smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@@H]1C[C@@H](NC(=O)N(C)C[C@H](O)CN2CCOCC2)CN1Cc1ccccc1 160280147 PDNKTELJTGCAFE-RLLQIKCJSA-N 390.528 0.984 70 20 GCID COc1cc(C(=O)NCCC(=O)NCCC(=O)O)ccc1S(=O)(=O)F 1607073576 INZMPACFQBYMOU-UHFFFAOYSA-N 376.362 0.064 70 20 GCID O=C(c1ccc(S(=O)(=O)F)cc1)N1CCC[C@H](N2CCCS2(=O)=O)C1 865211091 XDPSDXQMLXWDIV-ZDUSSCGKSA-N 390.458 0.985 70 20 GCID C[C@@H](O)C[C@@H](CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 159571041 ZQRAUQULVSUSNW-HIFRSBDPSA-N 399.451 0.105 70 20 GCID Cc1cc(N2CCN(C(=O)c3cnc4c(c3)ncn4C)CC2)n2ncnc2n1 159769171 HGTAZSJETUWTBV-UHFFFAOYSA-N 377.412 0.677 70 20 GCID O=C(O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(S(=O)(=O)F)ccc1Cl 1606058025 ZCKMBKSVCOXFOM-SNVBAGLBSA-N 399.805 0.322 70 20 GCID O=C(NC[C@@H]1CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 951358984 ZJMOHVSONCBTJY-KVMADOOQSA-N 397.428 0.427 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)CCc2ccc(S(=O)(=O)F)cc2)CC1 1339036610 ZUMTUPCATZQUFD-UHFFFAOYSA-N 392.474 0.771 70 20 GCID COCCN1CCN(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)CC1=O 1338938335 OHYAQVWKPJYYLL-UHFFFAOYSA-N 378.809 0.929 70 20 GCID O=C1NC(=O)[C@@H](Cc2ccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)cc2)N1 1348034013 FILMOQHXMYVTSE-GFCCVEGCSA-N 380.357 0.676 70 20 GCID O=S(=O)(F)c1cccc(S(=O)(=O)Nc2cc(-c3nn[nH]n3)ccn2)c1 1593428742 CXPCTKLQUQZSSN-UHFFFAOYSA-N 384.374 0.721 70 20 GCID Cc1c([C@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@@H]2C(N)=O)cnn1C 1550294976 AZMXBTRZNXPKDW-CABCVRRESA-N 394.428 0.728 70 20 GCID CN(C)CC1CCC(NC(=O)NCCCCN2CCN(CCO)CC2)CC1 159874423 QDJHXPYCGDRSRP-UHFFFAOYSA-N 383.581 0.796 70 20 GCID NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCN(Cc3ccccn3)CC2)C1 160314205 ZPPXGSFIKVPCRX-KRWDZBQOSA-N 388.516 0.496 70 20 GCID O=C1CN(C(=O)c2cn(C3CCNCC3)nn2)CCN1Cc1cccc(F)c1 161002522 QFVMVQDLAYRNSW-UHFFFAOYSA-N 386.431 0.826 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)CC1 1011796633 OHQRRFASLNLYHE-MIBAYGRRSA-N 397.428 0.381 70 20 GCID O=C(NCCNS(=O)(=O)c1ccccc1)c1cc(S(=O)(=O)F)c[nH]1 1337724901 MRBXSRRENGKAMS-UHFFFAOYSA-N 375.403 0.381 70 20 GCID CS(=O)(=O)N[C@@H]1CCCC[C@H]1CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1349622203 GKOBUIJYCXBLMZ-GXSJLCMTSA-N 381.451 0.511 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2CCn1cncn1)c1cc(S(=O)(=O)F)c[nH]1 1097873576 MBSQLMJBBOOHPW-QKCSRTOESA-N 382.421 0.300 70 20 GCID O=C(NNc1cc(-c2nn[nH]n2)cc(Cl)n1)c1cc(S(=O)(=O)F)c[nH]1 1593160160 NXSJQVVDKLBZFB-UHFFFAOYSA-N 386.756 0.658 70 20 GCID CN(C)N(C(=O)CCc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCS(=O)(=O)C1 1120910853 RDIUYTKISJFIEG-CYBMUJFWSA-N 392.474 0.770 70 20 GCID CN1CCN(c2ncccc2CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1123467226 CEDZAGKXPPFKOM-UHFFFAOYSA-N 381.433 0.750 70 20 GCID COC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)OC 218747606 REFBJWZKONTWQB-GXTWGEPZSA-N 380.397 0.912 70 20 GCID O=C(O)[C@H]1C[C@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777605248 DDHAWEGILHQCQB-WDSKDSINSA-N 385.263 0.553 70 20 GCID CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@@H]3C[C@@H]3C3CCCCC3)CC2)CC1 160226717 SDIJCEPYUTWNAP-QZTJIDSGSA-N 398.573 0.839 70 20 GCID O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cccc(S(=O)(=O)F)c1 1120948412 XWYJOWICNCCTHS-WFASDCNBSA-N 391.442 0.811 70 20 GCID O=C(O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(S(=O)(=O)F)ccc1Cl 1606058024 ZCKMBKSVCOXFOM-JTQLQIEISA-N 399.805 0.322 70 20 GCID O=C([C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1CCc2c(F)cccc2C1 160895055 UKIRMKLMZVQJMW-KBPBESRZSA-N 380.441 0.746 70 20 GCID NC(=O)CNC(=O)c1ccc(CNC(=O)c2ccc(S(=O)(=O)F)cc2)cc1 865205882 SVRWEHBJEDURKE-UHFFFAOYSA-N 393.396 0.490 70 20 GCID Cn1ncnc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863844 YXZIMKFQPFJLGH-XWIASGKRSA-N 382.421 0.337 70 20 GCID O=C(NCCNS(=O)(=O)c1cccnc1)c1cccc(S(=O)(=O)F)c1 1120944650 TZAGBRSOUJRUIV-UHFFFAOYSA-N 387.414 0.448 70 20 GCID COc1cc(C(=O)NCc2nc(-c3nn[nH]n3)cs2)ccc1S(=O)(=O)F 1591515053 BFMDCSSOFQZEFU-UHFFFAOYSA-N 398.401 0.920 70 20 GCID Cc1c(C(=O)NCCN(C)c2ccccc2)cnc2c1c(=O)n(C)c(=O)n2C 160123789 SPMZFDQXBLZBSR-UHFFFAOYSA-N 381.436 0.807 70 20 GCID Cc1c(-c2nc(CC(=O)NC3CCCC3)no2)cnc2c1c(=O)n(C)c(=O)n2C 161000990 MKIMVHMOYKBYGV-UHFFFAOYSA-N 398.423 0.592 70 20 GCID O=C(CN1CCCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1)N1CCCC1 1346290561 IXMDMURSLFPLNU-UHFFFAOYSA-N 386.449 0.443 70 20 GCID CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1349622291 IYYNQTAIESKDHG-RZFZLAGVSA-N 388.446 0.835 70 20 GCID COc1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1-c1nn[nH]n1 1591594107 KPMFMNFYLIQVHC-UHFFFAOYSA-N 380.361 0.792 70 20 GCID Cc1c(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)cnn1CC(=O)O 1600054623 NFVQVYGEBPENSZ-UHFFFAOYSA-N 377.375 0.735 70 20 GCID Cn1c(=O)[nH]c2ccc(C(=O)NC[C@@]3(N4CCOCC4)CCSC3)cc21 160630467 CIWIVBBTBNUPJC-SFHVURJKSA-N 376.482 0.804 70 20 GCID CN(C)S(=O)(=O)c1ccccc1CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1527341218 NGFQIBNDXBLOEW-UHFFFAOYSA-N 389.430 0.853 70 20 GCID Cc1[nH]c2ccnn2c(=O)c1CC(=O)N(C)CC(C)(C)CN1CCOCC1 160158293 QYBTZLMYGGAVSC-UHFFFAOYSA-N 375.473 0.690 70 20 GCID CN(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2nncn2c1 161032255 WRJQUKNPLGABFH-KRWDZBQOSA-N 380.452 0.748 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1ncc[nH]1 1002464660 BDDGGZVBXKZFIK-UISBYWKRSA-N 381.389 0.572 70 20 GCID COCCN(C(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1)[C@@H]1CCS(=O)(=O)C1 217285921 MQQFMIGURFXWQI-CHWSQXEVSA-N 375.491 0.231 70 20 GCID CCN(C(=O)NCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCS(=O)(=O)C1 217306180 LYWQRJYMXKGVER-ZDUSSCGKSA-N 393.465 0.891 70 20 GCID Cn1ncc(CN2[C@H]3CC[C@@H]2C[C@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n1 1097863622 ROWPIBIPAWHELV-QKCSRTOESA-N 382.421 0.337 70 20 GCID O=S1(=O)CC[C@H](N2CCN(S(=O)(=O)Cc3c(F)cccc3F)CC2)C1 160215090 ZPWPZIFJRAWEBL-LBPRGKRZSA-N 394.465 0.599 70 20 GCID COc1ccc(C[C@@H](CO)CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1O 1263760950 OLSBBDPJQXPQCK-LLVKDONJSA-N 386.401 0.968 70 20 GCID CS(=O)(=O)NCCCNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 159460001 GCQDVWOEJCKRPW-UHFFFAOYSA-N 391.375 0.955 70 20 GCID CS(=O)(=O)N1CCN(C(=O)CCc2ccc(S(=O)(=O)F)cc2)CC1 1262689911 MZSZBZYHBXHWTF-UHFFFAOYSA-N 378.447 0.381 70 20 GCID CCOC(=O)CNC(=O)C1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1519746568 XMZUSPXUGYWPBM-UHFFFAOYSA-N 389.405 0.204 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCN(CC(=O)NC(C)C)CC1 1337067048 QTBKFNYQSYTEPC-UHFFFAOYSA-N 385.461 0.936 70 20 GCID CS(=O)(=O)N[C@H]1CCCC[C@H]1CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1349622206 GKOBUIJYCXBLMZ-ONGXEEELSA-N 381.451 0.511 70 20 GCID CCCn1c(=O)[nH]c(=O)c2cc(C(=O)N[C@H]3c4ccccc4C[C@@H]3O)cnc21 159857028 KPUXLBSGFCMTDT-HOTGVXAUSA-N 380.404 0.883 70 20 GCID CN(CC(=O)NCC(C)(C)N)S(=O)(=O)c1ccc(Br)cc1 160065240 HHKAEBLMIKQQKH-UHFFFAOYSA-N 378.292 0.923 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CC[C@H](OCCN2CCOCC2)C1 1519745075 HLHNTBZHEALXRU-LBPRGKRZSA-N 375.422 0.236 70 20 GCID C[C@@](CNCCc1cnn[nH]1)(NC(=O)c1cc(S(=O)(=O)F)c[nH]1)C1CC1 1575609853 AZUZRSXRWFMRKV-HNNXBMFYSA-N 384.437 0.522 70 20 GCID C[C@H](C[C@@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[nH]c1=O 159469005 WWZKGGUBZHROBR-ZWNOBZJWSA-N 396.241 0.928 70 20 GCID COCCNC(=O)CNS(=O)(=O)c1cc(Br)cnc1Cl 159679150 HVCMBBWWCALRTA-UHFFFAOYSA-N 386.655 0.538 70 20 GCID CNC[C@H]1CCCN1C(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 161228963 YGPGTRWMDQSRNT-QGZVFWFLSA-N 394.541 0.512 70 20 GCID O=S(=O)(Cc1noc2ccccc12)N1CCN(S(=O)(=O)C2CC2)CC1 218383873 DZXGRPIAKIARHF-UHFFFAOYSA-N 385.467 0.767 70 20 GCID COCCn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)ccc1=O 1320366182 AVHMOFBAKABHEI-UHFFFAOYSA-N 390.414 0.954 70 20 GCID CS(=O)(=O)N1CC[C@H](CNC(=O)CCCc2ccc3[nH]c(=O)[nH]c3c2)C1 159485457 XYIPHVZLUAIMSR-CYBMUJFWSA-N 380.470 0.577 70 20 GCID O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)c1cc(S(=O)(=O)F)c[nH]1 1336920671 JPMQLNORLSTSOW-UHFFFAOYSA-N 380.357 0.977 70 20 GCID CCCN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1CCN(Cc2cnn[nH]2)C1 1576475767 XGDXUJBZERAVRC-GFCCVEGCSA-N 384.437 0.918 70 20 GCID O=C(Cc1c[nH]c2cc(F)ccc12)N1CCN(C(=O)CN2CCOCC2)CC1 159374812 GRXCYJVOXNSFTM-UHFFFAOYSA-N 388.443 0.853 70 20 GCID O=C(NCCCN1C(=O)c2ccccc2C1=O)N1CCN(c2ncccn2)CC1 217306251 YPWAJMQLQAZUJU-UHFFFAOYSA-N 394.435 0.995 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CC[C@@H](OCCN2CCOCC2)C1 1519745070 HLHNTBZHEALXRU-GFCCVEGCSA-N 375.422 0.236 70 20 GCID O=C([C@H]1CCS(=O)(=O)C1)N1CCN(Cc2noc(-c3cccs3)n2)CC1 159367632 VVJJRNMYICROKB-LBPRGKRZSA-N 396.494 0.877 70 20 GCID C[C@H](O)C[C@H](CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 159571182 ZQRAUQULVSUSNW-DZGCQCFKSA-N 399.451 0.105 70 20 GCID O=C(NC1CC1)[C@H]1CCCN1C(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O 160143456 TVPSPXSNGSCDCG-NWDGAFQWSA-N 376.379 0.992 70 20 GCID Cn1cc(S(=O)(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)cc1C(N)=O 160892993 LFAVWIPTDHHXNV-CQSZACIVSA-N 391.371 0.852 70 20 GCID Cn1cc(CCCNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cn1 160931365 YUKYEIKPWAGHBI-UHFFFAOYSA-N 384.484 0.993 70 20 GCID CNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1cc(S(=O)(=O)F)c[nH]1)CC2 1346290885 MAWRHJQUZFYIRJ-UHFFFAOYSA-N 387.414 0.784 70 20 GCID O=C(CCCNC1=NS(=O)(=O)c2ccccc21)N1CC[C@]2(CCNC2)C1 159367042 NBKLQNGBOZLZGO-SFHVURJKSA-N 376.482 0.717 70 20 GCID CCOC(=O)Cn1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 848946035 IZKKVANKUVDESG-UHFFFAOYSA-N 391.402 0.905 70 20 GCID C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCCc1cc2ccccc2[nH]1 159620568 AUAKPYYPAJCCFY-GFCCVEGCSA-N 375.454 0.927 70 20 GCID Cn1cc(N2CC[C@@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)cn1 160280487 XYFLHVCRQIHIOI-QGZVFWFLSA-N 383.456 0.448 70 20 GCID CN(C)N(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@H]1CCS(=O)(=O)C1 1120824498 STAPFXDXHJTWGJ-LBPRGKRZSA-N 378.447 0.380 70 20 GCID O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cc(S(=O)(=O)F)c[nH]1 1121032303 NVZYCNXJNNTEBO-ZANVPECISA-N 380.419 0.139 70 20 GCID O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)c1cccc(S(=O)(=O)F)c1 1336948986 FRLREYAGGARUOP-UHFFFAOYSA-N 396.400 0.652 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(Cc3cc(C)on3)CC1)CC2 160632075 QPUYOBDTGJGNCS-CQSZACIVSA-N 389.460 0.563 70 20 GCID CCN(CC(=O)NC(C)C)C(=O)COC(=O)c1ccc(S(=O)(=O)F)cc1 838087170 AJACSHSFHBTOQG-UHFFFAOYSA-N 388.417 0.875 70 20 GCID CN(C)S(=O)(=O)c1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1515237322 KJVZQGPPNIPAAI-UHFFFAOYSA-N 389.430 0.853 70 20 GCID COc1ccc(C(=O)NCCS(N)(=O)=O)cc1I 159637326 PELMFTZEHCAOEM-UHFFFAOYSA-N 384.195 0.318 70 20 GCID CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)c2cccc(S(=O)(=O)F)c2)C1=O 1348707610 NXOKAPLNSIIUSY-BZNIZROVSA-N 383.401 0.795 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(CCN1CCOCC1)[C@@H]1CCSC1 1123728802 ZOPMEVQKFPBLCS-GFCCVEGCSA-N 391.490 0.953 70 20 GCID Cc1nn2c(SC(F)(F)COS(=O)(=O)C(F)(F)F)n[nH]c2nc1=O 1333284510 WRRBCHKPJSOSEO-UHFFFAOYSA-N 395.291 0.672 70 20 GCID NC(=O)Cn1cc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)nn1 160461197 SDSRKHTZRABQML-UHFFFAOYSA-N 382.346 0.745 70 20 GCID O=[N+]([O-])c1cccnc1NNS(=O)(=O)c1cccc(S(=O)(=O)F)c1 