smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCc1ccccc1NC(=O)CN1CCN(C(=O)CSc2nc(-c3ccc(F)cc3)cs2)CC1 217495228 GAAXTXVNSHVRLG-UHFFFAOYSA-N 498.649 4.387 70 20 JIID Cc1cc(COc2ccc(C(=O)Nc3ccc(S(=O)(=O)F)cc3)cc2Br)on1 865204340 PAMSLXKLXDULDT-UHFFFAOYSA-N 469.288 4.235 70 20 JIID Nn1c(Cc2cccc3ccccc23)nnc1SCc1ccc(S(=O)(=O)C(F)F)cc1 216859281 BFRNAOVCZAVLBT-UHFFFAOYSA-N 460.531 4.025 70 20 JIID CC(C)c1c(C(=O)Nc2ccc(S(=O)(=O)F)cc2)cnn1-c1ccc(C(F)(F)F)cn1 865203828 AMUMGQNOBLJAOR-UHFFFAOYSA-N 456.421 4.320 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)c1ccc(Br)cc1 216772648 TWGPJOLPXYMVTP-OAQYLSRUSA-N 478.818 4.014 70 20 JIID O=S(=O)(c1ccc(CSc2ncnc3c2cnn3-c2ccc(F)cc2)cc1)C(F)F 217852453 SXLHPDGGLRBJCZ-UHFFFAOYSA-N 450.467 4.243 70 20 JIID CSc1nnc(CCCNC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)n1CC(C)C 217164414 MFAWKKGCHMVYRW-UHFFFAOYSA-N 466.533 4.223 70 20 JIID CC(=O)Nc1ccc(CNC(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)cc1 218262190 NGNKBTIIJUDFMB-UHFFFAOYSA-N 454.880 4.245 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)CCOc1ccc(Br)cc1)c1ccc(Br)cc1 216768350 ZSFKDCLREMDUBA-IBGZPJMESA-N 498.215 4.316 70 20 JIID Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)CC2)c(C)c1 217355298 HGRFFODJWRVIFV-UHFFFAOYSA-N 484.597 4.284 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)N1N=C(c2ccco2)C[C@@H]1c1ccco1 216786758 GAMOCUKNKJCMRP-QGZVFWFLSA-N 462.531 4.291 70 20 JIID Cc1cc(NC(=O)c2ccc(S(=O)(=O)N3CCCC[C@@H]3C)cc2)n(-c2ccc(F)cc2)n1 217358652 SWUFHNWCHVSSFM-KRWDZBQOSA-N 456.543 4.135 70 20 JIID Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cc2Cl)n1 865206761 UINQKUNAHSHCHW-AWEZNQCLSA-N 478.933 4.264 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)c1ccc(Br)cc1 216772607 TWGPJOLPXYMVTP-NRFANRHFSA-N 478.818 4.014 70 20 JIID O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 217164689 WFGHHWUKYMODTA-UHFFFAOYSA-N 455.440 4.011 70 20 JIID CC(C)[C@H](NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1nc(C2CC2)no1 216726723 FZQOMOUOGMFVNH-JKSBSHDWSA-N 454.571 4.242 70 20 JIID COc1ccccc1C(=O)NCC(=O)Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1 217119623 NEHOCXHHOWTQRE-UHFFFAOYSA-N 472.423 4.074 70 20 JIID COc1ccc(C(=O)c2c(NC(=O)c3cnc4ccccn4c3=O)sc3c2CCCC3)cc1 218227467 MNVPBWNVVQRCKD-UHFFFAOYSA-N 459.527 4.127 70 20 JIID O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc(S(=O)(=O)F)cc1 865204415 RXUOBGFYPKYGKL-FQEVSTJZSA-N 460.914 4.498 70 20 JIID Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)N3CCN(Cc4cccnc4)CC3)cc12 217828751 HRLMJXZXCGUNKI-UHFFFAOYSA-N 451.983 4.402 70 20 JIID COc1ccccc1-c1csc([C@H]2CCCN(C(=O)c3ccc(S(=O)(=O)F)cc3)C2)n1 865210016 OLIURBIYYNUPCZ-INIZCTEOSA-N 460.552 4.497 70 20 JIID Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)N[C@H](C)c2ccc(Br)cc2)CC1 217447295 DWWJZJQEGWJJST-GOSISDBHSA-N 473.415 4.093 70 20 JIID COc1cccc(/C=C(/C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)n2nnnc2C)c1 218132088 XHZRTXVXCOZLBA-GJVLPJBHSA-N 478.556 4.418 70 20 JIID C[C@@H](NC(=O)c1cccc(S(=O)(=O)F)c1)c1cccc(NC(=O)Cc2ccccc2F)c1 1120786473 IUSXBDODLXXMFC-OAHLLOKOSA-N 458.486 4.156 70 20 JIID CCN(CC)C(=O)c1cccc(NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)c1 216773462 LFWKPFOZXWYQID-HXUWFJFHSA-N 460.372 4.137 70 20 JIID O=C(Nc1ccccc1)c1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)ccc1Cl 848945656 XMJUEIXTOYQRKH-UHFFFAOYSA-N 468.915 4.051 70 20 JIID CC(=O)N[C@H](CC(=O)Nc1cc2c(cc1Cl)OCCCO2)c1ccc(Br)cc1 217086992 KCHWEBPRULAOHE-MRXNPFEDSA-N 467.747 4.470 70 20 JIID O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865207237 KSDSPCZYPDUQOQ-KRWDZBQOSA-N 459.326 4.285 70 20 JIID CC(=O)N[C@H](CC(=O)NCCSCc1ccccc1F)c1ccc(Br)cc1 216798898 CHYPTLUISWBDDY-LJQANCHMSA-N 453.377 4.205 70 20 JIID O=C(c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)N1CC=C(c2ccc(O)cc2)CC1 216883268 OGFWHZVGKJRUPB-UHFFFAOYSA-N 452.507 4.262 70 20 JIID C[C@H]1Cc2cc(-c3csc([C@H]4CN(Cc5ccccc5)CCO4)n3)ccc2N1S(C)(=O)=O 216648066 PRGQLVWLPFPCIH-GAJHUEQPSA-N 469.632 4.094 70 20 JIID CC(=O)N[C@@H](CC(=O)NC[C@@H](c1ccccc1Cl)N(C)C)c1ccc(Br)cc1 216772013 LHHDODOMLZCDQZ-PMACEKPBSA-N 466.807 4.089 70 20 JIID COC(=O)c1ccc2c(=O)n(Cc3ccco3)c(SCc3cnn(-c4ccccc4)c3)nc2c1 217500902 VVKCSXPSWSFBLU-UHFFFAOYSA-N 472.526 4.302 70 20 JIID O=C(Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1F)c1cccc(Cl)c1 848945146 HYYYCDQKJBELSG-UHFFFAOYSA-N 486.905 4.190 70 20 JIID COc1cccc([C@H](CNC(=O)NCc2c(C)nn(Cc3ccccc3)c2C)N2CCCC2)c1 217444478 LHUUUBMZDGQPCF-SANMLTNESA-N 461.610 4.193 70 20 JIID COc1cccc(/C=C(/C(=O)N[C@H](C)c2cc(F)c(Cl)cc2Cl)n2nnnc2C)c1 218135319 WYRMGKIKMADHGZ-DLGFXHSSSA-N 450.301 4.312 70 20 JIID CN(C(=O)c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1Cl)C1CCCCC1 848944622 RQDYTJPNSMTMAL-UHFFFAOYSA-N 488.990 4.204 70 20 JIID COc1cc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 865205880 SVONKUCEIXQZKT-GJZGRUSLSA-N 478.542 4.017 70 20 JIID O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1ccc(S(=O)(=O)F)cc1 865206607 NVTNGHOCOHAIDS-UHFFFAOYSA-N 458.898 4.340 70 20 JIID CC(=O)N[C@H](CC(=O)Nc1cccc(I)c1)c1ccc(Br)cc1 216760951 MNKFTNLFFZJIHZ-MRXNPFEDSA-N 487.135 4.260 70 20 JIID COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cccc(S(=O)(=O)F)c1)CC2 1337666988 KDBPRPQROLZINM-HSZRJFAPSA-N 455.507 4.150 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O 217138811 UUKFJEBGFIOXEM-HRAATJIYSA-N 466.390 4.358 70 20 JIID COc1cccc(CN(C)C(=O)c2cccc(S(=O)(=O)F)c2)c1OCc1ccccc1F 1340629954 MVYHSZDXFIFQHM-UHFFFAOYSA-N 461.486 4.344 70 20 JIID O=C(Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c(C(F)(F)F)c1)c1ccoc1 848946920 HVEIENMUZBXLAL-UHFFFAOYSA-N 492.428 4.010 70 20 JIID CC(=O)N[C@@H](CC(=O)NCCc1ccc(Br)s1)c1ccc(Br)cc1 218070762 SASCJMGTCLFHNM-HNNXBMFYSA-N 474.218 4.199 70 20 JIID Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)N1CC=C(c2ccc(O)cc2)CC1 216851738 FEQWDSYEHZNYCQ-IBGZPJMESA-N 454.592 4.193 70 20 JIID O=C(Nc1nc(-c2ccc3c(c2)CCC3)cs1)c1sccc1S(=O)(=O)N1CCCC1 218260610 KQROTCJBUVMINV-UHFFFAOYSA-N 459.618 4.397 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2c(Cl)cc(C(F)(F)F)cc2Cl)cc1 848948820 IPJXJSXQYMZCGX-UHFFFAOYSA-N 452.234 4.471 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1CCCOC 217152870 RBWOFRMRZQSCFQ-IBGZPJMESA-N 457.621 4.123 70 20 JIID O=S(=O)(c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 218050673 XYTBMMSALNLWCG-CYBMUJFWSA-N 462.925 4.245 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2Br)n1N 217149190 UPZDZMFOBQWWGH-HNNXBMFYSA-N 478.441 4.111 70 20 JIID CCN(CC(=O)Nc1ccccc1C(F)(F)F)Cc1ccc(S(=O)(=O)C(F)F)cc1 216897774 SAHKGEBIQPXRBA-UHFFFAOYSA-N 450.429 4.162 70 20 JIID CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)c3c[nH]nc3-c3ccc(Cl)cc3)n2)cc1 217676957 SPRHWDSKYTZXHV-UHFFFAOYSA-N 473.967 4.477 70 20 JIID CCOC(=O)c1sc(N(Cc2ccc(F)cc2)C(=O)c2cnc3c(c2)c(C)nn3C)nc1C 218179004 LCGQTNOTHLKPQH-UHFFFAOYSA-N 467.526 4.204 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)c2nc(-c3cccs3)n(-c3ccc(F)cc3)n2)CC1 218073567 YORZBHWXCKMPIK-UHFFFAOYSA-N 495.555 4.241 70 20 JIID CC(=O)N[C@@H](CC(=O)NCCSCc1ccccc1F)c1ccc(Br)cc1 216798861 CHYPTLUISWBDDY-IBGZPJMESA-N 453.377 4.205 70 20 JIID O=C(Nc1cccc2c1CCCN2C(=O)c1ccc(S(=O)(=O)F)cc1)c1ccc(F)cc1 865206750 SYTQCOHJZYKVIQ-UHFFFAOYSA-N 456.470 4.329 70 20 JIID O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1339472895 VFWBQFYBIFKUIB-QGZVFWFLSA-N 459.326 4.285 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C)CC1 218373333 HSKZOAXBLYPWBX-UHFFFAOYSA-N 476.474 4.305 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1cccc(C)c1 217159662 RFLUPTIFZKHGIT-FQEVSTJZSA-N 483.663 4.102 70 20 JIID CC(C)CCn1c(=O)c2ccccc2n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nnc12 216863297 FRVUSYADRQUIFU-UHFFFAOYSA-N 492.573 4.379 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1 848945772 CFRNLKCZOWZBQO-UHFFFAOYSA-N 454.498 4.070 70 20 JIID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1csc(-c2cccc(Br)c2)n1 216833689 UMVGOOTXEKVNPS-IBGZPJMESA-N 471.376 4.242 70 20 JIID COc1cc(OC)c(NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1Cl 216764144 ZXPTXVFRLKEDOR-OAHLLOKOSA-N 455.736 4.326 70 20 JIID Cc1cc(NC(=O)CSCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)n(-c2ccc(F)cc2)n1 217829868 RVUACNGLQONDHO-UHFFFAOYSA-N 483.594 4.369 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1ccc(Br)cc1F 216778773 MAFCVWGOWMWYKB-UHFFFAOYSA-N 450.333 4.267 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1)c1ccc(Br)cc1 216798295 GLKBTEVRLRCWPH-NRFANRHFSA-N 496.808 4.153 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)N[C@H](C)c2ccc(Br)cc2)CC1 217447087 AQBXZKZJZJFJQX-OAHLLOKOSA-N 450.352 4.185 70 20 JIID Cc1cc(=O)c(C(=O)N2CC=C(c3ccc(O)cc3)CC2)nn1-c1ccccc1C(F)(F)F 216853348 ZNSSZCYFDLXELP-UHFFFAOYSA-N 455.436 4.195 70 20 JIID CCOc1cc2c(cc1NC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1)O[C@@H](C)C2 216889867 DUFKIWLEJPBVRN-UGSOOPFHSA-N 461.356 4.377 70 20 JIID Cc1noc(CCC(=O)N(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)Cc2ccco2)n1 218324223 NXYBJPHBNVTYGE-UHFFFAOYSA-N 470.835 4.243 70 20 JIID CCCNc1ccc(S(=O)(=O)N(CC)CC)cc1NCc1cn2cc(Cl)ccc2n1 216637279 ZJFGJPWOBSUWSN-UHFFFAOYSA-N 450.008 4.452 70 20 JIID C[C@H](NC(=O)N1CCN(Cc2cn3ccccc3n2)CC1)c1cc(F)c(Cl)cc1Cl 217450290 NREQLWWCGDAMJU-AWEZNQCLSA-N 450.345 4.369 70 20 JIID Cc1cc(C(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c(C)n1CCc1cccs1 217986569 JPLHNCZBJWEHQH-UHFFFAOYSA-N 455.605 4.186 70 20 JIID Cc1nn(-c2ccc(Br)cc2)c(NC(=O)c2cccc(S(=O)(=O)F)c2)c1C 1354469292 HSIZZINNAGTVDT-UHFFFAOYSA-N 452.305 4.162 70 20 JIID CC(=O)N[C@H](CC(=O)NC[C@@H](c1ccccc1Cl)N(C)C)c1ccc(Br)cc1 216772055 LHHDODOMLZCDQZ-UXHICEINSA-N 466.807 4.089 70 20 JIID Cc1ccc(CNC(=O)c2ccccc2NC(=O)CNc2ccccc2C(=O)N2CCCC2)cc1 216627977 UMKIIVMLYVAGDO-UHFFFAOYSA-N 470.573 4.212 70 20 JIID CCOc1ccc([C@H](NC(=O)CNC(=O)c2ccc(Br)o2)C(C)C)cc1OCC 216793037 OKOHLPFNXBDOQO-HXUWFJFHSA-N 467.360 4.083 70 20 JIID O=S(=O)(c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@H](c2nnc3n2CCCCC3)C1 218050748 XYTBMMSALNLWCG-ZDUSSCGKSA-N 462.925 4.245 70 20 JIID COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)c3ccc(S(=O)(=O)F)cc3)C2)n1 865210017 OLIURBIYYNUPCZ-MRXNPFEDSA-N 460.552 4.497 70 20 JIID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 1347188789 GQUFVRCXCJNRHO-UHFFFAOYSA-N 467.975 4.013 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccc(Br)cc1 218024616 PZOXGHCOFUAOOE-NRFANRHFSA-N 457.368 4.138 70 20 JIID O=C(Nc1ccccc1F)Nc1cccc2c1CCCN2C(=O)c1cc(S(=O)(=O)F)c[nH]1 1336962282 XAJOJISFLPYLSB-UHFFFAOYSA-N 460.462 4.049 70 20 JIID C[C@@H](NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1cc(F)c(Cl)cc1Cl 217452227 RYBPLQOSKYFCSY-CYBMUJFWSA-N 492.375 4.439 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 865204434 SPHUQMJQQWANEF-LADGPHEKSA-N 466.534 4.463 70 20 JIID CC(=O)N[C@@H](CC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Br)cc1 218076004 