYUVGEWBW-IUCAKERBSA-N 446.588 4.954 70 10 IJIE C=CC1(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)CCC1 2168016924 KWKRWXCHHQNVRC-UHFFFAOYSA-N 444.572 4.874 70 10 IJIE CC(C)(COc1c(Br)cc(S(=O)(=O)F)cc1Br)C(F)F 2191414486 RBDMYEZKNJVMGE-UHFFFAOYSA-N 440.075 4.540 70 10 IJIE CC(C)CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 165162060 ZZWKQXIWPJDGMV-UHFFFAOYSA-N 434.577 4.954 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(Br)c(C(C)(C)CS(=O)(=O)Cl)c1 1952812557 YLMBVMZZOPYCHC-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE CCN(Cc1ccccc1)C(=O)c1cc(Br)ccc1I 217519528 WKJRSBIEHSIBGW-UHFFFAOYSA-N 444.110 4.716 70 10 IJIE CC(C)c1cc(=O)n(CC(=O)Nc2ccccc2-c2csc(-c3ccccc3F)n2)cn1 218609330 HQQWVLGOAJWDNV-UHFFFAOYSA-N 448.523 4.935 70 10 IJIE CC(C)(C)OC(=O)Nc1cccc([C@@H](CS(=O)(=O)Cl)C2CC2)c1Br 1952837832 CSMKMRQIZNCPIC-LBPRGKRZSA-N 438.771 4.858 70 10 IJIE C[C@@H](CCOc1cc(Br)cc(Br)c1)CCS(=O)(=O)Cl 2338709763 MUGICAVFIPYSHR-VIFPVBQESA-N 434.577 4.575 70 10 IJIE C[C@H]1CC[C@@H](C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353932 FNHJJAKQQQTLPT-KGLIPLIRSA-N 427.975 4.515 70 10 IJIE O=C(c1cc(Br)sc1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 1879738109 RASPRNDRTZTREZ-UPONEAKYSA-N 431.888 4.727 70 10 IJIE C[C@H]1CCC[C@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354725 LPUOZMBGQNARHH-ZFWWWQNUSA-N 428.959 4.990 70 10 IJIE O=C(NCOc1ccc(Cl)cc1Cl)Nc1ccc(I)cc1 217297443 NWXZWCKNKUUXKY-UHFFFAOYSA-N 437.064 4.756 70 10 IJIE C[C@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCCC1 2156353982 FXGQHIAQDAIVRK-ZDUSSCGKSA-N 427.975 4.563 70 10 IJIE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 1879739559 HGDGGFMOFLJNHA-KSBSHMNSSA-N 431.888 4.727 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)/C=C/c3ccccc3)c2)cc1 216692925 SZXJYJHXQYOWND-LFIBNONCSA-N 444.487 4.804 70 10 IJIE Cc1cc(I)ccc1NC(=O)NCc1ccccc1Br 217314270 CPTVQGZKHPLFSE-UHFFFAOYSA-N 445.098 4.684 70 10 IJIE C[C@@H](COCc1ccccc1)COc1ccc(S(=O)(=O)Cl)cc1Br 719544762 SUAZLCDPGZZZJQ-ZDUSSCGKSA-N 433.751 4.608 70 10 IJIE CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cc(Br)cc(S(=O)(=O)Cl)c1 2034760311 ULKVJRHYQQBGMM-CYBMUJFWSA-N 444.778 4.818 70 10 IJIE CCOc1cc(NC(=O)N[C@@H](C)c2ccc(OC)c(OC)c2)cc(OCC)c1OCC 217274483 UVNKHDRYVUXEAI-HNNXBMFYSA-N 432.517 4.783 70 10 IJIE CCC[C@@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 114770950 FKAHHKLEDSEWTC-VIFPVBQESA-N 434.577 4.575 70 10 IJIE Cc1ccc(C(=O)CCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 217281665 SHUVGYJGCWSPOK-UHFFFAOYSA-N 441.575 4.685 70 10 IJIE C[C@H]1CCCCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355814 UYVVUTGJRUPDEH-AWEZNQCLSA-N 427.975 4.659 70 10 IJIE C=CCCCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2123075456 QXCBWTOGSVOKMH-UHFFFAOYSA-N 432.561 4.874 70 10 IJIE O=S(=O)(Cl)c1ccccc1OCc1c(Br)cccc1Br 2366152803 JWVWEHVFXDYBPH-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE C[C@@H]1CC[C@@H](C)N(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353934 FNHJJAKQQQTLPT-ZIAGYGMSSA-N 427.975 4.515 70 10 IJIE C[C@H]1CC[C@@](C)(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2193328653 DAHVLSUXFXKAKI-ORAYPTAESA-N 427.975 4.563 70 10 IJIE C[C@@H]1CC(C)(C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2170907909 OAXCDNNKLDXTDF-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE COc1cc(Br)ccc1C(=O)Nc1ccc(C)c(I)c1 160672375 GBHBPFCBTILTIS-UHFFFAOYSA-N 446.082 4.623 70 10 IJIE O=S(=O)(NC[C@@H]1CCCN(c2nccs2)C1)c1ccc(-c2cccc(Cl)c2)cc1 218193472 WPOWNFTXKHOBAO-INIZCTEOSA-N 448.013 4.658 70 10 IJIE C[C@@H]1CCC[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2149833832 YMEYKYYUVGEWBW-RKDXNWHRSA-N 446.588 4.954 70 10 IJIE O=S(=O)(Cl)c1cccc(Oc2cc(Br)cc(Br)c2)c1 2338865381 MHDTYLRSUXBFMC-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE Nc1ccc2nc(NC(=O)c3cc(Br)ccc3Br)sc2c1 159559186 KBBOWWQSGAUZTA-UHFFFAOYSA-N 427.121 4.656 70 10 IJIE CCC[C@H]1CCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357454 IUOJBMLKSFYAMW-HNNXBMFYSA-N 427.975 4.659 70 10 IJIE CC[C@H]1CC[C@H]1N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2161927337 CSJXSWAYIMPPAA-GOEBONIOSA-N 427.975 4.515 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@]23CCC[C@H]2C3)c(Br)c1 2190968723 RMZUIOBQZNIKLX-SDBXPKJASA-N 444.572 4.708 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccc(I)cc2)c(Cl)c1 104925844 WKTHHCGGXYCEJM-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE NC(=S)c1ccc(Cl)cc1NC(=O)c1cc(Br)ccc1Br 159965486 STZJWGQFTFOSOP-UHFFFAOYSA-N 448.567 4.752 70 10 IJIE COc1ccc(Br)c(C(=O)NCc2ccc(C(=O)c3ccsc3)s2)c1 217293485 USYZNXXJMXEROZ-UHFFFAOYSA-N 436.352 4.742 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2ccccc2C)cc1 216662820 FQBPAWVHIMYKGS-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE CCCCCCCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156360319 DRENNEHKQYZYFH-UHFFFAOYSA-N 429.991 4.955 70 10 IJIE C[C@@H]1[C@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1(C)C 2366254555 DSATZLHWOMRANP-IUODEOHRSA-N 428.959 4.846 70 10 IJIE C[C@H]1CC[C@@H](COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2157879046 QPPZXQBXPRQCIC-DTWKUNHWSA-N 446.588 4.954 70 10 IJIE O=C(NCCn1nc(-c2ccncc2)c2c1CCCC2)Nc1cccc(C(F)(F)F)c1 217474049 PJMDQAUCRMVGJP-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)Cc2cccc(C)c2)cc1 216665248 AMHUWYOUIHIWOL-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE C=CCOc1ccc(CN(C(=O)CCc2ccc(S(=O)(=O)F)cc2)C(C)(C)C)cc1 1269611645 IIJNIZHGTMUSCS-UHFFFAOYSA-N 433.545 4.670 70 10 IJIE C=CCN(C(=O)c1cc(S(=O)(=O)F)ccc1Cl)c1nc(-c2ccccc2)cs1 1530619516 QPIZRKNAWDKULT-UHFFFAOYSA-N 436.917 4.955 70 10 IJIE CCCCCCN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2196691505 VRPBBZLVESZSOT-UHFFFAOYSA-N 429.991 4.907 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(C(C)(C)CS(=O)(=O)Cl)cc1OC(F)(F)F 1952625796 NHGWFMTUQHRGJF-UHFFFAOYSA-N 431.860 4.778 70 10 IJIE CC(C)C[C@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 2382180311 CMXFAHVDRSUKTI-SNVBAGLBSA-N 448.604 4.821 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2ccccc2F)cc1 216648490 UJKHQRGFCGDXJA-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE COc1cc(-c2cc(C(=O)N3CCCC[C@H](c4ccccc4)C3)[nH]n2)cc(OC)c1OC 217287994 ODNKUFYVGJMFHU-SFHVURJKSA-N 435.524 4.512 70 10 IJIE O=C(O[C@@H]1CC[C@H]2C[C@@H]2C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355634 SWANLMXDMFZMAP-RRFJBIMHSA-N 426.943 4.600 70 10 IJIE Cc1cc(I)c(Oc2ccc(S(=O)(=O)Cl)cc2)cc1Cl 2361696182 UMMAOXFGJLNGKF-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE O=S(=O)(NC[C@@H]1CCCN(c2nccs2)C1)c1ccc(-c2ccc(Cl)cc2)cc1 218192978 MNUURONBXSFEKA-INIZCTEOSA-N 448.013 4.658 70 10 IJIE CCOc1ccc2ccccc2c1C(=O)NCCn1nc(C(F)(F)F)c2c1CCCC2 217529829 WMEKPGWQDRDGQE-UHFFFAOYSA-N 431.458 4.763 70 10 IJIE C[C@H]1CC[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2227917796 BKNPDJOMLVIZGA-JGVFFNPUSA-N 432.561 4.564 70 10 IJIE CC[C@@H]1CC[C@@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2206133552 RKRRPQDACGCZIX-UKRRQHHQSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccccc2I)c(Cl)c1 104925872 QBPGKEBYTYOCLS-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCCCC2CC2)c(Br)c1 406089163 BPSQRIKQABXBBX-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE C[C@H](CCOc1c(Br)cccc1Br)CCS(=O)(=O)Cl 116490872 RJRFDFAUKIFOES-SECBINFHSA-N 434.577 4.575 70 10 IJIE CN[C@H](Cc1cc(Br)ccc1F)c1ccccc1I 160232945 TXGZEKAGVODMFH-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE C[C@H]1CCC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354470 JOEGRRLEMPVQPR-ZFWWWQNUSA-N 427.975 4.563 70 10 IJIE C[C@H](CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(C)(C)C 2156359677 XPNRAISPSPLDRE-CYBMUJFWSA-N 429.991 4.667 70 10 IJIE CC(C)c1cc(S(=O)(=O)Cl)ccc1OC[C@@H]1CC1(Br)Br 2233039195 MIRMGUUECFSKQY-VIFPVBQESA-N 446.588 4.622 70 10 IJIE CCC1(CC)CCN(S(=O)(=O)c2cc(Br)c(C)cc2Br)C1 159681857 AIDCKIJDKKGKSF-UHFFFAOYSA-N 439.213 4.721 70 10 IJIE CC(C)[C@H]1C[C@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743342 HPIIVBAIXVSVHS-LSDHHAIUSA-N 428.959 4.704 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)NC2C[C@@H](C)C[C@@H](C)C2)cc1Br 159665726 SDSNHHWYMJAJEK-DHHPTOIESA-N 439.213 4.623 70 10 IJIE CC[C@H]1CCCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354303 IHWOIGFPSSNPJS-HNNXBMFYSA-N 427.975 4.659 70 10 IJIE CCC(F)(F)CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191421468 JDNAOVCRPREJMO-UHFFFAOYSA-N 440.075 4.684 70 10 IJIE O=C(Cc1cccc(Br)c1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 216628650 MFBRGXIZNCHDQW-INIZCTEOSA-N 444.304 4.587 70 10 IJIE CC[C@@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722730106 FNJIRPTYCNFBDD-HTQZYQBOSA-N 432.561 4.564 70 10 IJIE O=S(=O)(Cl)CC1(COc2ccc(Br)cc2Br)CCCC1 115564223 NXWKUCFMVQSQQQ-UHFFFAOYSA-N 446.588 4.719 70 10 IJIE CC(=CBr)COc1c(Cl)cc(Br)cc1S(=O)(=O)Cl 2219374101 HXFNMSWAFXAKMG-UHFFFAOYSA-N 438.952 4.708 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC2=CCCCC2)c(Br)c1 2281248372 GEFXZIMSOZBWLR-UHFFFAOYSA-N 428.117 4.749 70 10 IJIE CC[C@]1(C)CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156359058 UTJVTYAPKHLBJF-LJQANCHMSA-N 427.975 4.517 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)Cc3ccc(C)cc3)c2)cc1 216690364 RDBDVKQOKIMYNK-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE C[C@@H]1CCC[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2191414992 XLQCYHHUZKDSMF-RKDXNWHRSA-N 430.133 4.685 70 10 IJIE CC1(C)CCCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156351379 HBIKKBBYXJREMX-UHFFFAOYSA-N 427.975 4.659 70 10 IJIE Cc1cc(I)ccc1NC(=O)N[C@@H](C)Oc1ccc(Cl)cc1 217294857 XPRFFEZTTJSGFW-LLVKDONJSA-N 430.673 4.800 70 10 IJIE O=C(NCCCOc1ccc(Br)cc1Cl)NCCCc1ccccc1 217299207 WEGJIBAMXVIPAL-UHFFFAOYSA-N 425.754 4.803 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)/C=C/C2CCCC2)cc1 216671304 OPHVRQAPBKVYTG-LFIBNONCSA-N 436.508 4.837 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@@H](NC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1=O 217284103 SLGGZZDAPSMBSD-OFVILXPXSA-N 427.548 4.761 70 10 IJIE O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)C1c2ccccc2Oc2ccccc21 218269101 ZTCDSOKRCIRTJC-GOSISDBHSA-N 439.471 4.599 70 10 IJIE C[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@@H](C)C1 2156353948 FOSAYABYYLRMHA-KBPBESRZSA-N 427.975 4.515 70 10 IJIE COc1ccc(C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1S(=O)(=O)Cl 1858135826 CNAQMYQYMSYKPX-UHFFFAOYSA-N 428.215 4.547 70 10 IJIE Cc1c(N)cc(CNC(=O)OCC2c3ccccc3-c3ccccc32)c(C)c1[B-](F)(F)F 1887510700 VGOZKVONUCRHIL-UHFFFAOYSA-N 439.266 4.979 70 10 IJIE CC1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCCCC1 2156354416 JCGKRKJKFCFPSG-UHFFFAOYSA-N 427.975 4.707 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2cccc(I)c2)c(Cl)c1 104925847 IPIAOWNWTCXWPF-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE CCC[C@@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200566329 OFSPLROTBFHVFT-BDAKNGLRSA-N 446.588 4.954 70 10 IJIE C[C@H](COc1c(Br)cc(S(=O)(=O)Cl)cc1Br)C1CC1 2087903180 HULMFNDXYRXFHD-SSDOTTSWSA-N 432.561 4.564 70 10 IJIE O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)Nc1ccc(C(F)(F)F)cc1 217511121 JHEZBHSAFRBNRT-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE O=C(O[C@@H]1CC[C@H]2C[C@@H]1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2198393843 QNARYRTVMYKPJP-IJEWVQPXSA-N 426.943 4.600 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCCCC2CC2)c(Br)c1 2235466020 SUENTQNOVFCQDI-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE O=C(NCc1ccc(CS(=O)(=O)F)cc1)OCC1c2ccccc2-c2ccccc21 2081128780 JJTGNALLZVRXJT-UHFFFAOYSA-N 425.481 4.525 70 10 IJIE COC(=O)[C@@H]1C[C@H](Oc2ccccc2F)CN1C(=O)CC(c1ccccc1)c1ccccc1 217950811 YJFUELJNIZVGNL-URXFXBBRSA-N 447.506 4.569 70 10 IJIE CC(=O)N1CCC(C(=O)Nc2cccc(-c3csc(Nc4ccccc4F)n3)c2)CC1 218532521 QSMZLBASKPURIZ-UHFFFAOYSA-N 438.528 4.890 70 10 IJIE O=C([C@H]1CC(=O)N(c2cccc(Br)c2)C1)N1CCCC[C@@H](c2ccccc2)C1 217287226 QBFSMGSCSYAXQW-MOPGFXCFSA-N 441.369 4.598 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2=CCCC2)c(Br)c1 401162493 JOAVHJXIJHZNML-UHFFFAOYSA-N 430.545 4.628 70 10 IJIE C[C@@H]1CCC[C@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193328873 GGOXGUDWQPJWGC-YJYMSZOUSA-N 427.975 4.563 70 10 IJIE CCCOc1ccc([C@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)cc1Br 217067714 JNGJCGYAAGSTPW-XMSQKQJNSA-N 428.374 4.760 70 10 IJIE C[C@H]1C[C@H]1CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2182710690 CICYKXCBAMMZQB-DTWKUNHWSA-N 446.588 4.954 70 10 IJIE CCN(c1ccccc1)S(=O)(=O)c1cc(Br)c(C)cc1Br 159535058 CJHPMRWAQHYKPG-UHFFFAOYSA-N 433.165 4.735 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3ccc(F)cc3)c2)cc1 216673806 HTAVJAOXVCSWEA-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE CC[C@@H](C)CN(CC)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357398 