780396250 YJNQIDRXRKOPIJ-UHFFFAOYSA-N 376.347 0.953 70 20 GCID C[C@H](C(=O)c1c(N)n(C)c(=O)n(C)c1=O)N1CCO[C@]2(CCc3ccccc32)C1 159667876 ZQZWJFOSHIMOJE-LRTDBIEQSA-N 398.463 0.411 70 20 GCID Cc1c([C@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@H]2C(N)=O)cnn1C 1550294986 AZMXBTRZNXPKDW-HUUCEWRRSA-N 394.428 0.728 70 20 GCID CS(=O)(=O)N1C[C@@H]2COC[C@]2(C(=O)Nc2ccc(S(=O)(=O)F)cc2)C1 460092182 MJERJPZGITWEEU-QMTHXVAHSA-N 392.430 0.191 70 20 GCID NC(=O)c1cccnc1N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346290162 CHZOSYLSYIDLCA-UHFFFAOYSA-N 381.389 0.129 70 20 GCID O=S(=O)(F)c1cccc(NS(=O)(=O)c2ccc(-c3nn[nH]n3)nc2)c1 1593429359 WBOXYUYGZUGYKX-UHFFFAOYSA-N 384.374 0.721 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCC[C@H]1[C@H](O)C(F)(F)F)CC2 160644430 IEQCOMLVTLAHKW-NRUUGDAUSA-N 377.367 0.837 70 20 GCID O=C(NCCS(=O)(=O)NCc1ccccc1)c1cc(S(=O)(=O)F)c[nH]1 1347810079 SBHBUTXLYQUORG-UHFFFAOYSA-N 389.430 0.522 70 20 GCID COC(=O)[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)c(OC)c2)C[C@H]1C(=O)O 1606423854 XBYBUQNDLLAZPS-NXEZZACHSA-N 389.357 0.299 70 20 GCID O=C(CN1CCN(C(=O)N[C@@H]2CCN(CC3CC3)C2)CC1)N1CCCCC1 160764060 XXYHTFCFLDAELP-GOSISDBHSA-N 377.533 0.810 70 20 GCID Cn1cc(S(=O)(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)cc1C(N)=O 160893105 LFAVWIPTDHHXNV-AWEZNQCLSA-N 391.371 0.852 70 20 GCID O=C(NC[C@H](O)CS(=O)(=O)c1cccs1)c1cc(S(=O)(=O)F)c[nH]1 1123647588 ABXISSDLATUYGA-QMMMGPOBSA-N 396.443 0.299 70 20 GCID C[C@]1(c2cccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)c2)NC(=O)NC1=O 1518681047 WLTAXPPHCLQMDU-OAHLLOKOSA-N 380.357 0.980 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2CCn1cccn1)c1cc(S(=O)(=O)F)c[nH]1 1096029654 PLSIALGUAMORBQ-ZLDLUXBVSA-N 381.433 0.905 70 20 GCID C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[nH]c1=O 159468863 WWZKGGUBZHROBR-GXFFZTMASA-N 396.241 0.928 70 20 GCID COCC(=O)N1CCN(C(=O)c2cncc(I)c2)CC1 159960849 SFCGGCUQOZAGBX-UHFFFAOYSA-N 389.193 0.617 70 20 GCID O=C(O)C[C@@H]1CN(C(F)(F)COS(=O)(=O)C(F)(F)F)[C@H]2COC[C@@H]2O1 1777646987 CZFFFGOLOSLUTA-CSMHCCOUSA-N 399.290 0.388 70 20 GCID COCCN(C(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1)[C@@H]1CCS(=O)(=O)C1 217285918 MQQFMIGURFXWQI-QWHCGFSZSA-N 375.491 0.231 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)[C@H]1CC[C@H](C(=O)N2CCOCC2)O1 1552596591 MVFNGBQJCRAVBZ-ZIAGYGMSSA-N 386.401 0.690 70 20 GCID O=C1CN(c2ccc(NC(=O)C(=O)NCCn3cccc3)cc2Cl)CCN1 160119602 ADAFTZJBWYVNAH-UHFFFAOYSA-N 389.843 0.833 70 20 GCID O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1ccc(S(=O)(=O)F)cc1 865209150 JEKRUBMYNGFKNQ-DOMZBBRYSA-N 391.442 0.811 70 20 GCID Cn1nccc1[C@@H]1c2[nH]cnc2CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1123829646 OFCGFMHNERBNJA-CQSZACIVSA-N 378.389 0.917 70 20 GCID CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1cc(S(N)(=O)=O)ccc1F)CC2 216725172 OCSNTQKLFWNNPA-GJZGRUSLSA-N 386.445 0.865 70 20 GCID NCCNC(=O)[C@H]1CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 852743705 IDNGGKRLGBSWHY-QMMMGPOBSA-N 383.339 0.232 70 20 GCID CC(C)Cn1ncc(C(=O)NCCN2CCS(=O)(=O)CC2)c1C(F)F 159898180 ZWQXMIKLJFSCNZ-UHFFFAOYSA-N 378.445 0.937 70 20 GCID O=S(=O)(NCC1CCN(CCO)CC1)c1cnn(-c2ccccc2F)c1 161397066 CZEDHPBRSXAXOQ-UHFFFAOYSA-N 382.461 0.994 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)Nc1nc2n(c1C(=O)O)CCOC2 1594707298 DEGPWCJHWPWDNU-UHFFFAOYSA-N 383.357 0.951 70 20 GCID Cc1noc(C)c1S(=O)(=O)N[C@H](C)C(=O)N1CCC(NCC2CC2)CC1 159776203 LRDNROPMKDXBOC-GFCCVEGCSA-N 384.502 0.949 70 20 GCID NS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(S(=O)(=O)F)c2)cc1 768888600 AVRZITYVWWCSQY-UHFFFAOYSA-N 394.427 0.793 70 20 GCID CCS(=O)(=O)N1CCC(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1123743056 ODPSIHNUSVHQEN-UHFFFAOYSA-N 381.451 0.464 70 20 GCID Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NC[C@@H](O)CN1CCCCC1 159920737 COGBSEUYZVOLJN-QZTJIDSGSA-N 390.463 0.867 70 20 GCID CN(C(=O)NCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCS(=O)(=O)C1 217306181 WMNKYHGLCVXUED-GFCCVEGCSA-N 379.438 0.501 70 20 GCID O=C(NCCNc1ccc(-c2nn[nH]n2)nc1)c1cc(S(=O)(=O)F)c[nH]1 1593089801 NQNLRLKKTJRNIQ-UHFFFAOYSA-N 380.365 0.090 70 20 GCID Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](O)CN1CCCCC1 159997424 UGYXEXZEMSLYER-MSOLQXFVSA-N 390.463 0.867 70 20 GCID C[C@@H]1CC[C@H](C(=O)N[C@@H]2CN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)C[C@H]2C)O1 940547567 YTCGHVDODLIBEY-DMTCVQMQSA-N 387.433 0.817 70 20 GCID O=C(Nc1ncc2c(c1-c1nn[nH]n1)COCC2)c1cc(S(=O)(=O)F)c[nH]1 1593267766 FFBFJIFLQUNMFR-UHFFFAOYSA-N 393.360 0.573 70 20 GCID O=C(CN1CCC[C@@H](C(=O)O)C1=O)Nc1ccc(S(=O)(=O)F)c(F)c1 1601311946 JQNXOBIMQOPUKD-SECBINFHSA-N 376.337 0.746 70 20 GCID Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N3C[C@H]4[C@@H](C3)OCCN4C)cc12 159661267 RNVXHUMAWVAKAI-FPMFFAJLSA-N 391.497 0.603 70 20 GCID O=C(CCCNC1=NS(=O)(=O)c2ccccc21)N1CC[C@@]2(CCNC2)C1 159367186 NBKLQNGBOZLZGO-GOSISDBHSA-N 376.482 0.717 70 20 GCID C[C@@H](CNC(=O)NCCNC(=O)c1c(F)cccc1F)CN1CCOCC1 159835272 XVRXFGAHMYRDCP-ZDUSSCGKSA-N 384.427 0.962 70 20 GCID O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1ccc(S(=O)(=O)F)cc1 275016469 YPBCWEINLSFNHL-GBOPCIDUSA-N 396.396 0.836 70 20 GCID Cn1c(=O)c2cc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cnc2n(C)c1=O 865205319 CFTSJCZMIKBGKW-UHFFFAOYSA-N 392.368 0.543 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)[C@@]12COC[C@@H]1C2 997262498 BQSOYLDDNFTOKT-BMJKNZIGSA-N 397.428 0.571 70 20 GCID Cc1c(NC(=O)C(=O)NCCCN2CCN(C)CC2)cnn1-c1ccccc1 160081819 HXAMSAJWULYUGP-UHFFFAOYSA-N 384.484 0.873 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(CCN1CCOCC1)[C@H]1CCSC1 1123728809 ZOPMEVQKFPBLCS-LBPRGKRZSA-N 391.490 0.953 70 20 GCID CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)C2)nc1 1346642347 RFSXEBUPPNAGEY-UHFFFAOYSA-N 396.400 0.863 70 20 GCID COc1cc(C(=O)N2CCN(CCC(=O)O)C[C@@H]2C)ccc1S(=O)(=O)F 1599351270 JVNUTGMKIAUEJU-NSHDSACASA-N 388.417 0.974 70 20 GCID Cc1c(C(=O)NCCCN2CCCCCC2)cnc2c1c(=O)n(C)c(=O)n2C 159942882 CUWXOWRMVSQSJF-UHFFFAOYSA-N 387.484 0.937 70 20 GCID COCC(=O)N[C@H](C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1)C(C)C 160077453 MDYRBSKMWCASSB-IBGZPJMESA-N 387.484 0.994 70 20 GCID Cn1c(=O)c2cc(C(=O)Nc3ccc(S(=O)(=O)F)cc3)cnc2n(C)c1=O 460090792 IQSQJTUDXXMNDG-UHFFFAOYSA-N 392.368 0.543 70 20 GCID COc1cc(C(=O)N2C[C@H](N(C)C)[C@H](n3ccnn3)C2)ccc1S(=O)(=O)F 906077918 KMUOBRUMCDMRRL-QWHCGFSZSA-N 397.432 0.572 70 20 GCID Cc1c(C(=O)NCc2nnc3n2CCCCC3)cnc2c1c(=O)n(C)c(=O)n2C 160382284 CLMCPAKWEQDATP-UHFFFAOYSA-N 397.439 0.189 70 20 GCID C[C@H](Nc1ccc2oc(N(C)C)nc2c1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O 160044525 VGIMJAGYOUDDGS-VIFPVBQESA-N 386.412 0.557 70 20 GCID CC[C@H]1CCCCN1CCNC(=O)c1cc(C)c2c(=O)n(C)c(=O)n(C)c2n1 160248273 DGJKIJUUOKECQX-AWEZNQCLSA-N 387.484 0.935 70 20 GCID CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NCCn3cccc3)cc2)CC1 160226234 GELKGBBKUVXOGF-UHFFFAOYSA-N 383.452 0.631 70 20 GCID CC(C)CN1CCC[C@@H]1CNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1 160308216 GIBNAWKEGZPHEH-GFCCVEGCSA-N 380.470 0.615 70 20 GCID O=C(c1cccc(S(=O)(=O)F)c1)N1CCC[C@@H](N2CCCS2(=O)=O)C1 1121094787 KWLSZXKBMMKWCK-CYBMUJFWSA-N 390.458 0.985 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(Cc3cc(C)on3)CC1)CC2 160632154 QPUYOBDTGJGNCS-AWEZNQCLSA-N 389.460 0.563 70 20 GCID Cc1ccc(-c2nc(C(=O)NCCN3CCS(=O)(=O)CC3)cs2)n1C 159895945 YRKBNSBKGGRMET-UHFFFAOYSA-N 382.511 0.917 70 20 GCID Cc1nn(C)c(C)c1-c1cc(C(=O)NC[C@H]2CCC[C@@H]2NS(C)(=O)=O)[nH]n1 160517875 ZDOJMEQRIOPGJT-OLZOCXBDSA-N 394.501 0.875 70 20 GCID Cc1cnn(Cc2cc(C(=O)N3CC[C@@H](S(=O)(=O)NC(C)C)C3)no2)c1 160687371 APHGWPRUYNXUBF-CQSZACIVSA-N 381.458 0.770 70 20 GCID Cc1c(C(=O)NCCCN2CCCC[C@@H]2C)cnc2c1c(=O)n(C)c(=O)n2C 159768497 FWELQSVPEQJEKB-ZDUSSCGKSA-N 387.484 0.935 70 20 GCID O=C(NCC1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 1003459594 FBKJPZAIRULZSW-MIBAYGRRSA-N 397.428 0.285 70 20 GCID Cc1sc(=O)n(CCC(=O)NC[C@@H]2CCC[C@@H]2NS(C)(=O)=O)c1C 160279236 BOKBLERJCITFOC-STQMWFEESA-N 375.516 0.751 70 20 GCID C[C@@H](C(=O)NC[C@H]1CC[C@H](C(N)=O)O1)N1CCN(c2ccc(F)cc2)CC1 161190581 RFFVRBLZORMSCT-IAOVAPTHSA-N 378.448 0.485 70 20 GCID Cc1nn(C)c2ncc(NC(=O)c3cnc4c(c3C)c(=O)n(C)c(=O)n4C)cc12 160430474 ABDHGNBDVFHYQB-UHFFFAOYSA-N 393.407 0.783 70 20 GCID Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1C 1527342102 XJNZBGWZBZIHJG-UHFFFAOYSA-N 382.373 0.689 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@]12COC[C@@H]1C2)c1cc(S(=O)(=O)F)c[nH]1 1000527127 NOXLYNWZHZVDCT-BMJKNZIGSA-N 397.428 0.571 70 20 GCID Cc1nn(C)cc1CNCCS(=O)(=O)N1CCN(c2ccccn2)CC1 160413537 VJOXNROZCXFZHK-UHFFFAOYSA-N 378.502 0.365 70 20 GCID O=S(=O)(NCC1CCN(CCO)CC1)c1cnn(Cc2ccccc2)c1 161417341 JFYOGOVIBPXMKJ-UHFFFAOYSA-N 378.498 0.914 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N[C@@H]1CCCCN(CC(=O)O)C1=O 1594328038 GVKPATQFLPCEEU-CYBMUJFWSA-N 386.401 0.849 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 289898954 MVFNGBQJCRAVBZ-UONOGXRCSA-N 386.401 0.690 70 20 GCID CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)c1cc(S(=O)(=O)F)c[nH]1 1346795487 FLRUCJVBQPHJJD-SECBINFHSA-N 379.410 0.631 70 20 GCID COC(=O)c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)nn1 848947974 UXDBLPSJRUUJTQ-UHFFFAOYSA-N 375.359 0.722 70 20 GCID COC(=O)c1cn([C@@H]2CCN(C(=O)c3ccc(S(=O)(=O)F)cc3)C2)nn1 865210053 QDIRSQRAKIESSD-LLVKDONJSA-N 382.373 0.810 70 20 GCID CC(C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1590341651 RUSCCSZQROOXHE-VIFPVBQESA-N 378.378 0.978 70 20 GCID Cn1c(=O)n(CCC(=O)NC[C@@H]2CCC[C@@H]2NS(C)(=O)=O)c2ccccc21 160313277 USRPNIZYSFWKNQ-KBPBESRZSA-N 394.497 0.564 70 20 GCID O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 161480597 LMDRYBGCTTWWFH-GFCCVEGCSA-N 383.399 0.994 70 20 GCID Cn1c(=O)c2ccn(CC(=O)Nc3ccc(S(=O)(=O)F)cc3)c2n(C)c1=O 460097122 ZMZBFHXZTGQMAB-UHFFFAOYSA-N 394.384 0.336 70 20 GCID O=C(N[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 942442145 HCYQGHSNCARKIW-MHVRPGDESA-N 397.428 0.427 70 20 GCID CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1OC 946890956 IOWPJXQIGIJIHG-WGEPELCKSA-N 387.433 0.675 70 20 GCID NC(=O)c1ccccc1N1CC[C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1347457809 OQDSBOGNWHNOGG-JTQLQIEISA-N 380.401 0.781 70 20 GCID Cn1cc(N2CCC[C@H](N3CCN(C(=O)c4ccc(=O)[nH]c4)CC3)C2=O)cn1 159454907 ZDAJRLYGZQKXJZ-INIZCTEOSA-N 384.440 0.062 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1262673257 FVGWFQDYPJJYOH-QWRGUYRKSA-N 394.446 0.481 70 20 GCID COCCN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H]1CCS(=O)(=O)C1 217263756 XWVGRHFAQBOYGH-LBPRGKRZSA-N 379.479 0.356 70 20 GCID CCS(=O)(=O)NCc1ccc(C(=O)NCc2nnc3n2CCCC3)cc1 160892570 MEXXAUUFEOVPHC-UHFFFAOYSA-N 377.470 0.984 70 20 GCID NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1 771833943 LXLWJUWLYITZFQ-UHFFFAOYSA-N 394.427 0.793 70 20 GCID COC[C@@H](O)CCNC(=O)C(=O)Nc1cccc(I)c1 159585882 SXGXXTIKHIAVOA-NSHDSACASA-N 392.193 0.743 70 20 GCID NC(=O)CCN(Cc1ccccc1)C(=O)Cn1c(-c2cccnc2)noc1=O 161283054 SQEBLFLXAIJYKU-UHFFFAOYSA-N 381.392 0.803 70 20 GCID C[C@H]1CC[C@H](C)N1CCN1CCN(S(=O)(=O)c2ccc(C(N)=O)cc2)CC1 161244083 OCPKREMSACSZEP-HOTGVXAUSA-N 394.541 0.965 70 20 GCID CCN(C(=O)[C@H](C)N1CCN(c2ccncc2)CC1)[C@H]1CCS(=O)(=O)C1 161389511 LAVLMRNXOXJLFI-RDJZCZTQSA-N 380.514 0.628 70 20 GCID CC(C)NS(=O)(=O)[C@@H]1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 159372333 QWGRAWAGYCJVGN-MSOLQXFVSA-N 396.557 0.808 70 