OEVSRVGLEGSCMV-FQEVSTJZSA-N 484.350 4.178 70 20 JIID CCOC(=O)c1sc2nc(CN(C)C)nc(NCCCc3nc4ccccc4[nH]3)c2c1C 217115546 VIQDSSZIEDVNDU-UHFFFAOYSA-N 452.584 4.159 70 20 JIID Cc1ccc(Cl)c(N(Cc2cccnc2)S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1 848947904 PIWBEZBDHAMCEX-UHFFFAOYSA-N 454.932 4.097 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 217519978 AEFFSCZEFCAXTQ-NHCUHLMSSA-N 475.511 4.121 70 20 JIID Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 217747077 BRKLMBIYRBUVQM-UHFFFAOYSA-N 464.591 4.044 70 20 JIID Cc1cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n(-c2cc(C(F)(F)F)ccc2Cl)n1 1336419051 RMDZFTLVSDAAEL-UHFFFAOYSA-N 450.801 4.092 70 20 JIID O=C(Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1)c1cccc(S(=O)(=O)F)c1 1338399840 ATZMZASKMATRAS-UHFFFAOYSA-N 452.916 4.242 70 20 JIID C[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)c1nc(-c2ccc(Br)cc2)cs1 1516702429 XFJPNCOYKQTOCB-VIFPVBQESA-N 458.334 4.050 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(c2ccccc2Cl)CC1)c1ccc(Br)cc1 216760587 GOKJSRSXPAGLAT-IBGZPJMESA-N 464.791 4.019 70 20 JIID CN(C)C1(CNC(=O)c2cc(Br)ccc2I)CCCCC1 217418539 RYQBWDVHXBSRNW-UHFFFAOYSA-N 465.173 4.048 70 20 JIID Cc1cc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)n(-c2ccc(F)cc2)n1 217343017 CGFDEQUBSPQBFW-UHFFFAOYSA-N 464.522 4.397 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)N[C@@H](C)c2ccc(Br)cc2)CC1 217447000 AQBXZKZJZJFJQX-HNNXBMFYSA-N 450.352 4.185 70 20 JIID CC(=O)N[C@@H](CC(=O)NCc1ccc(COCC(F)(F)F)cc1)c1ccc(Br)cc1 218013289 YXYVGAIAOSJTFP-IBGZPJMESA-N 487.316 4.412 70 20 JIID CC1CCN(c2nnc(SCC(=O)Nc3ccc(N4CCCCC4)nc3)n2Cc2ccco2)CC1 218778324 VPMLVHJZBOAIJS-UHFFFAOYSA-N 495.653 4.272 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N[C@@H](C)Cc2cccs2)cc1Br 159595507 VUDNFTMEXMGOJD-JTQLQIEISA-N 453.221 4.491 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1cccc(C)c1 217159653 RFLUPTIFZKHGIT-HXUWFJFHSA-N 483.663 4.102 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O 217139077 RHYMMSWABJSFJX-OAQYLSRUSA-N 459.571 4.080 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 217159889 AWZCQWCIDOHFQH-HXUWFJFHSA-N 483.663 4.102 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccc(Br)cc1 216759399 MCKNUWVSZBRXBF-HXUWFJFHSA-N 464.791 4.019 70 20 JIID C[C@H]1C[C@@H](C)CN(c2nnc(S[C@H](C)C(=O)N3CCc4ccccc43)n2Cc2ccco2)C1 217748973 UMZDBIXXVZDNQI-CEXWTWQISA-N 465.623 4.472 70 20 JIID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC([C@@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 1338388809 CQFOOSNXFBFCBS-NRFANRHFSA-N 476.574 4.002 70 20 JIID O=C(Nc1ccc2[nH]ncc2c1)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl 218103712 FOBMBBINSJTSRR-UHFFFAOYSA-N 466.950 4.216 70 20 JIID CNS(=O)(=O)c1ccc(C)c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)c1 217602505 FFOLDLCWXNIEJD-UHFFFAOYSA-N 466.382 4.041 70 20 JIID Cc1cc(NC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n(-c2ccc(F)cc2)n1 217342825 CZPBPSBUODORGF-UHFFFAOYSA-N 470.570 4.066 70 20 JIID O=C(c1ccc(S(=O)(=O)F)cc1)N1CCC(c2nc(-c3ccccc3Br)no2)CC1 865210256 XYXLKGNGILHQJT-UHFFFAOYSA-N 494.342 4.177 70 20 JIID C[C@H]1CN(Cc2csc(NC(=O)C3(c4ccccc4Cl)CCOCC3)n2)C[C@@H](C)O1 216977268 AXRPDSYLWFUPMT-IYBDPMFKSA-N 450.004 4.093 70 20 JIID CC(=O)N[C@H](CC(=O)NCCCSc1ccc(F)cc1)c1ccc(Br)cc1 216767355 SVYKJVJTJRRSDE-LJQANCHMSA-N 453.377 4.454 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C[C@H]1CCCO1 217156659 VUBRZCOYSLLJPL-UZLBHIALSA-N 469.632 4.265 70 20 JIID COc1ccc(/C=C2/CCCc3c2nc2ccccc2c3C(=O)NCCN2CCN(C)CC2)cc1 218010295 MYRKRPMFXDJXKI-XDOYNYLZSA-N 470.617 4.098 70 20 JIID COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(S(=O)(=O)F)cc2)c1 865204197 JJVZLNGCZIZPFZ-UHFFFAOYSA-N 481.505 4.467 70 20 JIID O=C(c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1)N1CCC[C@@H]1c1ccccc1 848945647 XCXPYSBPGQGXPP-JOCHJYFZSA-N 488.562 4.123 70 20 JIID Cc1cc(NC(=O)c2ccc3c(c2)S(=O)(=O)c2ccccc2C3=O)n(-c2ccc(Cl)cc2)n1 216752175 VEGHNUDOMYEIOC-UHFFFAOYSA-N 477.929 4.464 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1CCCOC 217152861 RBWOFRMRZQSCFQ-LJQANCHMSA-N 457.621 4.123 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(S(=O)(=O)N4CCC(C)CC4)cc3)c12 217943493 NRMUUVCITGKYTI-UHFFFAOYSA-N 456.568 4.328 70 20 JIID CN(Cc1ccccc1Br)C(=O)Cn1cnc2sc3c(c2c1=O)CCCCC3 216785594 GUXRLFDDDJRTIZ-UHFFFAOYSA-N 460.397 4.148 70 20 JIID CCN(CC)C(=O)c1ccc(NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1 217085926 KGVXXERYHJYLHY-HXUWFJFHSA-N 460.372 4.137 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1 865204278 MPKFOIXFRNLFOB-UHFFFAOYSA-N 494.953 4.002 70 20 JIID C[C@H](NC(=O)c1cccc(S(=O)(=O)F)c1)c1cccc(NC(=O)Cc2ccccc2F)c1 1120786472 IUSXBDODLXXMFC-HNNXBMFYSA-N 458.486 4.156 70 20 JIID CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)c1ccccc1 865210330 AXOSKXKMEHQTPN-LJQANCHMSA-N 450.532 4.121 70 20 JIID O=c1cc(CN2CCN(Cc3csc(-c4ccc(C(F)(F)F)cc4)n3)CC2)nc2sccn12 218263816 VXWQDFKUHDAMID-UHFFFAOYSA-N 491.564 4.216 70 20 JIID CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1 217058890 DUVXZCFAKIJZGN-UHFFFAOYSA-N 464.587 4.333 70 20 JIID O=C(Nc1cccc(C(=O)Nc2ccc(Br)cn2)c1)c1ccc(S(=O)(=O)F)cc1 865207354 MPVONFPPHGCYEY-UHFFFAOYSA-N 478.299 4.007 70 20 JIID COc1ccccc1-c1cc(NC(=O)c2cccc(S(=O)(=O)F)c2)n(-c2ccccc2)n1 1120786795 WBLKXXKCPJWEBH-UHFFFAOYSA-N 451.479 4.458 70 20 JIID O=C(c1cc(-c2cccs2)on1)N1CCN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1 217999349 MNYNXBXLPVBJQA-UHFFFAOYSA-N 489.479 4.430 70 20 JIID O=C(Nc1cccc(C(=O)Nc2ccc(Br)cn2)c1)c1cccc(S(=O)(=O)F)c1 1337519799 JMNUPOXLMQDWEV-UHFFFAOYSA-N 478.299 4.007 70 20 JIID CCOc1ccc([C@@H](NC(=O)CNC(=O)c2ccc(Br)cc2)C(C)C)cc1OCC 216792723 ZVSARRIPHSPHSI-QFIPXVFZSA-N 477.399 4.490 70 20 JIID O=C(C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)N1CC=C(c2ccc(O)cc2)CC1 216850486 NGXJBCNQNFIXAQ-UHFFFAOYSA-N 494.535 4.128 70 20 JIID C[C@H](NC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1cc(F)c(Cl)cc1Cl 217452313 RYBPLQOSKYFCSY-ZDUSSCGKSA-N 492.375 4.439 70 20 JIID O=C(N[C@H](Cc1ccccn1)c1ccc(Br)cc1)c1cccc(S(=O)(=O)F)c1 1354884512 FLOYAIWKAOBZBQ-LJQANCHMSA-N 463.328 4.216 70 20 JIID CN(C(=O)c1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1 848944710 WKQOBPFAIKULIQ-UHFFFAOYSA-N 482.942 4.076 70 20 JIID Cc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c2)n(-c2ccc(F)cc2)n1 217352686 XIBZPGURQFVNKI-UHFFFAOYSA-N 464.950 4.302 70 20 JIID Cc1cc(NC(=O)c2cccc(S(=O)(=O)N3CCCC[C@@H]3C)c2)n(-c2ccc(F)cc2)n1 217358455 LFHNYNCDWXIUBO-KRWDZBQOSA-N 456.543 4.135 70 20 JIID CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(S(=O)(=O)F)cc2)c1 865203656 JHVXGEFQJDGHIP-UHFFFAOYSA-N 482.942 4.076 70 20 JIID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 216834420 NLVCIPVPEZHDDI-QMLMGQGISA-N 486.612 4.259 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(-c3cccs3)n2C[C@H]2CCCO2)cc1)C(F)F 216865794 HPAPBKPKYOBIJY-CQSZACIVSA-N 471.576 4.474 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1 217156642 VUBRZCOYSLLJPL-JXFKEZNVSA-N 469.632 4.265 70 20 JIID CCOc1ccc([C@H](CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)c2c[nH]c3ccccc23)cc1OC 1350748294 ZSOKGZBKAUCEKV-SFHVURJKSA-N 485.537 4.123 70 20 JIID Cc1ccc(-n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nc3ccccc3c2=O)nc1 216867421 YPHBRRIYXDWOQV-UHFFFAOYSA-N 473.526 4.378 70 20 JIID Cc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)n(-c2ccc(F)cc2)n1 217339501 VVXVVJZUSSLVKQ-UHFFFAOYSA-N 476.961 4.400 70 20 JIID COc1ccc2cc(CNC(=O)C[C@@H](NC(C)=O)c3ccc(Br)cc3)ccc2c1 218012596 YMHXHHMDNBJRQJ-JOCHJYFZSA-N 455.352 4.495 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 217520533 BMXPISPSGMZEOP-VQTJNVASSA-N 475.511 4.121 70 20 JIID COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc(S(=O)(=O)F)cc1)CC2 865205362 DKJJRFYEMBSGCV-HSZRJFAPSA-N 455.507 4.150 70 20 JIID Cc1cc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc(S(=O)(=O)N2CCC(C)CC2)c1C 216852968 LNUGCWDPKUWRBH-UHFFFAOYSA-N 468.619 4.359 70 20 JIID CN(CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1)S(=O)(=O)c1ccc(Cl)s1 216827909 RUJTUFJTIDCGRY-UHFFFAOYSA-N 479.008 4.332 70 20 JIID O=C(N[C@H](Cc1ccccc1)c1nc2ccccc2n1CCS(=O)(=O)F)c1ccccc1 883954555 RAOBJGCBNFVLTC-OAQYLSRUSA-N 451.523 4.049 70 20 JIID O=C(c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1)N1CC=C(c2ccc(O)cc2)CC1 216847932 MVACZAFMYTURGC-UHFFFAOYSA-N 474.582 4.463 70 20 JIID COc1ccc([C@H]2CCCN2C(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 218300152 RIWHXIBPVDPDOF-VQTJNVASSA-N 475.383 4.397 70 20 JIID Cc1c(NC(=O)c2ccc(S(=O)(=O)F)cc2)cccc1C(=O)N1CCc2sccc2C1 865205970 PJPSRIKCQCONKS-UHFFFAOYSA-N 458.536 4.166 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)Cc1ccccc1Br)c1ccc(Br)cc1 216765723 PHZPWDSTYJFAQU-GOSISDBHSA-N 468.189 4.438 70 20 JIID C[C@@H]1CN(Cc2csc(NC(=O)C3(c4cccc(Cl)c4)CCOCC3)n2)C[C@@H](C)O1 217211074 LSJZRUPZCWFWQN-HZPDHXFCSA-N 450.004 4.093 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1 217156634 VUBRZCOYSLLJPL-OXJNMPFZSA-N 469.632 4.265 70 20 JIID O=C([C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 216898830 ZMKMIYVROWLWRH-HMXCVIKNSA-N 499.633 4.455 70 20 JIID CC(=O)N[C@H](CC(=O)NCc1ccc(COCC(F)(F)F)cc1)c1ccc(Br)cc1 218013363 YXYVGAIAOSJTFP-LJQANCHMSA-N 487.316 4.412 70 20 JIID C[C@@H]1CN(C(=O)c2cccc(S(=O)(=O)F)c2)c2ccccc2N(Cc2ccccc2)C1=O 1336953370 FDQXZTNDACACBY-QGZVFWFLSA-N 452.507 4.175 70 20 JIID COc1ccc(N(Cc2cccs2)C(=O)CN2C(=O)c3ccc(Br)cc3C2=O)cc1 216682925 LCSBBEWBUSFEEB-UHFFFAOYSA-N 485.359 4.349 70 20 JIID O=C1N[C@@]2(CCCc3sccc32)C(=O)N1CC(=O)N1CCc2sccc2[C@@H]1c1ccccc1 217817158 XMFGFAPHKMWEQV-WIOPSUGQSA-N 477.611 4.067 70 20 JIID COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cccc(S(=O)(=O)F)c1)CC2 1337727394 ZUFLICPKIVDBJM-OAQYLSRUSA-N 461.536 4.211 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)N(c2ccccc2)C2CCN(Cc3ccccc3)CC2)cc1 848947792 JMGMEWSJTSCXNL-UHFFFAOYSA-N 488.606 4.205 70 20 JIID COc1ccc([C@@H]2CCCN2C(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 218300090 RIWHXIBPVDPDOF-PMACEKPBSA-N 475.383 4.397 70 20 JIID CSc1nc2nc(C)c(CC(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)c(C)n2n1 218371043 RAYISTCYOWNTSV-UHFFFAOYSA-N 461.576 4.316 70 20 JIID CCn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nc2ccc(Br)cc2c1=O 216869997 SRCNDEFNGUTKDA-UHFFFAOYSA-N 489.363 4.468 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 217159900 AWZCQWCIDOHFQH-FQEVSTJZSA-N 483.663 4.102 70 20 JIID Cc1nc(-c2ccccc2Br)sc1[C@H](C)NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1336954522 RBAIXNNAVHXVKX-VIFPVBQESA-N 472.361 4.358 70 20 JIID Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)N1CC=C(c2ccc(O)cc2)CC1 216851768 FEQWDSYEHZNYCQ-LJQANCHMSA-N 454.592 4.193 70 20 JIID Cc1noc(C)c1COc1ccc(CC(=O)N2CCN(CCOc3ccccc3Cl)CC2)cc1 217589328 CMUKDQIWQNTOIJ-UHFFFAOYSA-N 483.996 4.290 70 20 JIID CN(C(=O)CSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCCCC1 865204139 GXNKXVBHMKNCAN-UHFFFAOYSA-N 