IJFKNNNUZFYIEY-CQSZACIVSA-N 429.991 4.763 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)Cc3ccc(C)cc3)cc2)cc1 216640313 HBOXVMUUFJSTSY-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2ccccc2F)cc1 216648555 USGFGINVZDBVQS-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE CC[C@H]1C[C@@H](C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358864 SPVOFDFENBXHGN-HIFRSBDPSA-N 427.975 4.515 70 10 IJIE Cc1ccccc1OCCCNC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217300281 BYYMNCGICCIQOD-UHFFFAOYSA-N 443.591 4.881 70 10 IJIE O=C(O[C@H]1CC[C@@H]2C[C@@H]2C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2354227168 SWANLMXDMFZMAP-KFWWJZLASA-N 426.943 4.600 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)c3ccccc3F)c2)cc1 216673629 APDZXFVWOKSRNE-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE CC(C)[C@@H](C)[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2365482402 WLURUYXJZYDWIY-ZIAGYGMSSA-N 429.991 4.665 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)F)c1OC[C@H](C)COCc1ccccc1 1890596918 MJFPWWWTXFUMNL-CQSZACIVSA-N 445.350 4.901 70 10 IJIE CN[C@@H](Cc1cc(Br)ccc1F)c1cccc(I)c1 160367720 ULJXRQUPOUPMNB-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@@H]([B-](F)(F)F)C1 1891516984 KUHDWPUFYLMDNX-QVKFZJNVSA-N 445.270 4.754 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(Br)c([C@H](CS(=O)(=O)Cl)C2CC2)c1 1952833954 LUABKFLJIDYGIR-CYBMUJFWSA-N 438.771 4.858 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CCCc2ccccc21 217450706 NQYVQCPMKWAOKA-UHFFFAOYSA-N 442.094 4.647 70 10 IJIE Cc1cc(I)c(Oc2cccc(S(=O)(=O)Cl)c2)cc1Cl 2361700370 HXQSKLCPDPSCJI-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE O=S(=O)(Cl)c1cc(Br)ccc1OCc1ccc(Br)cc1 88270384 ILKAMKFEZMQPIN-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC(C)=C(C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1877424252 DQTNNBANASNCLB-UHFFFAOYSA-N 432.561 4.874 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)ccc1C(C)(C)CS(=O)(=O)Cl 1952623875 TWVDHJVUKIZCLC-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE CC1(C)C[C@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191420840 BGZQWHLVCOPPNH-MRVPVSSYSA-N 430.133 4.685 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc([C@@H](CS(=O)(=O)Cl)C2CC2)c(Br)c1 1952697634 YHLRCMHKHGBJCE-ZDUSSCGKSA-N 438.771 4.858 70 10 IJIE CCN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCCC1 2156354563 KPPAGYYVPLYPPR-UHFFFAOYSA-N 427.975 4.659 70 10 IJIE CC[C@H]1CC[C@@H](NS(=O)(=O)c2cc(Br)c(C)cc2Br)[C@@H]1C 159668299 RVVGBQUKBXRSMX-UHIISALHSA-N 439.213 4.623 70 10 IJIE C[C@H](COc1c(Br)cc(S(=O)(=O)Cl)cc1Br)C1CCC1 398868478 YAXXWRQSXLHIFY-MRVPVSSYSA-N 446.588 4.954 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2CC3(CC3)C2)c(Br)c1 2154271383 IYGXZSZKDGMVGC-UHFFFAOYSA-N 444.572 4.708 70 10 IJIE O=C(O[C@@H]1CCC[C@@H]2C[C@H]21)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2206990279 NBQQWDZWKXDJHT-IIAWOOMASA-N 426.943 4.600 70 10 IJIE O=C(NCCCOc1ccc(Br)cc1Cl)NCCc1cccc(F)c1 217299194 IFAVEKQXSMOERU-UHFFFAOYSA-N 429.717 4.552 70 10 IJIE CCC(F)(F)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 704741197 TXZKQNBNOBDXOS-UHFFFAOYSA-N 442.503 4.563 70 10 IJIE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 1879730051 IXYKTFWWJBSPGO-KSBSHMNSSA-N 431.888 4.727 70 10 IJIE CC(C)Oc1ccc([C@@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)cc1Br 217067614 LKHQSOPVNDHQKU-GCJKJVERSA-N 428.374 4.759 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)[C@H](C)CC(C)C)cc1Br 159598737 GRSYSHQTYSYELR-LLVKDONJSA-N 427.202 4.575 70 10 IJIE Cc1cc(I)ccc1NC(=O)Nc1ccc2nc(C)c(C)nc2c1 217302013 RIJJRUQTZMDOMN-UHFFFAOYSA-N 432.265 4.804 70 10 IJIE F[B-](F)(F)[C@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325186895 RHMLDKCQJTZRIJ-JTQLQIEISA-N 446.865 4.867 70 10 IJIE O=S(=O)(Cl)c1cccc(OCc2c(Br)cccc2Br)c1 2366227677 QUCSSSDREKOOEW-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)Nc2ccc(CNC(=O)C(F)(F)F)cc2)cc1 216795120 GQYUJYGJOWLGJJ-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)Nc1cccc(C(F)(F)F)c1 217511015 CKRANBRKPNYNHA-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE C=CCOc1ccccc1CN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1ccc(C)c(C)c1 1348843572 YTWNMUNINRYDAR-UHFFFAOYSA-N 442.512 4.702 70 10 IJIE CCCN[C@H](CSc1cccc(Br)c1)c1c(Br)cnn1C 160785698 MQJNWCNPVRQPGC-CQSZACIVSA-N 433.213 4.778 70 10 IJIE Cc1cc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)ccc1F 159643602 LXFAXSPCZKLZID-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE C[C@@H](CCOCc1c(Br)cccc1Br)CCS(=O)(=O)Cl 2366177958 YCQSLSGAXLWURB-JTQLQIEISA-N 448.604 4.713 70 10 IJIE Cc1cc(C)c(NS(=O)(=O)c2ccc(Br)c(C)c2)c(Br)c1 159903348 BZZFDOQDLWAOMX-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE COc1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)c(OC)c1 217299009 DLEINGNJKPEPJP-UHFFFAOYSA-N 443.725 4.710 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)cc(C(C)(C)CS(=O)(=O)Cl)c1 1952810826 JGQUXFNKFZNEAP-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE CC[C@H]1[C@H](C)CCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358046 NDKJCZBEPTWVJV-CJNGLKHVSA-N 427.975 4.515 70 10 IJIE NC[C@H](c1c(F)cccc1Cl)[C@H](O)c1cc(Br)ccc1Br 161263881 RCQHZYCACHZBJG-MEBBXXQBSA-N 437.534 4.780 70 10 IJIE O=C(c1cc(Br)cc(S(=O)(=O)Cl)c1)N(Cc1ccccc1)C1CCC1 2034761072 DVDOPUMJTBCCDM-UHFFFAOYSA-N 442.762 4.572 70 10 IJIE C[C@H](c1ccccc1)N1C[C@H](NC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1=O 217284100 SLGGZZDAPSMBSD-PXDATVDWSA-N 427.548 4.761 70 10 IJIE CCC[C@@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156358670 REGHKDKIUWFINI-MRXNPFEDSA-N 427.975 4.563 70 10 IJIE C[C@H]1CC[C@H](C)N(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353931 FNHJJAKQQQTLPT-KBPBESRZSA-N 427.975 4.515 70 10 IJIE CC(F)(F)CCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191414861 VYDLXYIYNWKYDA-UHFFFAOYSA-N 440.075 4.684 70 10 IJIE CCC1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCCC1 2156359214 WDLWCFJRHSCCRF-UHFFFAOYSA-N 427.975 4.707 70 10 IJIE O=C(c1ccsc1)c1ccc(CNS(=O)(=O)c2cccc(C(F)(F)F)c2)s1 217293687 KFXRULLOSHDVGV-UHFFFAOYSA-N 431.482 4.538 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2C=CCCC2)c(Br)c1 2153101913 SOBFACVQZCGRGN-SECBINFHSA-N 444.572 4.874 70 10 IJIE C[C@H](CCC1CC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359072 UZPIXDDEGKFMKI-CYBMUJFWSA-N 427.975 4.563 70 10 IJIE CC1(C)CC(COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191413283 DBWCAZICNSTEIF-UHFFFAOYSA-N 430.133 4.685 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)Cc3ccccc3C)c2)cc1 216689053 AJTVVIOREDMNAF-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCC[C@H]1C[C@@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743750 KTLKLCJSFLSFRQ-LSDHHAIUSA-N 428.959 4.848 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)NCc2cccc(NC(=O)C(F)(F)F)c2)cc1 216836337 OARNVMDVEJRULV-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE CC(=O)c1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217298937 ZBROIKWCNKZSAA-UHFFFAOYSA-N 425.710 4.896 70 10 IJIE CCN[C@@H](CSc1ccc(Br)cc1)c1c(Br)cnn1CC 160694065 SJOWIWKNLHFOMA-AWEZNQCLSA-N 433.213 4.871 70 10 IJIE CCC1(CNC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCC1 2156355134 OYAXTAMODXHMGY-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE CC(C)(F)CCCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2162062338 BWKVJEMLUSCSND-UHFFFAOYSA-N 433.954 4.513 70 10 IJIE O=C(NCc1ccccc1OC(F)(F)F)c1ccccc1CSC1=NCCS1 217059451 UPOIZNZRNZKLOK-UHFFFAOYSA-N 426.485 4.851 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2cc(Br)ccc2Br)cc1 2175189389 MSJULUCCKYPKPI-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CN(CCC1(C)CC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2179764223 VIGGGRXFJBFQJM-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(C(=O)N2CC[C@@H]([B-](F)(F)F)C2)ccc1Br 2319681264 YJKFBIFYLMUIEM-LLVKDONJSA-N 436.057 4.860 70 10 IJIE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 1879738106 RASPRNDRTZTREZ-KBUNVGBDSA-N 431.888 4.727 70 10 IJIE O=C(Nc1ccc(Br)o1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217279892 CERXYIOIIUBKEF-UHFFFAOYSA-N 440.341 4.981 70 10 IJIE C[C@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2228261324 XNXHJNVFILSFJX-JGVFFNPUSA-N 432.561 4.564 70 10 IJIE CCC[C@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200565124 MCPMIZMKAPQJLX-DTWKUNHWSA-N 430.133 4.685 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2cccc(I)c2)cc1Cl 1927652632 NPCAIGIIWHOCDP-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE CCN(CC(C)(C)C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357075 GJPJDLAPQHPDBO-UHFFFAOYSA-N 429.991 4.763 70 10 IJIE O=C(O[C@@H]1CCC(F)(F)C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2238391879 CACAJDMYTIXBPS-GFCCVEGCSA-N 436.885 4.599 70 10 IJIE CC#CCCCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2196209949 SDJPPOSOXCBUEM-UHFFFAOYSA-N 444.572 4.712 70 10 IJIE CCC[C@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 114771146 USNJTRVRFMACNY-SECBINFHSA-N 434.577 4.575 70 10 IJIE Cc1cc(Oc2cc(I)ccc2Cl)ccc1S(=O)(=O)Cl 2288327752 XKLBJXDONKLFNJ-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE Cc1ccc(C)c(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159541796 UXOMZODKFWXXCA-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE CCC[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156355305 QICKENXLBQWRPZ-AWEZNQCLSA-N 427.975 4.517 70 10 IJIE C[C@@H](COc1c(Br)cc(S(=O)(=O)F)cc1Br)CC(F)F 2191435694 ZRIQFXLSKGJONX-ZCFIWIBFSA-N 440.075 4.540 70 10 IJIE CC[C@H](C)CCN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354910 NBUQFAVWCHWTHR-AWEZNQCLSA-N 429.991 4.763 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2CC23CCC3)c(Br)c1 2189485534 GXYDWLAMYULNHT-MRVPVSSYSA-N 444.572 4.708 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCCC(F)(F)F)c(Br)c1 2191430320 ISYUMZNZVCSWAX-UHFFFAOYSA-N 444.038 4.591 70 10 IJIE C[C@@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCCC1 2156353981 FXGQHIAQDAIVRK-CYBMUJFWSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2C=CCCC2)c(Br)c1 2153101914 SOBFACVQZCGRGN-VIFPVBQESA-N 444.572 4.874 70 10 IJIE NN[C@@H](c1cc(Br)ccc1Br)c1sccc1Br 160122310 RIAOLJJFWYYIHB-JTQLQIEISA-N 440.986 4.588 70 10 IJIE CCCCC1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156364550 XYGDGSWRHLPMOO-UHFFFAOYSA-N 427.975 4.707 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2cncc(Br)c2)c(Cl)c1Cl 166851591 FKIDPPVIQPZALR-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2nc3c(s2)C(=O)CCC3)c1 216725886 MAKGPDLXNXJCRD-UHFFFAOYSA-N 444.516 4.776 70 10 IJIE C[C@H]1CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@H]1C 2156354513 JZZHHDGBNPFVTG-KBPBESRZSA-N 427.975 4.515 70 10 IJIE C=C(Br)CCOc1c(CC)cc(Br)cc1S(=O)(=O)Cl 1890652087 XSLJHEJJDQCOGX-UHFFFAOYSA-N 432.561 4.617 70 10 IJIE C[C@@]1([B-](F)(F)F)CCN(C(=O)Cc2cc(Br)cc(Br)c2)C1 2368334411 CUNORYJPFMYYRH-CYBMUJFWSA-N 427.875 4.594 70 10 IJIE N[C@@H](c1cc2c(cc1Cl)OCCO2)c1cc(Br)ccc1Br 159810406 LYBHVEKRQOIHSO-OAHLLOKOSA-N 433.527 4.684 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@H](NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1=O 217283873 ZFZXNWYHRSVBCZ-SWLSCSKDSA-N 425.838 4.842 70 10 IJIE O=C(c1csc(Br)c1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 1879740628 RTNDVMHCSLDWRA-KGFZYKRKSA-N 431.888 4.727 70 10 IJIE COCCN(Cc1cccs1)C(=O)c1cc(Br)ccc1Br 160377698 AUPIHYSJOMIIIW-UHFFFAOYSA-N 433.165 4.562 70 10 IJIE Cc1cc(I)ccc1NC(=O)NCCCOc1ccccc1Cl 217299966 KKHVLUBMHNYOKE-UHFFFAOYSA-N 444.700 4.844 70 10 IJIE CC[C@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2236503478 OMNHDJKVYQZEJO-DTWKUNHWSA-N 430.133 4.685 70 10 IJIE C[C@]1([B-](F)(F)F)CCN(C(=O)Cc2cc(Br)cc(Br)c2)C1 2368334412 CUNORYJPFMYYRH-ZDUSSCGKSA-N 427.875 4.594 70 10 IJIE CC(C)CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156354996 NUBOSLVKPZCLTC-UHFFFAOYSA-N 427.975 4.515 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(CCC(C)C)C2CC2)cc1Br 159598084 FCTHBTGRVVJDLO-UHFFFAOYSA-N 439.213 4.719 70 10 IJIE CCN[C@H](CSc1ccccc1Br)c1c(Br)cnn1CC 160776020 UTCSRSYXRQZXSN-CYBMUJFWSA-N 433.213 4.871 70 10 IJIE CCC[C@H](C)CCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156361986 OVMRCXVLJYQOFP-AWEZNQCLSA-N 429.991 4.811 70 10 IJIE O=C(Cc1ccc(-c2ccccc2)cc1)Nc1cnn(C[C@H]2COc3ccccc3O2)c1 218271756 NBESAWUJQDIDSY-QHCPKHFHSA-N 425.488 4.571 70 10 IJIE Cc1c(CN2CCN(C(=O)OC(C)(C)C)CC2)c(C)c([B-](F)(F)F)c(C)c1N=[N+]=[N-] 1887511636 LPUWQRXADMASMI-UHFFFAOYSA-N 426.272 4.661 70 10 IJIE Cc1cc(Br)cc(S(=O)(=O)F)c1OC[C@H](C)COCc1ccccc1 2071420335 DKBBHLNYLRYBAP-CYBMUJFWSA-N 431.323 4.647 70 10 IJIE CC1(C)CC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353662 COWUWMWYIBBJIT-AWEZNQCLSA-N 427.975 4.563 70 10 IJIE