20 GCID Cc1cc(C(=O)N2CCC(CCN(C)C)CC2)nc2c1c(=O)n(C)c(=O)n2C 160139386 HESIQJAJAWOXED-UHFFFAOYSA-N 387.484 0.745 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)N[C@H]1CCN(C2CCOCC2)C1=O 1121190764 HWWRJTMTGFWOGQ-HNNXBMFYSA-N 384.429 0.783 70 20 GCID 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CNS(=O)(=O)c1cccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1 1123569001 VVAZURWPACVMAP-UHFFFAOYSA-N 375.403 0.511 70 20 GCID CCCS(=O)(=O)N1CCC(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1263922004 MOFFONLZXGBIJF-UHFFFAOYSA-N 381.451 0.607 70 20 GCID Cc1nn(C)c(C)c1CN1CCN(C(=O)NC[C@H]2CCCS2(=O)=O)CC1 160248738 SQWCREDPINMPKU-OAHLLOKOSA-N 383.518 0.441 70 20 GCID CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F 160491909 BQMJGQVDOTVYLE-RTXFEEFZSA-N 386.420 0.830 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ncc[nH]1)c1cc(S(=O)(=O)F)c[nH]1 1006338406 IUEZCDIWMJWOOF-UISBYWKRSA-N 381.389 0.572 70 20 GCID CC(C)[C@H](NCC(=O)NC[C@H](c1ccccc1)N(C)C)C(=O)N1CCOCC1 160475855 IQJCPJHLRXRLJK-QUCCMNQESA-N 390.528 0.879 70 20 GCID O=C(CN1CCN(C(=O)c2c[nH]nn2)CC1)Nc1ccc(Br)cc1 160502010 IAKGXSOBZSKNEF-UHFFFAOYSA-N 393.245 0.964 70 20 GCID CNS(=O)(=O)c1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)s1 1520703398 UPUFAANIDAVAET-UHFFFAOYSA-N 381.432 0.573 70 20 GCID NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NCCn3cccc3)c2)CC1 160229928 PRLAFSJBMGKRHQ-UHFFFAOYSA-N 397.479 0.940 70 20 GCID C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)N[C@@H]2CCc3ncnn3C2)CC1 160979377 CDFYCQBMOIVDNE-JKSUJKDBSA-N 389.504 0.321 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)C1=CC=CN2CCS(=O)(=O)N=C12 460092554 NAUGISXVTYUVNJ-UHFFFAOYSA-N 385.398 0.781 70 20 GCID CC(=O)NCCN([C@H](C)C(=O)O)C(F)(F)COS(=O)(=O)C(F)(F)F 852732411 TZSFHHIWDHATHF-ZCFIWIBFSA-N 386.295 0.357 70 20 GCID O=C([C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1CCc2c(F)cccc2C1 160894786 UKIRMKLMZVQJMW-UONOGXRCSA-N 380.441 0.746 70 20 GCID O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)c1cc(S(=O)(=O)F)c[nH]1 1337360785 JBDRFQJFNDJFJL-UHFFFAOYSA-N 380.357 0.977 70 20 GCID O=C(CN1CCC[C@H](C(=O)O)C1=O)Nc1ccc(S(=O)(=O)F)c(F)c1 1601311947 JQNXOBIMQOPUKD-VIFPVBQESA-N 376.337 0.746 70 20 GCID CN(C(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)C1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 954905300 LECAUXFQVNQTJW-MIBAYGRRSA-N 397.428 0.379 70 20 GCID Cc1sc(=O)n(CCC(=O)NC[C@H]2CCC[C@@H]2NS(C)(=O)=O)c1C 160279380 BOKBLERJCITFOC-OLZOCXBDSA-N 375.516 0.751 70 20 GCID C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 274962560 LFFYWWNVLJDQJL-ZPTNNJSTSA-N 396.396 0.834 70 20 GCID CCNC(=O)Cn1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 460095625 PGVVZCUZHZANHZ-UHFFFAOYSA-N 390.418 0.478 70 20 GCID C[C@@H]1C[C@H](NC(=O)N(C)C[C@H](O)CN2CCOCC2)CN1Cc1ccccc1 160279898 PDNKTELJTGCAFE-HOJAQTOUSA-N 390.528 0.984 70 20 GCID O=C(Cn1cnnn1)N1CCN(C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1 160477425 OIRNSZOVNIKNTH-QZTJIDSGSA-N 397.483 0.938 70 20 GCID COc1ccc(C[C@H](CO)CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1O 1263760951 OLSBBDPJQXPQCK-NSHDSACASA-N 386.401 0.968 70 20 GCID CN[C@H]1CCN(C(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)C1 160487572 YKEWPILRUBGURB-INIZCTEOSA-N 380.514 0.267 70 20 GCID O=C(NCCCN1C(=O)c2ccccc2C1=O)NCCN1C(=O)CSC1=O 217306292 WBMSCFPXQNKDTF-UHFFFAOYSA-N 390.421 0.667 70 20 GCID C[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cccc(S(N)(=O)=O)c1 1346040770 OQTLWASWIKSEIB-QMMMGPOBSA-N 375.403 0.811 70 20 GCID C[C@@H](OC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@H](C(N)=O)C1 838087651 GTJYCFOYBHEWLV-PWSUYJOCSA-N 386.401 0.614 70 20 GCID COC(=O)[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)c(OC)c2)C[C@@H]1C(=O)O 1606423857 XBYBUQNDLLAZPS-UWVGGRQHSA-N 389.357 0.299 70 20 GCID Cc1c(C(=O)NCCc2cn3c(n2)CCCC3)cnc2c1c(=O)n(C)c(=O)n2C 161107432 RAEMTZKEROFCJH-UHFFFAOYSA-N 396.451 0.446 70 20 GCID Cc1nc(CN2[C@H]3CC[C@@H]2C[C@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n[nH]1 1097873710 RFEDYZXZRWPTET-XWIASGKRSA-N 382.421 0.635 70 20 GCID Cc1c(NC(=O)C(=O)NCCN2CCOCC2)cnn1-c1ccccc1F 159953456 AJWHTNHEVMGKRS-UHFFFAOYSA-N 375.404 0.707 70 20 GCID O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 974341837 DVTSJHRFYFMYPF-MUDROIMGSA-N 397.428 0.473 70 20 GCID O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)F)c[nH]1 1338401582 XLEFMTWIUPLTMB-QMMMGPOBSA-N 376.391 0.481 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 160326491 DBBCUBAQGWMFPP-ROUUACIJSA-N 385.468 0.676 70 20 GCID Cn1cc(S(=O)(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)cc1C(N)=O 161266763 JQFSWWQAATZLDG-GFCCVEGCSA-N 376.438 0.487 70 20 GCID C[C@H]1CN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)CCN1S(C)(=O)=O 160651007 FEMUKIDRCYLKMW-RDJZCZTQSA-N 382.530 0.371 70 20 GCID Cn1cc(S(=O)(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)cc1C(N)=O 161266637 JQFSWWQAATZLDG-LBPRGKRZSA-N 376.438 0.487 70 20 GCID CN(C)C[C@](C)(O)CNS(=O)(=O)c1cccc(I)c1 161426132 JQTYMVCLCHKMEC-GFCCVEGCSA-N 398.266 0.882 70 20 GCID C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cccc(-n2cnnn2)c1 160949120 SUJBMCOLJFCKPX-ZDUSSCGKSA-N 379.424 0.728 70 20 GCID CNC[C@H]1CCCN1C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 161257274 VCGRNJIBSPQFQI-SECBINFHSA-N 383.250 0.103 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cnco1)c1cc(S(=O)(=O)F)c[nH]1 1000528651 ZLADDLYWFIMJDS-QRTLGDNMSA-N 382.373 0.836 70 20 GCID COc1cc(C(=O)Nc2nn(C)cc2-c2nn[nH]n2)ccc1S(=O)(=O)F 1605200544 CIYMAGBOEZHMTC-UHFFFAOYSA-N 381.349 0.519 70 20 GCID O=C(NC1CC1)[C@H]1CCCN1C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O 160143569 TVPSPXSNGSCDCG-VXGBXAGGSA-N 376.379 0.992 70 20 GCID CN1CCC(CNC(=O)c2ccc(S(=O)(=O)F)cc2)(N2CCOCC2)CC1 865211412 RRLHNVHMJVZYKW-UHFFFAOYSA-N 399.488 0.871 70 20 GCID Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)N[C@H]3CCOC4(CCCCC4)C3)nc21 160711021 BQBJEXUDNOZISN-LBPRGKRZSA-N 389.456 0.881 70 20 GCID COC[C@@H](O)CCNC(=O)Cn1cnc2ccc(Br)cc2c1=O 160845913 HJMQZEGNYFQXDM-NSHDSACASA-N 384.230 0.673 70 20 GCID CCOC(=O)Cn1cnc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 848949076 VMYKUHBPUQIROL-UHFFFAOYSA-N 392.390 0.300 70 20 GCID CN1CCN(C(=O)C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)CC1 1346210192 ZZZVIROWVQRQTQ-UHFFFAOYSA-N 386.449 0.299 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCN(C(=O)c2ccccc2O)CC1 1351578356 LRRNBVXVQBRTEZ-UHFFFAOYSA-N 381.385 0.977 70 20 GCID COC(=O)[C@H]1CC[C@H](C(=O)O)N(C(=O)Cc2ccc(S(=O)(=O)F)cc2)C1 1598771906 DJESZVGHJYWSQR-WCQYABFASA-N 387.385 0.752 70 20 GCID CN(c1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1)S(C)(=O)=O 1354469157 FUALUNNJFUFIHF-UHFFFAOYSA-N 389.430 0.999 70 20 GCID CN1CC[C@@]2(C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C[C@H]2C1 1777092126 VVKIEPATBOCIIK-PSASIEDQSA-N 396.334 0.784 70 20 GCID CN(CCNC(=O)N[C@@H]1CCc2[nH]ncc2C1)S(=O)(=O)c1cccs1 159457606 RREYIKNPAJEERX-GFCCVEGCSA-N 383.499 0.948 70 20 GCID CNC(=O)Cn1cc(NC(=O)c2cncc(I)c2)cn1 160346050 AWGGSBAPGVMQHE-UHFFFAOYSA-N 385.165 0.881 70 20 GCID COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1263697106 LWGNAJUPWNSLPG-QWRGUYRKSA-N 375.422 0.676 70 20 GCID COCCN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCS(=O)(=O)C1 1337923975 XMQIXGKIFYLOHC-CYBMUJFWSA-N 393.458 0.549 70 20 GCID CCNS(=O)(=O)c1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1346929146 MIKYGSIVSLNAEL-UHFFFAOYSA-N 389.430 0.901 70 20 GCID COCc1cc(N[C@@H](Cc2ccccc2)C(=O)NCCN(C)C)n2ncnc2n1 161383999 GTBLAPBMGTVPOK-KRWDZBQOSA-N 397.483 0.972 70 20 GCID CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)c2ccc(S(=O)(=O)F)cc2)C1=O 865208668 SAWLDZPCXJEJPS-BZNIZROVSA-N 383.401 0.795 70 20 GCID CCn1c(=O)c(=O)n(Cc2ccnn2C)c2cc(S(=O)(=O)N(C)C)ccc21 161268014 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C[C@@H]1CC[C@H](C(=O)N[C@H]2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)[C@@H]2C)O1 990349956 FFNAJZHQQNSPDI-KOXOONSLSA-N 387.433 0.960 70 20 GCID C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(CCO)CCN1CCOCC1 160014804 MQWBTPNGVSFQLM-ICSRJNTNSA-N 390.528 0.843 70 20 GCID COC(=O)C1CCN(C(=O)COC(=O)c2ccc(S(=O)(=O)F)cc2)CC1 838088403 VNIUBRLCIBEYIX-UHFFFAOYSA-N 387.385 0.913 70 20 GCID O=C(NCCNS(=O)(=O)Cc1ccon1)c1ccc(S(=O)(=O)F)cc1 865208075 BWTMDKVWYIEXKK-UHFFFAOYSA-N 391.402 0.182 70 20 GCID C[C@@H](O)C[C@H](CNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccccc1 160190793 JQNRIEHRLZCCGH-UKRRQHHQSA-N 399.451 0.105 70 20 GCID CN(CCNC(=O)c1cc(S(=O)(=O)F)c[nH]1)S(=O)(=O)c1cccs1 1123742095 GGSUNJNEGRYFDJ-UHFFFAOYSA-N 395.459 0.785 70 20 GCID CC[C@@H](C)N(C)CCNC(=O)CCC(=O)N1CCN(c2ncccn2)CC1 161389639 QDCUTYOCIKQDSE-MRXNPFEDSA-N 376.505 0.752 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1C[C@H](O)[C@H](NC(=O)[C@@]23CCC[C@@H]2C3)C1 969593165 DIFXSUIRHLIGLU-NJYNRLGGSA-N 385.417 0.165 70 20 GCID 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Cn1cncc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863709 UHYRMIWZBBWSPL-YVLXSGLVSA-N 381.433 0.942 70 20 GCID C[C@H](C(=O)NCCc1cccs1)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 159443650 PGWRJLQUZIYBNU-CQSZACIVSA-N 388.493 0.942 70 20 GCID Cc1ccc(-c2nnc(NC(=O)c3cnc4c(c3)c(=O)n(C)c(=O)n4C)[nH]2)o1 160359346 WAJVMVWMOBQASJ-UHFFFAOYSA-N 381.352 0.571 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)NC1(C(=O)O)CCS(=O)(=O)CC1 1600293691 HIWMMYOXUVEEAX-UHFFFAOYSA-N 393.414 0.415 70 20 GCID COC(=O)Cn1ncc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1C 848945841 UWUARCHBBVQTKY-UHFFFAOYSA-N 391.402 0.824 70 20 GCID CN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@H]1CCN(S(C)(=O)=O)C1 1349696347 GHEUJZACGYQWSA-LBPRGKRZSA-N 378.447 0.380 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)O[C@H](c2ccccn2)C(F)(F)F)n(C)c1=O 160381591 YDCUVDVQDQWNEH-GFCCVEGCSA-N 397.313 0.676 70 20 GCID CCS(=O)(=O)NCc1ccc(C(=O)NCCCCN2CCN(C)CC2)cc1 160408856 ACLCQQLYLOEKDH-UHFFFAOYSA-N 396.557 0.883 70 20 GCID 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O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ncn(-c2ccccc2)n1 159418806 PNFLNMOPCXVYJD-DARAHFNDSA-N 377.404 0.804 70 20 GCID O=C(CN1CCN(C(=O)c2ccc(=O)[nH]c2)CC1)N1CCc2sccc2C1 159442334 JXJKZAORYYTOFC-UHFFFAOYSA-N 386.477 0.779 70 20 GCID Cc1cccc2nc(CNC(=O)CNS(=O)(=O)c3cn(C)cn3)n(C)c12 159771636 MTNWOWRTMJTLHG-UHFFFAOYSA-N 376.442 0.210 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1C[C@@H](O)[C@H](NC(=O)[C@@]23CCC[C@@H]2C3)C1 1025038350 DIFXSUIRHLIGLU-RVXWVPLUSA-N 385.417 0.165 70 20 GCID CCCNC(=O)CN1CCC(NC(=O)N2CCCN(CC(F)F)CC2)CC1 160388149 MWZJILZUKULIPM-UHFFFAOYSA-N 389.491 0.959 70 20 GCID Cc1cc(C(=O)NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c2c(=O)[nH]n(C)c2n1 160548555 HYFJZDQSAHYZTF-HZPDHXFCSA-N 395.463 0.935 70 20 GCID Cc1cccc([C@H](C)C(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)c1 159656888 JCBXNYXQWVNCDI-KRWDZBQOSA-N 394.541 0.735 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(Cc3cccnc3)CC1)CC2 160658188 UEUNFQHTSVEWMD-INIZCTEOSA-N 385.472 0.662 70 20 GCID CC(C)N1CCO[C@@H](CN2CCN(C(=O)[C@@H]3CCn4ccnc4C3)CC2)C1 161448827 FJUNWUTUEAUXEE-MSOLQXFVSA-N 375.517 0.699 70 20 GCID CC(=O)N[C@]1(c2nc(C)no2)CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)C1 865211252 LYNDSWMHPDDTBG-MRXNPFEDSA-N 396.400 0.914 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N(C)[C@@H]1CCN(S(C)(=O)=O)C1 1337462945 LNAVDKDTVLMENF-LLVKDONJSA-N 378.447 