464.584 4.480 70 20 JIID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@@H](C)C(=O)NCCc3ccccc3C)cc2)cc1 218727069 RKTDVDAURONRRT-FQEVSTJZSA-N 451.592 4.264 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(COc2ccc(C(C)C)cc2)n1N 217159453 XTVSDMYHHMEWSZ-IBGZPJMESA-N 471.652 4.384 70 20 JIID CCCCN1C(=O)CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccc(OC)cc1 865204456 ULMPKPWSYCLXNZ-UNMCSNQZSA-N 462.543 4.072 70 20 JIID Cc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)n(-c2ccc(F)cc2)n1 217343844 BIWBXUGQGHDHNY-UHFFFAOYSA-N 464.522 4.397 70 20 JIID O=C(CSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)F)cc1)Nc1ccc2c(c1)OCO2 865204262 LTMUUUMDPUOMCP-UHFFFAOYSA-N 488.518 4.057 70 20 JIID NC(=O)Cc1cc(Br)c(-c2ccc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cc2)s1 865208451 KKFVPMFWPIJIJP-UHFFFAOYSA-N 497.367 4.116 70 20 JIID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 216832703 FZDQVUIKDKXUGZ-BJKOFHAPSA-N 476.960 4.328 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)cc1 848944936 CKZHLJIUJCQEFM-UHFFFAOYSA-N 478.310 4.035 70 20 JIID Cc1cc(NC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)n(-c2ccc(F)cc2)n1 217362980 QGJJKMMSEIEVFC-UHFFFAOYSA-N 485.313 4.097 70 20 JIID O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc(S(=O)(=O)F)cc1 865203837 ASHPZSPWKYESMA-RVDMUPIBSA-N 470.594 4.026 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(CN3CCCC3)n2Cc2ccccc2)cc1)C(F)F 217509666 SCLAOOGBBYHERS-UHFFFAOYSA-N 478.590 4.211 70 20 JIID Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)cc2)cc1 216851319 RRZSLLOIMFFRHF-UHFFFAOYSA-N 462.571 4.455 70 20 JIID Cc1cc(NC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)n(-c2ccc(F)cc2)n1 217361023 XVXWIAHXUYKHHU-UHFFFAOYSA-N 494.951 4.152 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 216788549 OYNFPQDQTBGJPY-IBGZPJMESA-N 479.602 4.252 70 20 JIID C[C@@H](Sc1nc(CN2CCOCC2)nc2ccccc12)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218777399 GTEGRGOBMLZAHW-LLVKDONJSA-N 498.477 4.277 70 20 JIID CCOc1cc2c(cc1NC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1)O[C@H](C)C2 216889941 DUFKIWLEJPBVRN-ACJLOTCBSA-N 461.356 4.377 70 20 JIID Cc1cc(-c2cc(C(=O)N3CCN(CCN4CCCC4)CC3)c3cnn(C(C)C)c3n2)c(C)s1 218091800 YLDBSWGNEHQYBD-UHFFFAOYSA-N 480.682 4.211 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(Br)cc1 216798012 FSKRXCNLFAXREZ-NRFANRHFSA-N 478.818 4.014 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2cc(Cl)ccc2c(=O)n1CCOC 217144239 LTYZLOPYSQZIPV-GOSISDBHSA-N 478.039 4.386 70 20 JIID CC(=O)N[C@H](CC(=O)Nc1cccc(Cl)c1N1CCOCC1)c1ccc(Br)cc1 218024268 FPLYPHBZIZPQHI-LJQANCHMSA-N 480.790 4.145 70 20 JIID Cc1cc(NC(=O)c2cccc(S(=O)(=O)N3CCCCCC3)c2)n(-c2ccc(F)cc2)n1 217341653 CWAVJMADRHRNCJ-UHFFFAOYSA-N 456.543 4.137 70 20 JIID COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1ccc(S(=O)(=O)F)cc1)CC2 865206460 GYQGOUDVGILGHC-UHFFFAOYSA-N 484.549 4.173 70 20 JIID CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)N(C)C1CCCCC1 217010085 SDUTZRPBKQICIA-MRXNPFEDSA-N 453.457 4.185 70 20 JIID N#CCCSc1ccc(C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848945621 VXVMLZHGLRFEIN-UHFFFAOYSA-N 468.475 4.170 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 217520620 BMXPISPSGMZEOP-PMACEKPBSA-N 475.511 4.121 70 20 JIID C[C@H](Sc1nc(CN2CCOCC2)nc2ccccc12)C(=O)N(C)Cc1c(F)cccc1Cl 218777656 KJERREWNLPHRAS-INIZCTEOSA-N 489.016 4.394 70 20 JIID CC1(C)CC(NC(=O)c2cc(Br)ccc2I)CC(C)(C)N1 217502445 XBYIOUOCBXOPSX-UHFFFAOYSA-N 465.173 4.093 70 20 JIID Cc1cc(NC(=O)c2cccc(S(=O)(=O)N3CCCC[C@H]3C)c2)n(-c2ccc(F)cc2)n1 217358528 LFHNYNCDWXIUBO-QGZVFWFLSA-N 456.543 4.135 70 20 JIID C[C@H]1CCCCN1CCCNC(=O)c1cc(Br)ccc1I 218687078 AIGNUWBDAKFFLQ-LBPRGKRZSA-N 465.173 4.048 70 20 JIID COCCOc1ccc(C(F)(F)F)cc1NC(=O)Cn1cnc2sc3c(c2c1=O)CCCCC3 216781854 HCRFSARCXDKOCM-UHFFFAOYSA-N 495.523 4.410 70 20 JIID Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)CSc2nc(-c3ccc(F)cc3)cs2)CC1 217495439 KRDNJLTYFBAQOP-UHFFFAOYSA-N 498.649 4.441 70 20 JIID O=C(N[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 216691253 SKXPGCPOLOWWOI-RUZDIDTESA-N 477.992 4.152 70 20 JIID Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)N[C@H](CC(C)C)c1nc2ccccc2[nH]1 217032425 QMPSBDCXKPXOPO-HSZRJFAPSA-N 480.590 4.460 70 20 JIID O=C(c1sc2cccc(F)c2c1COc1ccccc1)N1CCN(CCN2CCCC2)CC1 218073799 DMCRKUUVAKWKTM-UHFFFAOYSA-N 467.610 4.473 70 20 JIID CCCCN1C(=O)CC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccc(OC)cc1 865204454 ULMPKPWSYCLXNZ-IRLDBZIGSA-N 462.543 4.072 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)Cc1ccc(Br)cc1)c1ccc(Br)cc1 216770317 FVCLTVLIJXSQEO-GOSISDBHSA-N 468.189 4.438 70 20 JIID CC(=O)N1CCN(C(=O)[C@@H](C)Sc2nnc(-c3cccc(C)c3)n2-c2ccc(Cl)cc2)CC1 218668453 AJFLGYTVZMDQLT-QGZVFWFLSA-N 484.025 4.067 70 20 JIID CC(C)CC(=O)N[C@H](C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1)c1ccccc1 216674463 KQOTXGCUXZPUJU-FKRCVWNDSA-N 490.019 4.261 70 20 JIID C[C@@H](Sc1nc(CN2CCOCC2)nc2ccccc12)C(=O)N(C)Cc1c(F)cccc1Cl 218777584 KJERREWNLPHRAS-MRXNPFEDSA-N 489.016 4.394 70 20 JIID O=C(c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1)N1CCC[C@H]1c1ccccc1 848945648 XCXPYSBPGQGXPP-QFIPXVFZSA-N 488.562 4.123 70 20 JIID CN(CC(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1)Cc1nc2ccccc2s1 216703330 PMHNOIMGUJEFEH-UHFFFAOYSA-N 486.663 4.320 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCC(OCc2ccccc2)CC1)c1ccc(Br)cc1 217085822 HXXFPOKLXPLHPR-JOCHJYFZSA-N 459.384 4.224 70 20 JIID Cc1nn(-c2ccccc2)c(C)c1[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)C(F)(F)F 865209278 NBFYQUVZDCFJCN-GOSISDBHSA-N 455.433 4.181 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(Cc2cccc3ccccc23)n1N 217138288 XSPGCBUYXUBZMW-FQEVSTJZSA-N 463.632 4.426 70 20 JIID O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1cc(S(=O)(=O)F)c[nH]1 1339472350 OBGHJCSCGLNYSV-UHFFFAOYSA-N 455.389 4.196 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1ccc(Br)cc1 216769718 GXDMLTWQHZGDGM-SFHVURJKSA-N 455.299 4.276 70 20 JIID CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1cc(C(C)C)nc2onc(C)c12 217977859 CDKXNBYHQRIUAX-UHFFFAOYSA-N 470.595 4.278 70 20 JIID Cc1csc([C@H](C)NS(=O)(=O)c2cc(Br)c(C)cc2Br)n1 159664495 HYPXJDKFAFIPLL-VIFPVBQESA-N 454.209 4.324 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(c2ccccc2Cl)CC1)c1ccc(Br)cc1 216760628 GOKJSRSXPAGLAT-LJQANCHMSA-N 464.791 4.019 70 20 JIID CN(C)[C@H](CNC(=O)c1cc(Br)ccc1I)c1cccs1 217442643 XPGDVNKOZUMDMA-CYBMUJFWSA-N 479.181 4.148 70 20 JIID C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc(CN2CCC[C@@H](C(N)=O)C2)cc1 216804812 IYUMRKUWRNZWSF-GOEBONIOSA-N 450.366 4.097 70 20 JIID CC(C)CC(=O)N[C@H](C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1)c1ccccc1 216674387 KQOTXGCUXZPUJU-PZGSVQSZSA-N 490.019 4.261 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)CC1 218221896 ZSYYRNZOEDKRGG-UHFFFAOYSA-N 495.555 4.241 70 20 JIID O=C(NCc1ccc(NC(=O)C(F)(F)F)cc1)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 216791713 SBQLSQKHGOPLSX-UHFFFAOYSA-N 473.451 4.046 70 20 JIID O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1ccc(S(=O)(=O)F)cc1 865204103 FLBCXGNMXUODML-UHFFFAOYSA-N 461.359 4.474 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(c2cc(Cl)ccc2C)CC1)c1ccc(Br)cc1 216766090 DOWYEXNGFVSNPE-HXUWFJFHSA-N 478.818 4.327 70 20 JIID Cc1cc(NC(=O)[C@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)n(-c2ccc(F)cc2)n1 217355123 NPDFGEAKAVWWHD-AWEZNQCLSA-N 471.583 4.495 70 20 JIID O=C(CCc1ncc(-c2ccccc2Br)o1)Nc1ccc(S(=O)(=O)F)cc1 865203831 AOEJVFVZWBLIPG-UHFFFAOYSA-N 453.289 4.334 70 20 JIID O=C(NCC(c1ccccc1)c1ccccc1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 216920534 XRILRVFTUVLKHH-UHFFFAOYSA-N 481.593 4.064 70 20 JIID CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)CC(C)(C)O2 1123827964 CQXHUBCDLJMJAG-MRXNPFEDSA-N 467.519 4.052 70 20 JIID Cc1ccc(CN(Cc2ccco2)C(=O)c2cc(S(=O)(=O)F)c[nH]2)c(Br)c1 1349547219 UFJAYUGPYRMKKL-UHFFFAOYSA-N 455.305 4.179 70 20 JIID C[C@@H]1C[C@@H](C)CN(c2nnc(S[C@H](C)c3nc4ccccc4c(=O)[nH]3)n2Cc2ccco2)C1 217749882 XTTTXKKWOUPMFM-BRWVUGGUSA-N 464.595 4.492 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)CCOc1ccc(Br)cc1)c1ccc(Br)cc1 216768399 ZSFKDCLREMDUBA-LJQANCHMSA-N 498.215 4.316 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1ccccc1C(=O)NC1CCCC1 217591067 HABVDVZBWZOJMS-UHFFFAOYSA-N 464.591 4.038 70 20 JIID Cc1nn(-c2ccccc2)c(C)c1CC(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 217149252 DHHDDMWAGHHIHP-UHFFFAOYSA-N 481.603 4.165 70 20 JIID Cn1c(COc2ccc(Cl)cc2)nnc1SCc1ccc(S(=O)(=O)C(F)F)cc1 216868526 QLJHFMMKPIKACA-UHFFFAOYSA-N 459.927 4.336 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc(CN2CCOCC2)nc2ccccc12 217592874 KXNZLRYADCBGPF-FQEVSTJZSA-N 468.648 4.152 70 20 JIID O=C(CNC(=O)c1ccc(Br)cc1)NCc1cn(-c2ccccc2)nc1-c1ccccc1 216800956 PLDWVSIWTKPHAD-UHFFFAOYSA-N 489.373 4.348 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1cnn(-c2ncccc2Cl)c1C(F)(F)C(F)(F)F 865204198 JLRDXFXEDNSZRU-UHFFFAOYSA-N 498.792 4.485 70 20 JIID O=C(CSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)F)cc1)Nc1ccc(F)cc1 865204054 CRDUKFUIRFRJCU-UHFFFAOYSA-N 462.499 4.467 70 20 JIID O=S(=O)(c1ccc(CN2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)cc1)C(F)F 217089718 QJJTVAGKBNIQDK-UHFFFAOYSA-N 469.863 4.072 70 20 JIID O=C(C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)N1CC=C(c2ccc(O)cc2)CC1 216850521 UEPHJBCOPWOJPX-UHFFFAOYSA-N 494.535 4.128 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc1 848946383 CGRJUSLHLQDXAI-UHFFFAOYSA-N 483.387 4.093 70 20 JIID COc1ccc(C(=O)C2CCN(C(=O)C[C@H](NC(C)=O)c3ccc(Br)cc3)CC2)cc1 218024484 LBAKWSRABVNVNX-QFIPXVFZSA-N 487.394 4.147 70 20 JIID COc1cc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 865205881 SVONKUCEIXQZKT-HUUCEWRRSA-N 478.542 4.017 70 20 JIID O=C1N[C@]2(CCCc3sccc32)C(=O)N1CC(=O)N1CCc2sccc2[C@H]1c1ccccc1 217817397 XMFGFAPHKMWEQV-RDGATRHJSA-N 477.611 4.067 70 20 JIID CCCCN1C(=O)CC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccc(OC)cc1 865204453 ULMPKPWSYCLXNZ-IFMALSPDSA-N 462.543 4.072 70 20 JIID O=C([C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 216898762 ZMKMIYVROWLWRH-HLAWJBBLSA-N 499.633 4.455 70 20 JIID CC(=O)N[C@H](CC(=O)NC[C@H](c1ccccc1Cl)N(C)C)c1ccc(Br)cc1 216772143 LHHDODOMLZCDQZ-WOJBJXKFSA-N 466.807 4.089 70 20 JIID CCOc1ccc(CN2CCN(C(=O)NCc3ccc(OCC(F)(F)F)cc3)CC2)cc1 218115309 QBNBPPCOVSUQFE-UHFFFAOYSA-N 451.489 4.054 70 20 JIID CSCC[C@@H](NC(=O)c1sc(COc2ccc(F)cc2)nc1C)c1nnc2ccccn12 218144136 OINIVBBGJIDFHY-QGZVFWFLSA-N 471.583 4.437 70 20 JIID CC(=O)N[C@H](CC(=O)NCCc1ccc(C(F)(F)F)cc1)c1ccc(Br)cc1 216770946 ZYWHOPKSQWQMLZ-GOSISDBHSA-N 457.290 4.394 70 20 JIID O=C(c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F)N1CCN(c2cccc(O)c2)CC1 217033578 UYWMKPVPUGQMHU-UHFFFAOYSA-N 450.848 4.213 70 20 JIID CCN1CCN(c2ccc(NC(=O)C[C@H](NC(C)=O)c3ccc(Br)cc3)c(C)c2)CC1 216773620 ORMHSQZPSDYJOY-QHCPKHFHSA-N 487.442 4.105 70 20 JIID