C[C@@H]1CCC[C@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354723 LPUOZMBGQNARHH-HIFRSBDPSA-N 428.959 4.990 70 10 IJIE COc1ccc([C@@H](O)c2cc(Br)ccc2Br)c(OC)c1Cl 161057698 BWRPZIXUUBWYQW-CQSZACIVSA-N 436.527 4.964 70 10 IJIE C[C@H]1CC[C@](C)(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2193328652 DAHVLSUXFXKAKI-DJJJIMSYSA-N 427.975 4.563 70 10 IJIE C[C@H](CCOc1ccc(Br)cc1Br)CCS(=O)(=O)Cl 116049916 PWSYCRAZJAQWCA-SECBINFHSA-N 434.577 4.575 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC[C@@H]3C[C@@H]23)c(Br)c1 2191164421 QOXYHHXGQDDRFE-KHQFGBGNSA-N 444.572 4.564 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)c3cccc(C)c3)cc2)cc1 216633660 GZLPHFUYNDHNJO-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE Cc1cccc(OCc2nnc(S[C@@H](C)C(=O)Nc3ccccc3Br)o2)c1 218610716 BHUMSWSFBHWHCI-ZDUSSCGKSA-N 448.342 4.839 70 10 IJIE O=C(O[C@@H]1CCC[C@H]2C[C@@H]21)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2206990281 NBQQWDZWKXDJHT-OFQRWUPVSA-N 426.943 4.600 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cc(F)ccc2C)cc1Br 159537906 STJQXFTWQOFPMX-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE CC(C)(C)[C@@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2364046601 SFSAIMFWBSBICF-VIFPVBQESA-N 448.604 4.821 70 10 IJIE O=C(NCc1ccnc(N2CCCCCC2)c1)C1CCN(c2nc3ccccc3s2)CC1 216987609 BQQLKAABMJAMDB-UHFFFAOYSA-N 449.624 4.605 70 10 IJIE CC(=O)N(C)c1ccccc1NC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 217233163 GQGMKHIWQFAGEC-UHFFFAOYSA-N 432.505 4.603 70 10 IJIE O=C(c1c(Br)cccc1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194134431 WKMYWFOMNHTWOQ-AMIZOPFISA-N 425.859 4.665 70 10 IJIE CC(=O)N(C)c1ccccc1NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 217233145 QVUKSKIYJSNIOH-UHFFFAOYSA-N 433.455 4.993 70 10 IJIE C=C(Br)CCOc1c(Cl)cc(Br)cc1S(=O)(=O)Cl 2044982792 WZIMDJZSNIEFIR-UHFFFAOYSA-N 438.952 4.708 70 10 IJIE CC[C@H]1CC[C@H](C)N1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353376 ANLRHQVRYWUXMZ-ZFWWWQNUSA-N 427.975 4.658 70 10 IJIE CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)[C@H]1CCC1(C)C 2156357629 KEMWLWPYTZTAGA-HNNXBMFYSA-N 427.975 4.515 70 10 IJIE CC[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@@H]1C 2171919271 TTWFBUOOSOIMCT-HIFRSBDPSA-N 427.975 4.515 70 10 IJIE O=C(c1ccc(Br)cc1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 2194128195 CRXHHODNEBDOSG-ISVAXAHUSA-N 425.859 4.665 70 10 IJIE Cc1cc(I)ccc1NC(=O)NCCCOc1c(C)cccc1C 217298167 PQPUXYWJSBTKLA-UHFFFAOYSA-N 438.309 4.807 70 10 IJIE C=C(I)COc1cc(C)c(S(=O)(=O)Cl)cc1C(C)(C)C 2198135703 XUPLRVXXDSHHKD-UHFFFAOYSA-N 428.719 4.548 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)Cc2ccccc2C)cc1 216664545 DZQBMOWZSKYABN-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE O=S(=O)(NC[C@H]1CCCN(c2nccs2)C1)c1ccc(-c2cccc(Cl)c2)cc1 218193549 WPOWNFTXKHOBAO-MRXNPFEDSA-N 448.013 4.658 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)c3ccccc3C)cc2)cc1 216637267 MFCFFIBECXOCHP-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE Cc1ccc2nc(-c3ccc(NC(=O)NCCNC(=O)OC(C)(C)C)cc3)sc2c1 217263826 IEXRVSSTNUSRQS-UHFFFAOYSA-N 426.542 4.918 70 10 IJIE CC1(C)CC[C@@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197309323 OCCMMTBNTSJKII-LJQANCHMSA-N 427.975 4.563 70 10 IJIE CCOc1cc(NC(=O)N2CCN(c3cccc(Cl)c3)CC2)cc(OCC)c1OCC 217275070 GJJIDZSBXXTNEW-UHFFFAOYSA-N 447.963 4.890 70 10 IJIE O=C(Cc1ccc(-c2ccccc2)cc1)Nc1cnn(C[C@@H]2COc3ccccc3O2)c1 218271680 NBESAWUJQDIDSY-HSZRJFAPSA-N 425.488 4.571 70 10 IJIE C[C@@H]1C[C@@H]1CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2182710689 CICYKXCBAMMZQB-BDAKNGLRSA-N 446.588 4.954 70 10 IJIE COc1ccc([C@H](N)c2cc(Br)ccc2Br)c(OC)c1Cl 159911765 IRYOYSWJLVWIPJ-AWEZNQCLSA-N 435.543 4.930 70 10 IJIE Cc1c(N)cc([B-](F)(F)F)cc1CNC(=O)OCC1c2ccccc2-c2ccccc21 1887522191 JIZZRZXQPZTWTJ-UHFFFAOYSA-N 425.239 4.670 70 10 IJIE O=C(OCC1CCCCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355042 OEEDMHRXUFQLTF-UHFFFAOYSA-N 428.959 4.992 70 10 IJIE O=C(c1cc(Br)cc(Br)c1)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2194130123 NPUBAGVDGGMBME-ZANVPECISA-N 425.859 4.665 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)cc(C(=O)N2CC[C@@H]([B-](F)(F)F)C2)c1 2319679304 FPPNWJNWYAIDQM-LLVKDONJSA-N 436.057 4.860 70 10 IJIE C[C@H](C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)Cl 103014423 MSHZDZBASKZAEY-UWTATZPHSA-N 446.612 4.682 70 10 IJIE O=S(=O)(Cl)CC1(COc2c(Br)cccc2Br)CCCC1 115564016 KACUMDYLXLJRQJ-UHFFFAOYSA-N 446.588 4.719 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OCc2ccc(Br)cn2)c(Cl)c1 166852492 KINRYJPNJOHDNZ-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@H]([B-](F)(F)F)C1 1888324815 OHRGHTFYDTYIDM-CVEARBPZSA-N 445.270 4.754 70 10 IJIE CC[C@@H]1CC[C@H](NS(=O)(=O)c2cc(Br)c(C)cc2Br)[C@@H]1C 159667943 RVVGBQUKBXRSMX-GYSYKLTISA-N 439.213 4.623 70 10 IJIE O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)C(c1ccccc1)c1ccccc1 217491377 QJNDNUZBQVOAEX-UHFFFAOYSA-N 436.559 4.772 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCCCOCc2ccccc2)cc1F 379967848 GDUFKZKOAVHTRM-UHFFFAOYSA-N 437.714 4.501 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CC[C@@H]2CCCC[C@H]2C1 217480699 ALRVTCFXSLMPFP-RYUDHWBXSA-N 448.142 4.706 70 10 IJIE C[C@@H]1CC[C@H](COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2282924946 GLNQXAKZEIQORP-HIFRSBDPSA-N 428.959 4.848 70 10 IJIE O=C(Cc1cc(Br)cc(Br)c1)N1CCC[C@@H]([B-](F)(F)F)C1 2295281456 NWXGOOALYPMRHI-SNVBAGLBSA-N 427.875 4.594 70 10 IJIE N#CC(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)=NC(=O)c1ccccc1 2297515836 LWVLBVLUZHHVGC-UHFFFAOYSA-N 432.463 4.588 70 10 IJIE O=C(OCCCCC1CC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2238738957 ZSAOSBSDEBAAAS-UHFFFAOYSA-N 428.959 4.992 70 10 IJIE C[C@H](COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156355893 VROKKXYWJMSGDA-CYBMUJFWSA-N 428.959 4.848 70 10 IJIE CCCCC[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356947 FJZIEGHIFWXGKS-CQSZACIVSA-N 429.991 4.953 70 10 IJIE O=C(CCc1ccc(OCc2ccccc2)cc1)NC[C@H]1CCCN(c2nccs2)C1 218136219 JCPKIRDLNIWEPE-JOCHJYFZSA-N 435.593 4.688 70 10 IJIE C[C@H]1CC(C)(C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2170907918 OAXCDNNKLDXTDF-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE CC(C)=C(Br)COc1c(Cl)cc(Br)cc1S(=O)(=O)F 2340158153 QSGVXBYAQFQZIE-UHFFFAOYSA-N 436.524 4.828 70 10 IJIE C[C@H](COc1c(Br)cc(S(=O)(=O)F)cc1Br)C1CCC1 2191435404 WCMVOVLECYQWLP-MRVPVSSYSA-N 430.133 4.685 70 10 IJIE O=C(c1cc(Cl)cc(Cl)c1I)N1CC[C@H]([B-](F)(F)F)C1 2342485737 OHMYPGZGYJIMSB-LURJTMIESA-N 436.815 4.662 70 10 IJIE CC1(C)C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1921416396 JDDZBHHJERDVBB-QMMMGPOBSA-N 446.588 4.954 70 10 IJIE CC1(C)C[C@@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354452 JJOKLMKJGTVQQF-AWEZNQCLSA-N 428.959 4.848 70 10 IJIE CC1(C)CC[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2281089049 RFJMJIVWLIMQNZ-MRVPVSSYSA-N 446.588 4.954 70 10 IJIE CCC[C@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200565125 MCPMIZMKAPQJLX-IUCAKERBSA-N 430.133 4.685 70 10 IJIE Cc1nc(COc2c(Cl)cc(Br)cc2S(=O)(=O)Cl)sc1C 215766337 LVFWTRFEQIARHD-UHFFFAOYSA-N 431.160 4.682 70 10 IJIE C[C@H](CCOc1c(Br)cc(S(=O)(=O)F)cc1Br)C(F)F 2191422802 YLCQEANLQMPLLY-ZCFIWIBFSA-N 440.075 4.540 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2ccc(Br)cc2Br)cc1 2148813915 OGKMHNXFOHXTJK-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC[C@@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2236500456 CMQXEEVXFHMCTH-BDAKNGLRSA-N 446.588 4.954 70 10 IJIE CC(C)(C)OC(=O)Nc1c(Br)cccc1[C@@H](CS(=O)(=O)Cl)C1CC1 1952832494 DWIAINKHISATKE-LBPRGKRZSA-N 438.771 4.858 70 10 IJIE CC1(C)C[C@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354453 JJOKLMKJGTVQQF-CQSZACIVSA-N 428.959 4.848 70 10 IJIE CCOc1cc(C(=O)Nc2cccc(NC(=O)C(F)(F)F)c2)cc(OCC)c1OCC 216763017 BRDXRZWQOGQUNV-UHFFFAOYSA-N 440.418 4.636 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC[C@H]3C[C@@H]32)c(Br)c1 2191164422 QOXYHHXGQDDRFE-NRPADANISA-N 444.572 4.564 70 10 IJIE C[C@@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1(C)C 2286903070 LMEVJHLUMZMPFQ-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3ccc(C)cc3)c2)cc1 216673322 XGLJPIPHFPNSAN-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cccc(Cl)c2)cc1Br 159535490 VKXHODJZNFYKPT-UHFFFAOYSA-N 439.556 4.974 70 10 IJIE C[C@@H](CC1CCC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156362846 ROWNEDKDSATOJG-ZDUSSCGKSA-N 427.975 4.563 70 10 IJIE CC(C)(C)N1C(=O)c2ccc(NC(=O)NC(c3ccccc3)c3ccccc3)cc2C1=O 217280325 OPYARBCYVPTECF-UHFFFAOYSA-N 427.504 4.992 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(C(C)(C)CS(=O)(=O)Cl)c(Br)c1 1952626645 XCLASIVGSOXFJJ-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE CC[C@@H]1C[C@@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2369429797 WHWPHYCACPNASE-CABCVRRESA-N 428.959 4.848 70 10 IJIE CN(C)c1cccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)c1 217299074 AZQPRAXNMHZXFI-UHFFFAOYSA-N 426.742 4.759 70 10 IJIE O=C(N[C@H](CCS(=O)(=O)Cl)c1cccc(C(F)(F)F)c1)OCc1ccccc1 757175862 ZMPRVTDUNJHBHH-MRXNPFEDSA-N 435.851 4.632 70 10 IJIE CCC1(C)CC(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354916 NEXFHAVVOZNZKT-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE CC(C)(C)N(Cc1ccccc1)C(=O)c1cc(Br)cc(S(=O)(=O)Cl)c1 2034761950 QAFSSEVTRIOCLY-UHFFFAOYSA-N 444.778 4.818 70 10 IJIE CCc1ccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)cc1 159538410 XAQKNCQBQBWWCK-UHFFFAOYSA-N 433.165 4.883 70 10 IJIE Cc1cc(S(=O)(=O)NCc2ccc(C(=O)c3ccco3)s2)c(Cl)cc1Cl 217292932 JVRZQHLXAJXRHW-UHFFFAOYSA-N 430.334 4.666 70 10 IJIE O=C(NCCCOc1ccccc1Cl)Nc1ccc(I)cc1 217300147 IEOKHXBLERYLON-UHFFFAOYSA-N 430.673 4.535 70 10 IJIE CC[C@H]1CC[C@@H](C)N1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353374 ANLRHQVRYWUXMZ-HIFRSBDPSA-N 427.975 4.658 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)C=C3CCCCC3)cc2)cc1 216646266 FWNUTVZBMIMROO-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE CC[C@@H](CC1CC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355199 PJRZUXWGKMAZJZ-HNNXBMFYSA-N 427.975 4.563 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCC1(Br)CCC1 2197460583 AYXVRGNUEKLFQZ-UHFFFAOYSA-N 446.588 4.635 70 10 IJIE O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Nc1nc2c(s1)C(=O)CCC2 216723076 QVRLDRKNXFDRGZ-UHFFFAOYSA-N 445.500 4.842 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)C=C2CCCCC2)cc1 216671555 OWTIBPCCIJWCNO-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)C1(c2ccc(Cl)cc2)CCCC1 218267790 NOZAMNZUSNMKDD-HXUWFJFHSA-N 437.927 4.827 70 10 IJIE CN(CCN(Cc1ccccc1)c1ncc([B-](F)(F)F)cc1Cl)Cc1ccccc1 1961725506 YFTVNEXZXYSKOD-UHFFFAOYSA-N 432.706 4.928 70 10 IJIE CCCn1ncc(Br)c1[C@H](CSc1ccc(Br)cc1)NC 160693444 GSBDISUUXRSAIS-AWEZNQCLSA-N 433.213 4.871 70 10 IJIE COc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1S(=O)(=O)Cl 1858135832 CXLJGULCBVMGMN-UHFFFAOYSA-N 428.215 4.547 70 10 IJIE O=C(Nc1ccccc1O)C1CCN(C(=O)c2ccccc2CCc2ccccc2)CC1 216838268 HSASLZQZXKIXGS-UHFFFAOYSA-N 428.532 4.668 70 10 IJIE CC(C)[C@H](C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2132765352 YUTXXPIGVGFGOJ-MRVPVSSYSA-N 434.577 4.810 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CC[C@@H]2CCCC[C@@H]2C1 217480542 ALRVTCFXSLMPFP-NWDGAFQWSA-N 448.142 4.706 70 10 IJIE CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(F)c(CS(=O)(=O)F)c3)cc2)cc1 1532424015 FMBLBBKEOVWLTC-UHFFFAOYSA-N 445.443 4.872 70 10 IJIE O=C(c1cc(Cl)cc(S(=O)(=O)Cl)c1)N(CCC(F)(F)F)Cc1ccccc1 2152197014 OQFATDGNASYMJR-UHFFFAOYSA-N 440.270 4.862 70 10 IJIE CC[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@H]1C 2171919273 TTWFBUOOSOIMCT-ZFWWWQNUSA-N 427.975 4.515 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2C[C@H]2C2CC2)c(Br)c1 2199948119 BTUNRWCFWKSEEU-WPRPVWTQSA-N 444.572 4.564 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC2CCCCC2)c(Br)c1 2191432257 VJPQZGYNHRTSBO-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCCC2CCC2)c(Br)c1 2191433961 FJQYBENOPIGMPI-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2cccc(Br)c2)c(Br)c1 109526813 PLSNPQOAJHCYGI-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)NCCC2=CCCCC2)cc1Br 159569597 QJFATGVWLOFYBR-UHFFFAOYSA-N 437.197 4.689 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)/C=C/C2CCCC2)cc1 216671243 GZZPMQKMLDNEOP-LFIBNONCSA-N 436.508 4.837 70 10 IJIE CCN[C@H](CSc1ccc(Br)cc1)c1c(Br)cnn1CC 160694188 SJOWIWKNLHFOMA-CQSZACIVSA-N 433.213 4.871 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)CCc3ccccc3)c2)cc1 216683927 LVMQZRNZXDWNML-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccccc1-c1csc(-c2ccccc2F)n1 218673632 DAWFHEPRHBATKP-UHFFFAOYSA-N 442.541 4.767 70 10 IJIE C=C/C=C/CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 713679049 QGNHWCBSLQIPTK-ONEGZZNKSA-N 430.545 4.650 70 10 IJIE