0.759 70 20 GCID C[C@H]1CC[C@H](C)N1CCN1CCN(S(=O)(=O)c2cc(C(N)=O)n(C)c2)CC1 161244858 XCYPYYQVBVDCHI-GJZGRUSLSA-N 397.545 0.303 70 20 GCID CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)c2cccc(S(=O)(=O)F)c2)C1=O 1348707612 NXOKAPLNSIIUSY-ZBEGNZNMSA-N 383.401 0.795 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)N1CCS(=O)(=O)C[C@H]1C1CC1 1338183980 MBZKHCIDWWQVNU-AWEZNQCLSA-N 375.443 0.923 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(CC(F)F)C1CCS(=O)(=O)CC1 1338945517 ZHUQRNXJOIFUSU-UHFFFAOYSA-N 388.389 0.957 70 20 GCID COC(=O)C[C@H]1C(=O)NCCN1Cc1cnc2ccc(Br)cn12 159790849 TYTMRXOJXABDHB-LBPRGKRZSA-N 381.230 0.960 70 20 GCID Cc1cc(S(N)(=O)=O)cc(C(=O)N2CCN(c3cnn(C)c3)CC2)c1C 159699245 NOJKWLCHHRTASO-UHFFFAOYSA-N 377.470 0.647 70 20 GCID O=C(Cn1cc(Br)c(=O)[nH]c1=O)N[C@H]1CCOC2(CCCC2)C1 160198279 ZSZUBJIAZMUODV-JTQLQIEISA-N 386.246 0.907 70 20 GCID CS(=O)(=O)c1cc(C(=O)NCCCn2nc3n(c2=O)CCCC3)cs1 161461013 DWGQCZYRIJOBBJ-UHFFFAOYSA-N 384.483 0.666 70 20 GCID COC(=O)CCNC(=O)Cn1nnc(Cc2cccc(Br)c2)n1 159412845 UBWLWKHQPFCOQQ-UHFFFAOYSA-N 382.218 0.706 70 20 GCID C[C@@H]1CC[C@H](C(=O)N2CC[C@H](NC(=O)c3cc(S(=O)(=O)F)c[nH]3)[C@H]2C)O1 990016686 XMYGNRNBGOGHJI-KOXOONSLSA-N 387.433 0.960 70 20 GCID C[C@@H]1C[C@@H](NC(=O)N2CCN(S(C)(=O)=O)CC2)CN1Cc1ccccc1 160041053 JNYWHRJPDHRYSA-NVXWUHKLSA-N 380.514 0.936 70 20 GCID COCCCS(=O)(=O)NCCOC(=O)c1ccc(S(=O)(=O)F)cc1 838094710 XZNKJCDRACRCAS-UHFFFAOYSA-N 383.419 0.458 70 20 GCID C[C@@]1(c2cccc(N3CCOC3=O)c2)NC(=O)N(CCS(=O)(=O)F)C1=O 883953338 RKZKNJNJFIYFFP-HNNXBMFYSA-N 385.373 0.710 70 20 GCID CCCCN1CCC(NC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)CC1 159629291 VPZFZBZNGGROPU-UHFFFAOYSA-N 387.484 0.935 70 20 GCID CN(C)S(=O)(=O)c1cc(C(=O)N2CCN(CCN3CCCC3)CC2)co1 160699981 KTESAUNQXZDXOT-UHFFFAOYSA-N 384.502 0.384 70 20 GCID O=C(c1cccc(O)c1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1123649491 SDFYUHASHSIFCT-UHFFFAOYSA-N 381.385 0.977 70 20 GCID CS(=O)(=O)NC[C@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1337666826 IREUGZTXCKPVNZ-GFCCVEGCSA-N 378.447 0.889 70 20 GCID CN[C@@H]1CCN(C(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)C1 160638324 JQBXGMMELCQUTC-SNVBAGLBSA-N 376.276 0.839 70 20 GCID C[C@@H](OC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@@H](C(N)=O)C1 838087653 GTJYCFOYBHEWLV-ZYHUDNBSSA-N 386.401 0.614 70 20 GCID COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1263697105 LWGNAJUPWNSLPG-MNOVXSKESA-N 375.422 0.676 70 20 GCID CN(C[C@H]1CCCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)S(C)(=O)=O 1337490120 GZFDOFHDCGIVGE-SNVBAGLBSA-N 381.451 0.417 70 20 GCID CN1CCO[C@H]2CN(C(=O)CCC(=O)N3CCN(c4ccccc4)CC3)C[C@@H]21 159723498 SDVJDQJOJXAJOE-OALUTQOASA-N 386.496 0.657 70 20 GCID Cc1c(/C=C/C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cnn1C 160064641 YSOVSCYVGBLBHG-BQYQJAHWSA-N 381.436 0.630 70 20 GCID Cc1n[nH]c2ncc(NC(=O)c3cnc4c(c3C)c(=O)n(C)c(=O)n4C)cc12 160469081 XCXPLPLPMOKUHI-UHFFFAOYSA-N 379.380 0.773 70 20 GCID Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N3C[C@H]4OCCN(C)[C@@H]4C3)cc12 159661137 RNVXHUMAWVAKAI-MRVWCRGKSA-N 391.497 0.603 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC[C@H](N2CCCS2(=O)=O)C1 1520006311 HAGGEOAZYCUCCI-JTQLQIEISA-N 379.435 0.313 70 20 GCID Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N3C[C@H]4[C@@H](C3)OCCN4C)cc12 159661405 RNVXHUMAWVAKAI-KWCYVHTRSA-N 391.497 0.603 70 20 GCID COCCCS(=O)(=O)N1CCN(Cc2ccc(-n3ccnc3)nc2)CC1 160130896 DQAMXSGIMXIVEJ-UHFFFAOYSA-N 379.486 0.751 70 20 GCID CCN(C(=O)[C@@H](C)N1CCN(c2ccncc2)CC1)[C@@H]1CCS(=O)(=O)C1 161389114 LAVLMRNXOXJLFI-NVXWUHKLSA-N 380.514 0.628 70 20 GCID COC(=O)CNC(=O)c1ccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1120785258 TYIGRSFFQCQXMB-UHFFFAOYSA-N 383.357 0.828 70 20 GCID O=C(CS(=O)(=O)CCCc1ccccc1)NC[C@@H](O)CN1CCCCC1 160667349 GIOVSWMUWLRPQU-GOSISDBHSA-N 382.526 0.997 70 20 GCID COc1ccccc1CCNC(=O)CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1349545374 BCDXAYLGENUROS-UHFFFAOYSA-N 383.401 0.770 70 20 GCID O=C(COc1cccc(-c2nn[nH]n2)c1)Nc1ncc(S(=O)(=O)F)s1 1592894157 SBSJXXCTRFMVBU-UHFFFAOYSA-N 384.374 0.999 70 20 GCID COc1ccc(N(C)C(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)cc1F 159624960 PEAHHDSVECTWCC-UHFFFAOYSA-N 375.360 0.244 70 20 GCID CC(=O)N1CC[C@H](NC(=O)c2ccc(-n3cc(Br)cn3)nn2)C1 159450647 LEDYFLDBQUDUJL-NSHDSACASA-N 379.218 0.775 70 20 GCID COC(=O)c1cn(C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)nn1 1349236025 ZNVDRWHKFHKCOQ-UHFFFAOYSA-N 385.377 0.528 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1ccon1 995842129 QKKPMQICTDSGCP-WLTAIBSBSA-N 382.373 0.836 70 20 GCID CN1CCC(CNC(=O)c2cccc(S(=O)(=O)F)c2)(N2CCOCC2)CC1 1337490048 DZDMFFACPKRVQG-UHFFFAOYSA-N 399.488 0.871 70 20 GCID C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)N[C@H]2CCc3ncnn3C2)CC1 160979493 CDFYCQBMOIVDNE-CVEARBPZSA-N 389.504 0.321 70 20 GCID Cn1c(=O)c2ccc(C(=O)Nc3ccc(S(=O)(=O)F)cc3)nc2n(C)c1=O 460087527 AUHDMMURDOAUHM-UHFFFAOYSA-N 392.368 0.543 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(Cc3ccncc3)CC1)CC2 160720329 GUQHGXIFIWMUHG-MRXNPFEDSA-N 385.472 0.662 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)N(CCO)Cc3cccnc3)ccc21 161199406 JVXMSFKBMNDHST-UHFFFAOYSA-N 376.438 0.455 70 20 GCID COCCCNC(=O)[C@@H](C)N1CCN(C(=O)[C@H]2CCn3ccnc3C2)CC1 161411309 FKUKWLXLQHHMDI-CVEARBPZSA-N 377.489 0.131 70 20 GCID COC(=O)[C@@H]1CCN(C(=O)c2cccc(S(=O)(=O)F)c2)[C@@H](C(=O)OC)C1 1348707131 HYYIPDNTLWDIHH-DGCLKSJQSA-N 387.385 0.912 70 20 GCID CC(C)NC(=O)CN1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC1 1354129609 GWNOUXQGBFGPTM-UHFFFAOYSA-N 385.461 0.556 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1262673255 FVGWFQDYPJJYOH-GHMZBOCLSA-N 394.446 0.481 70 20 GCID Cn1c(=O)c2cc(NC(=O)c3cccc(-n4ccnn4)c3)cnc2n(C)c1=O 161244774 MEJQJHWEKMZBFC-UHFFFAOYSA-N 377.364 0.465 70 20 GCID O=C(CNS(=O)(=O)c1ccccc1F)N[C@@H]1CCN(c2ccccn2)C1 218085954 AYKJNUBHWVKPCB-CYBMUJFWSA-N 378.429 0.894 70 20 GCID Cc1nc(CN2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n[nH]1 1096026247 RFEDYZXZRWPTET-CDMKHQONSA-N 382.421 0.635 70 20 GCID CC1(NCCc2cnn[nH]2)CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1576004882 APOXZTOJLVDOGM-UHFFFAOYSA-N 384.437 0.618 70 20 GCID CN[C@H]1CCN(C(=O)CCNS(=O)(=O)c2ccc(Br)cc2)C1 160602521 NKLOCLFWQPMJFK-LBPRGKRZSA-N 390.303 0.938 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)C1=CN2CCS(=O)(=O)N=C2C=C1 460087680 AWUQPEOHBWYGEQ-UHFFFAOYSA-N 385.398 0.781 70 20 GCID CNC(=O)[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@H]1c1cnn(C)c1 1550256587 SLEZXBFUNFDWAA-LSDHHAIUSA-N 394.428 0.680 70 20 GCID COc1cc(C(=O)N2C[C@H](n3ccnn3)[C@H](N(C)C)C2)ccc1S(=O)(=O)F 1550707677 KMUOBRUMCDMRRL-OLZOCXBDSA-N 397.432 0.572 70 20 GCID Cn1c(=O)[nH]c(=O)c2cc(S(=O)(=O)N3CCC[C@H]4CCCC[C@H]43)cnc21 159486169 ZDFZGFWQBZYKNQ-BXUZGUMPSA-N 378.454 0.965 70 20 GCID CN1CCO[C@@H]2CN(C(=O)CCC(=O)N3CCN(c4ccccc4)CC3)C[C@@H]21 159723628 SDVJDQJOJXAJOE-RBUKOAKNSA-N 386.496 0.657 70 20 GCID COC(=O)c1cnc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cn1 848948308 NKMXAUDHAPQJBV-UHFFFAOYSA-N 375.359 0.722 70 20 GCID Cc1cc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)ccc1S(N)(=O)=O 1123829809 QGYOKKGZNGYGKJ-UHFFFAOYSA-N 375.403 0.559 70 20 GCID CN(C)S(=O)(=O)c1ccc(C(=O)NC2(CO)CC2)cc1Br 160350258 DNHVYCBAEWZWAV-UHFFFAOYSA-N 377.260 0.954 70 20 GCID CC(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc(C)c(S(=O)(=O)F)c1 857675276 IQKLCFCRKPOVPR-ZDUSSCGKSA-N 385.417 0.719 70 20 GCID C[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CCN1c1nccn2cnnc12 1340087217 GAPYDWJGYMHMNG-SNVBAGLBSA-N 393.404 0.462 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(Cc3cccnc3)CC1)CC2 160658049 UEUNFQHTSVEWMD-MRXNPFEDSA-N 385.472 0.662 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)[C@@H]1CC[C@@H](C(=O)N2CCOCC2)O1 1552596588 MVFNGBQJCRAVBZ-KBPBESRZSA-N 386.401 0.690 70 20 GCID Cn1cncc1[C@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550288095 JVGHSBGKLUNUPW-WFASDCNBSA-N 380.401 0.828 70 20 GCID O=C(CN1CCN(C(=O)CN2CCCC[C@@H]2CO)CC1)Nc1ccc(F)cc1 159920385 VJQGVPVZTBTJAW-GOSISDBHSA-N 392.475 0.755 70 20 GCID CN(C(=O)c1cccc(S(=O)(=O)F)c1)C1CCN(S(C)(=O)=O)CC1 1120944126 HKIMFEKLJNKQSO-UHFFFAOYSA-N 378.447 0.841 70 20 GCID O=C(NC[C@]1(N2CCOCC2)CCSC1)c1cc(S(=O)(=O)F)c[nH]1 1520702592 BMHRXZDFNLDFAD-CQSZACIVSA-N 377.463 0.611 70 20 GCID COC(=O)c1cn([C@H]2CCN(C(=O)c3ccc(S(=O)(=O)F)cc3)C2)nn1 865210054 QDIRSQRAKIESSD-NSHDSACASA-N 382.373 0.810 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)[C@H](C)C1 865211056 VXMRRQGNNZBFIL-LLVKDONJSA-N 378.447 0.841 70 20 GCID O=C1CNCCN1[C@@H]1CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 852746164 FIGVUEXHQVYWIS-SECBINFHSA-N 395.350 0.342 70 20 GCID CC(C)NS(=O)(=O)[C@H]1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 159372475 QWGRAWAGYCJVGN-ROUUACIJSA-N 396.557 0.808 70 20 GCID CS(=O)(=O)N1C[C@@H]2COC[C@]2(C(=O)Nc2cccc(S(=O)(=O)F)c2)C1 460096137 XGFZNPWLVDROJQ-QMTHXVAHSA-N 392.430 0.191 70 20 GCID COc1ncc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)cc1C(N)=O 460096868 SADOFVFHYXFHQN-UHFFFAOYSA-N 389.386 0.648 70 20 GCID C[C@@H]1[C@@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CCN1C(=O)[C@@]12COC[C@@H]1C2 990015836 LPUOLXQTBDBJNU-IZXSPOQTSA-N 385.417 0.429 70 20 GCID C[C@@H]1[C@@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CCN1C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 990015831 LATDIZAMRDNWGH-TUJOMHJISA-N 399.444 0.960 70 20 GCID NC(=O)c1ccccc1N1CC[C@@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1347457810 OQDSBOGNWHNOGG-SNVBAGLBSA-N 380.401 0.781 70 20 GCID O=C(O)C[C@H]1CS(=O)(=O)CCN1C(=O)c1ccc(S(=O)(=O)F)cc1 1601963503 CJIJYYHPEIWIFO-JTQLQIEISA-N 379.387 0.059 70 20 GCID O=C1NCCc2ccc(S(=O)(=O)N3CCC(Cn4ccnn4)CC3)cc21 159474830 MGKMPPODQBMIRF-UHFFFAOYSA-N 375.454 0.665 70 20 GCID O=C(NCCNc1ncccc1-c1nn[nH]n1)c1cc(S(=O)(=O)F)c[nH]1 1593095650 FVQMSFUOWAQWMH-UHFFFAOYSA-N 380.365 0.090 70 20 GCID O=C(O)Cn1cc(CC[S@](=O)Cc2ccc(S(=O)(=O)F)cc2)nn1 1608797325 ZHQFYVKTARLJHC-QHCPKHFHSA-N 375.403 0.512 70 20 GCID O=C(NCCN1CCN(c2ncccn2)CC1)c1cccc(-c2ncn[nH]2)c1 160985934 BRCWUZVJDPBZRF-UHFFFAOYSA-N 378.440 0.814 70 20 GCID O=C(NC[C@@H](O)CN1CCc2ccccc2C1)c1cccc(-n2cnnn2)c1 159365023 QVNJWWBKAXLDDV-LJQANCHMSA-N 378.436 0.811 70 20 GCID Cc1ccc(Br)c(C(=O)N2CCN(CCS(N)(=O)=O)CC2)c1 159827463 VYXPURNOAPGODG-UHFFFAOYSA-N 390.303 0.804 70 20 GCID NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1346929508 QECZLLKISNNPSY-UHFFFAOYSA-N 396.400 0.861 70 20 GCID CCc1c(C(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)cnc2c1c(=O)n(C)c(=O)n2C 160091696 HYGQWDSPRCIOMB-XJKSGUPXSA-N 399.495 0.751 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(Cc3ccncc3)CC1)CC2 160720464 GUQHGXIFIWMUHG-INIZCTEOSA-N 385.472 0.662 70 20 GCID CN(CCOCc1ccccc1)C(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C 161439446 FPWDNVASYZSFSE-UHFFFAOYSA-N 382.420 0.921 70 20 GCID O=C(NCC1(N2CCOCC2)CCOCC1)c1cc(S(=O)(=O)F)c[nH]1 1338068067 KJKUTEYXXKAXAU-UHFFFAOYSA-N 375.422 0.284 70 20 GCID CN1C(=O)C[C@H](NC(=O)c2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccnn1C 1550256643 VEGBGSCAUSKSRU-SWLSCSKDSA-N 380.401 0.780 70 20 GCID O=C(NCCC[C@@H]1CCCN1Cc1cnn[nH]1)c1cc(S(=O)(=O)F)c[nH]1 1578005593 NGODEEFPUUMWDE-GFCCVEGCSA-N 384.437 0.966 70 20 GCID COc1cc(C(=O)NCCN2CCS(=O)(=O)CC2)sc1Br 159897031 TUFSYDUYBCGILI-UHFFFAOYSA-N 397.316 0.979 70 20 GCID COc1cc(C(=O)N=c2cc[nH]cc2-c2nn[nH]n2)ccc1S(=O)(=O)F 