Cc1c(NC(=O)CCOc2ccc(Cl)cc2Br)c(=O)n(-c2ccccc2)n1C 217675823 OBYJMBOOYJVGCC-UHFFFAOYSA-N 464.747 4.308 70 20 JIID O=C(Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1)c1cc(S(=O)(=O)F)c[nH]1 1518676881 DUXVPTXSUJHXQO-UHFFFAOYSA-N 492.337 4.033 70 20 JIID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@H](C)C(=O)NCCc3ccccc3C)cc2)cc1 218727159 RKTDVDAURONRRT-HXUWFJFHSA-N 451.592 4.264 70 20 JIID COC1CCN(c2ccc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cc2C(F)(F)F)CC1 865207074 IICLCJVUDAZFPH-UHFFFAOYSA-N 460.449 4.231 70 20 JIID C[C@@H](NC(=O)Cn1cnc2sc3c(c2c1=O)CCCCC3)c1ccc(Br)cc1 216786937 HRACWQXBFIDEJT-CYBMUJFWSA-N 460.397 4.367 70 20 JIID O=C(Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1)c1ccc(Cl)cc1 848944412 IDIBZTLMASFZGA-UHFFFAOYSA-N 468.915 4.051 70 20 JIID COc1cc(C)c(CN(C)C(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 216763535 PYELAOOHXKNVJV-IBGZPJMESA-N 463.372 4.001 70 20 JIID CC(C)c1c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cnn1-c1ccccc1Cl 848944866 ALMBMQUHBJPJSO-UHFFFAOYSA-N 457.936 4.108 70 20 JIID O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc(S(=O)(=O)F)c[nH]1 1336414433 XJUFTYFKJRDECX-UHFFFAOYSA-N 467.356 4.376 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2Cl)C1=O 217138793 UUKFJEBGFIOXEM-KKSFZXQISA-N 466.390 4.358 70 20 JIID CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1354469427 LCRDPZAAJBXJKA-UHFFFAOYSA-N 451.398 4.291 70 20 JIID Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)N3CC=C(c4ccc(O)cc4)CC3)CC2)c1C 216849496 RTFPASLXXBLCCQ-UHFFFAOYSA-N 482.646 4.342 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)c2ccccc2SCc2cc(C)no2)CC1 218373046 WQSZKCGDWFNZNM-UHFFFAOYSA-N 455.555 4.381 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2Br)n1N 217149180 UPZDZMFOBQWWGH-OAHLLOKOSA-N 478.441 4.111 70 20 JIID CC(C)(C)OC(=O)N1CC(C)(C)N(S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c2ccccc21 848948971 NRYGQGCJKPXDJH-UHFFFAOYSA-N 484.571 4.074 70 20 JIID CCCn1c(=O)c2ccccc2n2c(SCC(=O)N3CCc4sccc4[C@H]3CC)nnc12 217150042 REUFMAJSNMLLSF-QGZVFWFLSA-N 467.620 4.144 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C)c1ccc(Br)cc1 216773693 ZNJBJZXXSFQTLT-FQEVSTJZSA-N 474.399 4.039 70 20 JIID O=C(N[C@@H](Cc1ccccc1)c1nc2ccccc2n1CCS(=O)(=O)F)c1ccccc1 883954554 RAOBJGCBNFVLTC-NRFANRHFSA-N 451.523 4.049 70 20 JIID C[C@H](NC(=O)Cn1cnc2sc3c(c2c1=O)CCCCC3)c1ccc(Br)cc1 216786980 HRACWQXBFIDEJT-ZDUSSCGKSA-N 460.397 4.367 70 20 JIID Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)Nc4ccc(S(=O)(=O)F)cc4)cc3C2=O)c1 865204592 ZURMITCQSPNDIJ-UHFFFAOYSA-N 452.463 4.015 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCC(C)CC2)n1C[C@@H]1CCCO1 218014477 PQRZJNSHGPNINJ-AZUAARDMSA-N 489.711 4.383 70 20 JIID Cc1cc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2C)n(-c2ccc(F)cc2)n1 217342929 QEYWRNGLPOEALL-UHFFFAOYSA-N 456.543 4.055 70 20 JIID C[C@H]1CN(C(=O)c2cccc(S(=O)(=O)F)c2)c2ccccc2N(Cc2ccccc2)C1=O 1336953369 FDQXZTNDACACBY-KRWDZBQOSA-N 452.507 4.175 70 20 JIID COc1ccccc1-c1csc(C2CCN(C(=O)c3cccc(S(=O)(=O)F)c3)CC2)n1 1121184759 HAGIHGDNYBNKAQ-UHFFFAOYSA-N 460.552 4.497 70 20 JIID COc1ccc([C@@H](CNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)N2CCOCC2)cc1OC 216846675 DBRXGEVDGFJMAU-IATGOMSSSA-N 456.627 4.190 70 20 JIID CCOc1cc2c(cc1NC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1)O[C@@H](C)C2 216889829 DUFKIWLEJPBVRN-SCLBCKFNSA-N 461.356 4.377 70 20 JIID COc1ccc([C@H]2CCCN2C(=O)Cn2cnc3sc4c(c3c2=O)CCCCC4)cc1OC 218613014 HPDRQKOVEKPPPO-GOSISDBHSA-N 467.591 4.108 70 20 JIID CS(=O)(=O)c1ccc(Sc2ccccc2C(=O)Nc2ccc(S(=O)(=O)F)cc2)cc1 865205625 ZLOBALRKEGSLPO-UHFFFAOYSA-N 465.549 4.152 70 20 JIID CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(CN2CCOCC2)cc1 216689782 HZGDYWMOKDTEBZ-DEOSSOPVSA-N 451.611 4.209 70 20 JIID Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1336954502 RBAIXNNAVHXVKX-SECBINFHSA-N 472.361 4.358 70 20 JIID O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CC=C(c2ccc(O)cc2)CC1 216847772 NJICJIPPRFICIN-UHFFFAOYSA-N 460.983 4.150 70 20 JIID CCCn1c(=O)c2ccccc2n2c(SCC(=O)N3CCc4sccc4[C@@H]3CC)nnc12 217150031 REUFMAJSNMLLSF-KRWDZBQOSA-N 467.620 4.144 70 20 JIID Cc1cc(NC(=O)c2ccc3c(c2)C(=O)N(Cc2ccccc2)C3=O)n(-c2ccc(F)cc2)n1 217353315 OSSUGKQANRCPCO-UHFFFAOYSA-N 454.461 4.368 70 20 JIID Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)N[C@@H](C)c2ccc(Br)cc2)CC1 217447193 DWWJZJQEGWJJST-SFHVURJKSA-N 473.415 4.093 70 20 JIID O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc(S(=O)(=O)F)cc1 865203835 ASHPZSPWKYESMA-PTNGSMBKSA-N 470.594 4.026 70 20 JIID CC(=O)NCc1ccc(C(=O)CSc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)s1 216656237 SIQIVSWSBKPIPZ-UHFFFAOYSA-N 467.547 4.197 70 20 JIID O=C(COc1ccc(I)cc1)OCc1nc2ccccc2n1C(F)F 217913207 CCAHOYRJMPHURJ-UHFFFAOYSA-N 458.202 4.158 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(Br)cc1 216798056 FSKRXCNLFAXREZ-OAQYLSRUSA-N 478.818 4.014 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 216788503 OYNFPQDQTBGJPY-LJQANCHMSA-N 479.602 4.252 70 20 JIID CC(C)CNS(=O)(=O)c1cc(C(=O)NCc2ccc(Cn3cccn3)cc2)c(Cl)cc1Cl 216889481 GJWPHSWLSYKDGC-UHFFFAOYSA-N 495.432 4.103 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)N3CCCc4cc(S(=O)(=O)N5CCCC5)ccc43)c12 217978155 HIUGQWPRMNQXMW-UHFFFAOYSA-N 468.579 4.032 70 20 JIID COc1ccc(C(=O)C2CCN(C(=O)C[C@@H](NC(C)=O)c3ccc(Br)cc3)CC2)cc1 218024402 LBAKWSRABVNVNX-JOCHJYFZSA-N 487.394 4.147 70 20 JIID COc1ccccc1CN(C)C(=O)c1cc(Br)ccc1I 217506545 XKKQZFHKSGLJLF-UHFFFAOYSA-N 460.109 4.335 70 20 JIID COc1ccccc1-c1cc(NC(=O)c2ccc(S(=O)(=O)F)cc2)n(-c2ccccc2)n1 865208017 ZXALSUOOEFWLPQ-UHFFFAOYSA-N 451.479 4.458 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)Cc1ccc(Br)s1)c1ccc(Br)cc1 216801105 LQJRJASXGJIFLK-OAHLLOKOSA-N 474.218 4.499 70 20 JIID Nn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nnc1-c1ccc(Cl)cc1Cl 216859765 OGZRVVSIYLRXRU-UHFFFAOYSA-N 465.334 4.254 70 20 JIID COc1ccc2c(c1)c(CC(=O)OCc1noc(C)n1)c(C)n2C(=O)c1ccc(Cl)cc1 216786472 FUGXPAJMQFZJRJ-UHFFFAOYSA-N 453.882 4.278 70 20 JIID Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)c2)cc1 216848645 USYSVHDQPHDUPC-UHFFFAOYSA-N 462.571 4.455 70 20 JIID O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N1CC=C(c2ccc(O)cc2)CC1 216884372 DEYHXZKZMXQARV-UHFFFAOYSA-N 488.915 4.049 70 20 JIID Cc1cc(COc2ccc(C(=O)Nc3ccc(S(=O)(=O)F)cc3)cc2Br)no1 865204215 JXADPYUDPOKTNA-UHFFFAOYSA-N 469.288 4.235 70 20 JIID CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)c1cccc(S(=O)(=O)F)c1)c1ccccc1 1517974993 KGRRSOBQDBOVRA-LJQANCHMSA-N 450.532 4.121 70 20 JIID C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc(CN2CCC[C@@H](C(N)=O)C2)cc1 216804772 IYUMRKUWRNZWSF-GDBMZVCRSA-N 450.366 4.097 70 20 JIID COc1ccccc1C(=O)NCC(=O)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 218502807 XMMQSINHYHYAGL-UHFFFAOYSA-N 450.347 4.418 70 20 JIID CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)ccc1Cl 217339201 HPDWVIYUTWTMHT-UHFFFAOYSA-N 464.950 4.256 70 20 JIID COc1ccccc1-c1cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n(-c2ccc(C)cc2)n1 1515249548 BNQXKEKLBKKBEL-UHFFFAOYSA-N 454.483 4.095 70 20 JIID Cc1ccc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1S(=O)(=O)NCc1ccccc1 216852679 CJHPFSWDAWZKOP-UHFFFAOYSA-N 462.571 4.109 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(CN3CCCC3)n2-c2ccccc2)cc1)C(F)F 217509785 RTABDTGXUOBIHV-UHFFFAOYSA-N 464.563 4.152 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 865204050 CQQTUVZWZHLOLY-CYBMUJFWSA-N 459.326 4.143 70 20 JIID Cc1ccc2nc(COc3cccc(C(=O)Nc4ccc(CN5CCOCC5)cc4)c3)cn2c1 218064386 YGKZHOCVISXGDT-UHFFFAOYSA-N 456.546 4.306 70 20 JIID CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)cc1 865208553 NPEWDSUGTRMAEP-UHFFFAOYSA-N 463.508 4.183 70 20 JIID COC(=O)CCc1c(C)nn(-c2ccc(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)cc2)c1C 217364559 YFELGPMCZRLVNL-UHFFFAOYSA-N 475.524 4.480 70 20 JIID CC(=O)N[C@@H](CC(=O)NCCc1ccc(C(F)(F)F)cc1)c1ccc(Br)cc1 216770894 ZYWHOPKSQWQMLZ-SFHVURJKSA-N 457.290 4.394 70 20 JIID O=C(C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1)N1CC=C(c2ccc(O)cc2)CC1 216851529 JXVWOZXQHJMFHR-UHFFFAOYSA-N 495.428 4.416 70 20 JIID O=C(c1sccc1S(=O)(=O)N1CCc2ccccc2C1)N1CC=C(c2ccc(O)cc2)CC1 218426436 NSLXOCWWODBHMO-UHFFFAOYSA-N 480.611 4.130 70 20 JIID O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N1CC=C(c2ccc(O)cc2)CC1 216882300 PFOQTGHXDMXPPD-UHFFFAOYSA-N 470.497 4.401 70 20 JIID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 218387957 WUEMXTLAHSCLHC-QHCPKHFHSA-N 457.555 4.367 70 20 JIID Cc1cc(NC(=O)[C@@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)n(-c2ccc(F)cc2)n1 217355048 NPDFGEAKAVWWHD-CQSZACIVSA-N 471.583 4.495 70 20 JIID Cc1cc(Br)ccc1NC(=O)CNc1cc(C(=O)NC2CC2)c2ccccc2n1 216801126 TXCWKSAZZDOFCG-UHFFFAOYSA-N 453.340 4.249 70 20 JIID O=C(Cc1csc(-c2cccc(Br)c2)n1)Nc1ccc(S(=O)(=O)F)cc1 865203821 ADZMNYZGPNMMBA-UHFFFAOYSA-N 455.330 4.412 70 20 JIID O=C(c1cccc(S(=O)(=O)F)c1)N1CCC(c2nc(-c3ccccc3Br)no2)CC1 1121184780 HQUZDZUGDPNBHT-UHFFFAOYSA-N 494.342 4.177 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 865204483 VLMQJKORQXWRMC-UHFFFAOYSA-N 475.420 4.127 70 20 JIID CC(=O)N1CCN(C(=O)[C@H](C)Sc2nnc(-c3cccc(C)c3)n2-c2ccc(Cl)cc2)CC1 218668520 AJFLGYTVZMDQLT-KRWDZBQOSA-N 484.025 4.067 70 20 JIID COc1ccc(-n2cnnc2SCC(=O)N[C@@H](CC(C)C)c2nc3ccccc3[nH]2)cc1 218234566 FPSLWYBBEVGVMY-FQEVSTJZSA-N 450.568 4.148 70 20 JIID CCn1c(SCC(=O)Nc2ccc(S(=O)(=O)F)cc2)nnc1-c1ccc(Cl)cc1 865204128 GKMAJUXZQFKXJJ-UHFFFAOYSA-N 454.936 4.007 70 20 JIID Cc1c(C(=O)NC[C@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)nnn1-c1ccccc1Cl 216834268 MSLLFVXHPBIECH-VBKZILBWSA-N 492.382 4.213 70 20 JIID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N[C@H]1CCS(=O)(=O)C1 217646547 ABBNQXYZOVTFKG-WMLDXEAASA-N 466.390 4.093 70 20 JIID O=C(CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)N1CC=C(c2ccc(O)cc2)CC1 216852095 HZZVTUUWNDCRIS-UHFFFAOYSA-N 467.616 4.118 70 20 JIID Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)Nc1ccc(S(=O)(=O)F)cc1 865205317 WVZHHUYHKHJYKZ-UHFFFAOYSA-N 466.332 4.221 70 20 JIID Cc1noc(CCC(=O)N(C[C@H]2CCCO2)c2nc(-c3ccc(Br)cc3)cs2)n1 218323388 UXFGDXDFKFOUNE-MRXNPFEDSA-N 477.384 4.409 70 20 JIID C[C@@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)NCc1ccccc1F 218648759 COCOVMNKJHUCKB-OAHLLOKOSA-N 451.498 4.461 70 20 JIID COc1cccc(CN(C)C(=O)c2ccc(S(=O)(=O)F)cc2)c1OCc1ccccc1F 865210388 CXMQWDOMWYZCRY-UHFFFAOYSA-N 461.486 4.344 70 20 JIID CCOc1ccc([C@H](NC(=O)CNC(=O)c2ccc(Br)cc2)C(C)C)cc1OCC 216792765 ZVSARRIPHSPHSI-JOCHJYFZSA-N 477.399 4.490 70 20 JIID O=C(CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)Nc1ccc(Br)cn1 217153787 ZMKQCFSZOGXCLA-UHFFFAOYSA-N 485.338 4.413 70 20 JIID CC(=O)N[C@H](CC(=O)Nc1ccc(I)cc1)c1ccc(Br)cc1 216758495 ILOIONMZFRTVAS-MRXNPFEDSA-N 487.135 4.260 70 20 JIID CC(C)[C@H](C(=O)Nc1cccc(C(=O)Nc2ccc(Br)cn2)c1)N1C[C@H](C)O[C@H](C)C1 216628166 CBAWZQYRJAEDTQ-VWKPWSFCSA-N 489.414 4.169 