C[C@H]1C[C@H](C)CCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353949 FOSAYABYYLRMHA-KGLIPLIRSA-N 427.975 4.515 70 10 IJIE CC[C@H]1CC[C@@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2206133550 RKRRPQDACGCZIX-DZGCQCFKSA-N 427.975 4.563 70 10 IJIE C[C@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2228261326 XNXHJNVFILSFJX-YUMQZZPRSA-N 432.561 4.564 70 10 IJIE CN[C@@H](Cc1ccc(F)cc1Br)c1ccc(I)cc1 161358388 SYWNMTTWVWQFQT-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE CN[C@H](Cc1ccc(F)cc1Br)c1cccc(I)c1 161405744 KXLMQTRNMVTMHT-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC3(CCCC3)c3cc4c(cc3[C@@H]2C)OCCO4)c1 216964042 LCOQSYOXVNPQFB-HSQYWUDLSA-N 433.548 4.985 70 10 IJIE C[C@H](N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1(C)CC1 2156359116 VGDBJVDGMHJPMD-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE CC[C@H]1C[C@@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2369429798 WHWPHYCACPNASE-GJZGRUSLSA-N 428.959 4.848 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cc(F)cc(F)c2)cc1Br 159539898 ZNPZTIAFUZYFOJ-UHFFFAOYSA-N 441.091 4.599 70 10 IJIE O=C(NCCCOc1ccccc1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217299657 IOAJRTIDKCFJQK-UHFFFAOYSA-N 429.564 4.572 70 10 IJIE C[C@H]1CC[C@H](N(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156352500 SBOHURWUCSOGRW-ZFWWWQNUSA-N 427.975 4.515 70 10 IJIE O=C(O[C@@H]1CC[C@@H]2C[C@@H]2C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355633 SWANLMXDMFZMAP-RBSFLKMASA-N 426.943 4.600 70 10 IJIE C[C@H](COc1c(Br)cc(S(=O)(=O)F)cc1Br)CC(F)F 2191435693 ZRIQFXLSKGJONX-LURJTMIESA-N 440.075 4.540 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2ccc(Br)cn2)c(Cl)c1Cl 166851480 XMZMQLCHPQDGKC-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3ccccc3F)c2)cc1 216673695 HFICHAHVKXZSRN-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE Cc1cc(OCNC(=O)Nc2ccc(I)cc2)cc(C)c1Cl 217290724 RUDHUSFFTXTKRZ-UHFFFAOYSA-N 430.673 4.719 70 10 IJIE O=S(=O)(Cl)c1cc(Br)ccc1OCc1cccc(Br)c1 88270803 FHSPWGQRVVLWGQ-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC[C@@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722730119 FNJIRPTYCNFBDD-SFYZADRCSA-N 432.561 4.564 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2c(C)cccc2C)cc1Br 159540047 MITASNCPJNKCPA-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE CC[C@H](C)C[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356797 DBVISBJVFMSUIQ-UONOGXRCSA-N 429.991 4.809 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCCCC(F)F)c(Br)c1 2238526769 DHNVUERPJVCLGS-UHFFFAOYSA-N 440.075 4.684 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)c2ccc(C)cc2)cc1 216648173 GQMIMBROMNCJNP-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@@](C)([B-](F)(F)F)C1 1891517492 PCAWDGHAZCDPJT-NPMXOYFQSA-N 445.270 4.754 70 10 IJIE O=C(O[C@@H]1CC[C@@H]2C[C@H]2C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355632 SWANLMXDMFZMAP-QLFBSQMISA-N 426.943 4.600 70 10 IJIE COc1cccc(/C=C/NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 217926672 SJTTUZCAIQGDDV-FOCLMDBBSA-N 427.548 4.783 70 10 IJIE CC(C)C(NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(C)C 2156360966 JNZJHJFMQWIRQN-UHFFFAOYSA-N 429.991 4.665 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2[C@@H]3CCC[C@@H]23)c(Br)c1 2150091222 LXJYTGUSWQFJEP-RKDXNWHRSA-N 444.572 4.564 70 10 IJIE C#Cc1cccc(N(Cc2ccccc2)C(=O)c2cc(S(=O)(=O)F)ccc2Cl)c1 1359866821 AGFYVZFBCYZMAM-UHFFFAOYSA-N 427.884 4.827 70 10 IJIE O=C(O[C@@H]1CCC[C@@H]2C[C@@H]21)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2206990280 NBQQWDZWKXDJHT-IJEWVQPXSA-N 426.943 4.600 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)cc([C@@H](CS(=O)(=O)Cl)C2CC2)c1 1952837303 WJHCNLUZMNYIMA-AWEZNQCLSA-N 438.771 4.858 70 10 IJIE C[C@@H](COc1c(Br)cc(S(=O)(=O)Cl)cc1Br)C1CCC1 398868481 YAXXWRQSXLHIFY-QMMMGPOBSA-N 446.588 4.954 70 10 IJIE CC(C)[C@H]1CCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354211 HQXQCGCOBSVCCM-MRXNPFEDSA-N 427.975 4.515 70 10 IJIE O=C(Cc1ccc(-c2ccccc2)cc1)NCCn1nc(-c2ccncc2)c2c1CCCC2 217454174 HBPGJURYZCVOLU-UHFFFAOYSA-N 436.559 4.850 70 10 IJIE CC(C)=CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 698032793 NYTHUHFNKWMHON-UHFFFAOYSA-N 432.561 4.874 70 10 IJIE O[C@H](c1cc2c(cc1Cl)OCCO2)c1cc(Br)ccc1Br 161033517 XBSLOEXXTZWDHD-HNNXBMFYSA-N 434.511 4.718 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)CCc3ccccc3)cc2)cc1 216633785 ONZZIZKJRRFYTL-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE CC[C@@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)[C@H]1C 2171919270 TTWFBUOOSOIMCT-DZGCQCFKSA-N 427.975 4.515 70 10 IJIE O=C(Nc1ccsc1-c1nc(C2CC2)no1)c1ccccc1I 217286260 YDINYIKQWCBCMY-UHFFFAOYSA-N 437.262 4.532 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(F)c(Br)cc1C(C)(C)CS(=O)(=O)Cl 1952649073 ZLFMKPJVLGQXJU-UHFFFAOYSA-N 444.750 4.781 70 10 IJIE CC[C@@H]1C[C@H]1CCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2369429799 WHWPHYCACPNASE-HUUCEWRRSA-N 428.959 4.848 70 10 IJIE CCC1CC(N(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353507 BOSUFCYVZYSFKX-UHFFFAOYSA-N 427.975 4.515 70 10 IJIE CCCN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2197365373 XSHIVFNXUFELGD-UHFFFAOYSA-N 427.975 4.659 70 10 IJIE CC[C@@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2236503480 OMNHDJKVYQZEJO-RKDXNWHRSA-N 430.133 4.685 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2ccccc2Cl)cc1Br 159536108 PIMMPYZLBFNMCG-UHFFFAOYSA-N 439.556 4.974 70 10 IJIE COc1cc(Cl)c([C@@H](N)c2cc(Br)ccc2Br)cc1OC 159811393 COSVTMIZJSJKPH-HNNXBMFYSA-N 435.543 4.930 70 10 IJIE Cc1c(CNC(=O)OCC2c3ccccc3-c3ccccc32)cc(N)cc1[B-](F)(F)F 1887561554 GSJQFEOATSOMBD-UHFFFAOYSA-N 425.239 4.670 70 10 IJIE C[C@@H]1CCCC[C@H]1OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353836 DXCREIRNYSISKC-CZUORRHYSA-N 428.959 4.990 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OC[C@H]2CC=CCC2)c(Br)c1 2191435084 RNPTYZAVQZAHTM-VIFPVBQESA-N 428.117 4.605 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2C[C@H]2C2CC2)c(Br)c1 2199948117 BTUNRWCFWKSEEU-SCZZXKLOSA-N 444.572 4.564 70 10 IJIE O=S(=O)(Cl)c1ccc(-c2oc3cc(S(=O)(=O)Cl)ccc3c2Cl)cc1 196579577 SJOONYIEWGVYFN-UHFFFAOYSA-N 425.698 4.608 70 10 IJIE CC(C)(C)OC(=O)N(Cc1ccccc1)[C@@H]1CC=C(OS(=O)(=O)C(F)(F)F)CC1 145276000 AOZIGOGGDWQFNF-OAHLLOKOSA-N 435.464 4.726 70 10 IJIE CCN(CCC1CC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356920 FFFFUEDCRKAZJI-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CC(C)[C@H](C)[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2365482399 WLURUYXJZYDWIY-KBPBESRZSA-N 429.991 4.665 70 10 IJIE COC(=O)c1cc(OS(=O)(=O)C(F)(F)F)c2cccc(Oc3ccccc3)c2c1 100461947 IMURCWIRCPJLKC-UHFFFAOYSA-N 426.368 4.647 70 10 IJIE O=C([C@@H]1CC(=O)N(c2cccc(Br)c2)C1)N1CCCC[C@@H](c2ccccc2)C1 217287223 QBFSMGSCSYAXQW-RTBURBONSA-N 441.369 4.598 70 10 IJIE O=C(OCC1=CCCCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2380448998 XCEZINAXPSBWOJ-UHFFFAOYSA-N 426.943 4.912 70 10 IJIE COc1ccc(OC)c(C(=O)C=P(c2ccccc2)(c2ccccc2)c2ccccc2)c1 196200066 PEHATOZGMNIENO-UHFFFAOYSA-N 440.479 4.683 70 10 IJIE O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)C1(c2ccc(Cl)cc2)CCCC1 218267739 NOZAMNZUSNMKDD-FQEVSTJZSA-N 437.927 4.827 70 10 IJIE NN[C@@H](c1cc(Br)c(Br)s1)c1sccc1Br 160140639 GEWBCYNXBVBFJJ-ZETCQYMHSA-N 447.015 4.650 70 10 IJIE NC[C@H](c1ccc(F)cc1Cl)[C@H](O)c1cc(Br)ccc1Br 161275721 JFKCDPXEGZEGJW-IUODEOHRSA-N 437.534 4.780 70 10 IJIE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)N3C[C@H](C)O[C@H](c4ccccc4)C3)ccc21 216865596 AHEIZARIZGDOLK-CYFREDJKSA-N 448.567 4.504 70 10 IJIE O=C(O[C@@H]1CCCC[C@H]1F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197117933 KGSZIHDPKVEMDB-HUUCEWRRSA-N 432.922 4.692 70 10 IJIE O=S(=O)(Cl)c1cc(Br)ccc1OCc1ccccc1Br 88270433 KLDBUZAKUGRDSK-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CCCCC[C@@H](C)NS(=O)(=O)c1cc(Br)c(C)cc1Br 159591247 MUYNUBZDUXPTBH-LLVKDONJSA-N 427.202 4.767 70 10 IJIE O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 217287288 HANABSZLYPRTIX-MRXNPFEDSA-N 445.363 4.647 70 10 IJIE CC(C)OCCCNC(=O)NCCCOc1ccc(C(C)(C)C)cc1Br 217298614 AADRPOXJKNOCSF-UHFFFAOYSA-N 429.399 4.630 70 10 IJIE C=CCOc1ccc(Br)cc1NC(=O)c1ccc(S(=O)(=O)F)cc1Cl 1528415616 HGFVGCLHWWRKGG-UHFFFAOYSA-N 448.697 4.578 70 10 IJIE CC[C@@]1(C)CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156359057 UTJVTYAPKHLBJF-IBGZPJMESA-N 427.975 4.517 70 10 IJIE Cc1cc(F)cc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159677098 BNPXVJRFQDQQIA-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE CC(C)CC[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356691 CLLSIUGBJSHXDX-CQSZACIVSA-N 429.991 4.809 70 10 IJIE CC(C)=C(C)CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191435417 WGWAGDLEGLCKEI-UHFFFAOYSA-N 430.133 4.995 70 10 IJIE N[C@H](c1cc2c(cc1Cl)OCCO2)c1cc(Br)ccc1Br 159810286 LYBHVEKRQOIHSO-HNNXBMFYSA-N 433.527 4.684 70 10 IJIE O=S(=O)(NC[C@H]1CCCN(c2nccs2)C1)c1ccc(-c2ccc(Cl)cc2)cc1 218193051 MNUURONBXSFEKA-MRXNPFEDSA-N 448.013 4.658 70 10 IJIE CCC[C@@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200566332 OFSPLROTBFHVFT-RKDXNWHRSA-N 446.588 4.954 70 10 IJIE CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)[C@@]1(C)CC1(C)C 2288805273 JJMFCFIUVWXARF-IBGZPJMESA-N 427.975 4.515 70 10 IJIE NN[C@@H](c1cscc1Br)c1cc(Br)ccc1Br 159381864 VAPMKFVGUZWKCV-LLVKDONJSA-N 440.986 4.588 70 10 IJIE O=C(c1ccc(Br)cc1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194128196 CRXHHODNEBDOSG-OQPBUACISA-N 425.859 4.665 70 10 IJIE CC[C@](C)(NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156358459 PRGUJLULFZCRKO-IBGZPJMESA-N 427.975 4.563 70 10 IJIE O=C(O[C@@H]1C[C@H]2CC[C@H]1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2240698010 GUHYQXUILGTALV-OFQRWUPVSA-N 426.943 4.600 70 10 IJIE O=C(NCCCOc1ccc(Br)cc1Cl)NCCc1ccc(F)cc1 217299125 QUYCVRLKNMQGIQ-UHFFFAOYSA-N 429.717 4.552 70 10 IJIE O=C(O[C@@H]1CCCC12CC2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2183260226 JJUUKIBTBHTCRZ-OAHLLOKOSA-N 426.943 4.744 70 10 IJIE CC[C@@H]1CCCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354304 IHWOIGFPSSNPJS-OAHLLOKOSA-N 427.975 4.659 70 10 IJIE CN(CCN(Cc1ccccc1)c1ccnc2cc([B-](F)(F)F)cnc12)Cc1ccccc1 2052598186 OKHSINJCBQYIHV-UHFFFAOYSA-N 449.309 4.823 70 10 IJIE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)N3C[C@H](C)O[C@@H](c4ccccc4)C3)ccc21 216865541 AHEIZARIZGDOLK-YADARESESA-N 448.567 4.504 70 10 IJIE CC(C)Sc1ccc(CC(=O)NCCn2nc(-c3ccncc3)c3c2CCCC3)cc1 217453888 KGJJKEFDTOKMKD-UHFFFAOYSA-N 434.609 4.683 70 10 IJIE CC[C@H]1[C@@H](C)CCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358045 NDKJCZBEPTWVJV-BBRMVZONSA-N 427.975 4.515 70 10 IJIE CCC1(CN(C)C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156363466 UQQLLORANNXHRV-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CC[C@@H]1C[C@@H](C)CN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358865 SPVOFDFENBXHGN-UKRRQHHQSA-N 427.975 4.515 70 10 IJIE COc1cc([C@@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)ccc1OCc1ccccc1 217067998 VARRULGKWSCENY-KCWPFWIISA-N 427.548 4.797 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2[C@H]3CCC[C@H]32)c(Br)c1 2150091221 LXJYTGUSWQFJEP-MYJAWHEDSA-N 444.572 4.564 70 10 IJIE CC[C@@H]1CC[C@@H](C)N1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353375 ANLRHQVRYWUXMZ-UKRRQHHQSA-N 427.975 4.658 70 10 IJIE O=C(OCCCC(F)(F)F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200768696 HXUYCSXJGNTPDR-UHFFFAOYSA-N 442.864 4.754 70 10 IJIE Cc1cc(I)c(Oc2ccccc2S(=O)(=O)Cl)cc1Cl 2361693342 HVCGKPIVCOTVRW-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE CCCC1CC(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2180055477 GXWWHZFIAZFQJL-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE O=C(O[C@H]1CCCC1(F)F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197020699 XGBRNNPTCJZPPT-ZDUSSCGKSA-N 436.885 4.599 70 10 IJIE F[B-](F)(F)c1cnc(N(CCC(F)(F)F)Cc2ccccc2)c(Br)c1 2004990278 FZKWLPPSELNVLH-UHFFFAOYSA-N 425.987 4.858 70 10 IJIE O=C([C@@H]1CC(=O)N(c2cccc(Br)c2)C1)N1CCCC[C@H](c2ccccc2)C1 217287224 QBFSMGSCSYAXQW-RBUKOAKNSA-N 441.369 4.598 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@@H](C)CCC(C)C)cc1Br 159590655 GATYWXUPCZQFPC-NSHDSACASA-N 427.202 4.623 70 10 IJIE O=C(c1cc(Br)cc(Br)c1)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194130120 NPUBAGVDGGMBME-NOZJJQNGSA-N 425.859 4.665 70 10 IJIE O=C(Cc1ccc(-c2ccccc2)cc1)NCCn1nc(C(F)(F)F)c2c1CCCC2 217529162 LYQPWXNYQBNMFD-UHFFFAOYSA-N 427.470 4.807 70 10 IJIE C[C@@H](C(=O)Nc1ccccc1-c1cn2ccsc2n1)n1nc(-c2cccs2)ccc1=O 218559892 FYXFEFJPKDKFMO-AWEZNQCLSA-N 447.545 4.548 70 10 IJIE C[C@H]1CCCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156363252 TYVDVFFHLRBYEC-AWEZNQCLSA-N 427.975 4.517 70 10 IJIE CC(C)[C@@H](C)CN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359752 XXOSSUHZECURFH-AWEZNQCLSA-N 429.991 4.619 70 