1579915791 NNBPPQFHWKNODJ-UHFFFAOYSA-N 378.345 0.603 70 20 GCID CCCn1[nH]cc/c1=N\C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 216656992 MKRBTYBKVIEPST-GIJQJNRQSA-N 394.233 0.560 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cnco1 1004531016 GKBGOESDWSVZSS-UISBYWKRSA-N 382.373 0.836 70 20 GCID CN1CCN(CCCN(C)CC(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 160139913 HHBCZNVBSVRSOM-FQEVSTJZSA-N 375.561 0.975 70 20 GCID C[C@@H](CNS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C)CN1CCOCC1 160374510 WNRRIPPHUYCLRR-ZDUSSCGKSA-N 382.486 0.124 70 20 GCID COC(=O)[C@H]1CC[C@@H](C(=O)O)CN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1598765424 IXQVCCVRHVAJBR-DGCLKSJQSA-N 387.385 0.752 70 20 GCID Cc1nn(C)c(C)c1-c1cc(C(=O)NC[C@H]2CCC[C@H]2NS(C)(=O)=O)[nH]n1 160518130 ZDOJMEQRIOPGJT-CHWSQXEVSA-N 394.501 0.875 70 20 GCID Cc1c(C(=O)N2CCn3c2nc2ccccc23)cnc2c1c(=O)n(C)c(=O)n2C 160938174 FXARGNJQSYNDQD-UHFFFAOYSA-N 390.403 0.951 70 20 GCID CC[C@@H](NC(=O)Cn1ccc(=O)[nH]c1=O)[C@@H]1CN(Cc2ccccc2)CCO1 159638168 HPEHBUDCCGRPNX-SJORKVTESA-N 386.452 0.332 70 20 GCID C[C@@H](CNC(=O)C(=O)Nc1ccc(Br)nc1)CN1CCOCC1 161268389 VDKUSFYCNKZURF-NSHDSACASA-N 385.262 0.867 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCN(c2cnn(C)c2)C(=O)C1 1337989667 JFCGCSAJUMEQTN-UHFFFAOYSA-N 380.401 0.876 70 20 GCID CN(CCCOCc1ccccc1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 218473022 OLKIVRAVXXLNNQ-UHFFFAOYSA-N 399.451 0.499 70 20 GCID O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1cccc(S(=O)(=O)F)c1 460090891 JGIPLLUWDZTFBI-GBOPCIDUSA-N 396.396 0.836 70 20 GCID COc1ccc(N(C)C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1Cl 160204289 SBZMVFZDKBMXEL-UHFFFAOYSA-N 391.815 0.759 70 20 GCID Cn1c(=O)[nH]c(=O)c2cc(S(=O)(=O)N3CCC4(CCCC4)CC3)cnc21 160600396 YXRRMJGEFDCKNS-UHFFFAOYSA-N 378.454 0.967 70 20 GCID Cn1cc(CN(CCn2ccnc2)C(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1521437105 BTMQRAGJBACDIX-UHFFFAOYSA-N 380.405 0.946 70 20 GCID O=C(O)[C@@H]1C[C@@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777605246 DDHAWEGILHQCQB-PHDIDXHHSA-N 385.263 0.553 70 20 GCID CC(=O)N[C@H]1CCCN(C(=O)COC(=O)c2ccc(S(=O)(=O)F)cc2)C1 838087320 BCYYQVSOTAMWPV-ZDUSSCGKSA-N 386.401 0.629 70 20 GCID O=C(NCCNS(=O)(=O)c1cccs1)c1cc(S(=O)(=O)F)c[nH]1 1120944357 LRJBKHPJZKWUIH-UHFFFAOYSA-N 381.432 0.443 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCN(S(C)(=O)=O)[C@@H](C)C1 1338044100 DVDGQBHHJNLGCB-NSHDSACASA-N 378.447 0.759 70 20 GCID CC(C)CCn1ccc(NC(=O)C(=O)NC[C@H](C)CN2CCN(C)CC2)n1 160394093 CLGUSEGPNVGDPJ-INIZCTEOSA-N 378.521 0.867 70 20 GCID O=C(CN1CCN(C(=O)N[C@H]2CCN(CC3CC3)C2)CC1)N1CCCCC1 160764184 XXYHTFCFLDAELP-SFHVURJKSA-N 377.533 0.810 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1ccon1 1001511872 QKKPMQICTDSGCP-DYLAAIIWSA-N 382.373 0.836 70 20 GCID Cc1c(C(=O)NCCCN2CCC[C@H](C(N)=O)C2)cnn1C1CCOCC1 160115758 ROVCCCFADKVLMB-HNNXBMFYSA-N 377.489 0.860 70 20 GCID CCc1c(C(=O)N2CCN(CC(=O)NCCOC)CC2)cnn1CC(C)C 160524900 UOSDLLZMYDWULZ-UHFFFAOYSA-N 379.505 0.622 70 20 GCID COc1cc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)ccc1-c1nn[nH]n1 1605215117 MGRGDPKJIBPKCB-UHFFFAOYSA-N 380.361 0.792 70 20 GCID CNS(=O)(=O)c1cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)ccc1F 1354885700 PAWCLJLAIFAKSC-UHFFFAOYSA-N 379.366 0.972 70 20 GCID O=S(=O)(NCCNc1ccc2nnc(C(F)(F)F)n2n1)c1cccnc1 161206945 VHTNMYSMYJXPHA-UHFFFAOYSA-N 387.347 0.929 70 20 GCID C[C@H]1CN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CCN1S(C)(=O)=O 1337475466 XQJPKSLIJFLMCK-NSHDSACASA-N 378.447 0.380 70 20 GCID COC[C@@H](O)CCNC(=O)C(=O)Nc1ccccc1I 159488848 CGERKKIXHVZQNP-VIFPVBQESA-N 392.193 0.743 70 20 GCID C[C@H](C(=O)NC[C@@H]1CC[C@H](C(N)=O)O1)N1CCN(c2ccc(F)cc2)CC1 161190478 RFFVRBLZORMSCT-XOKHGSTOSA-N 378.448 0.485 70 20 GCID NC(=O)[C@@H]1CCCN1C1CCN(CCNS(=O)(=O)c2ccccc2)CC1 159361304 AYFAFBPKIILIEF-KRWDZBQOSA-N 380.514 0.379 70 20 GCID CCn1c(=O)n(CCS(=O)(=O)F)c2cc(S(=O)(=O)N(C)C)ccc21 883953417 VCEDUOJJQPGJED-UHFFFAOYSA-N 379.435 0.373 70 20 GCID CSCC(=O)N1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1006340813 ZODSPSFWWLFAKH-UISBYWKRSA-N 375.447 0.898 70 20 GCID COC(=O)CCN1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)[C@@H](C)C1 1338786107 CZVFYJCCZVWULY-ZDUSSCGKSA-N 386.445 0.983 70 20 GCID NC(=O)[C@H]1CCCN1C1CCN(CCNS(=O)(=O)c2ccccc2)CC1 159361171 AYFAFBPKIILIEF-QGZVFWFLSA-N 380.514 0.379 70 20 GCID O=C1CN(C(=O)CS(=O)(=O)Cc2ccc(F)c(Br)c2)CCN1 160478558 NLBAWTBBVHTLFV-UHFFFAOYSA-N 393.234 0.461 70 20 GCID COCCNC(=O)C1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC1 1336637438 JAOPBSUNZBRBNE-UHFFFAOYSA-N 386.445 0.889 70 20 GCID CNC(=O)COc1cccc(CC(=O)N2CCN(CCN3CCCC3)CC2)c1 161104777 GWXLSMOWDFFTCL-UHFFFAOYSA-N 388.512 0.594 70 20 GCID O=C(c1ccc(S(=O)(=O)F)cc1)N1CCC[C@@H](N2CCCS2(=O)=O)C1 865211090 XDPSDXQMLXWDIV-CYBMUJFWSA-N 390.458 0.985 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cocn1)c1cc(S(=O)(=O)F)c[nH]1 1006339958 UPVQVDMIOZMBCX-JQEORGNBSA-N 382.373 0.836 70 20 GCID Cc1c(C(=O)NC[C@H]2Cc3ccccc3O2)cnc2c1c(=O)n(C)c(=O)n2C 161280955 DYLYQBJMICCRAW-CYBMUJFWSA-N 380.404 0.674 70 20 GCID O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 973483374 DVTSJHRFYFMYPF-SBPBUDONSA-N 397.428 0.473 70 20 GCID COC[C@H](O)CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1111032780 QCYBBWVWCFYWHR-FTUHBYGFSA-N 375.422 0.015 70 20 GCID CC(C)c1cc(=O)n(CC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cn1 160767894 VSJWFMXUGKVRRP-UHFFFAOYSA-N 377.489 0.426 70 20 GCID NCc1cn([C@@H]2CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C2)nn1 852750635 ARFRMQYOZCYUKC-SECBINFHSA-N 393.338 0.833 70 20 GCID CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1O 1025531561 JVKZZGLDURKNKB-WGEPELCKSA-N 387.433 0.411 70 20 GCID CN1C[C@H](C(=O)O)N(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)CC1=O 1606200280 PDSVFCHGGNSVSE-SNVBAGLBSA-N 378.765 0.366 70 20 GCID NS(=O)(=O)c1ccc(F)c(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1 1346851820 IJRFZOIDBIVQIX-UHFFFAOYSA-N 379.366 0.389 70 20 GCID CN(CC(C)(C)CN1CCOCC1)C(=O)CCn1nnc2ccccc2c1=O 160086046 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70 20 GCID O=C1NC[C@@H]2CN([C@H]3CCN(c4ccc(Cl)c(F)c4)C3=O)CCN2C1=O 161378314 BJTXZOUVLFFYRZ-RISCZKNCSA-N 380.807 0.227 70 20 GCID CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1cc(S(N)(=O)=O)ccc1F)CC2 216725215 OCSNTQKLFWNNPA-HUUCEWRRSA-N 386.445 0.865 70 20 GCID COC[C@H](O)CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1109731862 QCYBBWVWCFYWHR-KLTVKPSUSA-N 375.422 0.015 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC(N2CCS(=O)(=O)CC2)CC1 1521206448 OEASZTAUKAERCY-UHFFFAOYSA-N 393.462 0.008 70 20 GCID Cn1cc(CNC(=O)NC[C@@](C)(O)CN2CCOCC2)c(C(F)(F)F)n1 160763627 ITOKDWSMLIUYBC-CQSZACIVSA-N 379.383 0.321 70 20 GCID O=C(NCCNS(=O)(=O)Cc1ccon1)c1cccc(S(=O)(=O)F)c1 1120944647 SZKVGULGXCPRGH-UHFFFAOYSA-N 391.402 0.182 70 20 GCID COCCCNC(=O)[C@H](C)N1CCN(C(=O)[C@@H]2CCn3ccnc3C2)CC1 161410848 FKUKWLXLQHHMDI-JKSUJKDBSA-N 377.489 0.131 70 20 GCID COCCN(C(=O)c1ccc(S(=O)(=O)F)cc1)[C@H]1CCS(=O)(=O)C1 865206981 DQNFEBKINRXOJZ-LBPRGKRZSA-N 379.431 0.621 70 20 GCID COC(=O)c1cn([C@H]2CCN(C(=O)c3cccc(S(=O)(=O)F)c3)C2)nn1 1120948406 XUBPTCFIDIJXGU-NSHDSACASA-N 382.373 0.810 70 20 GCID O=C(NCCCN1CCN(c2ncccn2)CC1)c1ccnc(-n2cccn2)c1 159394425 KLQLRXHFBCHBGF-UHFFFAOYSA-N 392.467 0.999 70 20 GCID CN(C)CCn1nnnc1SC(F)(F)COS(=O)(=O)C(F)(F)F 1350109003 RXXUWIPEDADNHO-UHFFFAOYSA-N 385.340 0.786 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)NCCN2CCC(N(C)C)CC2)c1CC 160422317 WJJBMIYKEARMEB-UHFFFAOYSA-N 378.521 0.720 70 20 GCID C[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 940565368 SDNROHXPSUYOSU-KVOBGNBSSA-N 399.444 0.817 70 20 GCID COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1338260900 QCPUOIZEKQLJRW-KCJUWKMLSA-N 376.362 0.240 70 20 GCID Cc1ccc(C[C@@H](C)NS(=O)(=O)c2cnc3c(c2)c(=O)[nH]c(=O)n3C)s1 159662438 BIQNXXGGKZASFV-SECBINFHSA-N 394.478 0.901 70 20 GCID CC(C)CC(=O)NCCC(=O)NCCCN1CCN(c2ncccn2)CC1 159799612 VOCAGNDQPONCIE-UHFFFAOYSA-N 376.505 0.657 70 20 GCID O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Nc1cccc(S(=O)(=O)F)c1 460090894 JGIPLLUWDZTFBI-QHSBEEBCSA-N 396.396 0.836 70 20 GCID O=C(COC(=O)c1ccc(S(=O)(=O)F)cc1)NC(=O)NCC(F)(F)F 838088234 QPVOLSRMPVUTMQ-UHFFFAOYSA-N 386.279 0.890 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1[C@H]2CC[C@@H]1C[C@H]2NC(=O)[C@@]12COC[C@@H]1C2 1003298239 BQSOYLDDNFTOKT-KJNLQNJYSA-N 397.428 0.571 70 20 GCID Cc1sc(=O)n(CCC(=O)NC[C@H]2CCC[C@H]2NS(C)(=O)=O)c1C 160279660 BOKBLERJCITFOC-CHWSQXEVSA-N 375.516 0.751 70 20 GCID CC(C)(CNC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1COCC12OCCO2 1337361072 OOSYGJLHOZQUCA-LBPRGKRZSA-N 376.406 0.818 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)NCc1ccc(-c2nn[nH]n2)cn1 1582142312 OXOVZXOIJHASQM-UHFFFAOYSA-N 376.373 0.779 70 20 GCID COC(=O)c1cn([C@H]2CCCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)C2)nn1 1346332444 FOOQHZBFQAHKBQ-VIFPVBQESA-N 385.377 0.528 70 20 GCID CN1CCO[C@@H]2CN(C(=O)CNC(=O)c3ccc(Br)cc3)C[C@@H]21 159721521 CWNSHVIMEJJWMZ-UONOGXRCSA-N 382.258 0.720 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 160326570 DBBCUBAQGWMFPP-QZTJIDSGSA-N 385.468 0.676 70 20 GCID C[C@H]1CC[C@@H](C)N1CCN1CCN(S(=O)(=O)c2cc(C(N)=O)n(C)c2)CC1 161244729 XCYPYYQVBVDCHI-GASCZTMLSA-N 397.545 0.303 70 20 GCID NC(=O)CNC(=O)c1ccc(CNC(=O)c2cccc(S(=O)(=O)F)c2)cc1 1515237650 SMKDORABSQBKLP-UHFFFAOYSA-N 393.396 0.490 70 20 GCID CC[C@@H]1CCCCN1CCNC(=O)c1cc(C)c2c(=O)n(C)c(=O)n(C)c2n1 160248139 DGJKIJUUOKECQX-CQSZACIVSA-N 387.484 0.935 70 20 GCID CN(C)C(=O)Cn1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 460091206 HIIXFEUEOBLWPQ-UHFFFAOYSA-N 390.418 0.430 70 20 GCID O=C(O)CN1CCC[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)C1=O 1606252909 CUTSOUFFRLRKTF-VIFPVBQESA-N 376.337 0.746 70 20 GCID O=C(Cn1nnc(-c2ccccc2)n1)N[C@@H]1CCN(C(=O)c2ccccn2)C1 160169530 PXTGBCJTRBLQOC-OAHLLOKOSA-N 377.408 0.766 70 20 GCID Cc1cc(NC(=O)CN2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)no1 1346208958 OIYPAMTZJCAZOM-UHFFFAOYSA-N 399.404 0.366 70 20 GCID Cc1c(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)cnn1C1CCOCC1 161374983 ICVQRDRDIIOFIO-UHFFFAOYSA-N 389.500 0.923 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N1CC[C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@H]1C 990015086 ARFFDSPMHUCXAT-KLTVKPSUSA-N 387.433 0.817 70 20 GCID CCN1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)CC1 159786107 DYXIUMUDBJRELJ-UHFFFAOYSA-N 388.516 0.858 70 20 GCID COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)C2)nn1 1346332443 FOOQHZBFQAHKBQ-SECBINFHSA-N 385.377 0.528 70 20 GCID O=C1NC(=O)[C@H](Cc2ccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)cc2)N1 1348034014 FILMOQHXMYVTSE-LBPRGKRZSA-N 380.357 0.676 70 20 GCID CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(=O)(=O)F)cc2)CC1 838087746 HWQKHIFLBVYNKF-NSHDSACASA-N 386.401 0.581 70 20 GCID C[C@@H](O)C[C@H](CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 159571343 ZQRAUQULVSUSNW-UKRRQHHQSA-N 399.451 0.105 70 20 GCID O=C([C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1CCc2c(F)cccc2C1 160894650 UKIRMKLMZVQJMW-ZIAGYGMSSA-N 380.441 0.746 70 20 GCID O=C(O)[C@@H]1CC(=O)N(C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)C1 1594898073 VMFLZAYCJCZGHV-SECBINFHSA-N 387.389 0.211 70 20 GCID CN(C)[C@H]1C[C@@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777026197 AJXWXYJRIDMTBF-SFYZADRCSA-N 