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(Br)cc1 216761739 WMTAZRCIXFYHRD-FQEVSTJZSA-N 498.343 4.384 70 20 JIID CC1CCN(c2nnc(SCc3cc(=O)oc4cc(O)ccc34)n2Cc2ccco2)CC1 217857121 JMCSQNCYUKWLAP-UHFFFAOYSA-N 452.536 4.260 70 20 JIID Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)Nc4cc(C)nn4-c4ccccn4)cc3C2=O)c1 216740968 WBYLAXDOQASSRL-UHFFFAOYSA-N 451.486 4.245 70 20 JIID CC(C)c1c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cnn1-c1ccc(Cl)cc1 848945535 QMSYSLUCXWBGOO-UHFFFAOYSA-N 457.936 4.108 70 20 JIID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 216834385 NLVCIPVPEZHDDI-MASDEKCNSA-N 486.612 4.259 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)N3CCN(S(=O)(=O)c4cc(Cl)ccc4Cl)CC3)c12 217651949 LYVSEUKWMYLCEY-UHFFFAOYSA-N 497.404 4.108 70 20 JIID Cc1nn(-c2ccc(Br)cc2)c(NC(=O)c2ccc(S(=O)(=O)F)cc2)c1C 865207510 KQCFYESPHVUYAF-UHFFFAOYSA-N 452.305 4.162 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 865204863 NAQYXLCCTIHRCB-UHFFFAOYSA-N 477.477 4.045 70 20 JIID COc1cc(NC(=O)c2cccc(S(=O)(=O)F)c2)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 1347810103 SGNHZICIZOYZFN-HUUCEWRRSA-N 478.542 4.017 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)CCOc1ccc(Cl)cc1)c1ccc(Br)cc1 216768976 DFRAVASKJVDXMW-LJQANCHMSA-N 453.764 4.207 70 20 JIID O=C1N[C@@]2(CCCc3sccc32)C(=O)N1CC(=O)N1CCc2sccc2[C@H]1c1ccccc1 217817320 XMFGFAPHKMWEQV-RCZVLFRGSA-N 477.611 4.067 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N(CC(F)(F)F)C2CC2)cc1Br 159629175 ODYMLTNXTIOUPN-UHFFFAOYSA-N 451.102 4.235 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2cc(Cl)ccc2c(=O)n1CCOC 217144250 LTYZLOPYSQZIPV-SFHVURJKSA-N 478.039 4.386 70 20 JIID CC(=O)N[C@H](CC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccc(Br)cc1 216764314 VCBWVWNLQQOHEE-GOSISDBHSA-N 480.790 4.145 70 20 JIID Cc1noc(CCC(=O)N(C[C@@H]2CCCO2)c2nc(-c3ccc(Br)cc3)cs2)n1 218323314 UXFGDXDFKFOUNE-INIZCTEOSA-N 477.384 4.409 70 20 JIID COc1ccc([C@H](CNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)N2CCOCC2)cc1OC 216846704 DBRXGEVDGFJMAU-ZIPXTLALSA-N 456.627 4.190 70 20 JIID O=C(Cc1csc(COc2ccc(Cl)cc2)n1)Nc1ccc(CN2CCOCC2)cc1 216876983 KSTBIRUDSQONNC-UHFFFAOYSA-N 457.983 4.389 70 20 JIID CC(=O)N[C@@H](CC(=O)Nc1ccc(I)cc1)c1ccc(Br)cc1 216758453 ILOIONMZFRTVAS-INIZCTEOSA-N 487.135 4.260 70 20 JIID Cc1cc(-c2cc(C(=O)N(C)Cc3nc4ccsc4c(=O)[nH]3)c3c(C)noc3n2)c(C)s1 217986821 JOJXOBIVBBSQJH-UHFFFAOYSA-N 465.560 4.447 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCC(C)CC2)n1C[C@@H]1CCCO1 218014557 PQRZJNSHGPNINJ-ICSRJNTNSA-N 489.711 4.383 70 20 JIID O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1338390299 PGPZOJOZRDFZGL-KRWDZBQOSA-N 459.326 4.285 70 20 JIID CC(=O)N[C@H](CC(=O)NCc1ccc(OC(F)(F)F)cc1)c1ccc(Br)cc1 217586051 MWSGNNRWPQPVFD-QGZVFWFLSA-N 459.262 4.231 70 20 JIID COc1ccc2cc(CNC(=O)C[C@H](NC(C)=O)c3ccc(Br)cc3)ccc2c1 218012670 YMHXHHMDNBJRQJ-QFIPXVFZSA-N 455.352 4.495 70 20 JIID O=C(c1cccc(S(=O)(=O)Nc2ccccc2F)c1)N1CC=C(c2ccc(O)cc2)CC1 216882234 VQYZGEVKOXAQQV-UHFFFAOYSA-N 452.507 4.262 70 20 JIID CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC(=O)c2cc(C(C)C)nc3onc(C)c23)cc1 217647073 SNODMGDNZFHPED-HNNXBMFYSA-N 458.584 4.176 70 20 JIID C[C@H]1CN(Cc2csc(NC(=O)C3(c4cccc(Cl)c4)CCOCC3)n2)C[C@@H](C)O1 217211081 LSJZRUPZCWFWQN-IYBDPMFKSA-N 450.004 4.093 70 20 JIID COc1cccc(/C=C(/C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)n2nnnc2C)c1 218116853 BUFYWHYYIWHKQL-HAHDFKILSA-N 451.490 4.170 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 217520362 BMXPISPSGMZEOP-WOJBJXKFSA-N 475.511 4.121 70 20 JIID Cc1cc(C(=O)N2CCN(Cc3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)c(C)n1C1CC1 218600654 PNYGKPFDFVOCFK-UHFFFAOYSA-N 473.499 4.467 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(Br)cc1 216761782 WMTAZRCIXFYHRD-HXUWFJFHSA-N 498.343 4.384 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCC(C)CC2)n1C[C@H]1CCCO1 218014726 PQRZJNSHGPNINJ-QUCCMNQESA-N 489.711 4.383 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N(C)CCc2cccs2)cc1Br 159679474 OLWJGGROGLPZTE-UHFFFAOYSA-N 453.221 4.445 70 20 JIID CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)c2cc(C(C)C)nc3onc(C)c23)cc1 217646989 SNODMGDNZFHPED-OAHLLOKOSA-N 458.584 4.176 70 20 JIID CC(C)[C@H](NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1nc(C2CC2)no1 216726672 FZQOMOUOGMFVNH-HOIFWPIMSA-N 454.571 4.242 70 20 JIID O=S(=O)(c1ccc(CN2CCN(Cc3csc(-c4ccccc4)n3)CC2)cc1)C(F)F 218017519 BVCVBZICQGBPNN-UHFFFAOYSA-N 463.575 4.124 70 20 JIID COc1ccc([C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)c2ccc(C(F)(F)F)cc2)cc1 1262733152 IGYFDXSSHVPZIV-GOSISDBHSA-N 456.417 4.220 70 20 JIID Cc1ncc(CN(C)S(=O)(=O)c2cc(Br)c(C)cc2Br)s1 159605378 ULLYABCTHBJRSS-UHFFFAOYSA-N 454.209 4.106 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)c(Br)s2)cc1 848947056 PXXJANQDMDVCNM-UHFFFAOYSA-N 477.358 4.032 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 217520440 BMXPISPSGMZEOP-UXHICEINSA-N 475.511 4.121 70 20 JIID Cc1ccnc(-n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nc3ccccc3c2=O)c1 216870238 ZWEGXSQQKNYOCW-UHFFFAOYSA-N 473.526 4.378 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl 865204149 HFDWNDUCFDIVPK-UHFFFAOYSA-N 465.240 4.119 70 20 JIID Cc1cc(NC(=O)c2nn(-c3cccc(C(F)(F)F)c3)c(C)cc2=O)n(-c2ccc(F)cc2)n1 217366127 LMYXWQGWUPCJAX-UHFFFAOYSA-N 471.414 4.445 70 20 JIID O=C(N[C@@H](Cc1ccccn1)c1ccc(Br)cc1)c1ccc(S(=O)(=O)F)cc1 865209933 LRGZMZIGUFSEQH-IBGZPJMESA-N 463.328 4.216 70 20 JIID COc1ccc([C@@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)c2ccc(C(F)(F)F)cc2)cc1 1262733153 IGYFDXSSHVPZIV-SFHVURJKSA-N 456.417 4.220 70 20 JIID COCc1nc(OC)c2c(C)c(C(=O)Nc3ccc4c(c3)nc3n4CCCCC3)sc2n1 216825742 VJSQHJLHRYQZIG-UHFFFAOYSA-N 451.552 4.483 70 20 JIID Cc1cc(NC(=O)c2cccc(CN3C(=O)CNC3=O)c2)n(-c2cc(C(F)(F)F)ccc2Cl)n1 218459922 OTIFCDZKRWJHQJ-UHFFFAOYSA-N 491.857 4.157 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 865204435 SPHUQMJQQWANEF-UPVQGACJSA-N 466.534 4.463 70 20 JIID Cc1sc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)nc1-c1ccc(OC(F)F)cc1 848946696 VFVMCOXQYFGRFZ-UHFFFAOYSA-N 478.495 4.179 70 20 JIID COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cccc(S(=O)(=O)F)c1)CC2 1337727393 ZUFLICPKIVDBJM-NRFANRHFSA-N 461.536 4.211 70 20 JIID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 216832632 FZDQVUIKDKXUGZ-DNQXCXABSA-N 476.960 4.328 70 20 JIID Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848945534 QKORLTVCSSHDPO-UHFFFAOYSA-N 482.942 4.360 70 20 JIID CCN(CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(S(=O)(=O)C(F)F)cc1 216907654 NYKXKVUOYGMKMQ-UHFFFAOYSA-N 451.322 4.450 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C[C@H]1CCCO1 217156649 VUBRZCOYSLLJPL-OXQOHEQNSA-N 469.632 4.265 70 20 JIID Cc1cc(NC(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)n(-c2ccc(F)cc2)n1 217351815 WHYLTFFGNFGLCJ-UHFFFAOYSA-N 454.461 4.368 70 20 JIID CCN(CC)CCC[C@@H](C)NC(=O)c1cc(Br)ccc1I 218174815 TUXWSDLFCDAZJP-GFCCVEGCSA-N 467.189 4.294 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 217520154 AEFFSCZEFCAXTQ-LEWJYISDSA-N 475.511 4.121 70 20 JIID O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865207239 KSDSPCZYPDUQOQ-QGZVFWFLSA-N 459.326 4.285 70 20 JIID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC([C@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 1338388816 CQFOOSNXFBFCBS-OAQYLSRUSA-N 476.574 4.002 70 20 JIID CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)N1CC=C(c2ccc(O)cc2)CC1 216850087 DUBMQRDHPNLXME-OAQYLSRUSA-N 489.435 4.322 70 20 JIID CCc1c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)noc1-c1ccc(Cl)s1 848947365 KOCAEVROIJELSS-UHFFFAOYSA-N 450.922 4.078 70 20 JIID CN([C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)S(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848948135 DFHFLXDPIOLMDG-CQSZACIVSA-N 479.395 4.288 70 20 JIID Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)N[C@@H](CC(C)C)c1nc2ccccc2[nH]1 217032381 QMPSBDCXKPXOPO-QHCPKHFHSA-N 480.590 4.460 70 20 JIID O=C(NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1)c1ccc(S(=O)(=O)F)cc1 865208415 JAOHXBKPJAMWHX-UHFFFAOYSA-N 469.534 4.360 70 20 JIID Cc1ccc(Cn2nccc2NC(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)cc1 217612255 KUTCWVCEVALHEZ-UHFFFAOYSA-N 492.626 4.301 70 20 JIID CC(C)C[C@H](NC(=O)CCn1cnc2ccc(Br)cc2c1=O)c1nc2ccccc2[nH]1 218130120 WSPJNUBLWDSNMJ-FQEVSTJZSA-N 482.382 4.329 70 20 JIID Cc1cc(NC(=O)c2nn(-c3ccccc3C(F)(F)F)c(C)cc2=O)n(-c2ccc(F)cc2)n1 217366450 XEIPWXNNTDXOSI-UHFFFAOYSA-N 471.414 4.445 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1ccccc1C 217159612 VTBYWNKQSYYYST-IBGZPJMESA-N 483.663 4.102 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1ccnn1Cc1ccccc1Cl 217137003 XAUOBHGIOTUVDM-UHFFFAOYSA-N 467.982 4.264 70 20 JIID O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc(S(=O)(=O)F)cc1 865204416 RXUOBGFYPKYGKL-HXUWFJFHSA-N 460.914 4.498 70 20 JIID O=C1C[C@H](C(F)(F)F)N(C(=O)Cn2cnc3sc4c(c3c2=O)CCCCC4)c2ccccc2N1 217755546 ZRDJKMBOUCDXII-QGZVFWFLSA-N 490.507 4.033 70 20 JIID C[C@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)NCc1ccccc1F 218648847 COCOVMNKJHUCKB-HNNXBMFYSA-N 451.498 4.461 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(COc2ccc(C(C)C)cc2)n1N 217159447 XTVSDMYHHMEWSZ-LJQANCHMSA-N 471.652 4.384 70 20 JIID CCn1c(C)cc(C(=O)N2CCN(Cc3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)c1C 218025499 XSNZYISYEVKXAT-UHFFFAOYSA-N 461.488 4.152 70 20 JIID COc1ccc([C@H]2CCCN2C(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 218300038 RIWHXIBPVDPDOF-WOJBJXKFSA-N 475.383 4.397 70 20 JIID O=C(Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1ccc(S(=O)(=O)F)cc1 865207664 SOFQQOPHPWCSCZ-UHFFFAOYSA-N 452.507 4.119 70 20 JIID C[C@@H]1Cc2cc(-c3csc([C@H]4CN(Cc5ccccc5)CCO4)n3)ccc2N1S(C)(=O)=O 216648018 PRGQLVWLPFPCIH-UZUQRXQVSA-N 469.632 4.094 70 20 JIID CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)N(C)C1CCCCC1 217010126 SDUTZRPBKQICIA-INIZCTEOSA-N 453.457 4.185 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(Cc2cccc3ccccc23)n1N 217138276 XSPGCBUYXUBZMW-HXUWFJFHSA-N 463.632 4.426 70 20 JIID O=C1N[C@]2(CCCc3sccc32)C(=O)N1CC(=O)N1CCc2sccc2[C@@H]1c1ccccc1 217817243 XMFGFAPHKMWEQV-DHLKQENFSA-N 477.611 4.067 70 20 JIID COc1ccc(SCC(=O)N2CCN(Cc3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)cc1 217998862 NEBFSJPOIVWAMG-UHFFFAOYSA-N 492.523 4.201 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(S(=O)(=O)N4CCC[C@H](C)C4)cc3)c12 217955761 PZOXYOPYXVXQBS-HNNXBMFYSA-N 456.568 4.328 70 20 JIID C[C@@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)c1nc(-c2ccc(Br)cc2)cs1 1516702428 XFJPNCOYKQTOCB-SECBINFHSA-N 458.334 4.050 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnnn1-c1ccc(OC(F)(F)F)cc1 217145699 FLYJMERRKQJSBA-OAHLLOKOSA-N 469.514 4.251 70 20 JIID C[C@@H]1C[C@@H](C)CN(c2nnc(S[C@H](C)C(=O)N3CCc4ccccc43)n2Cc2ccco2)C1 217749061 UMZDBIXXVZDNQI-GUDVDZBRSA-N 465.623 4.472 70 20 JIID