10 IJIE O=C(NCCC1CCCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355062 OILBWMNNPLMURO-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE O=C(Cc1cc(Br)cc(Br)c1)N1CCC[C@H]([B-](F)(F)F)C1 2295281455 NWXGOOALYPMRHI-JTQLQIEISA-N 427.875 4.594 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2C[C@@H]3C[C@@H]3C2)c(Br)c1 2164332803 IJQTWJXXZKOIEQ-PSVAKVPMSA-N 444.572 4.564 70 10 IJIE CCOc1ccc2ccccc2c1C(=O)NCCn1nc(-c2ccncc2)c2c1CCCC2 217454813 LGFACGPJIAZTJB-UHFFFAOYSA-N 440.547 4.806 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3cccc(C)c3)c2)cc1 216683802 VHYPLBZINKLXNQ-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE C[C@@H](CCOc1c(Br)cc(S(=O)(=O)F)cc1Br)C(F)F 2191422801 YLCQEANLQMPLLY-LURJTMIESA-N 440.075 4.540 70 10 IJIE O=C(O[C@H]1CCCC[C@H]1F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197117931 KGSZIHDPKVEMDB-CABCVRRESA-N 432.922 4.692 70 10 IJIE CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(Br)cc(S(=O)(=O)Cl)c1 2034760312 ULKVJRHYQQBGMM-ZDUSSCGKSA-N 444.778 4.818 70 10 IJIE Cc1ccc(OCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c(C)c1 217276691 WAQMDJLLXKOKQB-UHFFFAOYSA-N 429.564 4.757 70 10 IJIE Cc1ccc(-c2ccc(S(=O)(=O)N3CCC4(CC3)OC(=O)c3ccccc34)cc2)cc1 217550565 FYWQHPWYLYQTAB-UHFFFAOYSA-N 433.529 4.512 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2C[C@@H]3C[C@@H]3C2)c(Br)c1 698091295 IJQTWJXXZKOIEQ-AYMMMOKOSA-N 444.572 4.564 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2C[C@H]3C[C@@H]3C2)c(Br)c1 698091302 IJQTWJXXZKOIEQ-IUCAKERBSA-N 444.572 4.564 70 10 IJIE CC(C)COc1ccc(S(=O)(=O)NCc2ccc(C(=O)c3ccsc3)s2)cc1 217293695 IRORYJXBPIIFAA-UHFFFAOYSA-N 435.592 4.554 70 10 IJIE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC([B-](F)(F)F)CC1 2210039106 HQQJUKPZYJGNAJ-OAHLLOKOSA-N 445.270 4.754 70 10 IJIE Cn1nc(-c2ccc(F)c(F)c2)cc1C(=O)Nc1ccccc1-c1cn2ccsc2n1 218568566 FJVCJIGDXMACKD-UHFFFAOYSA-N 435.459 4.994 70 10 IJIE C[C@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1(C)C 2286903073 LMEVJHLUMZMPFQ-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE CN[C@@H](Cc1ccc(F)cc1Br)c1cccc(I)c1 161405615 KXLMQTRNMVTMHT-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE F[B-](F)(F)[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325186896 RHMLDKCQJTZRIJ-SNVBAGLBSA-N 446.865 4.867 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2cccc(F)c2C)cc1Br 159629965 KBUTUHZQJRPHLB-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE CC1(CCOc2c(Br)cc(S(=O)(=O)Cl)cc2Br)CC1 2123184610 AKVQOIFSFQNYMO-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE CCN(C(=O)C(C)(C)CCl)[C@@H](C)c1nc2ccccc2c(=O)n1-c1ccc(C)cc1 35062925 JSASTLDJOAPSMN-KRWDZBQOSA-N 425.960 4.869 70 10 IJIE CC(C)[C@@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200584886 NSTSJQZBMWLWFN-SCZZXKLOSA-N 446.588 4.810 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@@H]2CCCCC2(C)C)cc1Br 159680853 HLRWWXYKGQAXMG-CQSZACIVSA-N 439.213 4.767 70 10 IJIE CCN(CCc1ccncc1)C(=O)NCCCOc1ccc(Br)cc1Cl 217299053 SLCMDYTUNMYECV-UHFFFAOYSA-N 440.769 4.541 70 10 IJIE O=S(=O)(Cl)CCCCCCOCc1c(Br)cccc1Br 2366162889 KWSNVMALOQNOPX-UHFFFAOYSA-N 448.604 4.857 70 10 IJIE O=C(NCCn1nc(-c2ccncc2)c2c1CCCC2)Nc1ccccc1C(F)(F)F 217473926 RMBNVFFAULFSCJ-UHFFFAOYSA-N 429.446 4.664 70 10 IJIE C[C@H](c1ccccc1)N1C[C@H](NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1=O 217284820 PALPUQYVLMJGSF-IUODEOHRSA-N 425.838 4.842 70 10 IJIE CC[C@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722730116 FNJIRPTYCNFBDD-JGVFFNPUSA-N 432.561 4.564 70 10 IJIE C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Cl)c(S(=O)(=O)F)cc1OC 1524186812 ZXUDYQNMCAWJRI-UHFFFAOYSA-N 438.329 4.550 70 10 IJIE CCCCC[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356946 FJZIEGHIFWXGKS-AWEZNQCLSA-N 429.991 4.953 70 10 IJIE N[C@H](c1ccccc1)c1nnc(-c2cc(Br)ccc2Br)s1 161289171 AFUAXSIWYCTOBC-CYBMUJFWSA-N 425.149 4.778 70 10 IJIE C[C@@H]1CCC[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2191414989 XLQCYHHUZKDSMF-BDAKNGLRSA-N 430.133 4.685 70 10 IJIE CC(C)CCCN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355081 OKPZLPDIWMUODV-UHFFFAOYSA-N 429.991 4.763 70 10 IJIE O=C(Cc1ccc(-c2ccccc2)cc1)NCCn1nc(-c2ccccn2)c2c1CCCC2 217491288 ZVNWMUFZBKKCCU-UHFFFAOYSA-N 436.559 4.850 70 10 IJIE C[C@H]1C[C@@H]1CCCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182894061 NLPGILJZQMXSCA-ZFWWWQNUSA-N 428.959 4.848 70 10 IJIE CCC[C@@H](C)CCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156361988 OVMRCXVLJYQOFP-CQSZACIVSA-N 429.991 4.811 70 10 IJIE NN[C@H](c1cc(Br)c(Br)s1)c1cscc1Br 159403892 CMVXDPJOLPNRQH-QMMMGPOBSA-N 447.015 4.650 70 10 IJIE CC(C)(C)C#CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 302236732 ALSOJKIWTQTOPR-UHFFFAOYSA-N 444.572 4.567 70 10 IJIE CCC[C@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 114770953 FKAHHKLEDSEWTC-SECBINFHSA-N 434.577 4.575 70 10 IJIE C[C@@H]1C[C@]1(C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2134420832 CLOHAENEXZWJQZ-JMCQJSRRSA-N 432.561 4.564 70 10 IJIE COc1cc(Cl)c([C@@H](O)c2cc(Br)ccc2Br)cc1OC 161033266 QJZIHUGEAKBIBG-HNNXBMFYSA-N 436.527 4.964 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCCCCCF)c(Br)c1 311385566 OWQTXONVAAYVBD-UHFFFAOYSA-N 438.540 4.658 70 10 IJIE O=S(=O)(Cl)CCCCCCOc1c(Br)cccc1Br 112356550 MRBIDQSRJGZMDP-UHFFFAOYSA-N 434.577 4.719 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)Cc3ccccc3C)cc2)cc1 216638983 LQNBUKZSXBUEFG-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE Cc1cc(C(=O)c2cc(C(=O)C(Cl)(Cl)Cl)n(C)c2)sc1Br 160874773 MYYRLQBGWHKOFZ-UHFFFAOYSA-N 429.550 4.941 70 10 IJIE CC(C)(C)OC(=O)Nc1cc([C@H](CS(=O)(=O)Cl)C2CC2)ccc1Br 1952683431 WCIAMSRGYKELJV-GFCCVEGCSA-N 438.771 4.858 70 10 IJIE CN(CCC1CCC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358642 QXZSSOPWRFQHSN-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE O=S(=O)(Cl)CCCCCCOCc1cc(Br)cc(Br)c1 2362252957 NZGCMEWJCMXEOT-UHFFFAOYSA-N 448.604 4.857 70 10 IJIE CCCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2-c2cn3ccsc3n2)cc1 218653312 WYOCXEMXDUBXBN-UHFFFAOYSA-N 440.550 4.602 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(Br)c([C@@H](CS(=O)(=O)Cl)C2CC2)c1 1952833955 LUABKFLJIDYGIR-ZDUSSCGKSA-N 438.771 4.858 70 10 IJIE COc1cccc(OC)c1NC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217270437 PJWIPCHLCWKFJK-UHFFFAOYSA-N 431.536 4.643 70 10 IJIE O=C(O[C@@H]1CC[C@H]2C[C@H]2C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355635 SWANLMXDMFZMAP-SOUVJXGZSA-N 426.943 4.600 70 10 IJIE C[C@@H]1CN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C(C)(C)C1 2156359880 YLMNNSJYYQYTTP-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@]23CCC[C@H]2C3)c(Br)c1 2190968721 RMZUIOBQZNIKLX-ISVAXAHUSA-N 444.572 4.708 70 10 IJIE Cc1cccc(Oc2ccc(S(=O)(=O)Cl)cc2Cl)c1I 2295351917 USRQSSJFHSCAJX-UHFFFAOYSA-N 443.089 4.973 70 10 IJIE CC[C@@H]1CC[C@@H](NS(=O)(=O)c2cc(Br)c(C)cc2Br)[C@@H]1C 159668186 RVVGBQUKBXRSMX-JTNHKYCSSA-N 439.213 4.623 70 10 IJIE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 1879730052 IXYKTFWWJBSPGO-UPONEAKYSA-N 431.888 4.727 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CC[C@@H]([B-](F)(F)F)C2)cc1Br 2319680541 QYICASRTHBCECJ-LLVKDONJSA-N 436.057 4.860 70 10 IJIE CCOc1ccc(CCNC(=O)NCOc2ccc(C)cc2C(C)(C)C)cc1OCC 217290164 OXLUNDLRFKRKFR-UHFFFAOYSA-N 428.573 4.968 70 10 IJIE O=C(CCc1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1CCCN(c2nccs2)C1 218140417 AZXGXMGHGCIJRM-AWEZNQCLSA-N 431.911 4.781 70 10 IJIE O=S(=O)(Cl)c1cccc(Oc2cc(I)ccc2Cl)c1 2272686756 TZHUPFDFUHVUAM-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE O=C(NC1CCCCCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156355243 PTLHPRACTZQTDV-UHFFFAOYSA-N 427.975 4.707 70 10 IJIE CCCN[C@@H](CSc1ccccc1Br)c1c(Br)cnn1C 160777457 XUSKBZQZCIAJPC-ZDUSSCGKSA-N 433.213 4.778 70 10 IJIE CC1(C)CC[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2281065341 NOVHPKPQNNYREJ-QMMMGPOBSA-N 430.133 4.685 70 10 IJIE CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@H]([B-](F)(F)F)C1 1891516986 KUHDWPUFYLMDNX-YCRPNKLZSA-N 445.270 4.754 70 10 IJIE CC(=O)c1sc(NC(=O)c2cc(S(=O)(=O)F)ccc2Cl)nc1-c1ccccc1 1349646157 HJNZDTSFZFEFOC-UHFFFAOYSA-N 438.889 4.577 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OC[C@@H]2C=CCCC2)c(Br)c1 2191421614 KPGIMQHXIKHRHR-SECBINFHSA-N 428.117 4.605 70 10 IJIE O=S(=O)(Cc1ccc(C(F)(F)F)cc1)Nc1ccsc1-c1nc(C2CC2)no1 217286942 SDYGOWDYCOANSB-UHFFFAOYSA-N 429.445 4.636 70 10 IJIE CCCCOc1ccc(NC(=O)NCCn2nc(-c3ccncc3)c3c2CCCC3)cc1 217474369 KEPDWRXBDPLCPL-UHFFFAOYSA-N 433.556 4.825 70 10 IJIE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 1879739557 HGDGGFMOFLJNHA-KBUNVGBDSA-N 431.888 4.727 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@@H]2CCCCC[C@H]2C)cc1Br 159673055 DHPCIIVLZHAFQV-QMTHXVAHSA-N 439.213 4.767 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC(Cl)=CCl)c(Br)c1 2071428559 AZDZVSHGZRIGBQ-UHFFFAOYSA-N 442.915 4.568 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)ccc1[C@H](CS(=O)(=O)Cl)C1CC1 1952693194 UMNOZEOALMJVKD-CYBMUJFWSA-N 438.771 4.858 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H]2CC[C@@H](C)C[C@@H]2C)cc1Br 159659992 WLVCBIYRMBFKRQ-PUYPPJJSSA-N 439.213 4.623 70 10 IJIE Cc1cc(I)ccc1NC(=O)NCc1ccc(Br)cc1 217315433 OTFJNIZNUFONMB-UHFFFAOYSA-N 445.098 4.684 70 10 IJIE CC(C)(C)OC(=O)Nc1cccc(C(C)(C)CS(=O)(=O)Cl)c1Br 1952802714 YXUPVRQZHJCFST-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE O=C(c1c(Br)cccc1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 2194134433 WKMYWFOMNHTWOQ-ISVAXAHUSA-N 425.859 4.665 70 10 IJIE CC(C)[C@@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200575123 DCHOPUUOUGNARM-SCZZXKLOSA-N 430.133 4.541 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2ccc(F)cc2)cc1 216648618 RLBCPZNNKFUZGG-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 1879740629 RTNDVMHCSLDWRA-KSBSHMNSSA-N 431.888 4.727 70 10 IJIE CC[C@@H](C)C[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356798 DBVISBJVFMSUIQ-ZIAGYGMSSA-N 429.991 4.809 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@]23CCC[C@@H]2C3)c(Br)c1 2190968720 RMZUIOBQZNIKLX-AMIZOPFISA-N 444.572 4.708 70 10 IJIE CCC[C@@H]1C[C@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743747 KTLKLCJSFLSFRQ-CABCVRRESA-N 428.959 4.848 70 10 IJIE CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)[C@]1(C)CC1(C)C 2288805274 JJMFCFIUVWXARF-LJQANCHMSA-N 427.975 4.515 70 10 IJIE CC(C)C[C@@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2382174906 WWVYOXLRLIKPAA-JTQLQIEISA-N 448.604 4.821 70 10 IJIE C[C@@]1([B-](F)(F)F)CCN(C(=O)CCNC(=O)OCC2c3ccccc3-c3ccccc32)C1 1891516720 JDSSECHXTJQCIG-HSZRJFAPSA-N 445.270 4.755 70 10 IJIE C[C@H]1[C@H](C)CCCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354514 JZZHHDGBNPFVTG-KGLIPLIRSA-N 427.975 4.515 70 10 IJIE C[C@@H]1CC[C@@H](COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2282924948 GLNQXAKZEIQORP-UKRRQHHQSA-N 428.959 4.848 70 10 IJIE CN[C@H](Cc1cc(Br)ccc1F)c1ccc(I)cc1 160282810 PPDYZWDPDGNLFQ-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE CCOc1ccc(CCNC(=O)NCOc2ccc(Cl)cc2Cl)cc1OCC 217297359 ITNIDAPZJGQVEK-UHFFFAOYSA-N 427.328 4.669 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OCCOCCOCc2ccccc2)cc1Cl 2226071970 HSGSKRGEHFUJJI-UHFFFAOYSA-N 439.744 4.533 70 10 IJIE CC(C)(C)c1ccc(OCCCNC(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1 217299532 FPPMHHIJXXONQY-UHFFFAOYSA-N 429.992 4.938 70 10 IJIE CC[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1cc(Br)c(C)cc1Br 159596938 FCZCUPVITYNPQA-RISCZKNCSA-N 439.213 4.767 70 10 IJIE CC(C)[C@@H](C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2132765355 YUTXXPIGVGFGOJ-QMMMGPOBSA-N 434.577 4.810 70 10 IJIE Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccccc1-c1csc(-c2ccccc2F)n1 218672805 VZCIKQIAWOSGIS-UHFFFAOYSA-N 428.514 4.757 70 10 IJIE CS[C@H]1C[C@H](COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2287644395 MAVQLKBKSJZZPS-HDJSIYSDSA-N 446.999 4.553 70 10 IJIE CCOc1ccc(CCNC(=O)N/C=C/c2cccc(Br)c2)cc1OCC 218079329 HOYCNGWYECDVHZ-ZRDIBKRKSA-N 433.346 4.759 70 10 IJIE O=C(O[C@@H]1CCC2CC1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2198393852 QNARYRTVMYKPJP-ZBCRRDGASA-N 426.943 4.600 70 10 IJIE CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(S(=O)(=O)F)c(F)c3)cc2)cc1 1587962434 IFIQMFYMKLJQCZ-UHFFFAOYSA-N 431.416 4.731 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1cc(Br)cc(Br)c1)C1CCC1 2364044701 FBANQKPVJJYFNL-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE CC(C)CCCCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358565 QMHAOHHFHQIOTM-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE O=S(=O)(Cl)CC1(COc2cc(Br)cc(Br)c2)CCCC1 2364226155 HZXHOZGCBYWVDH-UHFFFAOYSA-N 446.588 4.719 70 10 IJIE CN[C@@H](Cc1ccc(F)cc1Br)c1ccccc1I 161331858 UPAITKWIWHHOBR-HNNXBMFYSA-N 434.090 4.696 70 10 IJIE