384.323 0.782 70 20 GCID Cn1ccnc1[C@H]1CNCCN1C(F)(F)COS(=O)(=O)C(F)(F)F 852747978 FGDAAYZWLXDIBK-MRVPVSSYSA-N 378.323 0.825 70 20 GCID CN1CCN(c2ncc(CN3CCCC[C@@H]3CCNS(C)(=O)=O)cn2)CC1 159429208 ZLGMESCLDMWVMV-QGZVFWFLSA-N 396.561 0.522 70 20 GCID COc1cc(C(=O)N2CCN(CCC(=O)O)C[C@H]2C)ccc1S(=O)(=O)F 1599351269 JVNUTGMKIAUEJU-LLVKDONJSA-N 388.417 0.974 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccon1)c1cc(S(=O)(=O)F)c[nH]1 1000528346 XAPUXKFPHNDCQB-WLTAIBSBSA-N 382.373 0.836 70 20 GCID C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 274962550 LFFYWWNVLJDQJL-OJGWYHNPSA-N 396.396 0.834 70 20 GCID CN(C)CCCN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1CCS(=O)(=O)C1 1527977284 PBMYGNHNHNQIDB-LLVKDONJSA-N 395.478 0.254 70 20 GCID O=C(O)C[C@@H]1CS(=O)(=O)CCN1C(=O)c1ccc(S(=O)(=O)F)cc1 1601963505 CJIJYYHPEIWIFO-SNVBAGLBSA-N 379.387 0.059 70 20 GCID Cc1ccc(NC(=O)[C@@H](C)n2cnc(-c3nn[nH]n3)n2)cc1S(=O)(=O)F 1605868608 MQDIRPPTUBCWRG-MRVPVSSYSA-N 380.365 0.625 70 20 GCID Cc1c(C(=O)NC[C@H](c2ccco2)N(C)C)cnc2c1c(=O)n(C)c(=O)n2C 159462112 KEAFTSFMQDSZCY-CYBMUJFWSA-N 385.424 0.566 70 20 GCID CC(C)(C)N1C[C@@H](NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)CC1=O 217286019 LFXVJKNKADILJP-ZDUSSCGKSA-N 382.486 0.575 70 20 GCID C[C@H](O)C[C@@H](CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1 159570903 ZQRAUQULVSUSNW-ZFWWWQNUSA-N 399.451 0.105 70 20 GCID CNC(=O)[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@@H]1c1cnn(C)c1 865210876 SLEZXBFUNFDWAA-CABCVRRESA-N 394.428 0.680 70 20 GCID COC(=O)[C@@H]1CC[C@H](C(=O)O)N(C(=O)Cc2ccc(S(=O)(=O)F)cc2)C1 1598771904 DJESZVGHJYWSQR-DGCLKSJQSA-N 387.385 0.752 70 20 GCID Cc1cnn(Cc2cc(C(=O)N3CC[C@H](S(=O)(=O)NC(C)C)C3)no2)c1 160687232 APHGWPRUYNXUBF-AWEZNQCLSA-N 381.458 0.770 70 20 GCID Cc1noc(CN2CCN(C(=O)N[C@@H]3CCc4nc(C(C)C)nn4C3)CC2)n1 161430465 RHDJQWUASNPDGP-CQSZACIVSA-N 388.476 0.935 70 20 GCID CCCn1c(=O)[nH]c(=O)c2cc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cnc21 159856898 KPUXLBSGFCMTDT-JKSUJKDBSA-N 380.404 0.883 70 20 GCID O=C(Cn1nc2ccccn2c1=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 160082650 JAAZORFPYLCUQI-UHFFFAOYSA-N 391.435 0.717 70 20 GCID CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)N1CCCN(CC(F)F)CC1 161507102 WHZBSXOYVXHJOC-OAHLLOKOSA-N 389.491 0.912 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc[nH]n1)c1cc(S(=O)(=O)F)c[nH]1 1000526152 FEEPRQOXEACWFW-WLTAIBSBSA-N 381.389 0.572 70 20 GCID COCCN(Cc1ccco1)C(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C 161102418 WUMHOVGMJUYPDZ-UHFFFAOYSA-N 386.408 0.822 70 20 GCID O=C(NC1CC1)[C@@H]1CCCN1C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O 160143852 TVPSPXSNGSCDCG-NEPJUHHUSA-N 376.379 0.992 70 20 GCID CCn1cc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)c(C(N)=O)n1 460095453 OUUYQJZRUHGJKU-UHFFFAOYSA-N 376.391 0.461 70 20 GCID O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 161472275 ADDQMUYBCGEWEY-GFCCVEGCSA-N 383.399 0.994 70 20 GCID O=C(O)CC1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCS(=O)(=O)CC1 1608685838 AGWJFUQVIVKKHR-UHFFFAOYSA-N 393.414 0.497 70 20 GCID NC(=O)CCn1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 460090387 GALFKKABNXLNNT-UHFFFAOYSA-N 376.391 0.218 70 20 GCID O=C(N[C@@H]1Cc2ccc(-c3nn[nH]n3)cc2C1)c1cc(S(=O)(=O)F)c[nH]1 1593004399 LRKIXIOECURJOS-LLVKDONJSA-N 376.373 0.750 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCC[C@@H]1[C@H](O)C(F)(F)F)CC2 160644172 IEQCOMLVTLAHKW-BREBYQMCSA-N 377.367 0.837 70 20 GCID c1cnn(CCNc2nc(NCCn3cccn3)nc(N3CCOCC3)n2)c1 160763933 HPIVBUPBZGSLLC-UHFFFAOYSA-N 384.448 0.325 70 20 GCID O=C(N[C@H]1CCN(C2CCCC2)C1)N1CCN(c2ccc3nncn3n2)CC1 160891904 UWXZZAXGJCPELC-HNNXBMFYSA-N 384.488 0.973 70 20 GCID Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@H]2CCc3[nH]ncc3C2)s1 159459146 CIAZUCLNZMNITF-LBPRGKRZSA-N 383.499 0.915 70 20 GCID O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1cnc2c(c1)c(=O)[nH]c(=O)n2C1CC1 159787670 WBXSCXPVUSSFPN-JKSUJKDBSA-N 378.388 0.808 70 20 GCID COCCCNC(=O)[C@@H](C)N1CCN(C(=O)[C@@H]2CCn3ccnc3C2)CC1 161410988 FKUKWLXLQHHMDI-HZPDHXFCSA-N 377.489 0.131 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccc(S(=O)(=O)F)cc1 865208354 HSAHNFVBKYDKJT-DDHJSBNISA-N 392.408 0.882 70 20 GCID COC(=O)C1CCC(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)(C(=O)OC)CC1 1348707311 LKIQTNOAETZYRC-UHFFFAOYSA-N 390.389 0.678 70 20 GCID Cc1cc(C(=O)NCc2cn3cccc(C)c3n2)nc2c1c(=O)n(C)c(=O)n2C 159475092 QWYBJJACIZLZCS-UHFFFAOYSA-N 392.419 0.827 70 20 GCID CN1CCN(CCCN(C)CC(=O)NC[C@H](c2ccccc2)N(C)C)CC1 160140047 HHBCZNVBSVRSOM-HXUWFJFHSA-N 375.561 0.975 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC(S(=O)(=O)N2CCCC2)CC1 1263791502 WYNOZITYYJMUTG-UHFFFAOYSA-N 393.462 0.703 70 20 GCID O=C(CCNC(=O)C1CCCCC1)NCCN1CCN(c2ncccn2)CC1 160563906 LFCDHJWILYXEEG-UHFFFAOYSA-N 388.516 0.801 70 20 GCID O=C(CNC(=O)Cc1ccc(S(=O)(=O)F)cc1)NCCN1CCCCCC1 1121217702 OSBKSMRJEAEMPA-UHFFFAOYSA-N 399.488 0.996 70 20 GCID CCOC(=O)c1cn(CCS(=O)(=O)F)nc1I 883953801 LNEPXEXZPAJTSE-UHFFFAOYSA-N 376.147 0.964 70 20 GCID COc1cc(C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)ccc1S(=O)(=O)F 1599355357 PIMYVMWUNFKDKS-YUMQZZPRSA-N 376.362 0.061 70 20 GCID COCCCNC(=O)CN(C)[C@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1 159471180 YVXVVWPMXLQFKL-MRXNPFEDSA-N 394.491 0.947 70 20 GCID O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Nc1ccc(S(=O)(=O)F)cc1 275016473 YPBCWEINLSFNHL-QHSBEEBCSA-N 396.396 0.836 70 20 GCID CNC(=O)Cn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cn1 460096824 RWGINWXJUFPOSC-UHFFFAOYSA-N 376.391 0.088 70 20 GCID COC[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1109731861 QCYBBWVWCFYWHR-IHOMSZDFSA-N 375.422 0.015 70 20 GCID Cc1cc(C(=O)NC[C@@H](CC(C)C)N(C)C)nc2c1c(=O)n(C)c(=O)n2C 160046199 FGWPOOKGPHCYPJ-CYBMUJFWSA-N 375.473 0.647 70 20 GCID Cc1c(C(=O)NCc2ccccc2CN(C)C)cnc2c1c(=O)n(C)c(=O)n2C 159827771 PKIQNQFWGSFWHO-UHFFFAOYSA-N 395.463 0.932 70 20 GCID O=C(Cn1cnnn1)N1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1 160477053 OIRNSZOVNIKNTH-ROUUACIJSA-N 397.483 0.938 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCO)c1cc(S(=O)(=O)F)c[nH]1 1109726193 JRSOSUNZHSSZSF-OSMZGAPFSA-N 375.422 0.017 70 20 GCID Cc1c(C(=O)N[C@H]2CCN(c3ccccn3)C2)cnc2c1c(=O)n(C)c(=O)n2C 161247317 BKLSVVOEAOKLKA-ZDUSSCGKSA-N 394.435 0.344 70 20 GCID CCN(C(=O)[C@H](C)N1CCN(c2ccncc2)CC1)[C@@H]1CCS(=O)(=O)C1 161389370 LAVLMRNXOXJLFI-DOTOQJQBSA-N 380.514 0.628 70 20 GCID COC(=O)[C@@H](NC(=O)COC(=O)c1ccc(S(=O)(=O)F)cc1)C(C)C 838091849 FCEXQFGQAGLLHB-ZDUSSCGKSA-N 375.374 0.815 70 20 GCID C[C@@H]1CN(C(=O)[C@H]2OCC[C@H]2C)C[C@H]1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 940341777 VOIQECVXCLGWQP-MHWZDGSBSA-N 387.433 0.675 70 20 GCID CN1C(=O)CO[C@@H](C(=O)Nc2cccc(S(=O)(=O)F)c2)[C@@H]1c1cnn(C)c1 280126327 UWALDAKVDFFZGH-LSDHHAIUSA-N 396.400 0.615 70 20 GCID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2cncc(N3CCCC3)n2)cc1 460093800 MDMBUPMOQKLZLV-UHFFFAOYSA-N 386.430 1.536 70 20 GCID O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Nc1ccc(S(=O)(=O)F)cc1 274948522 HRGOSDDSWCGFRV-HBJVGIJOSA-N 382.369 0.446 70 20 GCID Cc1c(C(=O)NCc2cn3ccccc3n2)cnc2c1c(=O)n(C)c(=O)n2C 159693176 DGOAHKVLJUXDLS-UHFFFAOYSA-N 378.392 0.518 70 20 GCID C[C@@H](C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1)n1cnc(-c2nn[nH]n2)n1 1589017921 NABHHEGMZOQFHH-LURJTMIESA-N 384.328 0.455 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1000526163 FLKCDLNRXYWJLW-SLFYDOTPSA-N 399.444 0.960 70 20 GCID CCN(C(=O)NCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCS(=O)(=O)C1 217306179 LYWQRJYMXKGVER-CYBMUJFWSA-N 393.465 0.891 70 20 GCID O=C(C1=CCCC1)N1CCN(S(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)CC1 160143781 BGJJDXKSVFLOHN-UHFFFAOYSA-N 376.438 0.799 70 20 GCID C[C@H](CNC(=O)c1cc(N2CCNC2=O)ccc1F)CN1CCN(C)CC1 160106215 WIZBRODMRXKBMR-CQSZACIVSA-N 377.464 0.969 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1 1006371537 UGOUTVRYVJLCHQ-CZQLTYJNSA-N 399.444 0.960 70 20 GCID Cn1nncc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863541 OJPCHDBQMAJVFX-IUPBHXKESA-N 382.421 0.337 70 20 GCID CN(C)CCN1C[C@H](C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)CC1=O 160035596 CZNUWONGNJRXOL-MRXNPFEDSA-N 398.511 0.617 70 20 GCID CCn1nccc1CNCCS(=O)(=O)N1CCN(c2ccccn2)CC1 160057551 WKOXLUPZMPYZIN-UHFFFAOYSA-N 378.502 0.540 70 20 GCID Cn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550255534 CZFGEDKDGNJZEX-DOMZBBRYSA-N 380.401 0.828 70 20 GCID Cn1cc(-c2nc(C(=O)NC[C@H]3CCC[C@H]3NS(C)(=O)=O)cs2)cn1 160302174 NNYLAUMBYAFHGN-ZYHUDNBSSA-N 383.499 0.991 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)N1CCS(=O)(=O)C[C@@H]1C1CC1 1338183981 MBZKHCIDWWQVNU-CQSZACIVSA-N 375.443 0.923 70 20 GCID CN1CCO[C@H]2CN(C(=O)CNC(=O)c3cccc(Br)c3)C[C@@H]21 159720176 PJVPFBUCITWPHR-KBPBESRZSA-N 382.258 0.720 70 20 GCID CS(=O)(=O)Cc1ccc(NC(=O)Cn2nc3ccccn3c2=O)cc1F 160566230 LRTWXTFNBHIYAY-UHFFFAOYSA-N 378.385 0.818 70 20 GCID COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1123742990 MKGOHTHHADABCN-NSHDSACASA-N 377.394 0.107 70 20 GCID CCN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1 159588108 MTRJYRKFYIXHOV-UHFFFAOYSA-N 375.521 0.726 70 20 GCID CN[C@@H]1CCN(C(=O)CCNS(=O)(=O)c2ccc(Br)cc2)C1 160602409 NKLOCLFWQPMJFK-GFCCVEGCSA-N 390.303 0.938 70 20 GCID C[C@](CNCCc1cnn[nH]1)(NC(=O)c1cc(S(=O)(=O)F)c[nH]1)C1CC1 1575609857 AZUZRSXRWFMRKV-OAHLLOKOSA-N 384.437 0.522 70 20 GCID Cn1cncc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 865211120 JVGHSBGKLUNUPW-IUODEOHRSA-N 380.401 0.828 70 20 GCID CC(C)(C)S(=O)(=O)N1CCC(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1354884493 FHZZLCPWHDAQJS-UHFFFAOYSA-N 395.478 0.995 70 20 GCID Cc1cc(C(=O)Nc2cccc([S@](C)=O)c2)nc2c1c(=O)n(C)c(=O)n2C 159740951 XUKVLDHVWMBDCY-HHHXNRCGSA-N 386.433 0.930 70 20 GCID CN(CC(C)(C)CN1CCOCC1)C(=O)CN(C)c1ncnc2nc[nH]c12 160106096 NIYWGCVMRXJCFM-UHFFFAOYSA-N 375.477 0.606 70 20 GCID COc1cc(S(=O)(=O)F)c(Cl)cc1C(=O)N[C@@]1(C(=O)O)CCOC1 1594067909 XDCSEAHOGWULAS-ZDUSSCGKSA-N 381.765 0.980 70 20 GCID CS(=O)(=O)Nc1ccc(C(=O)Nc2cncc(OS(=O)(=O)F)c2)cn1 2088594917 HORSNUVMSKMFSW-UHFFFAOYSA-N 390.374 0.694 70 20 GCID Cc1cc(N2CCN(C(=O)CNC(=O)CC3CCCC3)CC2)n2ncnc2n1 159953044 SJIAQVLGAYGEKC-UHFFFAOYSA-N 385.472 0.778 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)NC[C@@H](O)CN2CCC(C)CC2)c1CC 160407501 KBZSTEKLPGESCA-CQSZACIVSA-N 379.505 0.787 70 20 GCID CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F 160491648 BQMJGQVDOTVYLE-RAIGVLPGSA-N 386.420 0.830 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)C1=CN2CCS(=O)(=O)N=C2C=C1 460088695 DEQYZCFPMFJDNF-UHFFFAOYSA-N 385.398 0.781 70 20 GCID CN(CCNC(=O)CCCc1cnn[nH]1)C(=O)c1cc(S(=O)(=O)F)c[nH]1 1576821696 HXJSNHZYARUOAE-UHFFFAOYSA-N 386.409 0.002 70 20 GCID O=S(=O)(F)c1ccc(N2CCN(C[C@H]3CCCS3(=O)=O)CC2)nc1 1550634425 LZIKNGPVNOKRID-CYBMUJFWSA-N 377.463 0.439 70 20 GCID O=C(Nc1ncc(S(=O)(=O)F)s1)[C@H]1CC[C@@H](CN2CCOCC2)O1 1553321289 ZEKGFFWRMGFSEF-VHSXEESVSA-N 379.435 0.620 70 20 GCID COC(=O)[C@H]1CC[C@H](C(=O)O)CN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1598765426 IXQVCCVRHVAJBR-WCQYABFASA-N 387.385 0.752 70 20 GCID CC(C)CCn1ccc(NC(=O)C(=O)NC[C@@H](C)CN2CCN(C)CC2)n1 160393955 CLGUSEGPNVGDPJ-MRXNPFEDSA-N 378.521 0.867 70 20 GCID CC(=O)N[C@@]1(c2nc(C)no2)CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)C1 865211251 LYNDSWMHPDDTBG-INIZCTEOSA-N 396.400 0.914 70 20 GCID CN(C[C@@H]1CCCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)S(C)(=O)=O 