Cc1ccn2c(CN3CCN(C(=O)c4ccc(NC(=O)c5cccs5)cc4)CC3)c(C)nc2c1 216646958 UOXKQXKRWIEAPW-UHFFFAOYSA-N 473.602 4.223 70 20 JIID CC(C)(C)OC(=O)NCCC[C@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)c1ccccc1 865210329 AXOSKXKMEHQTPN-IBGZPJMESA-N 450.532 4.121 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 865204503 VZTYYGAGXDPPKI-UHFFFAOYSA-N 454.405 4.074 70 20 JIID CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cc(C)nn2-c2ccccn2)c1 216738940 IEBWHAIGCKWQJW-UHFFFAOYSA-N 461.547 4.043 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCOCC2)n1-c1ccccc1C 217159604 VTBYWNKQSYYYST-LJQANCHMSA-N 483.663 4.102 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)N3CCN(S(=O)(=O)c4ccc(Cl)c(Cl)c4)CC3)c12 217651841 HADOBVKMCLENLN-UHFFFAOYSA-N 497.404 4.108 70 20 JIID Cc1nnc(SCC(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)n1Cc1ccccc1 217608919 MXVYFRPXHCROLV-UHFFFAOYSA-N 463.588 4.424 70 20 JIID Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)N1CC=C(c2ccc(O)cc2)CC1 216884545 CGHVNDBZRKXZKT-UHFFFAOYSA-N 462.571 4.109 70 20 JIID Cc1csc([C@@H](C)NS(=O)(=O)c2cc(Br)c(C)cc2Br)n1 159664639 HYPXJDKFAFIPLL-SECBINFHSA-N 454.209 4.324 70 20 JIID Cc1c(NC(=O)c2cccc(S(=O)(=O)F)c2)cccc1C(=O)N1CCc2sccc2C1 1262673540 RJOGBNUWWAFFCH-UHFFFAOYSA-N 458.536 4.166 70 20 JIID COc1cc(NC(=O)c2cccc(S(=O)(=O)F)c2)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 1347810100 SGNHZICIZOYZFN-GASCZTMLSA-N 478.542 4.017 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O 217139089 RHYMMSWABJSFJX-NRFANRHFSA-N 459.571 4.080 70 20 JIID Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848944493 LPWYKJOCBHSYQS-UHFFFAOYSA-N 463.512 4.098 70 20 JIID COc1cc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 865205879 SVONKUCEIXQZKT-GASCZTMLSA-N 478.542 4.017 70 20 JIID O=C(Nc1cccc2c1CCCN2C(=O)c1cccc(S(=O)(=O)F)c1)c1ccc(F)cc1 1348707259 JPTALMBMCSSMIM-UHFFFAOYSA-N 456.470 4.329 70 20 JIID COc1cccc([C@@H](CNC(=O)N(C)Cc2ccc(Br)s2)N2CCCC2)c1 216920360 YGGLRHWPRNBLHL-GOSISDBHSA-N 452.418 4.498 70 20 JIID C[C@H]1C[C@@H](C)CN(c2nnc(S[C@H](C)c3nc4ccccc4c(=O)[nH]3)n2Cc2ccco2)C1 217749798 XTTTXKKWOUPMFM-IXDOHACOSA-N 464.595 4.492 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(-c3cccnc3)n2Cc2ccco2)cc1)C(F)F 216866471 LDBDVVIFWQABCF-UHFFFAOYSA-N 462.503 4.270 70 20 JIID Cn1c(COc2ccccc2Cl)nnc1SCc1ccc(S(=O)(=O)C(F)F)cc1 216868487 ZPRWGTPGGBEFMI-UHFFFAOYSA-N 459.927 4.336 70 20 JIID C[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)c2ccccc2N(Cc2ccccc2)C1=O 865208710 UEUVRWBUPRPORV-QGZVFWFLSA-N 452.507 4.175 70 20 JIID Cc1nc(-c2cccs2)ccc1C(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1 216874878 WAXAEQKSFYUVRQ-UHFFFAOYSA-N 453.545 4.442 70 20 JIID CCN(CC)CCC[C@H](C)NC(=O)c1cc(Br)ccc1I 218174870 TUXWSDLFCDAZJP-LBPRGKRZSA-N 467.189 4.294 70 20 JIID CC(C)NS(=O)(=O)c1cccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)c1 217028746 ROLXDPUIZZLJPT-UHFFFAOYSA-N 452.561 4.297 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCC(OCc2ccccc2)CC1)c1ccc(Br)cc1 217085799 HXXFPOKLXPLHPR-QFIPXVFZSA-N 459.384 4.224 70 20 JIID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnnn1-c1ccc(OC(F)(F)F)cc1 217145711 FLYJMERRKQJSBA-HNNXBMFYSA-N 469.514 4.251 70 20 JIID Cc1cc(NC(=O)c2sc3nc4n(c(=O)c3c2C)CCCCC4)n(-c2ccc(F)cc2)n1 217348577 YQAPCCXUOKFNOJ-UHFFFAOYSA-N 451.527 4.378 70 20 JIID COc1cccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc(S(=O)(=O)F)cc2)c1 865203878 AZYRAKYFOBZSHP-UHFFFAOYSA-N 474.535 4.337 70 20 JIID C[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)c2ccccc2N(Cc2ccccc2)C1=O 865208709 UEUVRWBUPRPORV-KRWDZBQOSA-N 452.507 4.175 70 20 JIID COc1cc(NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)c(OC)cc1Cl 216771487 SIYLURVDHVRZSK-HNNXBMFYSA-N 455.736 4.326 70 20 JIID COc1cc2nc(CN3CCOCC3)n(Cc3sc4ccccc4c3Cl)c(=O)c2cc1OC 216895273 ORTPXBPAHMIKFE-UHFFFAOYSA-N 485.993 4.162 70 20 JIID Cc1cc(NC(=O)CCSCc2nc3sc4c(c3c(=O)[nH]2)CCC4)n(-c2ccc(F)cc2)n1 218441884 QEFFRPBNLABFGQ-UHFFFAOYSA-N 483.594 4.369 70 20 JIID CN(C)[C@@H](CNC(=O)c1cc(Br)ccc1I)c1cccs1 217442564 XPGDVNKOZUMDMA-ZDUSSCGKSA-N 479.181 4.148 70 20 JIID COc1ccc([C@@H]2CCCN2C(=O)Cn2cnc3sc4c(c3c2=O)CCCCC4)cc1OC 218612952 HPDRQKOVEKPPPO-SFHVURJKSA-N 467.591 4.108 70 20 JIID Cc1ccc(-c2cc(C(=O)Nc3cc(C(N)=O)ccc3N3CCCC3)c3c(C)noc3n2)cc1 217978713 OJIXKFIVYKEKIP-UHFFFAOYSA-N 455.518 4.458 70 20 JIID Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)N3CC=C(c4ccc(O)cc4)CC3)CC2)c(C)c1 216851198 ZBSTVJMKUMJGBD-UHFFFAOYSA-N 468.619 4.034 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)Cc1ccc(Br)s1)c1ccc(Br)cc1 216801063 LQJRJASXGJIFLK-HNNXBMFYSA-N 474.218 4.499 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)cc1 848945089 GIUNDFQDGFJTKC-UHFFFAOYSA-N 466.459 4.288 70 20 JIID C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 216803036 PPNSFAGXGOGCGE-ZEQRLZLVSA-N 499.659 4.300 70 20 JIID COc1cc(OC)c(NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1Cl 216764193 ZXPTXVFRLKEDOR-HNNXBMFYSA-N 455.736 4.326 70 20 JIID O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865207420 NMFJPFMFGVONOW-KRWDZBQOSA-N 459.326 4.285 70 20 JIID O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc(S(=O)(=O)F)c[nH]1 1337666763 FUXHWPZQQDUBBL-QGZVFWFLSA-N 466.416 4.087 70 20 JIID COc1ccc(/C=C2/C[C@H](C)Cc3c2nc2ccccc2c3C(=O)NCCN2CCN(C)CC2)cc1 218010489 MEYZVNVGHRLNFU-HWNIBJRTSA-N 484.644 4.344 70 20 JIID CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)c2cccc(S(=O)(=O)F)c2)cc1 1338400745 PUAIBPDAXXCTHU-UHFFFAOYSA-N 463.508 4.183 70 20 JIID Cc1ccc(-c2csc3ncn(CCC(=O)Nc4ccc(S(=O)(=O)F)cc4)c(=O)c23)cc1 865204063 DBZPTCVQAZISQF-UHFFFAOYSA-N 471.535 4.120 70 20 JIID Cc1cc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)n(-c2ccc(F)cc2)n1 217342513 KLVVBMGOKRQBBM-UHFFFAOYSA-N 456.543 4.055 70 20 JIID C[C@H](Sc1nc(CN2CCOCC2)nc2ccccc12)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218777476 GTEGRGOBMLZAHW-NSHDSACASA-N 498.477 4.277 70 20 JIID Nn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nc2scc(-c3ccccc3)c2c1=O 216860001 JWUNJRPRNFYPNQ-UHFFFAOYSA-N 479.555 4.127 70 20 JIID Cc1ccc(-n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nnc2N2CCCC2)cc1 216872730 KNUBUBQIRSHCGA-UHFFFAOYSA-N 464.563 4.465 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(S(=O)(=O)N4CCC[C@@H](C)C4)cc3)c12 217955679 PZOXYOPYXVXQBS-OAHLLOKOSA-N 456.568 4.328 70 20 JIID O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)Nc1ccc2c(c1)nc1n2CCCCC1 218669455 GGCVQZNTANHBBW-UHFFFAOYSA-N 462.575 4.223 70 20 JIID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1sccc1S(=O)(=O)N1CCCC1 218259423 WQPHBRMBJHJGOU-UHFFFAOYSA-N 470.601 4.457 70 20 JIID O=C(NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1)c1cccc(S(=O)(=O)F)c1 1121032193 MLICSRYJNOATEX-UHFFFAOYSA-N 469.534 4.360 70 20 JIID CCCCn1c(=O)c2ccccc2n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nnc12 216863229 HTJDTPHDAZTRHP-UHFFFAOYSA-N 478.546 4.133 70 20 JIID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NCc1ccc(N2CCN(C)CC2)nc1 218261685 SVBYGNSTLLRWPI-UHFFFAOYSA-N 465.601 4.216 70 20 JIID Cc1cc(NC(=O)c2ccc(S(=O)(=O)Nc3ccccc3)cc2)n(-c2ccc(F)cc2)n1 218443970 PADNPTQQKIUHJL-UHFFFAOYSA-N 450.495 4.373 70 20 JIID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 216832594 FZDQVUIKDKXUGZ-RPWUZVMVSA-N 476.960 4.328 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2Cl)C1=O 217138783 UUKFJEBGFIOXEM-IERDGZPVSA-N 466.390 4.358 70 20 JIID CCOc1ccc([C@@H](NC(=O)CNC(=O)c2ccc(Br)o2)C(C)C)cc1OCC 216793004 OKOHLPFNXBDOQO-FQEVSTJZSA-N 467.360 4.083 70 20 JIID CC(C)(C)c1ccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2N)cc1 216862865 UAMVLQPWSZGKNW-UHFFFAOYSA-N 452.552 4.245 70 20 JIID COc1cccc(/C=C(/C(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)n2nnnc2C)c1 218136495 MKFDAGPADAKTNR-UUYOSTAYSA-N 458.547 4.239 70 20 JIID Cc1sc2nc(CS[C@H](C)C(=O)N3CC=C(c4ccc(O)cc4)CC3)[nH]c(=O)c2c1C 216851156 KPEANVMFZRXIKR-OAHLLOKOSA-N 455.605 4.245 70 20 JIID COc1cccc([C@@H](CNC(=O)NCc2c(C)nn(Cc3ccccc3)c2C)N2CCCC2)c1 217444399 LHUUUBMZDGQPCF-AREMUKBSSA-N 461.610 4.193 70 20 JIID CCN(CC)S(=O)(=O)c1cccc(-c2nnc(SCc3cccc4cccnc34)n2C)c1 217502178 OWXGIXXKRNEHEM-UHFFFAOYSA-N 467.620 4.353 70 20 JIID COc1ccccc1-c1csc(C2CCN(C(=O)c3ccc(S(=O)(=O)F)cc3)CC2)n1 865210299 ZUNJPFZAGVVHFG-UHFFFAOYSA-N 460.552 4.497 70 20 JIID CCCOc1c(Br)cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc1OC 216690276 VXJJCHXCQJRGRS-UHFFFAOYSA-N 463.372 4.331 70 20 JIID COc1cc(C)c(CN(C)C(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 216763490 PYELAOOHXKNVJV-LJQANCHMSA-N 463.372 4.001 70 20 JIID Cc1cc(NC(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)n(-c2ccc(F)cc2)n1 218442764 RCZHJQRTZBTILK-UHFFFAOYSA-N 475.505 4.133 70 20 JIID CCOC(=O)c1sc2nc(CN(C)C)nc(N3CC=C(c4ccc(O)cc4)CC3)c2c1C 217115086 PFFOXBQXQQROEP-UHFFFAOYSA-N 452.580 4.237 70 20 JIID Cc1cc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)n(-c2ccc(F)cc2)n1 217359993 JPCYLBZHKHEDRW-UHFFFAOYSA-N 496.608 4.238 70 20 JIID C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 216802999 PPNSFAGXGOGCGE-RPWUZVMVSA-N 499.659 4.300 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 865204436 SPHUQMJQQWANEF-VWNXMTODSA-N 466.534 4.463 70 20 JIID O=C(Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1)c1ccc(S(=O)(=O)F)cc1 865208182 DZHFDCBWWGZSQM-UHFFFAOYSA-N 452.916 4.242 70 20 JIID CC(C)(C)OC(=O)Nc1cccc(C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)c1 1123828173 DXMZEKRVYGBTFK-UHFFFAOYSA-N 451.520 4.040 70 20 JIID C[C@@H]1CN(Cc2csc(NC(=O)C3(c4ccccc4Cl)CCOCC3)n2)C[C@@H](C)O1 216977253 AXRPDSYLWFUPMT-HZPDHXFCSA-N 450.004 4.093 70 20 JIID C[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)c1cccc(NC(=O)Cc2ccccc2F)c1 865206089 WXCBKKVKWGZXKW-OAHLLOKOSA-N 458.486 4.156 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc(CN2CCOCC2)nc2ccccc12 217592775 KXNZLRYADCBGPF-HXUWFJFHSA-N 468.648 4.152 70 20 JIID CCc1ccc(-c2csc(NC(=O)c3cc(S(N)(=O)=O)ccc3Br)n2)cc1 218592230 YPXCVWWNKAYCGW-UHFFFAOYSA-N 466.382 4.035 70 20 JIID CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)N1CC=C(c2ccc(O)cc2)CC1 216850113 DUBMQRDHPNLXME-NRFANRHFSA-N 489.435 4.322 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1ccc2c(c1)OC1(CCCC1)O2 216786370 CAVYXTXGBQFZGO-UHFFFAOYSA-N 451.548 4.407 70 20 JIID Cc1cc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)n(-c2ccc(F)cc2)n1 217352359 PRMSOKZALPMPQU-UHFFFAOYSA-N 484.597 4.483 70 20 JIID CC(=O)N[C@H](CC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Br)cc1 218076086 OEVSRVGLEGSCMV-HXUWFJFHSA-N 484.350 4.178 70 20 JIID O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cccc(S(=O)(=O)F)c1 1340089168 YKUDKXFEHMSWIW-UHFFFAOYSA-N 458.898 4.340 70 20 JIID CCOc1ccc(CCNC(=O)Nc2ccccc2I)cc1OCC 217273023 LGVOMDKGEPNBLT-UHFFFAOYSA-N 454.308 4.453 70 20 JIID CCOc1ccc([C@@H](CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)c2c[nH]c3ccccc23)cc1OC 1350748283 ZSOKGZBKAUCEKV-GOSISDBHSA-N 485.537 4.123 70 20 JIID