O=C(O[C@H]1CCC2CC1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2198393849 QNARYRTVMYKPJP-XUJLQICISA-N 426.943 4.600 70 10 IJIE CC(C)(C)[C@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 115572022 CVUJJLGGSMBDAL-SECBINFHSA-N 448.604 4.821 70 10 IJIE O=C(NCCCC1CCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358223 OGLGMBGUZWAPFX-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE CN(C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC(C)(C)C1 2156358603 QPZBSCXTBZUOGI-UHFFFAOYSA-N 427.975 4.515 70 10 IJIE C[C@@H]1CC[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2227917804 BKNPDJOMLVIZGA-SFYZADRCSA-N 432.561 4.564 70 10 IJIE O=C(N[C@@H](CCS(=O)(=O)Cl)c1cccc(C(F)(F)F)c1)OCc1ccccc1 757175841 ZMPRVTDUNJHBHH-INIZCTEOSA-N 435.851 4.632 70 10 IJIE COc1nc(C(C)(C)S(=O)(=O)Cl)c(Cl)c(NC(=O)OC(C)(C)C)c1Cl 1953006679 BHHYHEAFNVYSRY-UHFFFAOYSA-N 433.741 4.548 70 10 IJIE C[C@@H]1CC[C@@H](COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191422419 UDACGCCIOPVSPF-RKDXNWHRSA-N 430.133 4.685 70 10 IJIE O=C(OC1CC2(CCC2)C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182185328 MGQUKYJMLJRUNI-UHFFFAOYSA-N 426.943 4.744 70 10 IJIE CCC[C@H](COCc1c(Br)cccc1Br)CS(=O)(=O)Cl 2366165180 WNXFRMXYEZDFCZ-SNVBAGLBSA-N 448.604 4.713 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)/C=C/c3ccccc3)cc2)cc1 216642875 HXKPFDWNVAMEEA-LICLKQGHSA-N 444.487 4.804 70 10 IJIE CC[C@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 722730121 FNJIRPTYCNFBDD-YUMQZZPRSA-N 432.561 4.564 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)Cc2ccc(C)cc2)cc1 216665911 IKECBGBPXCWMTK-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCCn1ncc(Br)c1[C@H](CSc1ccccc1Br)NC 160775230 LYJMKNYUUTXAEP-ZDUSSCGKSA-N 433.213 4.871 70 10 IJIE C[C@@H]1C[C@@]1(C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2134420834 CLOHAENEXZWJQZ-KRTXAFLBSA-N 432.561 4.564 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)C=C3CCCCC3)c2)cc1 216696046 HONHIVMGKDXCBK-UHFFFAOYSA-N 436.508 4.981 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2CC[C@H]3C[C@H]32)c(Br)c1 2191164423 QOXYHHXGQDDRFE-OYNCUSHFSA-N 444.572 4.564 70 10 IJIE CC(=O)c1sc(NC(=O)c2ccc(S(=O)(=O)F)cc2Cl)nc1-c1ccccc1 1357623564 UNCURWSEKWQJGK-UHFFFAOYSA-N 438.889 4.577 70 10 IJIE CC[C@H]1C[C@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2236500464 CMQXEEVXFHMCTH-DTWKUNHWSA-N 446.588 4.954 70 10 IJIE CCCCOc1ccc(NC(=O)NCCn2nc(-c3ccccn3)c3c2CCCC3)cc1 217511366 FELVSCLUKHVREF-UHFFFAOYSA-N 433.556 4.825 70 10 IJIE O=S(=O)(Cl)c1cc(Cl)c(OCc2cncc(Br)c2)c(Cl)c1 166852601 DFDRLZFBZQUZRF-UHFFFAOYSA-N 431.522 4.657 70 10 IJIE O=C(c1csc(Br)c1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 1879740630 RTNDVMHCSLDWRA-UPONEAKYSA-N 431.888 4.727 70 10 IJIE CCC[C@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200566331 OFSPLROTBFHVFT-IUCAKERBSA-N 446.588 4.954 70 10 IJIE CC(C)C[C@@H](COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 2382180310 CMXFAHVDRSUKTI-JTQLQIEISA-N 448.604 4.821 70 10 IJIE O=C(OC[C@H]1CC12CCC2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2367060434 SBKVGIRVASPCIO-CQSZACIVSA-N 426.943 4.602 70 10 IJIE CCC(CC)(COc1ccc(Br)cc1Br)CS(=O)(=O)Cl 115563021 KRBHDXWTBYRQMP-UHFFFAOYSA-N 448.604 4.965 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2ccc(F)cc2F)cc1Br 159537598 LZNNWSSOPPBGHI-UHFFFAOYSA-N 441.091 4.599 70 10 IJIE NC[C@@H](c1c(F)cccc1Cl)[C@@H](O)c1cc(Br)ccc1Br 161264249 RCQHZYCACHZBJG-BONVTDFDSA-N 437.534 4.780 70 10 IJIE C[C@@H](c1ccccc1)N(C)C(=O)c1cc(Br)ccc1I 218166579 CDYZSHAOOCWSGF-NSHDSACASA-N 444.110 4.887 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H]2CC[C@H](C)C[C@@H]2C)cc1Br 159659694 WLVCBIYRMBFKRQ-CHIMOYNISA-N 439.213 4.623 70 10 IJIE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)N3C[C@@H](C)O[C@H](c4ccccc4)C3)ccc21 216865569 AHEIZARIZGDOLK-DVECYGJZSA-N 448.567 4.504 70 10 IJIE CN[C@H](Cc1ccc(F)cc1Br)c1ccccc1I 161331964 UPAITKWIWHHOBR-OAHLLOKOSA-N 434.090 4.696 70 10 IJIE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC([B-](F)(F)F)CC1 2210039105 HQQJUKPZYJGNAJ-HNNXBMFYSA-N 445.270 4.754 70 10 IJIE CC(C)[C@H](C)[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2365482401 WLURUYXJZYDWIY-UONOGXRCSA-N 429.991 4.665 70 10 IJIE O=C(NCCn1nc(C(F)(F)F)c2c1CCCC2)C(c1ccccc1)c1ccccc1 217529271 BVJHQWMJCLZTGS-UHFFFAOYSA-N 427.470 4.729 70 10 IJIE CCC(CC)[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356967 FPKNXTMGMXIAJZ-CYBMUJFWSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)CCc2ccccc2)cc1 216659194 CKYJWJLIHWJWOC-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE CCOc1cc(C(=O)Nc2ccccc2NC(=O)C(F)(F)F)cc(OCC)c1OCC 216775635 XQKZYOHIPORCEW-UHFFFAOYSA-N 440.418 4.636 70 10 IJIE CCC[C@@H](COCc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2362255139 UMXPFYCSCAROMW-JTQLQIEISA-N 448.604 4.713 70 10 IJIE O=S(=O)(Cl)C[C@H](COc1ccc(Br)cc1Br)CC1CC1 2169173827 VZADPRFSXPBOAE-JTQLQIEISA-N 446.588 4.575 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@@H]2C[C@@H]2C2CC2)c(Br)c1 2199948118 BTUNRWCFWKSEEU-WCBMZHEXSA-N 444.572 4.564 70 10 IJIE O=C(NCCc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 217281474 AMDWSKRSUWFGSP-UHFFFAOYSA-N 425.916 4.633 70 10 IJIE CCOc1ccc(CCNC(=O)N/C=C/c2ccccc2Br)cc1OCC 217862594 BPCOIXCGNRCOJK-WYMLVPIESA-N 433.346 4.759 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2cccc(C)c2)cc1 216659009 IDUSBKSDRWIZRI-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)Cc3cccc(C)c3)c2)cc1 216689643 OJHJVLCUZXJLCW-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCOc1cc(NC(=O)NCc2ccc(Br)cc2)cc(OCC)c1OCC 217275260 NIHOLZLXPCDKHB-UHFFFAOYSA-N 437.334 4.967 70 10 IJIE CCC[C@@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2338859169 DGNFDHGDCLOUNR-VIFPVBQESA-N 434.577 4.575 70 10 IJIE C[C@@H]1N(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCC1(C)C 2156362358 PVMRDLCVNDBVJY-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC=C(Cl)Cl)c(Br)c1 2071432024 LUQBDROQGASFSP-UHFFFAOYSA-N 442.915 4.568 70 10 IJIE O=C(c1cccc(Br)c1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2194130945 VWGNETZNENTUKK-SDBXPKJASA-N 425.859 4.665 70 10 IJIE CC[C@@H]1CC[C@H](C)N1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353373 ANLRHQVRYWUXMZ-DZGCQCFKSA-N 427.975 4.658 70 10 IJIE C[C@@H]1CCC[C@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354468 JOEGRRLEMPVQPR-HIFRSBDPSA-N 427.975 4.563 70 10 IJIE Nc1ccc(Br)c(NC(=O)c2cc(Br)ccc2Br)c1 159586222 CLKBTRLDFMHCRP-UHFFFAOYSA-N 448.940 4.809 70 10 IJIE COc1cc(-c2cc(C(=O)N3CCCC[C@@H](c4ccccc4)C3)[nH]n2)cc(OC)c1OC 217287995 ODNKUFYVGJMFHU-GOSISDBHSA-N 435.524 4.512 70 10 IJIE CCCC1CC(OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2188314842 OHZVILKXGZIDHD-UHFFFAOYSA-N 428.959 4.990 70 10 IJIE CCC(CC)[C@@H](C)NS(=O)(=O)c1cc(Br)c(C)cc1Br 159656360 LYOOCXAXLPIWGY-SNVBAGLBSA-N 427.202 4.623 70 10 IJIE C=CCC[C@H](NC(=O)c1ccc(S(=O)(=O)F)c(OC)c1)c1ccc(C(F)(F)F)cc1 1519590349 UTTHNTKQLSRBOV-INIZCTEOSA-N 445.434 4.810 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2CC=CCC2)c(Br)c1 402272455 USLLUNKUCSPJCZ-VIFPVBQESA-N 444.572 4.874 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CC[C@H]2CCCC[C@H]2C1 217480785 ALRVTCFXSLMPFP-NEPJUHHUSA-N 448.142 4.706 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCC(F)=C2CCC2)c(Br)c1 2201556838 AMYJVMLGEARJSG-UHFFFAOYSA-N 432.080 4.656 70 10 IJIE CN(c1ncc([B-](F)(F)F)cc1Br)[C@H]1CC(C)(C)[C@H]1OCc1ccccc1 2116131450 YATCNMMJWXPEDG-IRXDYDNUSA-N 442.108 4.719 70 10 IJIE CCOc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)N(C(C)(C)C)C3=O)cc1OCC 217280413 ALQYYCPEPINYGG-UHFFFAOYSA-N 425.485 4.523 70 10 IJIE COc1cccc([C@@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)c1OCc1ccccc1 217068069 DHQRGOCBJPHRGT-BVAGGSTKSA-N 427.548 4.797 70 10 IJIE Cc1cc(Br)cc(S(=O)(=O)F)c1OC[C@@H](C)COCc1ccccc1 2071420336 DKBBHLNYLRYBAP-ZDUSSCGKSA-N 431.323 4.647 70 10 IJIE CCN(CC)CCCNC(=O)NCCCOc1ccc(C(C)(C)C)cc1Br 217298604 JZJNOLHNZOOUTL-UHFFFAOYSA-N 442.442 4.547 70 10 IJIE CC(C)[C@@H](COCc1c(Br)cccc1Br)CS(=O)(=O)Cl 2366177392 QIUXBFXTBBQKLW-JTQLQIEISA-N 448.604 4.569 70 10 IJIE C[C@@H]1CCC[C@@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354724 LPUOZMBGQNARHH-UKRRQHHQSA-N 428.959 4.990 70 10 IJIE C[C@@H](COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156355894 VROKKXYWJMSGDA-ZDUSSCGKSA-N 428.959 4.848 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2CC[C@@H]3C[C@H]23)c(Br)c1 2357140324 QOXYHHXGQDDRFE-MRTMQBJTSA-N 444.572 4.564 70 10 IJIE CC[C@@H](OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156356420 ZUGLMCYXZGEWJY-MRXNPFEDSA-N 428.959 4.990 70 10 IJIE CCOc1ccccc1OCNC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217289446 GOSULKQCFOMHBU-UHFFFAOYSA-N 445.563 4.538 70 10 IJIE C[C@H](Cc1nc(Cl)c(Cl)c(NC(=O)OC(C)(C)C)c1Cl)S(=O)(=O)Cl 1953008154 GMVYKGRPFDPRRM-ZCFIWIBFSA-N 438.160 4.888 70 10 IJIE CCOc1ccc(NC(=O)Nc2ccccc2I)cc1OCC 217272887 ZYTLKIWCZQMFLC-UHFFFAOYSA-N 426.254 4.733 70 10 IJIE CCCC1(COc2c(Br)cc(S(=O)(=O)F)cc2Br)CC1 2195211916 OFYLNGFNIUTSKE-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1ccccc1Oc1ccccc1 218251571 XLURTXNHFWMUSL-HXUWFJFHSA-N 427.460 4.768 70 10 IJIE O=S(=O)(F)c1cc(Br)c(OCCC2CCCC2)c(Br)c1 2191431856 SBBOGMAVQRNLGR-UHFFFAOYSA-N 430.133 4.829 70 10 IJIE CCOc1cc(C(=O)N(Cc2cccs2)C2CCOCC2)cc(OCC)c1OCC 217290703 MJTAVVYEVLLZAT-UHFFFAOYSA-N 433.570 4.766 70 10 IJIE COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)CC(c1ccccc1)c1ccccc1 217951059 YJFUELJNIZVGNL-ZJSXRUAMSA-N 447.506 4.569 70 10 IJIE CC1CC(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2087868186 UULUAXUYRNAANL-UHFFFAOYSA-N 432.561 4.564 70 10 IJIE C=CCN(C(=O)CCc1ccc(S(=O)(=O)F)cc1)c1nc(-c2ccccc2)cs1 1522119629 TUYGZMPFGMENAC-UHFFFAOYSA-N 430.526 4.620 70 10 IJIE Cc1ncc(Oc2ccc(S(=O)(=O)Cl)cc2Br)cc1Br 2148855122 ANSLGYOXLMUJLJ-UHFFFAOYSA-N 441.528 4.635 70 10 IJIE C[C@@H]1CCCC[C@@H]1OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353835 DXCREIRNYSISKC-CJNGLKHVSA-N 428.959 4.990 70 10 IJIE CC(C)[C@H](COCc1c(Br)cccc1Br)CS(=O)(=O)Cl 2366177393 QIUXBFXTBBQKLW-SNVBAGLBSA-N 448.604 4.569 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2ccc(C)cc2)cc1 216648128 QZNNGVZZGHDIPJ-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE CC1(CCCNC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156361081 KOXIULXFBJZDEY-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)/C=C/C3CCCC3)c2)cc1 216695858 WUTGYLHYBAVQHK-XNTDXEJSSA-N 436.508 4.837 70 10 IJIE Cc1ccc(CCNC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217299197 BSTQAHYYNUQLNV-UHFFFAOYSA-N 425.754 4.722 70 10 IJIE CCN[C@@H](CSc1ccccc1Br)c1c(Br)cnn1CC 160775884 UTCSRSYXRQZXSN-ZDUSSCGKSA-N 433.213 4.871 70 10 IJIE Cc1ccc(OCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1C 217292829 QXMWQMMSMHXTDM-UHFFFAOYSA-N 429.564 4.757 70 10 IJIE C[C@@H](CCOc1c(Br)cccc1Br)CCS(=O)(=O)Cl 116490868 RJRFDFAUKIFOES-VIFPVBQESA-N 434.577 4.575 70 10 IJIE O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H]1CC(=O)N(Cc2ccccc2)C1 217287286 HANABSZLYPRTIX-INIZCTEOSA-N 445.363 4.647 70 10 IJIE Cc1nc(CCC(=O)Nc2ccc3c(c2)CCO3)oc1-c1ccc(Br)cc1 216964246 COTXCBARAQAHLK-UHFFFAOYSA-N 427.298 4.919 70 10 IJIE CCCn1ncc(Br)c1[C@H](CSc1cccc(Br)c1)NC 160783237 DTJWZZHEXLSMMH-AWEZNQCLSA-N 433.213 4.871 70 10 IJIE C[C@H]1C[C@H]1CCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2191423558 IBSBDTNXCVNADT-DTWKUNHWSA-N 430.133 4.685 70 10 IJIE NN[C@H](c1cc(Br)c(Br)s1)c1sccc1Br 160140518 GEWBCYNXBVBFJJ-SSDOTTSWSA-N 447.015 4.650 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CCC[C@H]2CCCC[C@H]21 217479427 RUOODQYQHSGOQN-IAQYHMDHSA-N 448.142 4.849 70 10 IJIE CC(C)(C)[C@@H](COc1c(Br)cccc1Br)CS(=O)(=O)Cl 115572018 CVUJJLGGSMBDAL-VIFPVBQESA-N 448.604 4.821 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)c2cccc(F)c2)cc1 216662606 WNIYGKNXCRVDKB-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE CC[C@@H](C)CCN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156354911 NBUQFAVWCHWTHR-CQSZACIVSA-N 429.991 4.763 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)/C=C/c2ccccc2)cc1 216668285 PBTCRMHEQHLNPX-SFQUDFHCSA-N 444.487 4.804 70 10 IJIE CC[C@@H]1[C@H](C)CCN1C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358047 NDKJCZBEPTWVJV-CZUORRHYSA-N 427.975 4.515 70 10 IJIE CC(C)[C@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200584887 NSTSJQZBMWLWFN-WCBMZHEXSA-N 446.588 4.810 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)ccc1C(=O)N1CC[C@@H]([B-](F)(F)F)C1 2319676467 FDWMMQVWIYTJDS-SNVBAGLBSA-N 436.057 4.860 70 10 IJIE CCC1CCC(NS(=O)(=O)c2cc(Br)c(C)cc2Br)CC1 159624883 DABUCKJTWJQDQF-UHFFFAOYSA-N 439.213 4.767 70 10 IJIE CCCCC(C)(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2186457102 HCTQAKMISYYWRN-UHFFFAOYSA-N 429.991 4.953 70 10 IJIE O=C(Nc1cc(C(=O)O)cc([B-](F)(F)F)c1)OCC1c2ccccc2-c2ccccc21 1887511876 SMWNIAUHFADYGV-UHFFFAOYSA-N 426.179 4.800 