1337490119 GZFDOFHDCGIVGE-JTQLQIEISA-N 381.451 0.417 70 20 GCID O=C1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)c2cc(-c3nn[nH]n3)ccc2N1 1607047135 WIYOJXZZAWWHGW-UHFFFAOYSA-N 391.344 0.452 70 20 GCID COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1263697107 LWGNAJUPWNSLPG-WDEREUQCSA-N 375.422 0.676 70 20 GCID CN1CCO[C@@H]2CN(C(=O)CNC(=O)c3ccc(Br)s3)C[C@@H]21 159669418 XNSTVYDJMNCSIZ-VHSXEESVSA-N 388.287 0.782 70 20 GCID O=C(NCCS(=O)(=O)N1CCSCC1)c1ccc(S(=O)(=O)F)cc1 865207252 FBFCVGFGTMDTNB-UHFFFAOYSA-N 396.487 0.453 70 20 GCID CN(C)c1nc(N)nc(Cn2nnc(Cc3ccccc3Br)n2)n1 160043664 NRQMMVMOPWGLFP-UHFFFAOYSA-N 390.249 0.908 70 20 GCID C[C@H](C(=O)N(C)CC(=O)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1)n1cccn1 160637427 WSAUNUQWVHCXHR-NEWSRXKRSA-N 399.495 0.654 70 20 GCID Cc1c(C(=O)NCCCN2CCCC[C@H]2C)cnc2c1c(=O)n(C)c(=O)n2C 159768630 FWELQSVPEQJEKB-CYBMUJFWSA-N 387.484 0.935 70 20 GCID C[C@H](CC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)[C@H]1CCCNC1 160751997 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GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)NCC(C)(C)O)c(Br)cc21 160993937 NEIAFEIGRUPXBA-UHFFFAOYSA-N 392.275 0.689 70 20 GCID O=C1C[C@H](C(=O)N2CCc3c(F)cccc3C2)CN1CCN1CCOCC1 161054733 MJMQKOFEEULJLD-INIZCTEOSA-N 375.444 0.891 70 20 GCID O=C(N[C@H]1Cc2ccc(-c3nn[nH]n3)cc2C1)c1cc(S(=O)(=O)F)c[nH]1 1593004401 LRKIXIOECURJOS-NSHDSACASA-N 376.373 0.750 70 20 GCID Cn1cnc2cc(C(=O)N3CCN([C@@H](C(N)=O)c4ccccc4)CC3)cnc21 160050125 DUIOXHQFXULFOG-QGZVFWFLSA-N 378.436 0.953 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)C#CC1CC1)c1cc(S(=O)(=O)F)c[nH]1 1006340264 QPGNXGQTIYFUTJ-KYOSRNDESA-N 379.413 0.948 70 20 GCID CCOC(=O)[C@@H]1CN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC12COC2 1262799596 KNRICULPGOVRGB-AWEZNQCLSA-N 385.413 0.925 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccn1)CC2 160797880 QFCAZNMVRXYIBB-INIZCTEOSA-N 387.488 0.908 70 20 GCID CCNS(=O)(=O)[C@H]1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 160235008 GPNJKHZFRXRVLR-IRXDYDNUSA-N 382.530 0.419 70 20 GCID C[C@H](OC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@@H](C(N)=O)C1 838087649 GTJYCFOYBHEWLV-CMPLNLGQSA-N 386.401 0.614 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 1337810804 WUXNYRUZOFPQME-LLVKDONJSA-N 378.447 0.759 70 20 GCID O=C(NCC1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 1004490884 YULWDZJCRGRRIN-MIBAYGRRSA-N 397.428 0.285 70 20 GCID Cc1ccc(NC(=O)C2(C(=O)O)CCS(=O)(=O)CC2)cc1S(=O)(=O)F 1594369391 NCAACJMMFQUMIG-UHFFFAOYSA-N 393.414 0.871 70 20 GCID CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1cc(S(N)(=O)=O)ccc1F)CC2 216725131 OCSNTQKLFWNNPA-LSDHHAIUSA-N 386.445 0.865 70 20 GCID CN1CCO[C@H]2CN(C(=O)CNC(=O)c3ccc(Br)s3)C[C@@H]21 159669282 XNSTVYDJMNCSIZ-UWVGGRQHSA-N 388.287 0.782 70 20 GCID Cc1cc(C(=O)N(CCN(C)C)C2CCCC2)nc2c1c(=O)n(C)c(=O)n2C 160060120 TYLVAOXZWJNXIF-UHFFFAOYSA-N 387.484 0.887 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)[C@H](C(=O)OC)C1 865209714 DRECDQQKKXDGOE-AAEUAGOBSA-N 387.385 0.912 70 20 GCID Cn1ncc2c(N3CCN(C(=O)N[C@H]4CCN(CC5CC5)C4)CC3)ncnc21 160659441 RJWDHVPLTPCCHU-HNNXBMFYSA-N 384.488 0.679 70 20 GCID CNS(=O)(=O)Nc1ccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1346847594 CRGQSEBXQBTLNK-UHFFFAOYSA-N 376.391 0.801 70 20 GCID CCN1CCN([C@H]2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C2)CC1 216970594 KHPNYGWSHZTUOV-INIZCTEOSA-N 384.480 0.911 70 20 GCID C[C@@H](C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1)n1cnc(-c2nn[nH]n2)n1 1573756195 NNCVLBLZGAVYSY-ZETCQYMHSA-N 398.355 0.596 70 20 GCID O=C(c1ccc(=O)[nH]c1)N1CCN(C[C@H](O)COCc2ccccc2F)CC1 159441425 NGPHLHNOSDVDRM-KRWDZBQOSA-N 389.427 0.850 70 20 GCID O=C(Nc1ncc(S(=O)(=O)F)s1)[C@@H]1CC[C@H](CN2CCOCC2)O1 906084469 ZEKGFFWRMGFSEF-ZJUUUORDSA-N 379.435 0.620 70 20 GCID CC(=O)N[C@@H](CSC(F)(F)COS(=O)(=O)C(F)(F)F)C(=O)O 1589157485 OXAZIBKYRUORHP-YFKPBYRVSA-N 375.293 0.768 70 20 GCID C[C@H]1C[C@H](NC(=O)N2CCN(S(C)(=O)=O)CC2)CN1Cc1ccccc1 160040916 JNYWHRJPDHRYSA-RDJZCZTQSA-N 380.514 0.936 70 20 GCID O=C(NC1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 999951614 GWFXHGYTUBVEFJ-QXJJFIIZSA-N 383.401 0.037 70 20 GCID Cc1nn(C)c(C)c1-c1cc(C(=O)NC[C@@H]2CCC[C@H]2NS(C)(=O)=O)[nH]n1 160517999 ZDOJMEQRIOPGJT-QWHCGFSZSA-N 394.501 0.875 70 20 GCID CCN(C(=O)[C@@H](C)N1CCN(Cc2ccncc2)CC1)[C@@H]1CCS(=O)(=O)C1 161230993 DRPAZFCQXDBTAP-SJLPKXTDSA-N 394.541 0.623 70 20 GCID NCc1cn([C@H]2CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C2)nn1 852750636 ARFRMQYOZCYUKC-VIFPVBQESA-N 393.338 0.833 70 20 GCID C[C@H](C(=O)NCc1ccccc1F)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 159433253 RGRYMYABRCFMDC-CQSZACIVSA-N 386.427 0.977 70 20 GCID CCCn1c(=O)[nH]c(=O)c2cc(C(=O)N[C@@H]3c4ccccc4C[C@H]3O)cnc21 159857169 KPUXLBSGFCMTDT-HZPDHXFCSA-N 380.404 0.883 70 20 GCID Cc1c(C(=O)N(C)Cc2nccn2C(F)F)cnc2c1c(=O)n(C)c(=O)n2C 160833056 OMGNLHJEBWNCOG-UHFFFAOYSA-N 392.366 0.804 70 20 GCID CCN(C1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1)S(C)(=O)=O 1346291699 TZJKQFTUGIJZPG-UHFFFAOYSA-N 381.451 0.559 70 20 GCID C[C@@H](CNC(=O)c1cc(N2CCNC2=O)ccc1F)CN1CCN(C)CC1 160106088 WIZBRODMRXKBMR-AWEZNQCLSA-N 377.464 0.969 70 20 GCID NS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)c1 780363788 UILOXYKNWQDWJP-UHFFFAOYSA-N 394.427 0.793 70 20 GCID CCS(=O)(=O)CCn1cc(C)c(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n1 1346850308 VHYRYRSFBDWWTB-UHFFFAOYSA-N 392.434 0.865 70 20 GCID CN(C)C(=O)Cn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cn1 460097862 UYBYQQHEHPMLIH-UHFFFAOYSA-N 390.418 0.430 70 20 GCID CN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)C1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1 955355276 LTCAAHWXZWDCKP-MIBAYGRRSA-N 397.428 0.379 70 20 GCID COc1cc(C(=O)Nc2c(-c3nn[nH]n3)c(C)nn2C)ccc1S(=O)(=O)F 1591517465 VATVOIFXPYFAOR-UHFFFAOYSA-N 395.376 0.828 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)NCc2cn(C)nc2C(F)(F)F)CC1 160823095 ZRRRJVYYPOCXBC-UHFFFAOYSA-N 383.396 0.616 70 20 GCID O=C(O)c1cnc(O)c(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)c1 1602233553 KTYBUFHCBAGXIQ-UHFFFAOYSA-N 376.343 0.944 70 20 GCID O=C(CNC(=O)c1c[nH]nc1-c1c(F)cccc1F)NCCN1CCOCC1 159902736 RBYYYNVPCOHQKV-UHFFFAOYSA-N 393.394 0.533 70 20 GCID CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1349622289 IYYNQTAIESKDHG-OZAJXLCCSA-N 388.446 0.835 70 20 GCID Cn1cc([C@@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@H]2C(N)=O)cn1 1550255562 DHWJKENNAKMNFN-UONOGXRCSA-N 380.401 0.419 70 20 GCID CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C)c(S(=O)(=O)F)c1 857675275 IQKLCFCRKPOVPR-CYBMUJFWSA-N 385.417 0.719 70 20 GCID NC(=O)CNC(=O)c1cccc(NC(=O)c2cccc(S(=O)(=O)F)c2)c1 1339472929 WRBQRWJUQHQSOA-UHFFFAOYSA-N 379.369 0.812 70 20 GCID NC(=O)CCn1ccc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)n1 460089766 DXWPAFJPWQXLMC-UHFFFAOYSA-N 376.391 0.218 70 20 GCID C[C@@H](CC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)[C@H]1CCCNC1 160751904 KOFQCQOTVHDDJZ-GJZGRUSLSA-N 397.545 0.715 70 20 GCID O=C(NCc1ccc(S(=O)(=O)CCO)cc1)c1cc(S(=O)(=O)F)c[nH]1 1123727899 RSOYWMNOCFVARM-UHFFFAOYSA-N 390.414 0.369 70 20 GCID O=C(Nc1ncc(S(=O)(=O)F)s1)[C@@H]1CC[C@@H](CN2CCOCC2)O1 1553321287 ZEKGFFWRMGFSEF-UWVGGRQHSA-N 379.435 0.620 70 20 GCID O=C(NCc1n[nH]c(=O)[nH]1)c1ccc(=O)n(CCOc2ccccc2Cl)c1 160123792 JQFWEUAXQJVSIV-UHFFFAOYSA-N 389.799 0.922 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(Cc3cc(C)no3)CC1)CC2 161081279 BWUGMYYMXUHDFG-CQSZACIVSA-N 389.460 0.563 70 20 GCID CN(CC(=O)N1CCN(c2ncnc3c2cnn3C)CC1)C[C@@H]1CCC[C@@H]1O 159470017 KYQNGYXNUZPECJ-HOCLYGCPSA-N 387.488 0.105 70 20 GCID O=C(Nc1ncc(S(=O)(=O)F)s1)[C@H]1CC[C@H](CN2CCOCC2)O1 1553321278 ZEKGFFWRMGFSEF-NXEZZACHSA-N 379.435 0.620 70 20 GCID CN1C[C@@H](C(=O)O)N(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)CC1=O 1606200279 PDSVFCHGGNSVSE-JTQLQIEISA-N 378.765 0.366 70 20 GCID CCN(C(=O)[C@H](C)N1CCN(Cc2ccncc2)CC1)[C@H]1CCS(=O)(=O)C1 161231358 DRPAZFCQXDBTAP-WMZOPIPTSA-N 394.541 0.623 70 20 GCID O=C(NC[C@H]1CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 951358985 ZJMOHVSONCBTJY-MHVRPGDESA-N 397.428 0.427 70 20 GCID O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NC1CCN(C2CC2)CC1 161247390 FCFVBOGBMUHZAF-UHFFFAOYSA-N 386.500 0.648 70 20 GCID CCc1c(C(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)cnc2c1c(=O)n(C)c(=O)n2C 160091846 HYGQWDSPRCIOMB-BBRMVZONSA-N 399.495 0.751 70 20 GCID Cc1nc(N2CCN(C(=O)c3cnc4c(c3)ncn4C)CC2)c2cnn(C)c2n1 160505664 URZXFBJUCHWCPT-UHFFFAOYSA-N 391.439 0.916 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 160769811 NGUNANUGLGORSJ-IAGOWNOFSA-N 386.452 0.830 70 20 GCID Cn1cc(CNC(=O)NC[C@](C)(O)CN2CCOCC2)c(C(F)(F)F)n1 160763757 ITOKDWSMLIUYBC-AWEZNQCLSA-N 379.383 0.321 70 20 GCID O=C(CCn1[nH]c(=O)c2ccccc2c1=O)N[C@H]1CCN(c2ccccn2)C1 161270822 XUVXCEPNTYVQMH-AWEZNQCLSA-N 379.420 0.870 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N(CCN(C)C)Cc1ccccn1)CC2 160797749 QFCAZNMVRXYIBB-MRXNPFEDSA-N 387.488 0.908 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cocn1 1001664954 DXNRWZPWUWJMAZ-JQEORGNBSA-N 382.373 0.836 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)[C@H](C)C1 1338177941 CRKYMBWQAXKSKK-GFCCVEGCSA-N 392.474 0.770 70 20 GCID O=C(CN1CCC[C@H](C(=O)O)C1=O)Nc1ccc(F)c(CS(=O)(=O)F)c1 1601310989 ABDLVHUFEQSVDX-NSHDSACASA-N 390.364 0.887 70 20 GCID CN[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCC2)C1 160793772 UMEHMYHIFXHYHF-CQSZACIVSA-N 380.514 0.971 70 20 GCID Cc1cc(C(=O)N2CCC[C@H](N3CCCC3)C2)nc2c1c(=O)n(C)c(=O)n2C 159402027 BMHJURLJQNFSCT-AWEZNQCLSA-N 385.468 0.641 70 20 GCID O=C(NCCc1cc2ccccc2[nH]1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 159582480 FNEJRQJVKGYFKF-GDBMZVCRSA-N 389.477 0.862 70 20 GCID Cc1nc(S(=O)(=O)NCC(=O)NCCc2cc3ccccc3[nH]2)cn1C 159601795 ZVIKTGBVJSQEDH-UHFFFAOYSA-N 375.454 0.847 70 20 GCID CS(=O)(=O)c1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1 460093869 MIMQABSDCYNZEF-UHFFFAOYSA-N 394.427 0.944 70 20 GCID Cc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1S(=O)(=O)F 857675401 MGBKCMBWWFLUKY-YIKOMLBNSA-N 396.396 0.754 70 20 GCID O=C(NCC1(N2CCOCC2)CCOCC1)c1ccc(S(=O)(=O)F)cc1 865211382 QRUTWLSDDHODFN-UHFFFAOYSA-N 386.445 0.956 70 20 GCID CNS(=O)(=O)Cc1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1120866794 WWPOPCILRZLVKX-UHFFFAOYSA-N 389.430 0.652 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1262673258 FVGWFQDYPJJYOH-WDEREUQCSA-N 394.446 0.481 70 20 GCID CC(C)(C)OC(=O)NCCNC(=O)NCCc1ccc(S(N)(=O)=O)cc1 217263799 UTLPMGRHYRZYBC-UHFFFAOYSA-N 386.474 0.700 70 20 GCID Cc1ccc(-c2n[nH]c(NC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)o1 161404519 NMFPWVDTHPZDRN-UHFFFAOYSA-N 397.395 0.672 70 20 GCID CN1C[C@@H](C(=O)O)N(C(=O)c2ccc(S(=O)(=O)F)cc2Cl)CC1=O 1598563645 UKCMLAIQNQUIPW-JTQLQIEISA-N 378.765 0.366 70 20 GCID COCCN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@H]1CCS(=O)(=O)C1 1337923978 XMQIXGKIFYLOHC-ZDUSSCGKSA-N 393.458 0.549 70 20 GCID O=C(Nc1nc2n(c1-c1nn[nH]n1)CCS2)c1cc(S(=O)(=O)F)c[nH]1 1582653511 OTLQZOISSHCMSV-UHFFFAOYSA-N 384.378 0.408 70 20 GCID C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)N[C@@H]2CCc3ncnn3C2)CC1 160979256 CDFYCQBMOIVDNE-HZPDHXFCSA-N 389.504 0.321 70 20 GCID CCc1c(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)cnn1CC(C)C 161286034 MRUWMJANHNTGSD-UHFFFAOYSA-N 391.516 0.718 70 20 GCID Cn1ncc2c(N3CCN(C(=O)c4cc(S(=O)(=O)F)c[nH]4)CC3)ncnc21 