CC(=O)N[C@@H](CC(=O)NCCCSc1ccc(F)cc1)c1ccc(Br)cc1 216767310 SVYKJVJTJRRSDE-IBGZPJMESA-N 453.377 4.454 70 20 JIID CSCC[C@H](NC(=O)c1sc(COc2ccc(F)cc2)nc1C)c1nnc2ccccn12 218144206 OINIVBBGJIDFHY-KRWDZBQOSA-N 471.583 4.437 70 20 JIID O=C(Cn1c(COc2ccccc2)nc2ccccc21)Nc1ccc(CN2CCOCC2)cc1 217580500 UIOIDGYKQDHBOQ-UHFFFAOYSA-N 456.546 4.086 70 20 JIID CCc1ccccc1-n1cnnc1SCC(=O)OCc1nc(-c2cccc(Cl)c2)no1 217864760 VAFGHJBFYAEUJU-UHFFFAOYSA-N 455.927 4.369 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccc(Br)cc1 216759355 MCKNUWVSZBRXBF-FQEVSTJZSA-N 464.791 4.019 70 20 JIID CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)CC(C)(C)O2 1123827957 CQXHUBCDLJMJAG-INIZCTEOSA-N 467.519 4.052 70 20 JIID C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)ccc2Cl)C1 216849411 UGBIZZZYYYSDTI-KRWDZBQOSA-N 475.010 4.396 70 20 JIID CCOC(=O)c1c(NC(=O)C23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)sc(C(=O)NC)c1C 216858860 MUIVVUDZJABWEN-QQRKTFAASA-N 483.428 4.265 70 20 JIID CC[C@H](CNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1)c1ccccc1 216654518 KOSPOMCVSYNUMW-HXUWFJFHSA-N 457.640 4.241 70 20 JIID O=c1c2ccccc2nc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1Cc1ccco1 216863112 PPFCMKPVTCRPRE-UHFFFAOYSA-N 462.499 4.326 70 20 JIID CCCCN1C(=O)CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccccc1OC 865204246 LFKHGMTVVFSJNQ-UGKGYDQZSA-N 462.543 4.072 70 20 JIID Cc1ccn2c(CN3CCN(C(=O)c4cccc(NC(=O)c5cccs5)c4)CC3)c(C)nc2c1 216798486 PCVZUGGTFDKQGF-UHFFFAOYSA-N 473.602 4.223 70 20 JIID COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(S(=O)(=O)F)cc1)CC2 865206034 QNKVOPGHKHFJNE-OAQYLSRUSA-N 461.536 4.211 70 20 JIID COc1cc(NC(=O)c2cccc(S(=O)(=O)F)c2)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 1347810101 SGNHZICIZOYZFN-GJZGRUSLSA-N 478.542 4.017 70 20 JIID CC(=O)N[C@@H](CC(=O)NCc1ccc(OC(F)(F)F)cc1)c1ccc(Br)cc1 217585964 MWSGNNRWPQPVFD-KRWDZBQOSA-N 459.262 4.231 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)N1N=C(c2ccco2)C[C@H]1c1ccco1 216786811 GAMOCUKNKJCMRP-KRWDZBQOSA-N 462.531 4.291 70 20 JIID Cc1cc(NC(=O)c2ccc(S(=O)(=O)N3CCCC[C@H]3C)cc2)n(-c2ccc(F)cc2)n1 217358722 SWUFHNWCHVSSFM-QGZVFWFLSA-N 456.543 4.135 70 20 JIID CCCCN1C(=O)CC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccccc1OC 865204243 LFKHGMTVVFSJNQ-DENIHFKCSA-N 462.543 4.072 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O 217138801 UUKFJEBGFIOXEM-IIBYNOLFSA-N 466.390 4.358 70 20 JIID C[C@H](NC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1)c1cc(F)c(Cl)cc1Cl 217453391 DNZIHUAXXZRNAT-NSHDSACASA-N 480.414 4.408 70 20 JIID CC(=O)N[C@@H](CC(=O)Nc1cccc(Cl)c1N1CCOCC1)c1ccc(Br)cc1 218024197 FPLYPHBZIZPQHI-IBGZPJMESA-N 480.790 4.145 70 20 JIID CN([C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)S(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848948134 DFHFLXDPIOLMDG-AWEZNQCLSA-N 479.395 4.288 70 20 JIID O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)N1CC=C(c2ccc(O)cc2)CC1 216850721 CGCFYOHJEZNSPN-UHFFFAOYSA-N 467.616 4.118 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 217520070 AEFFSCZEFCAXTQ-RTWAWAEBSA-N 475.511 4.121 70 20 JIID COc1cccc(CNC(=O)[C@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c1 218646022 XOCTULPKABMSRA-INIZCTEOSA-N 463.534 4.330 70 20 JIID COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(S(=O)(=O)F)cc1)CC2 865206032 QNKVOPGHKHFJNE-NRFANRHFSA-N 461.536 4.211 70 20 JIID O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc(S(=O)(=O)F)c[nH]1 1337666762 FUXHWPZQQDUBBL-KRWDZBQOSA-N 466.416 4.087 70 20 JIID C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)ccc2Cl)C1 216849380 UGBIZZZYYYSDTI-QGZVFWFLSA-N 475.010 4.396 70 20 JIID O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 217520242 AEFFSCZEFCAXTQ-SFTDATJTSA-N 475.511 4.121 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2nc(-c3cc(Br)cs3)cs2)cc1 848947181 YOOXRCULEQHJON-UHFFFAOYSA-N 483.387 4.093 70 20 JIID CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)N3CC=C(c4ccc(O)cc4)CC3)CC2)cc1 216850564 QNQKWOLVQZRLDG-UHFFFAOYSA-N 468.619 4.232 70 20 JIID COc1ccccc1-c1csc([C@H]2CCCN(C(=O)c3cccc(S(=O)(=O)F)c3)C2)n1 1337361714 VITBGKKXZJFZAN-INIZCTEOSA-N 460.552 4.497 70 20 JIID COc1cccc(/C=C(/C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)n2nnnc2C)c1 218132006 XHZRTXVXCOZLBA-YMCFUUGVSA-N 478.556 4.418 70 20 JIID COC(=O)CCc1c(C)nn(-c2ccc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)cc2)c1C 216853006 ONIJUWDOCZLEOM-UHFFFAOYSA-N 459.546 4.230 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N(C)Cc2scnc2C)cc1Br 159656783 NRUFJODBETYEOH-UHFFFAOYSA-N 454.209 4.106 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)Cc1ccccc1Br)c1ccc(Br)cc1 216765674 PHZPWDSTYJFAQU-SFHVURJKSA-N 468.189 4.438 70 20 JIID COc1cccc(/C=C(/C(=O)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)n2nnnc2C)c1 218135242 WYRMGKIKMADHGZ-VDZJHUJMSA-N 450.301 4.312 70 20 JIID Cc1ccc(-c2csc3ncn(CCC(=O)Nc4c(C(N)=O)oc5ccccc45)c(=O)c23)cc1 216837947 CNOPHCYQMXLKRV-UHFFFAOYSA-N 472.526 4.307 70 20 JIID CC(=O)N[C@@H](CC(=O)N1CCN(c2cc(Cl)ccc2C)CC1)c1ccc(Br)cc1 216766043 DOWYEXNGFVSNPE-FQEVSTJZSA-N 478.818 4.327 70 20 JIID CSc1nnc(CCCNC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)n1C1CCCC1 217055820 WUMLOJVNGZVLPV-UHFFFAOYSA-N 486.041 4.341 70 20 JIID CN(c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)S(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848944831 CFPRLGNMEVNMMK-UHFFFAOYSA-N 490.456 4.376 70 20 JIID NC(=O)Cc1cc(Br)c(-c2ccc(NC(=O)c3cccc(S(=O)(=O)F)c3)cc2)s1 1336961104 FBUWJCBZUHDWEA-UHFFFAOYSA-N 497.367 4.116 70 20 JIID Cc1cc(Br)cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1NC(=O)OC(C)(C)C 1336962309 YACDRXGAIOPZPR-UHFFFAOYSA-N 476.324 4.343 70 20 JIID C[C@H]1CN(C(=O)c2ccc(CNC(=O)[C@H](C)Oc3cc(Cl)cc(Cl)c3)cc2)C[C@@H](C)O1 216657221 UXFXQNGCUMLWQV-XHSDSOJGSA-N 465.377 4.327 70 20 JIID CC(C)C[C@@H](NC(=O)CCn1cnc2ccc(Br)cc2c1=O)c1nc2ccccc2[nH]1 218130043 WSPJNUBLWDSNMJ-HXUWFJFHSA-N 482.382 4.329 70 20 JIID Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cccc(S(=O)(=O)F)c3)cc2Cl)n1 1337666760 FTWPQNUHTZPGGK-CQSZACIVSA-N 478.933 4.264 70 20 JIID O=c1c2ccccc2nc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1Cc1cccnc1 217403727 LKOWMIJWDBGFKQ-UHFFFAOYSA-N 473.526 4.128 70 20 JIID CC(=O)N[C@H](CC(=O)NCCc1ccc(Br)s1)c1ccc(Br)cc1 218070829 SASCJMGTCLFHNM-OAHLLOKOSA-N 474.218 4.199 70 20 JIID O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1338390300 PGPZOJOZRDFZGL-QGZVFWFLSA-N 459.326 4.285 70 20 JIID COc1ccc(C(=O)N2CCC(NC(=O)C(c3ccccc3)c3ccccc3)CC2)cc1OC 216886956 VXKFXYVHSNTCHH-UHFFFAOYSA-N 458.558 4.257 70 20 JIID Cc1nn(-c2ccccc2)c(C)c1[C@@H](NC(=O)c1cccc(S(=O)(=O)F)c1)C(F)(F)F 1121031734 CPQIPNNPLYAHBS-GOSISDBHSA-N 455.433 4.181 70 20 JIID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1cccc(S(=O)(=O)NC2CC2)c1 216828563 KDXUOMVDWSXETR-UHFFFAOYSA-N 450.545 4.051 70 20 JIID Cc1sc2nc(CS[C@@H](C)C(=O)N3CC=C(c4ccc(O)cc4)CC3)[nH]c(=O)c2c1C 216851130 KPEANVMFZRXIKR-HNNXBMFYSA-N 455.605 4.245 70 20 JIID Cc1c(C(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCO[C@@H](C)C2)nnn1-c1ccccc1Cl 216834236 MSLLFVXHPBIECH-XOBRGWDASA-N 492.382 4.213 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1ccc(Br)cc1 216769767 GXDMLTWQHZGDGM-GOSISDBHSA-N 455.299 4.276 70 20 JIID CC(=O)N[C@@H](CC(=O)NC[C@H](c1ccccc1Cl)N(C)C)c1ccc(Br)cc1 216772103 LHHDODOMLZCDQZ-VQTJNVASSA-N 466.807 4.089 70 20 JIID O=C(c1cc(Br)ccc1I)N(Cc1ccccn1)C1CC1 218685615 ZYNQSQSTAFCKNM-UHFFFAOYSA-N 457.109 4.254 70 20 JIID CCOc1cc2c(cc1NC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1)O[C@H](C)C2 216889902 DUFKIWLEJPBVRN-FZKQIMNGSA-N 461.356 4.377 70 20 JIID CC1CCN(c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2Cc2ccco2)CC1 218015094 NXOGFBJVZSREJS-UHFFFAOYSA-N 482.578 4.444 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(Cl)c(S(=O)(=O)N4CCCC4)c3)c12 217951870 WXWUBGROGNWFCH-UHFFFAOYSA-N 462.959 4.345 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1)c1ccc(Br)cc1 216798336 GLKBTEVRLRCWPH-OAQYLSRUSA-N 496.808 4.153 70 20 JIID COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc(S(=O)(=O)F)cc1)CC2 865205363 DKJJRFYEMBSGCV-QHCPKHFHSA-N 455.507 4.150 70 20 JIID C[C@H]1CN(Cc2csc(NC(=O)C3(c4cccc(Cl)c4)CCOCC3)n2)C[C@H](C)O1 217211086 LSJZRUPZCWFWQN-HOTGVXAUSA-N 450.004 4.093 70 20 JIID COCCCn1c(=S)[nH]c2cc(C(=O)Nc3ccc4c(c3)nc3n4CCCCC3)ccc2c1=O 218340017 GIJXZPCXRPPTQL-UHFFFAOYSA-N 477.590 4.424 70 20 JIID COc1ccc(/C=C2/C[C@@H](C)Cc3c2nc2ccccc2c3C(=O)NCCN2CCN(C)CC2)cc1 218010415 MEYZVNVGHRLNFU-HBFAPYFHSA-N 484.644 4.344 70 20 JIID O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1339472894 VFWBQFYBIFKUIB-KRWDZBQOSA-N 459.326 4.285 70 20 JIID COc1cccc([C@H](CNC(=O)N(C)Cc2ccc(Br)s2)N2CCCC2)c1 216920382 YGGLRHWPRNBLHL-SFHVURJKSA-N 452.418 4.498 70 20 JIID C[C@@H]1CCCCN1CCCNC(=O)c1cc(Br)ccc1I 218687006 AIGNUWBDAKFFLQ-GFCCVEGCSA-N 465.173 4.048 70 20 JIID CC1CCN(C(=S)SCC(=O)Nc2ccnn2Cc2ccccc2Br)CC1 216854601 DVAVHAITMFRUIN-UHFFFAOYSA-N 467.458 4.382 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(N3CCCCC3)n2Cc2ccco2)cc1)C(F)F 218013509 FISMVZFKVIDYNM-UHFFFAOYSA-N 468.551 4.198 70 20 JIID COC(=O)c1cc(CN(C)Cn2nc(CN3CCCCC3)n(-c3ccccc3)c2=S)oc1C 217131885 QCBQKJCMQMLFGV-UHFFFAOYSA-N 469.611 4.167 70 20 JIID O=C(c1ccnc2ccccc12)N1CCN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1 217998997 BQZXXIVLGKXVHH-UHFFFAOYSA-N 467.451 4.262 70 20 JIID Cc1nn(-c2ccccc2)c(C)c1[C@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)C(F)(F)F 865209279 NBFYQUVZDCFJCN-SFHVURJKSA-N 455.433 4.181 70 20 JIID Cc1cc(C(=O)Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)c2cnn(C(C)C)c2n1 217162759 BPKWQZLNDHSTFD-UHFFFAOYSA-N 458.547 4.451 70 20 JIID COc1ccc(C(=O)Nc2ccccc2C(=O)N2CCN(Cc3c(C)nc4cc(C)ccn34)CC2)cc1 218764126 IDRNVMRGBSPBRW-UHFFFAOYSA-N 497.599 4.170 70 20 JIID O=C(N[C@@H](Cc1ccccn1)c1ccc(Br)cc1)c1cccc(S(=O)(=O)F)c1 1354884510 FLOYAIWKAOBZBQ-IBGZPJMESA-N 463.328 4.216 70 20 JIID CCN(CC)C(=O)c1cccc(NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)c1 216773506 LFWKPFOZXWYQID-FQEVSTJZSA-N 460.372 4.137 70 20 JIID O=C(N[C@H](Cc1ccccn1)c1ccc(Br)cc1)c1ccc(S(=O)(=O)F)cc1 865209934 LRGZMZIGUFSEQH-LJQANCHMSA-N 463.328 4.216 70 20 JIID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N[C@@H]1CCS(=O)(=O)C1 217646453 ABBNQXYZOVTFKG-PBHICJAKSA-N 466.390 4.093 70 20 JIID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2ccnc(Oc3ccccc3Br)c2)cc1 848949073 VKRGNHGOJFINRR-UHFFFAOYSA-N 487.328 4.095 70 20 JIID COC1CCN(c2ccc(NC(=O)c3cccc(S(=O)(=O)F)c3)cc2C(F)(F)F)CC1 1516701338 IAUDNSUEKKHAGF-UHFFFAOYSA-N 460.449 4.231 70 20 JIID COc1cc(NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)c(OC)cc1Cl 216771446 SIYLURVDHVRZSK-OAHLLOKOSA-N 455.736 4.326 70 20 JIID COc1cc(-c2noc(Cn3cnc4sc5c(c4c3=O)CCCCC5)n2)ccc1OC(F)F 216788139 GZLVSBZERAXLFA-UHFFFAOYSA-N 474.489 4.435 70 20 JIID Cn1cnnc1Sc1ccc(NC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)cc1 217834781 JCERJQXBPBQGTD-UHFFFAOYSA-N 451.939 