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(F)c(Br)cc1C=CCS(=O)(=O)Cl 1952408220 QMXIXTSMOATTHM-UHFFFAOYSA-N 428.707 4.517 70 10 IJIE CN(Cc1cc(N)ccc1Cl)C(=O)c1cc(Br)ccc1Br 159573283 SZDALXKELRQIRN-UHFFFAOYSA-N 432.543 4.719 70 10 IJIE CCCOc1ccc([C@@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)cc1Br 217067682 JNGJCGYAAGSTPW-GCJKJVERSA-N 428.374 4.760 70 10 IJIE CCCN[C@@H](CSc1cccc(Br)c1)c1c(Br)cnn1C 160785573 MQJNWCNPVRQPGC-AWEZNQCLSA-N 433.213 4.778 70 10 IJIE CCOc1cc(NC(=O)N[C@H](C)c2ccc(OC)c(OC)c2)cc(OCC)c1OCC 217274485 UVNKHDRYVUXEAI-OAHLLOKOSA-N 432.517 4.783 70 10 IJIE CC(=O)c1ccc(OCC(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cc1 216850224 LZNOOQZVYLTHKR-YVMONPNESA-N 443.499 4.786 70 10 IJIE CCOc1ccc(CCNC(=O)N/C=C/c2ccc(Br)cc2)cc1OCC 218281690 DOCXWXRUGFDNIT-ACCUITESSA-N 433.346 4.759 70 10 IJIE C[C@H]1C[C@@]1(C)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2134420835 CLOHAENEXZWJQZ-MADCSZMMSA-N 432.561 4.564 70 10 IJIE CC1(C)CC[C@@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2280870989 FUXVDZIJVLBDFH-CQSZACIVSA-N 428.959 4.848 70 10 IJIE O=C(NCCCCC1CC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156362770 RFFDNSPKVNHAHA-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE C[C@@H]1C[C@H]1CCCOC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182894060 NLPGILJZQMXSCA-UKRRQHHQSA-N 428.959 4.848 70 10 IJIE CC[C@H]1CCCC[C@H]1NS(=O)(=O)c1cc(Br)c(C)cc1Br 159597359 FCZCUPVITYNPQA-SMDDNHRTSA-N 439.213 4.767 70 10 IJIE C#Cc1cccc(N(Cc2cccs2)C(=O)c2ccc(S(=O)(=O)F)cc2Cl)c1 1358372031 UVERTMYEYWUPKV-UHFFFAOYSA-N 433.913 4.888 70 10 IJIE O=C(NCCn1nc(C(F)(F)F)c2c1CCCC2)C1c2ccccc2Oc2ccccc21 217530635 MKZSGLXYJBMXSK-UHFFFAOYSA-N 441.453 4.835 70 10 IJIE COc1ccc(C(=O)Nc2ccc(NC(=O)COc3ccc(C)cc3C)cc2)cc1OC 216898550 UZZHEKHYIVIBLX-UHFFFAOYSA-N 434.492 4.590 70 10 IJIE CCCc1nn(-c2ccc(OCc3ccccc3)cc2)c(Cl)c1S(=O)(=O)Cl 703611588 CSOWTEVVJOAOOZ-UHFFFAOYSA-N 425.337 4.985 70 10 IJIE CCC[C@@H]1CCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156355306 QICKENXLBQWRPZ-CQSZACIVSA-N 427.975 4.517 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 2362203373 AWFWQEPBYNCKHO-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC1CC(C)(COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2279358384 VBQNGPLHBFILHZ-UHFFFAOYSA-N 430.133 4.685 70 10 IJIE CCCN[C@H](CSc1ccc(Br)cc1)c1c(Br)cnn1C 160695872 QDWVHDIKXQYYBV-CQSZACIVSA-N 433.213 4.778 70 10 IJIE CC(C)[C@@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200575125 DCHOPUUOUGNARM-WPRPVWTQSA-N 430.133 4.541 70 10 IJIE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@@H]([B-](F)(F)F)C1 1891517453 ORVKYQRVJLESTB-OAHLLOKOSA-N 445.270 4.754 70 10 IJIE CN(c1ncc([B-](F)(F)F)cc1Br)[C@@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2116131449 YATCNMMJWXPEDG-IAGOWNOFSA-N 442.108 4.719 70 10 IJIE C[C@H](c1ccccc1)N1C[C@H](NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1=O 217283872 ZFZXNWYHRSVBCZ-IUODEOHRSA-N 425.838 4.842 70 10 IJIE C#Cc1cccc(N(Cc2cccs2)C(=O)CCc2ccc(S(=O)(=O)F)cc2)c1 1358371558 QPQGFOZUPZZNEO-UHFFFAOYSA-N 427.522 4.554 70 10 IJIE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@](C)([B-](F)(F)F)C1 1891517490 PCAWDGHAZCDPJT-CMJOXMDJSA-N 445.270 4.754 70 10 IJIE CC1CCC(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355854 VJWRVPOXOSWUSR-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE C[C@@H](c1ccccc1)N1C[C@@H](NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1=O 217284825 PALPUQYVLMJGSF-WFASDCNBSA-N 425.838 4.842 70 10 IJIE O=S(=O)(Cl)c1ccc(OCCCOCc2ccccc2)c2nc(Cl)ccc12 312502055 FHEKFEKEVCCXDN-UHFFFAOYSA-N 426.321 4.801 70 10 IJIE Cc1cc(C)cc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159537761 PYOPYZHSPVNKNN-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE Cc1ccc(NC(=O)Nc2ccc3c(c2)C(=O)N(C(C)(C)C)C3=O)c(Br)c1 217280592 UUCVAHQFFDYQRY-UHFFFAOYSA-N 430.302 4.796 70 10 IJIE O=C(NCCCN1C(=O)c2ccccc2C1=O)Nc1ccccc1Sc1ccccc1 217306072 OQTVIWUJJNUVAI-UHFFFAOYSA-N 431.517 4.646 70 10 IJIE O=C(O[C@H]1CCCC12CC2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2183260225 JJUUKIBTBHTCRZ-HNNXBMFYSA-N 426.943 4.744 70 10 IJIE C[C@@H](CC1CC1)N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2158007396 UHHFWHYBJXJJIO-ZDUSSCGKSA-N 427.975 4.515 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)Cc2cccc(C)c2)cc1 216665187 XXZOQXMKMJHAHF-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2cccc(CNC(=O)c3ccccc3C)c2)cc1 216687296 VENNCDVHRULNTG-UHFFFAOYSA-N 432.476 4.713 70 10 IJIE C[C@H]1N(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCC1(C)C 2156362356 PVMRDLCVNDBVJY-CYBMUJFWSA-N 427.975 4.515 70 10 IJIE COc1ccc(F)cc1-c1csc(NC(=O)[C@]2(C)CCCN2C(=O)c2ccccc2)n1 217225780 MHANMTRJDPBNSG-QHCPKHFHSA-N 439.512 4.591 70 10 IJIE O=S(=O)(Cl)c1cc(Br)cc(Cl)c1OCCOCc1ccccc1 309706566 HYKAZVRDHVKTKJ-UHFFFAOYSA-N 440.142 4.626 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC2C[C@@H]3C[C@H]3C2)c(Br)c1 698091304 IJQTWJXXZKOIEQ-RKDXNWHRSA-N 444.572 4.564 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCC/C=C/Br 1890556554 UHVMPZCGTHCVLZ-HWKANZROSA-N 432.561 4.617 70 10 IJIE CCC(C)(C)[C@@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358526 QHQXKVXKQPHSFQ-CYBMUJFWSA-N 429.991 4.809 70 10 IJIE O=C(O[C@H]1CCC(F)(F)C1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2238391880 CACAJDMYTIXBPS-LBPRGKRZSA-N 436.885 4.599 70 10 IJIE CC1(C)CC[C@@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2281065340 NOVHPKPQNNYREJ-MRVPVSSYSA-N 430.133 4.685 70 10 IJIE Nc1ccc2c(c1)CCC[C@H]2NC(=O)c1cc(Br)c(Br)s1 159374513 NSYSYOWRNQFDLJ-GFCCVEGCSA-N 430.165 4.663 70 10 IJIE CC(C)(C)CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 105046357 YIWRVPXWCNKTIG-UHFFFAOYSA-N 434.577 4.954 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)Cc3ccc(C)cc3)cc2)cc1 216640380 PPFRLXFJNUKOLZ-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)F)c1OC[C@@H](C)COCc1ccccc1 1890596917 MJFPWWWTXFUMNL-AWEZNQCLSA-N 445.350 4.901 70 10 IJIE CCC(CC)[C@H](C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156356968 FPKNXTMGMXIAJZ-ZDUSSCGKSA-N 429.991 4.809 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)Cc3cccc(C)c3)cc2)cc1 216639685 VXUARXYXQFFZTA-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE CC1(C)CC(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 723569625 SOIQUNHPVKZXDT-UHFFFAOYSA-N 446.588 4.954 70 10 IJIE C[C@@H](CCC1CC1)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156359073 UZPIXDDEGKFMKI-ZDUSSCGKSA-N 427.975 4.563 70 10 IJIE Cc1cc(I)ccc1NC(=O)NCc1cccc(Br)c1 217314997 USVLQMHWBSOJTI-UHFFFAOYSA-N 445.098 4.684 70 10 IJIE C[Si@@H](O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C 2070260802 JRQYNNFQXZXPRR-IBGZPJMESA-N 444.974 4.695 70 10 IJIE CC(C)CC1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156361186 LENDWFAPWGUDIC-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE C[C@]1([B-](F)(F)F)CCN(Cc2ccc(I)c(Br)c2)C1 2325259943 GKWSXKIQSMBIEJ-LBPRGKRZSA-N 446.865 4.867 70 10 IJIE O=S(=O)(Cl)c1ccc(OCc2cccc(Br)c2)c(Br)c1 59211520 SCDJSMCLPOZKOF-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCCCOCc1ccccc1 2076826858 WEJXNFYRTHBTJE-UHFFFAOYSA-N 447.778 4.925 70 10 IJIE CCC(C)(C)CN(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2182326323 OPVBZVOMTWOKDA-UHFFFAOYSA-N 429.991 4.763 70 10 IJIE O=C(c1cccc(Br)c1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194130942 VWGNETZNENTUKK-AMIZOPFISA-N 425.859 4.665 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2cccc(NC(=O)/C=C/C3CCCC3)c2)cc1 216695796 BNLCJYOUMCDMPW-XNTDXEJSSA-N 436.508 4.837 70 10 IJIE O=C(c1c(Br)cccc1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 2194134437 WKMYWFOMNHTWOQ-SDBXPKJASA-N 425.859 4.665 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(C(C)(C)CS(=O)(=O)Cl)ccc1Br 1952649086 ZPLCXVHOVQZOQC-UHFFFAOYSA-N 426.760 4.642 70 10 IJIE O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)C1c2ccccc2Oc2ccccc21 218269163 ZTCDSOKRCIRTJC-SFHVURJKSA-N 439.471 4.599 70 10 IJIE Cc1ccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)cc1C 159535206 QZKYRMZDVWMAHK-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE NN[C@H](c1cc(Br)ccc1Br)c1sccc1Br 160122459 RIAOLJJFWYYIHB-SNVBAGLBSA-N 440.986 4.588 70 10 IJIE Cc1cc(C)c(NS(=O)(=O)c2cc(C)c(Br)s2)c(Br)c1 159902060 MTPABGHLPWESCF-UHFFFAOYSA-N 439.194 4.999 70 10 IJIE O=C(NC(C=S)=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1 207607065 FZUXEBYACXNKKG-UHFFFAOYSA-N 439.520 4.540 70 10 IJIE COCCCN1C(=O)c2ccc(NC(=O)Nc3ccc(Oc4ccccc4)cc3)cc2C1=O 217280776 PTKVTUBWNIMKPD-UHFFFAOYSA-N 445.475 4.755 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCCCC(F)F)c(Br)c1 688784774 XGBWVWOYDLKZEN-UHFFFAOYSA-N 442.503 4.563 70 10 IJIE CC(C)[C@@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200584892 NSTSJQZBMWLWFN-WPRPVWTQSA-N 446.588 4.810 70 10 IJIE CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@H]([B-](F)(F)F)C1 1891516983 KUHDWPUFYLMDNX-BTYIYWSLSA-N 445.270 4.754 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)/C=C/C3CCCC3)cc2)cc1 216646059 PCMOZFVSJLXEPW-CXUHLZMHSA-N 436.508 4.837 70 10 IJIE C/C(=C\Cl)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 231996926 SWZMOHFZWZCLTG-GQCTYLIASA-N 438.952 4.661 70 10 IJIE CC(C)CN(Cc1ccccc1)C(=O)c1cc(Br)cc(S(=O)(=O)Cl)c1 2034683426 XPMOJJVGBLKOPF-UHFFFAOYSA-N 444.778 4.675 70 10 IJIE C[C@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1(C)CCC1 2172426878 OHRPUTQIKXDNNG-ZDUSSCGKSA-N 427.975 4.563 70 10 IJIE COc1ccc([C@@H](N)c2cc(Br)ccc2Br)c(OC)c1Cl 159911881 IRYOYSWJLVWIPJ-CQSZACIVSA-N 435.543 4.930 70 10 IJIE C=CC=CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 1911859469 QGNHWCBSLQIPTK-UHFFFAOYSA-N 430.545 4.650 70 10 IJIE O=C(O[C@H]1CC[C@H]2C[C@@H]1C2)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2198393845 QNARYRTVMYKPJP-LZWOXQAQSA-N 426.943 4.600 70 10 IJIE Cc1cc(C)c(NS(=O)(=O)c2cc(Br)sc2C)c(Br)c1 159902752 XQIDXUIQSNRYFG-UHFFFAOYSA-N 439.194 4.999 70 10 IJIE O=C(c1cc(Br)ccc1I)N1CCC[C@@H]2CCCC[C@@H]21 217479206 RUOODQYQHSGOQN-NHYWBVRUSA-N 448.142 4.849 70 10 IJIE CC(C)(NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156358431 PKXWCRQXIQLLIC-UHFFFAOYSA-N 427.975 4.563 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1cc(Br)cc(Br)c1)CC1CC1 2364225774 BUHKXLXOPNODGH-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(F)c(Br)cc1C(C)(C)S(=O)(=O)Cl 1952738122 QCLBQHCLKLDZPL-UHFFFAOYSA-N 430.723 4.739 70 10 IJIE CC(C)[C@@H](COCc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2362255948 YQYVONWBFLYXRU-NSHDSACASA-N 448.604 4.569 70 10 IJIE C=C(C)CCCCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2287379726 QEMIPIZHPGHHGV-UHFFFAOYSA-N 430.133 4.995 70 10 IJIE C[C@H]1CCC[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2149833830 YMEYKYYUVGEWBW-DTWKUNHWSA-N 446.588 4.954 70 10 IJIE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC[C@H]([B-](F)(F)F)C1 1891517452 ORVKYQRVJLESTB-HNNXBMFYSA-N 445.270 4.754 70 10 IJIE CC[C@@](C)(NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156358460 PRGUJLULFZCRKO-LJQANCHMSA-N 427.975 4.563 70 10 IJIE C[C@H](CCOCc1cc(Br)cc(Br)c1)CCS(=O)(=O)Cl 2362255780 YBHGBVSYBRYRAE-SNVBAGLBSA-N 448.604 4.713 70 10 IJIE O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1ccc(Oc2ccccc2)cc1 218274229 WJARTGRFIQCUHJ-QFIPXVFZSA-N 427.460 4.768 70 10 IJIE C[C@@H](CCOCc1cc(Br)cc(Br)c1)CCS(=O)(=O)Cl 2362255779 YBHGBVSYBRYRAE-JTQLQIEISA-N 448.604 4.713 70 10 IJIE CC(C)Oc1ccc([C@H]2NN=C3CCN(Cc4ccccc4)C[C@H]32)cc1Br 217067651 LKHQSOPVNDHQKU-XMSQKQJNSA-N 428.374 4.759 70 10 IJIE COc1ccc([C@@H](C)NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217298908 GFMVOLHZHUCUPK-CYBMUJFWSA-N 441.753 4.940 70 10 IJIE O=C(c1cc(Br)ccc1Br)N1CC[C@H]2C[C@@]2([B-](F)(F)F)C1 2194127699 AWEJHKFPURAUBU-ISVAXAHUSA-N 425.859 4.665 70 10 IJIE C[C@H]1[C@@H](OC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1(C)C 2366254557 DSATZLHWOMRANP-WFASDCNBSA-N 428.959 4.846 70 10 IJIE C[C@H]1CC[C@@H](C)N(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156353933 FNHJJAKQQQTLPT-UONOGXRCSA-N 427.975 4.515 70 10 IJIE O=S(=O)(Cl)c1ccccc1OCc1cc(Br)cc(Br)c1 2362203767 HIISNMRPYRTBAW-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE NN[C@H](c1cscc1Br)c1cc(Br)ccc1Br 159381748 VAPMKFVGUZWKCV-NSHDSACASA-N 440.986 4.588 70 10 IJIE Cc1cccc(OCNC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1C 217291009 NYZNAPVICSPCEJ-UHFFFAOYSA-N 429.564 4.757 70 10 IJIE O=S(=O)(Cl)c1cccc(OCc2cc(Br)cc(Br)c2)c1 2362200673 BNWJRDYXIBFUNE-UHFFFAOYSA-N 440.540 4.718 70 10 IJIE CC[C@@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CCC1 2156357664 KLCSLVJWBSMWFC-MRXNPFEDSA-N 427.975 4.563 70 10 IJIE C#CCCCCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 686708581 JKRASKOZSWELCL-UHFFFAOYSA-N 444.572 4.712 70 10 IJIE NC[C@H](c1c(F)cccc1Cl)[C@@H](O)c1cc(Br)ccc1Br 161264134 RCQHZYCACHZBJG-BMIGLBTASA-N 437.534 4.780 70 10 IJIE C[C@@H]1CCC[C@@H](NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2156354469 JOEGRRLEMPVQPR-UKRRQHHQSA-N 427.975 4.563 70 10 IJIE O=C(NCCC(=O)N1CCC[C@@H]([B-](F)(F)F)C1)OCC1c2ccccc2-c2ccccc21 2241641398 UBGSNOZDJRGSLB-MRXNPFEDSA-N 445.270 4.755 70 10 IJIE CCCn1ncc(Br)c1[C@@H](CSc1cccc(Br)c1)NC 160783129 DTJWZZHEXLSMMH-CQSZACIVSA-N 433.213 4.871 70 10 IJIE CC1(COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCCC1 2156355117 OVFAGNBLFCZLML-UHFFFAOYSA-N 428.959 4.992 70 10 IJIE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)N3C[C@H](c4ccccc4)O[C@H](C)C3)ccc21 216865514 AHEIZARIZGDOLK-NTKDMRAZSA-N 448.567 4.504 70 10 IJIE O=C(c1cc(Br)sc1Br)N1CC[C@H]2C[C@]2([B-](F)(F)F)C1 1879738107 RASPRNDRTZTREZ-KGFZYKRKSA-N 431.888 4.727 70 10 IJIE O=C(c1cccc(Br)c1Br)N1CC[C@@H]2C[C@]2([B-](F)(F)F)C1 2194130944 VWGNETZNENTUKK-OQPBUACISA-N 425.859 4.665 70 10 IJIE Cc1cc(Br)cc(S(=O)(=O)Cl)c1OC[C@H](C)COCc1ccccc1 719540441 GKXNLGOPYKUYDV-CYBMUJFWSA-N 447.778 4.917 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OCC=C2CCC2)c(Br)c1 2136918097 NQTFNOXAEFKGTP-UHFFFAOYSA-N 430.545 4.628 70 10 IJIE CCC[C@H]1C[C@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743748 KTLKLCJSFLSFRQ-GJZGRUSLSA-N 428.959 4.848 70 10 IJIE CC[C@@H]1CC[C@H]1N(C)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2161927336 CSJXSWAYIMPPAA-GDBMZVCRSA-N 427.975 4.515 70 10 IJIE Cc1ccc(F)c(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c1 159552439 BRCKCORBKIUQNG-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE O=S(=O)(Cl)c1cc(Br)c(OC[C@H]2[C@H]3CCC[C@H]32)c(Br)c1 2167338745 LXJYTGUSWQFJEP-ILWJIGKKSA-N 444.572 4.564 70 10 IJIE O=C(O[C@H]1CCCC[C@@H]1F)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2197117932 KGSZIHDPKVEMDB-GJZGRUSLSA-N 432.922 4.692 70 10 IJIE CC(C)Sc1ccc(CC(=O)NCCn2nc(-c3ccccn3)c3c2CCCC3)cc1 217490955 JGSIQABGDQFPIX-UHFFFAOYSA-N 434.609 4.683 70 10 IJIE Cc1cccc(Oc2ccc(S(=O)(=O)N3CCC[C@]4(C3)OC(=O)c3ccccc34)cc2)c1 217631495 BPNCJCCFHPTYMI-RUZDIDTESA-N 449.528 4.638 70 10 IJIE CC(C)(C)OC(=O)Nc1cc(Br)ccc1[C@@H](CS(=O)(=O)Cl)C1CC1 1952693295 UMNOZEOALMJVKD-ZDUSSCGKSA-N 438.771 4.858 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccc(Br)cc2Br)cc1 113939194 KSZLRPNIHIALOD-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE CC(=O)Oc1cccc(NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 217264910 RNHRYXUNXKSEIO-UHFFFAOYSA-N 429.520 4.551 70 10 IJIE CN(CCCC1CC1)C(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156358751 RVUPTEGZKGIMNL-UHFFFAOYSA-N 427.975 4.517 70 10 IJIE CC(C)[C@@H]1C[C@H]1COC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2200743340 HPIIVBAIXVSVHS-GJZGRUSLSA-N 428.959 4.704 70 10 IJIE CCCCC#CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2203853141 KKWNYFKRTLJDBC-UHFFFAOYSA-N 444.572 4.712 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OC/C(C)=C/Br 2226545880 YYKWYQYNCDPGAF-SOFGYWHQSA-N 432.561 4.617 70 10 IJIE O=C(Cc1cc(Br)cc(Br)c1)N1CCC([B-](F)(F)F)CC1 2295280423 BJFTVAHVFFXONA-UHFFFAOYSA-N 427.875 4.594 70 10 IJIE CN[C@H](Cc1ccc(OC(F)(F)F)cc1)c1csc(I)c1 161453538 CDJUARXBJGFQBU-GFCCVEGCSA-N 427.229 4.755 70 10 IJIE C[C@H]1CCCN(C(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2156355059 OHRIWIQCMULOIJ-AWEZNQCLSA-N 427.975 4.517 70 10 IJIE CCC1CC(COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191421289 HFEFNOWBTZFNDU-UHFFFAOYSA-N 430.133 4.685 70 10 IJIE CC[C@H](CNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(C)C 2156360447 FJZWLPXHWMHPBX-OAHLLOKOSA-N 429.991 4.667 70 10 IJIE C[C@@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1(C)CCC1 2172426877 OHRPUTQIKXDNNG-CYBMUJFWSA-N 427.975 4.563 70 10 IJIE O=C(NCCCOc1ccc(Br)cc1Cl)NCCc1ccccc1F 217299189 NLTVHIOUUXGVOX-UHFFFAOYSA-N 429.717 4.552 70 10 IJIE C[C@H](c1ccccc1)N(C)C(=O)c1cc(Br)ccc1I 218166641 CDYZSHAOOCWSGF-LLVKDONJSA-N 444.110 4.887 70 10 IJIE O=S(=O)(Cl)C[C@@H](COc1c(Br)cccc1Br)CC1CC1 2169172680 PJECYXFRYHYLRI-SNVBAGLBSA-N 446.588 4.575 70 10 IJIE CC(=O)Nc1ccc(NC(=O)NCCCOc2ccc(Br)cc2Cl)cc1 217298820 DQBASTHPCQXRAI-UHFFFAOYSA-N 440.725 4.652 70 10 IJIE CC(C)(C)c1cc(NC(=O)c2cc(Br)ccc2I)on1 217443816 RNVKZNVMHGYJPU-UHFFFAOYSA-N 449.086 4.592 70 10 IJIE O=C(Nc1ccsc1-c1nc(C2CC2)no1)c1cccc(I)c1 217286542 DUBZSBBLXYFIQM-UHFFFAOYSA-N 437.262 4.532 70 10 IJIE CC1(COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)CCC1 388692842 GFPGEFAGDIQAJF-UHFFFAOYSA-N 432.561 4.708 70 10 IJIE CC(C)(C)CCCNC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156357373 IEUKPOQDHSFVTB-UHFFFAOYSA-N 429.991 4.811 70 10 IJIE C[C@H]1CCC[C@]1(C)NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2193328871 GGOXGUDWQPJWGC-DJJJIMSYSA-N 427.975 4.563 70 10 IJIE CCC[C@H](NC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C1CC1 2156358669 REGHKDKIUWFINI-INIZCTEOSA-N 427.975 4.563 70 10 IJIE O=C(NCC1CCCCC1)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1 2156353901 FGPQELDIYRVAAL-UHFFFAOYSA-N 427.975 4.565 70 10 IJIE Cc1cccc(Oc2ccc(S(=O)(=O)N3CCC[C@@]4(C3)OC(=O)c3ccccc34)cc2)c1 217631583 BPNCJCCFHPTYMI-VWLOTQADSA-N 449.528 4.638 70 10 IJIE C/C(=C/Cl)COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 310648850 SWZMOHFZWZCLTG-XQRVVYSFSA-N 438.952 4.661 70 10 IJIE C[C@H]1CC[C@H](COc2c(Br)cc(S(=O)(=O)F)cc2Br)C1 2191422418 UDACGCCIOPVSPF-IUCAKERBSA-N 430.133 4.685 70 10 IJIE CCOc1cc(C(=O)N(CCc2cccs2)C2CCOCC2)cc(OCC)c1OCC 217291337 GEUGVJFYJIFOHC-UHFFFAOYSA-N 447.597 4.808 70 10 IJIE CCc1ccccc1OCNC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217309833 QBFNAKHKTSNYOP-UHFFFAOYSA-N 429.564 4.702 70 10 IJIE C/C=C/CCCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2123147746 HCTBPWAPDLOHKK-NSCUHMNNSA-N 432.561 4.874 70 10 IJIE C[C@H]1CC[C@H](COC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)C1 2282924951 GLNQXAKZEIQORP-ZFWWWQNUSA-N 428.959 4.848 70 10 IJIE COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1C(=O)CC(c1ccccc1)c1ccccc1 217950894 YJFUELJNIZVGNL-XUZZJYLKSA-N 447.506 4.569 70 10 IJIE CCc1ccccc1NS(=O)(=O)c1cc(Br)c(C)cc1Br 159538715 AFJYUHBNSSMPDV-UHFFFAOYSA-N 433.165 4.883 70 10 IJIE Cc1cccc(CCNC(=O)NCCCOc2ccc(Br)cc2Cl)c1 217299192 RNZKHTULWBSKBF-UHFFFAOYSA-N 425.754 4.722 70 10 IJIE O=C(c1cc(Cl)cc(Cl)c1I)N1CC[C@@H]([B-](F)(F)F)C1 2342485738 OHMYPGZGYJIMSB-ZCFIWIBFSA-N 436.815 4.662 70 10 IJIE Cc1cc(Br)ccc1NC(=O)Nc1ccc2c(c1)C(=O)N(C(C)(C)C)C2=O 217280593 TWSRPXTWWKBIIF-UHFFFAOYSA-N 430.302 4.796 70 10 IJIE CCC[C@@H]1C[C@H]1COc1c(Br)cc(S(=O)(=O)F)cc1Br 2200565123 MCPMIZMKAPQJLX-BDAKNGLRSA-N 430.133 4.685 70 10 IJIE C=CC1(COc2c(Br)cc(S(=O)(=O)F)cc2Br)CCC1 2191421687 LRNRSLIKHDGAGA-UHFFFAOYSA-N 428.117 4.605 70 10 IJIE O=S(=O)(Cl)c1ccccc1Oc1cc(Br)cc(Br)c1 2338709190 RLNHSYAWAQWDLX-UHFFFAOYSA-N 426.513 4.931 70 10 IJIE CC(C)C[C@H](COc1cc(Br)cc(Br)c1)CS(=O)(=O)Cl 2382174907 WWVYOXLRLIKPAA-SNVBAGLBSA-N 448.604 4.821 70 10 IJIE O=C(NCOc1ccc(Cl)cc1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217301529 WDWPBABORGHXJE-UHFFFAOYSA-N 435.955 4.793 70 10 IJIE Cc1ccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)c(C)c1 159529059 VNZBZCRSEICGBZ-UHFFFAOYSA-N 433.165 4.938 70 10 IJIE CN[C@@H](Cc1ccc(OC(F)(F)F)cc1)c1csc(I)c1 161453416 CDJUARXBJGFQBU-LBPRGKRZSA-N 427.229 4.755 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccccc2NC(=O)CCc2ccccc2)cc1 216659133 LHKVYEOKMUWHNU-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE CC(C)[C@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200584883 NSTSJQZBMWLWFN-PSASIEDQSA-N 446.588 4.810 70 10 IJIE CCN(C(=O)C(C)(C)CCl)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(C)cc1 35062928 JSASTLDJOAPSMN-QGZVFWFLSA-N 425.960 4.869 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)/C=C/c3ccccc3)cc2)cc1 216642942 UKCWMJJRJXJGSZ-LICLKQGHSA-N 444.487 4.804 70 10 IJIE CC(C)c1c(C(=O)Nc2nc3c(s2)C(=O)CCC3)cnn1-c1ccc(C(F)(F)F)cn1 216725072 WMEWQAIXXAJKOY-UHFFFAOYSA-N 449.458 4.637 70 10 IJIE COc1ccc([C@H](O)c2cc(Br)ccc2Br)c(OC)c1Cl 161057572 BWRPZIXUUBWYQW-AWEZNQCLSA-N 436.527 4.964 70 10 IJIE CC(C)(OC(=O)c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)C(F)(F)F 2193595056 DGKAMGZYRMTEFV-UHFFFAOYSA-N 442.864 4.752 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N(C)[C@@H](C)CC(C)C)cc1Br 159598583 GRSYSHQTYSYELR-NSHDSACASA-N 427.202 4.575 70 10 IJIE O=S(=O)(Cl)c1ccc(Oc2ccc(I)cc2)cc1Cl 1927652821 PBONOGPAKMSAOU-UHFFFAOYSA-N 429.062 4.664 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)NCc2ccc(NC(=O)c3cccc(F)c3)cc2)cc1 216636982 SWQCDPZIFSESNF-UHFFFAOYSA-N 436.439 4.543 70 10 IJIE O=C(c1ccccc1)c1ccc(CNS(=O)(=O)Cc2ccc(C(F)(F)F)cc2)s1 217294421 SOWNIUVBYLSQAU-UHFFFAOYSA-N 439.480 4.618 70 10 IJIE CC(C)CNCCCc1nnc(-c2cc(Br)ccc2Br)s1 161291466 LPFLFKGPWTZURR-UHFFFAOYSA-N 433.213 4.908 70 10 IJIE CC[C@@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)F)cc1Br 2236503477 OMNHDJKVYQZEJO-BDAKNGLRSA-N 430.133 4.685 70 10 IJIE CC(C)(C)c1ccc(OCCCC(=O)NCc2ccc(NC(=O)C(F)(F)F)cc2)cc1 216795181 DQSYJIQCXBCTKE-UHFFFAOYSA-N 436.474 4.960 70 10 IJIE COc1ccc(Br)cc1S(=O)(=O)Nc1ccccc1-c1csc(C)n1 218664111 UUTHSQWBZDSJGB-UHFFFAOYSA-N 439.356 4.690 70 10 IJIE CCc1cc(Br)cc(S(=O)(=O)Cl)c1OCCC=CBr 1890556556 UHVMPZCGTHCVLZ-UHFFFAOYSA-N 432.561 4.617 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)N[C@H]2CCCCC2(C)C)cc1Br 159680934 HLRWWXYKGQAXMG-AWEZNQCLSA-N 439.213 4.767 70 10 IJIE O=C(c1cc(Br)ccc1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 2194127698 AWEJHKFPURAUBU-AMIZOPFISA-N 425.859 4.665 70 10 IJIE CCC[C@H]1C[C@@H]1COc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2200566330 OFSPLROTBFHVFT-DTWKUNHWSA-N 446.588 4.954 70 10 IJIE COc1ccccc1/C=C/NC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217707494 ZPFGHYAJLWVLOA-WUKNDPDISA-N 427.548 4.783 70 10 IJIE CC1(CCCOC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CC1 2366986542 IUIQLSZLPMCDKS-UHFFFAOYSA-N 428.959 4.992 70 10 IJIE CCOc1cccc2cc(C(=O)Nc3ccccc3-c3cn4ccsc4n3)c(=O)oc12 218537583 FMCCWVIVUTUCQJ-UHFFFAOYSA-N 431.473 4.820 70 10 IJIE O=C(Nc1nc2c(s1)C(=O)CCC2)c1cccnc1Oc1ccc(Br)cc1 216724934 JRRXXVPXLMMTBU-UHFFFAOYSA-N 444.310 4.864 70 10 IJIE C#Cc1cccc(N(Cc2cccs2)C(=O)c2cc(S(=O)(=O)F)ccc2Cl)c1 1361104634 VSFXAHSGROISDW-UHFFFAOYSA-N 433.913 4.888 70 10 IJIE CC[C@H]1C[C@@H]1CCOc1c(Br)cc(S(=O)(=O)Cl)cc1Br 2236500471 CMQXEEVXFHMCTH-IUCAKERBSA-N 446.588 4.954 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccc(CNC(=O)CCc3ccccc3)cc2)cc1 216633863 HVJYZYFNLWBDFA-UHFFFAOYSA-N 446.503 4.723 70 10 IJIE CCOC(=O)Oc1ccc(C(=O)Nc2ccccc2CNC(=O)Cc2ccccc2C)cc1 216664603 APEMKZSNGXOJKO-UHFFFAOYSA-N 446.503 4.642 70 10 IJIE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@@]2([B-](F)(F)F)C1 1879738108 RASPRNDRTZTREZ-KSBSHMNSSA-N 431.888 4.727 70 10 IJIE CCOc1ccc2ccccc2c1C(=O)NCCn1nc(-c2ccccn2)c2c1CCCC2 217491920 XKBVUWVKJVTSCI-UHFFFAOYSA-N 440.547 4.806 70 10 IJIE O=C(c1csc(S(=O)(=O)Cl)c1OCc1ccccc1)N1CCCCCCC1 2156354358 IQMPLJCBZUFFIH-UHFFFAOYSA-N 427.975 4.661 70 10 IJIE C=CCC[C@H](NC(=O)Cc1ccc(S(=O)(=O)F)cc1)c1ccc(C(F)(F)F)cc1 1435632967 BXENMLRXYOVTTM-SFHVURJKSA-N 429.435 4.730 70 10 IJIE CC(C)(C)OC(=O)Nc1c(Br)cccc1[C@H](CS(=O)(=O)Cl)C1CC1 1952832493 DWIAINKHISATKE-GFCCVEGCSA-N 438.771 4.858 70 10 IJIE COc1cc(Cl)c([C@H](O)c2cc(Br)ccc2Br)cc1OC 161033139 QJZIHUGEAKBIBG-OAHLLOKOSA-N 436.527 4.964 70 10 IJIE Cc1cccc(OCc2nnc(S[C@H](C)C(=O)Nc3ccccc3Br)o2)c1 218610786 BHUMSWSFBHWHCI-CYBMUJFWSA-N 448.342 4.839 70 10 IJIE Cc1cc(Br)cc(S(=O)(=O)Cl)c1OC[C@@H](C)COCc1ccccc1 719540444 GKXNLGOPYKUYDV-ZDUSSCGKSA-N 447.778 4.917 70 10 IJIE O=S(=O)(NC[C@H]1CCCN1c1nccs1)c1ccc(Oc2ccccc2Cl)cc1 217801959 UILKRWBSAYZDQH-OAHLLOKOSA-N 449.985 4.536 70 10 IJIE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCC[C@H]([B-](F)(F)F)C1 1888324816 OHRGHTFYDTYIDM-HOTGVXAUSA-N 445.270 4.754 70 10 IJIE O=C(Cn1ccc2c(Br)cccc21)c1ccc(I)cc1 159431452 LXJDBFUKQZBCQZ-UHFFFAOYSA-N 440.078 4.891 70 10 IJIE O=C(NCCc1cccc(Cl)c1)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 217281471 DWILBGCHGBYHOQ-UHFFFAOYSA-N 425.916 4.633 70 10 IJIE CCCC1(NC(=O)c2csc(S(=O)(=O)Cl)c2OCc2ccccc2)CCC1 2156352815 VMZHDCCGEFYECL-UHFFFAOYSA-N 427.975 4.707 70 10 IJIE CC[C@H]1CCCC[C@@H]1NS(=O)(=O)c1cc(Br)c(C)cc1Br 159597095 FCZCUPVITYNPQA-FZMZJTMJSA-N 439.213 4.767 70 10 IJIE O=C(NC1(C(=O)N2CC[C@H]([B-](F)(F)F)C2)CC1)OCC1c2ccccc2-c2ccccc21 1891517005 KXFODDXFGGHQKM-HNNXBMFYSA-N 443.254 4.508 70 10 IJIE C[C@@H]1CC[C@H](COc2c(Br)cc(S(=O)(=O)Cl)cc2Br)C1 2157879045 QPPZXQBXPRQCIC-BDAKNGLRSA-N 446.588 4.954 70 10 IJIE Cc1cc(Br)c(S(=O)(=O)Nc2ccc(Cl)cc2)cc1Br 159535842 WSGHDXIMNFOXJT-UHFFFAOYSA-N 439.556 4.974 70 10 IJIE CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CC[C@H]([B-](F)(F)F)C2)cc1Br 2319680542 QYICASRTHBCECJ-NSHDSACASA-N 436.057 4.860 70 10 IJIE Cc1ccc(NS(=O)(=O)c2cc(Br)c(C)cc2Br)cc1F 159538545 DVKPXYFRHOHMOS-UHFFFAOYSA-N 437.128 4.768 70 10 IJIE CCOC(=O)Oc1ccc(NC(=O)Nc2ccc(I)cc2C)cc1 217266032 MDBQJRKAGXKOCL-UHFFFAOYSA-N 440.237 4.779 70 10 IJIE