4.082 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1cccc(NC(=O)c2ccc(Br)o2)c1 865204224 KDJXPVKYDLSUST-UHFFFAOYSA-N 467.272 4.205 70 20 JIID COc1ccc([C@@H]2CCCN2C(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1OC 218299989 RIWHXIBPVDPDOF-UXHICEINSA-N 475.383 4.397 70 20 JIID CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(S(=O)(=O)F)cc2)c1 865204026 YWZIPPYRGJYBDL-UHFFFAOYSA-N 496.969 4.071 70 20 JIID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N[C@H]1CCS(=O)(=O)C1 217646620 ABBNQXYZOVTFKG-YOEHRIQHSA-N 466.390 4.093 70 20 JIID COc1ccc(S(=O)(=O)Nc2ccc(Br)cc2)cc1NC(=O)c1ccc(C)n1C 216875487 INHPIDYLFJOJDK-UHFFFAOYSA-N 478.368 4.158 70 20 JIID Cc1ccc(-c2csc3ncn(CCC(=O)Nc4ccc(CN5CCOCC5)cc4)c(=O)c23)cc1 216877428 JXSVHMQYKGHPDX-UHFFFAOYSA-N 488.613 4.294 70 20 JIID O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc(Cl)cc1 216691203 SKXPGCPOLOWWOI-VWLOTQADSA-N 477.992 4.152 70 20 JIID C[C@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)c1cccc(NC(=O)Cc2ccccc2F)c1 865206084 WXCBKKVKWGZXKW-HNNXBMFYSA-N 458.486 4.156 70 20 JIID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1csc(-c2cccc(Br)c2)n1 216833723 UMVGOOTXEKVNPS-LJQANCHMSA-N 471.376 4.242 70 20 JIID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 216832668 FZDQVUIKDKXUGZ-ZEQRLZLVSA-N 476.960 4.328 70 20 JIID COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(-c5cccs5)nc4C)CC3)n2)cc1 218025083 XUGZSEGKAHFMJB-UHFFFAOYSA-N 475.574 4.135 70 20 JIID C[C@@H](NC(=O)N1CCN(Cc2cn3ccccc3n2)CC1)c1cc(F)c(Cl)cc1Cl 217450208 NREQLWWCGDAMJU-CQSZACIVSA-N 450.345 4.369 70 20 JIID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1cc2c(cc1Cl)OCCCO2 217136781 MDKVJTCTPHLNSY-UHFFFAOYSA-N 459.955 4.180 70 20 JIID CN(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=O)c1cc(S(=O)(=O)F)c[nH]1 1263697319 VAYOAAGXARTSTA-UHFFFAOYSA-N 472.929 4.451 70 20 JIID COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cccc(S(=O)(=O)F)c1)CC2 1337666989 KDBPRPQROLZINM-QHCPKHFHSA-N 455.507 4.150 70 20 JIID O=C(Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c(C(F)(F)F)c1)c1ccco1 848946882 FLIPOJNKOCGHRQ-UHFFFAOYSA-N 492.428 4.010 70 20 JIID Cc1noc2nc(C(C)C)cc(C(=O)N3CCc4cc(S(=O)(=O)N5CCCCC5)ccc43)c12 217978482 RQDLEWHHADABDX-UHFFFAOYSA-N 468.579 4.032 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 865204433 SPHUQMJQQWANEF-ISKFKSNPSA-N 466.534 4.463 70 20 JIID O=C(CN1C(=O)c2ccc(Br)cc2C1=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216828917 JCGMDZXPDPUIKP-UHFFFAOYSA-N 493.342 4.356 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 865204051 CQQTUVZWZHLOLY-ZDUSSCGKSA-N 459.326 4.143 70 20 JIID COc1ccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1OCc1ccc2ccccc2n1 1336949851 UAQNKRNYCXKWQG-UHFFFAOYSA-N 455.467 4.061 70 20 JIID CC[C@@H](CNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1)c1ccccc1 216654470 KOSPOMCVSYNUMW-FQEVSTJZSA-N 457.640 4.241 70 20 JIID Cc1cc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cccc(Cl)c3)c2)n(-c2ccccn2)n1 216740191 LLIWIWIPHBDCOQ-UHFFFAOYSA-N 481.965 4.307 70 20 JIID CC(=O)N[C@@H](CC(=O)Nc1cc(Cl)ccc1N1CCOCC1)c1ccc(Br)cc1 216764268 VCBWVWNLQQOHEE-SFHVURJKSA-N 480.790 4.145 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)CCOc1ccc(Cl)cc1)c1ccc(Br)cc1 216768934 DFRAVASKJVDXMW-IBGZPJMESA-N 453.764 4.207 70 20 JIID Cc1cc(NC(=O)Cn2cnc3scc(-c4cccs4)c3c2=O)n(-c2ccc(F)cc2)n1 217361220 PFDWWXWUKIZLSJ-UHFFFAOYSA-N 465.535 4.458 70 20 JIID CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1ccc(OC(F)(F)F)cc1 217570570 GGJOCCOPNMKBDS-UHFFFAOYSA-N 464.465 4.340 70 20 JIID O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865207422 NMFJPFMFGVONOW-QGZVFWFLSA-N 459.326 4.285 70 20 JIID Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 217445685 RHWSOEGOCCSFMZ-UHFFFAOYSA-N 459.594 4.174 70 20 JIID CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1 217028855 HBOIPEFPTQZFAC-UHFFFAOYSA-N 452.561 4.297 70 20 JIID O=C1C[C@@H](C(F)(F)F)N(C(=O)Cn2cnc3sc4c(c3c2=O)CCCCC4)c2ccccc2N1 217755624 ZRDJKMBOUCDXII-KRWDZBQOSA-N 490.507 4.033 70 20 JIID Cc1cc(=O)c(C(=O)N2CC=C(c3ccc(O)cc3)CC2)nn1-c1cccc(C(F)(F)F)c1 216853220 DQEPXMNRWZKEAW-UHFFFAOYSA-N 455.436 4.195 70 20 JIID CC(=O)N[C@@H](CC(=O)NCc1ccc(OCC(F)(F)F)cc1)c1ccc(Br)cc1 218168739 UJXLORXSDGCECE-SFHVURJKSA-N 473.289 4.274 70 20 JIID Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cc2Cl)n1 865206762 UINQKUNAHSHCHW-CQSZACIVSA-N 478.933 4.264 70 20 JIID CCOC(=O)c1sc2nc(CN(C)C)nc(NCc3ccc(Cn4cccn4)cc3)c2c1C 216802737 ZWFLMXXUNCEQEX-UHFFFAOYSA-N 464.595 4.095 70 20 JIID Cn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nc2sc3c(c2c1=O)CCCC3 216859170 YIXNTTSFOAYYNL-UHFFFAOYSA-N 456.561 4.162 70 20 JIID O=C(CNc1ccccc1C(=O)N1CCCC1)Nc1ccccc1C(=O)Nc1ccc(F)cc1 216656538 LMBWPRAVDIQLIC-UHFFFAOYSA-N 460.509 4.365 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 865204080 DUVCPGQKWRYJCO-UHFFFAOYSA-N 470.566 4.430 70 20 JIID COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1cccc(S(=O)(=O)F)c1)CC2 1354469440 LPXVGYCDFZCSRV-UHFFFAOYSA-N 484.549 4.173 70 20 JIID Cc1c(NS(=O)(=O)c2ccc3[nH]c(-c4ccc(F)c(F)c4)nc3c2)c(=O)n(-c2ccccc2)n1C 218029807 VGRPGLXZLRDQJY-UHFFFAOYSA-N 495.511 4.107 70 20 JIID Cc1cc(I)ccc1NC(=O)Cn1cnc2sc3c(c2c1=O)CCCCC3 216779752 RMZUCFCNLQQGAR-UHFFFAOYSA-N 493.370 4.279 70 20 JIID CN(C(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1)c1ccccc1 848945257 MVKMRMXSVVEHEN-UHFFFAOYSA-N 482.942 4.076 70 20 JIID CCN(CC)C(=O)c1ccc(NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1 217085947 KGVXXERYHJYLHY-FQEVSTJZSA-N 460.372 4.137 70 20 JIID O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc(S(=O)(=O)F)c[nH]1 1354468902 ACYOFYFALADVQZ-UHFFFAOYSA-N 461.902 4.058 70 20 JIID CCCCN1C(=O)CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccc(OC)cc1 865204455 ULMPKPWSYCLXNZ-RBBKRZOGSA-N 462.543 4.072 70 20 JIID O=C(Nc1ccc(S(=O)(=O)F)cc1)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 865204117 FWRFJMAYDUQWCJ-UHFFFAOYSA-N 465.856 4.267 70 20 JIID COc1cccc(/C=C(/C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)n2nnnc2C)c1 218372549 RYMJFIXYYLHQHK-MOSHPQCFSA-N 469.530 4.299 70 20 JIID CCN1CCN(c2ccc(NC(=O)C[C@@H](NC(C)=O)c3ccc(Br)cc3)c(C)c2)CC1 216773574 ORMHSQZPSDYJOY-HSZRJFAPSA-N 487.442 4.105 70 20 JIID CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1 216800000 ZZWPADUWQMUAAG-UWJYYQICSA-N 486.975 4.255 70 20 JIID CC(C)(C)OC(=O)NCCC[C@H](NC(=O)c1cccc(S(=O)(=O)F)c1)c1ccccc1 1517974985 KGRRSOBQDBOVRA-IBGZPJMESA-N 450.532 4.121 70 20 JIID CCCCN1C(=O)CC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccccc1OC 865204245 LFKHGMTVVFSJNQ-SIKLNZKXSA-N 462.543 4.072 70 20 JIID Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cccc(S(=O)(=O)F)c3)cc2Cl)n1 1337666759 FTWPQNUHTZPGGK-AWEZNQCLSA-N 478.933 4.264 70 20 JIID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCC(C)CC2)n1C[C@H]1CCCO1 218014639 PQRZJNSHGPNINJ-UYAOXDASSA-N 489.711 4.383 70 20 JIID O=C(Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1cccc(S(=O)(=O)F)c1 1337520384 WSIHVUVGHCDJCT-UHFFFAOYSA-N 452.507 4.119 70 20 JIID CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(CN2CCOCC2)cc1 216689734 HZGDYWMOKDTEBZ-XMMPIXPASA-N 451.611 4.209 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N[C@H](C)Cc2cccs2)cc1Br 159595619 VUDNFTMEXMGOJD-SNVBAGLBSA-N 453.221 4.491 70 20 JIID CC(=O)N[C@@H](CC(=O)N(C)Cc1ccc(Br)cc1)c1ccc(Br)cc1 216770266 FVCLTVLIJXSQEO-SFHVURJKSA-N 468.189 4.438 70 20 JIID CC(=O)N[C@H](CC(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C)c1ccc(Br)cc1 216773737 ZNJBJZXXSFQTLT-HXUWFJFHSA-N 474.399 4.039 70 20 JIID Cc1ccc(OCc2nc3ccccc3n2CCOc2ccc(S(=O)(=O)N(C)C)cc2)cc1 217131371 ODQNGNRDLTXPHO-UHFFFAOYSA-N 465.575 4.253 70 20 JIID CC(=O)N[C@H](CC(=O)NCc1ccc(OCC(F)(F)F)cc1)c1ccc(Br)cc1 218168823 UJXLORXSDGCECE-GOSISDBHSA-N 473.289 4.274 70 20 JIID Cc1cc(Br)c(S(=O)(=O)N2CCc3sccc3C2)cc1Br 159530940 OBEPEKVHXNNIFP-UHFFFAOYSA-N 451.205 4.329 70 20 JIID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 218388030 WUEMXTLAHSCLHC-HSZRJFAPSA-N 457.555 4.367 70 20 JIID CN1CCN(c2ccc(CNC(=O)c3ccccc3Nc3ccc(OC(F)F)cc3)cn2)CC1 218101567 WBRGXGOAJCKDRN-UHFFFAOYSA-N 467.520 4.108 70 20 JIID O=S(=O)(c1ccc(CSc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)cc1)C(F)F 216865768 HPAPBKPKYOBIJY-AWEZNQCLSA-N 471.576 4.474 70 20 JIID CC(=O)N[C@H](CC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccc(Br)cc1 218024708 PZOXGHCOFUAOOE-OAQYLSRUSA-N 457.368 4.138 70 20 JIID CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(S(=O)(=O)F)cc2)c1 865204025 YWXQYLGRXAJCHE-UHFFFAOYSA-N 496.969 4.466 70 20 JIID COc1ccc(-n2cnnc2SCC(=O)N[C@H](CC(C)C)c2nc3ccccc3[nH]2)cc1 218234656 FPSLWYBBEVGVMY-HXUWFJFHSA-N 450.568 4.148 70 20 JIID CCCCN1C(=O)CC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccccc1OC 865204244 LFKHGMTVVFSJNQ-KNQAVFIVSA-N 462.543 4.072 70 20 JIID CCOc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCO[C@@H](C)C1 216800043 ZZWPADUWQMUAAG-LAUBAEHRSA-N 486.975 4.255 70 20 JIID COc1ccc(F)cc1CN1CCN(C(=O)c2cnn(-c3ccc(C)cc3)c2C(F)(F)F)CC1 218373145 KNMFLTOEINZDNF-UHFFFAOYSA-N 476.474 4.305 70 20 JIID O=C(CSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)F)cc1)NCC1CCCCC1 865204581 ZLELYULDNBCXJC-UHFFFAOYSA-N 464.584 4.386 70 20 JIID O=S(=O)(c1cccc(-c2nnc(SCc3cnn(-c4ccccc4)c3)o2)c1)N1CCCCC1 217501605 DWGXVDRNAPZCTQ-UHFFFAOYSA-N 481.603 4.389 70 20 JIID Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1cc(C(C)C)nc2onc(C)c12 217938357 UPUYZAIQTFELAN-UHFFFAOYSA-N 456.568 4.390 70 20 JIID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N[C@@H]1CCS(=O)(=O)C1 217646360 ABBNQXYZOVTFKG-RHSMWYFYSA-N 466.390 4.093 70 20 JIID COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(S(=O)(=O)F)cc2)c(OC)c1 865204105 FMZQYHSWEZRCEV-UHFFFAOYSA-N 481.505 4.467 70 20 JIID COc1cccc(CNC(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c1 218645959 XOCTULPKABMSRA-MRXNPFEDSA-N 463.534 4.330 70 20 JIID C[C@@H](NC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1)c1cc(F)c(Cl)cc1Cl 217453308 DNZIHUAXXZRNAT-LLVKDONJSA-N 480.414 4.408 70 20 JIID CC(=O)N[C@@H](CC(=O)Nc1cc2c(cc1Cl)OCCCO2)c1ccc(Br)cc1 217086964 KCHWEBPRULAOHE-INIZCTEOSA-N 467.747 4.470 70 20 JIID Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc(S(=O)(=O)F)c[nH]4)cc3s2)s1 1515252742 QROIXOFOWUBMFB-UHFFFAOYSA-N 464.525 4.157 70 20 JIID Cc1nn(-c2ccccc2)c(C)c1[C@H](NC(=O)c1cccc(S(=O)(=O)F)c1)C(F)(F)F 1121031735 CPQIPNNPLYAHBS-SFHVURJKSA-N 455.433 4.181 70 20 JIID COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)c3cccc(S(=O)(=O)F)c3)C2)n1 1337361716 VITBGKKXZJFZAN-MRXNPFEDSA-N 460.552 4.497 70 20 JIID CC(=O)N[C@@H](CC(=O)Nc1cccc(I)c1)c1ccc(Br)cc1 216760906 MNKFTNLFFZJIHZ-INIZCTEOSA-N 487.135 4.260 70 20 JIID O=C(c1ccc(Br)cc1)N1CCC(C(=O)N2CC=C(c3ccc(O)cc3)CC2)CC1 216852881 DMPAYWDXFBPCDY-UHFFFAOYSA-N 469.379 4.323 70 20 JIID C[C@H]1CN(Cc2csc(NC(=O)C3(c4ccccc4Cl)CCOCC3)n2)C[C@H](C)O1 216977288 AXRPDSYLWFUPMT-HOTGVXAUSA-N 450.004 4.093 70 20 JIID