1527340320 HIRFWTXHBPMUMK-UHFFFAOYSA-N 393.404 0.312 70 20 GCID O=C(O)[C@H]1CC(=O)N(C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)C1 1594898074 VMFLZAYCJCZGHV-VIFPVBQESA-N 387.389 0.211 70 20 GCID COc1ccc(N(C)C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1F 159733217 JVQMPMSHZKOZIW-UHFFFAOYSA-N 375.360 0.244 70 20 GCID O=C(NCCN1CCN(c2ncccn2)CC1)c1ccc(C(=O)NC2CC2)cc1 160202025 KSWSQGKFORCJCM-UHFFFAOYSA-N 394.479 0.921 70 20 GCID COCCCN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@H]1CCS(=O)(=O)C1 1120866605 SRKYYZRTFLFQPJ-JTQLQIEISA-N 382.435 0.339 70 20 GCID COCCCNC(=O)C1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346291295 PPOQYJDNAIXOFX-UHFFFAOYSA-N 375.422 0.678 70 20 GCID NC(=O)CNC(=O)c1cccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c1 865205048 FKYMPIQKLQTQQG-UHFFFAOYSA-N 379.369 0.812 70 20 GCID Cc1cc(N2CC[C@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)n(C)n1 160452043 BUWQGIPIIMAWMZ-KRWDZBQOSA-N 397.483 0.756 70 20 GCID O=C(N[C@H]1CCCN(CCN2CCOCC2)C1)c1cc(S(=O)(=O)F)c[nH]1 1350388960 QGRKIULOPRWMTK-ZDUSSCGKSA-N 388.465 0.199 70 20 GCID COCCCNC(=O)CN(C)[C@@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1 159471029 YVXVVWPMXLQFKL-INIZCTEOSA-N 394.491 0.947 70 20 GCID Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NC[C@@H](O)CN1CCCCC1 159920608 COGBSEUYZVOLJN-MSOLQXFVSA-N 390.463 0.867 70 20 GCID COC[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1111032781 QCYBBWVWCFYWHR-JCRCQARHSA-N 375.422 0.015 70 20 GCID O=C(Nc1cnn(CC(F)F)c1)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 161480728 LMDRYBGCTTWWFH-LBPRGKRZSA-N 383.399 0.994 70 20 GCID Cn1ncc(CN2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n1 1096026262 ROWPIBIPAWHELV-OSMZGAPFSA-N 382.421 0.337 70 20 GCID Cc1cc(N2CC[C@@H](NC(=O)c3cccc(S(=O)(=O)F)c3)C2=O)n(C)n1 1338259655 FDYWFAQQSNCHBX-CYBMUJFWSA-N 380.401 0.922 70 20 GCID CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)c2cccc(S(=O)(=O)F)c2)C1=O 1348707611 NXOKAPLNSIIUSY-MEDUHNTESA-N 383.401 0.795 70 20 GCID Cc1c(C(=O)N(CCO)Cc2ccccc2)cnc2c1c(=O)n(C)c(=O)n2C 159581410 MKPYRDXYJQZVJZ-UHFFFAOYSA-N 382.420 0.575 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)N2CC[C@H](N3CCN(CC)CC3)C2)c1CC 160392155 QDIBMWRNQVTBHG-HNNXBMFYSA-N 390.532 0.816 70 20 GCID COCCN(C(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1)[C@H]1CCS(=O)(=O)C1 217285923 MQQFMIGURFXWQI-OLZOCXBDSA-N 375.491 0.231 70 20 GCID Cn1c(CCC(N)=O)nnc1SC(F)(F)COS(=O)(=O)C(F)(F)F 1327193287 JAFNLAKXLUYJNZ-UHFFFAOYSA-N 398.335 0.784 70 20 GCID COCCO[C@@H]1COCC[C@@H]1NC(=O)Cc1ccc(S(=O)(=O)F)cc1 1338085491 USCUYEQXSFATFQ-LSDHHAIUSA-N 375.418 0.824 70 20 GCID CC(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1 857674190 DZKZRQWBEAQZQW-LBPRGKRZSA-N 389.380 0.550 70 20 GCID O=C(N[C@@H]1CN(C(=O)[C@@]23CCC[C@@H]2C3)C[C@@H]1O)c1cc(S(=O)(=O)F)c[nH]1 970677347 WVOBCRUIKLWCFT-NJYNRLGGSA-N 385.417 0.165 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1006337437 FLKCDLNRXYWJLW-CZQLTYJNSA-N 399.444 0.960 70 20 GCID Cn1ccnc1[C@@H]1CNCCN1C(F)(F)COS(=O)(=O)C(F)(F)F 852747979 FGDAAYZWLXDIBK-QMMMGPOBSA-N 378.323 0.825 70 20 GCID O=C(NC[C@@H](O)CS(=O)(=O)c1cccs1)c1cc(S(=O)(=O)F)c[nH]1 1123647587 ABXISSDLATUYGA-MRVPVSSYSA-N 396.443 0.299 70 20 GCID C[C@@H](CNC(=O)C(=O)Nc1ccc(Br)nc1)CN1CCN(C)CC1 160394250 VEWWTHMCDMWNRD-LBPRGKRZSA-N 398.305 0.782 70 20 GCID NS(=O)(=O)CCN1CCN(C(=O)c2cc(-c3ccc(F)cc3)on2)CC1 161266382 PFJRPDGMBYCWNE-UHFFFAOYSA-N 382.417 0.527 70 20 GCID NCCC(=O)NC[C@H]1CCCCN1C(F)(F)COS(=O)(=O)C(F)(F)F 852748115 JSNABXCVLCLCQN-SECBINFHSA-N 397.366 0.765 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCN(S(=O)(=O)N(C)C)CC1 1337367724 BASPSPFQTVUVEX-UHFFFAOYSA-N 393.462 0.217 70 20 GCID NC(=O)COCCNC(=O)c1cc(I)c(F)cc1F 160801006 ZLZYWJUZWBLCHJ-UHFFFAOYSA-N 384.120 0.801 70 20 GCID CN(C(=O)CCc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCN(S(C)(=O)=O)C1 1354978908 FLCWRLKTLLMSMH-CYBMUJFWSA-N 392.474 0.770 70 20 GCID CN1CCC[C@@H]1C(=O)N1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CC1 161092915 FEXFFWSXKXKFOX-HZMVEIRTSA-N 376.501 0.892 70 20 GCID CCC[C@@H]1C[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1025698369 NAZWRYMOJRQFNC-WGEPELCKSA-N 387.433 0.411 70 20 GCID Cn1ccc(CN2[C@H]3CC[C@@H]2C[C@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n1 1097863398 MFJFEKWIZXAUSJ-KYOSRNDESA-N 381.433 0.942 70 20 GCID COCCN(C(=O)c1cccc(S(=O)(=O)F)c1)[C@@H]1CCS(=O)(=O)C1 1337726310 XYZXSHOEBXOTDI-GFCCVEGCSA-N 379.431 0.621 70 20 GCID O=C(Cn1cc(C(=O)NC[C@@H](O)CN2CCCCC2)cn1)NC1CCCCC1 160292755 VEBOYCGFSICZHC-GOSISDBHSA-N 391.516 0.909 70 20 GCID Cn1cc([C@@H]2CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C[C@H]2N)cn1 852752950 RNNWAZFXJKDSLK-DTWKUNHWSA-N 378.323 0.606 70 20 GCID O=C(Cc1ccc(Br)c(F)c1)NCCN1CCS(=O)(=O)CC1 161119396 QUWWBOHRNLAFQJ-UHFFFAOYSA-N 393.278 0.977 70 20 GCID Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NC[C@@H](O)COCC1CC1 159400709 WSTOCWMXYZPZMO-IAGOWNOFSA-N 377.420 0.808 70 20 GCID Cc1cccc2[nH]c(CNC(=O)CCc3nc4c([nH]3)c(=O)[nH]c(=O)n4C)nc12 160591213 ZNMDTGXFQLBQLJ-UHFFFAOYSA-N 381.396 0.384 70 20 GCID Cn1nccc1CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1096026401 YTUDDRODEWKONG-DGFSRKRXSA-N 381.433 0.942 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cc(S(=O)(=O)F)c[nH]1 1521206009 LEUQQPYDSPYCKZ-RBJBARPLSA-N 381.385 0.210 70 20 GCID O=C1CNC(=O)N1CCCn1nnc(Cc2ccccc2Br)n1 160058185 SNBLZXIJFVBYIC-UHFFFAOYSA-N 379.218 0.968 70 20 GCID O=C(N[C@@H]1CCN(C2CCCC2)C1)N1CCN(c2ccc3nncn3n2)CC1 160891777 UWXZZAXGJCPELC-OAHLLOKOSA-N 384.488 0.973 70 20 GCID Cc1c(C(=O)N2CCN(C3CCCC3)CC2)cnc2c1c(=O)n(C)c(=O)n2C 160980679 NGDVQBGFLZLXDD-UHFFFAOYSA-N 385.468 0.641 70 20 GCID O=C(NCCNS(=O)(=O)c1cccnc1)c1ccc(S(=O)(=O)F)cc1 865209037 FWYHHMPGGGWVFF-UHFFFAOYSA-N 387.414 0.448 70 20 GCID Cn1cc(C(=O)NCC2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)cn1 1527565674 NHJMYABUXNSPJR-UHFFFAOYSA-N 397.432 0.689 70 20 GCID CN(c1ccc(-c2nn[nH]n2)nc1)S(=O)(=O)c1cccc(S(=O)(=O)F)c1 1591155244 LLZMEDZOFIJBJN-UHFFFAOYSA-N 398.401 0.745 70 20 GCID CCS(=O)(=O)CCN(C)C(=O)NCCN1CCN(Cc2ccccc2)CC1 160064973 UFWZWQNAIYCTRR-UHFFFAOYSA-N 396.557 0.880 70 20 GCID CS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(S(=O)(=O)F)c2)cn1 794597255 WAIWUCWWMMBIHS-UHFFFAOYSA-N 394.427 0.944 70 20 GCID CC(C)(C)n1ncn(CC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)c1=O 159610477 XJEYOZOZYFSAIH-CQSZACIVSA-N 384.502 0.758 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N[C@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@@H]1C 990110104 USXGVOOTPSHJAD-KLTVKPSUSA-N 387.433 0.817 70 20 GCID CC[C@H](NC(=O)Cn1ccc(=O)[nH]c1=O)[C@@H]1CN(Cc2ccccc2)CCO1 159638033 HPEHBUDCCGRPNX-IRXDYDNUSA-N 386.452 0.332 70 20 GCID Cn1ccnc1[C@](O)(CCNC(=O)c1cc(S(=O)(=O)F)c[nH]1)C(F)(F)F 1348385580 YWFUUUYQBMTTIS-GFCCVEGCSA-N 398.338 0.976 70 20 GCID CS(=O)(=O)N[C@@H]1CCC[C@H]1CNC(=O)c1cn(Cc2cccs2)nn1 160402211 LLFBAPNLPATVDU-WCQYABFASA-N 383.499 0.836 70 20 GCID COc1ncc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1C(N)=O 460092564 JTALYVCZVHQXTM-UHFFFAOYSA-N 389.386 0.648 70 20 GCID CS(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)c1cn(Cc2ccccc2)nn1 160373001 NQMZHJZFTZJAOU-GJZGRUSLSA-N 377.470 0.774 70 20 GCID CCCS(=O)(=O)NC1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1337724027 CASFRKJCBKQGJG-UHFFFAOYSA-N 381.451 0.607 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 160573150 XWAKTJDLDDBKLJ-IAGOWNOFSA-N 378.473 0.963 70 20 GCID O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1cccc(S(=O)(=O)F)c1 460088306 CFUVRFBCAVJUFA-OXHZDVMGSA-N 382.369 0.446 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)NCCOc2ccccc2Cl)n(C)c1=O 159377795 SDRDBQPWZLCJFQ-UHFFFAOYSA-N 391.815 0.282 70 20 GCID CN1CCN(c2ncc(CN3CCCC[C@H]3CCNS(C)(=O)=O)cn2)CC1 159429337 ZLGMESCLDMWVMV-KRWDZBQOSA-N 396.561 0.522 70 20 GCID CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1C[C@H]2OCCN(C)[C@@H]2C1 159701958 ZVJXHHWNRMSSAR-GUDVDZBRSA-N 388.443 0.896 70 20 GCID CCc1c(C(=O)N2CCOC3(CCCC3)C2)cnc2c1c(=O)n(C)c(=O)n2C 160080377 ZUGZOLHGIJOEDY-UHFFFAOYSA-N 386.452 0.980 70 20 GCID CCCCn1c(=O)[nH]c(=O)c2c1nc(Cn1c(-c3cccnc3)noc1=O)n2C 161291298 WHFFRVFDJZPUEM-UHFFFAOYSA-N 397.395 0.483 70 20 GCID CN(C)C[C@@](C)(O)CNS(=O)(=O)c1cccc(I)c1 161426276 JQTYMVCLCHKMEC-LBPRGKRZSA-N 398.266 0.882 70 20 GCID COC(=O)Cn1cc(CCn2nc(Br)nc2Br)nn1 159840028 YCSUVVDUWXSUGT-UHFFFAOYSA-N 394.027 0.810 70 20 GCID CN(C)c1ccc(Br)c(S(=O)(=O)N[C@H]2CCS(=O)(=O)C2)c1 159952275 DDXQLPJDGKJMLM-VIFPVBQESA-N 397.316 0.981 70 20 GCID CC(C)(C(=O)O)N1CCN(C(F)(F)COS(=O)(=O)C(F)(F)F)CC1 1776238970 QTDSRMJVPZRWQD-UHFFFAOYSA-N 384.323 0.926 70 20 GCID CNC[C@@H]1CCCN1C(=O)Cn1cnc2c(c(Br)nn2C)c1=O 161257137 VCGRNJIBSPQFQI-VIFPVBQESA-N 383.250 0.103 70 20 GCID Cn1c(=O)n(CCC(=O)NC[C@@H]2CCC[C@H]2NS(C)(=O)=O)c2ccccc21 160313559 USRPNIZYSFWKNQ-UONOGXRCSA-N 394.497 0.564 70 20 GCID O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1cnc2c(c1)c(=O)[nH]c(=O)n2C1CC1 159787806 WBXSCXPVUSSFPN-HZPDHXFCSA-N 378.388 0.808 70 20 GCID Cc1nc(CC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)c(C)s1 160576768 IXHZJKODLWMBLE-UHFFFAOYSA-N 388.497 0.948 70 20 GCID C[C@H](C(=O)N(C)CC(=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1)n1cccn1 160637670 WSAUNUQWVHCXHR-QRQLOZEOSA-N 399.495 0.654 70 20 GCID CN(C)N(C(=O)CCc1ccc(S(=O)(=O)F)cc1)[C@H]1CCS(=O)(=O)C1 1120910854 RDIUYTKISJFIEG-ZDUSSCGKSA-N 392.474 0.770 70 20 GCID O=C(O)CN1CCC[C@H](C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)C1=O 1606252908 CUTSOUFFRLRKTF-SECBINFHSA-N 376.337 0.746 70 20 GCID Cc1c(C(=O)NCCCN2CCC(C)CC2)cnc2c1c(=O)n(C)c(=O)n2C 159841547 FUIMDKWKMNFMJK-UHFFFAOYSA-N 387.484 0.792 70 20 GCID Cn1nc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1OC(F)F 460087258 ABSMGPADNCEOTJ-UHFFFAOYSA-N 385.345 1.481 70 20 GCID Cc1nc2n(n1)C[C@@H](NC(=O)CCC(=O)N1CCN(c3ccccn3)CC1)CC2 161344960 DKCITIDCXUQNAJ-INIZCTEOSA-N 397.483 0.542 70 20 GCID Cc1cc(C(=O)Nc2cccc([S@@](C)=O)c2)nc2c1c(=O)n(C)c(=O)n2C 159741059 XUKVLDHVWMBDCY-MHZLTWQESA-N 386.433 0.930 70 20 GCID COc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1 1320367274 OQKSYGWOPVYKDZ-UHFFFAOYSA-N 388.398 0.977 70 20 GCID CN1C(=O)CO[C@@H](C(=O)Nc2ccc(S(=O)(=O)F)cc2)[C@@H]1c1cnn(C)c1 369139918 MOIBVJGGJIQBFB-LSDHHAIUSA-N 396.400 0.615 70 20 GCID CN1CCN(c2cc(CNC(=O)c3cc(S(=O)(=O)F)c[nH]3)ccn2)CC1 1348385026 OPSCNOUGWLYTFF-UHFFFAOYSA-N 381.433 0.750 70 20 GCID O=C(CNC(=O)c1cc(S(=O)(=O)F)c[nH]1)Nc1ccc(-n2cncn2)cc1 1516701123 GTRHOPZMQXOJRR-UHFFFAOYSA-N 392.372 0.622 70 20 GCID O=C(O)C[C@@H]1CS(=O)(=O)CCN1C(=O)c1cccc(S(=O)(=O)F)c1 1601964216 POIKCQIEPQDZGR-SNVBAGLBSA-N 379.387 0.059 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)[C@@H](C(=O)OC)C1 865209716 DRECDQQKKXDGOE-WCQYABFASA-N 387.385 0.912 70 20 GCID CN1CCN(CCNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)CC1 160392400 FXMMNHUMIZGHNU-UHFFFAOYSA-N 387.528 0.479 70 20 GCID Cc1ccccc1CC(=O)N1CCN(C(=O)N[C@H]2CCc3ncnn3C2)CC1 160959953 REDRTANTXKOVRI-KRWDZBQOSA-N 382.468 0.998 70 20 GCID O=C(c1cccc(S(=O)(=O)F)c1)N1CCC(N2CCCS2(=O)=O)CC1 1340629287 HLAGDXTYVZCNLM-UHFFFAOYSA-N 390.458 0.985 70 20 GCID CN(C[C@H](O)CN1CCOCC1)[C@H](C(N)=O)c1cccc(Br)c1 160901455 ZIRYMDYHUZVXMG-GJZGRUSLSA-N 386.290 0.600 70 20 GCID COCCN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H]1CCS(=O)(=O)C1 217263754 XWVGRHFAQBOYGH-GFCCVEGCSA-N 379.479 0.356 70 20 GCID COC(=O)Cn1cc(S(=O)(=O)Nc2cccc(S(=O)(=O)F)c2)cn1 768892611 VLXNXQGZZVRRII-UHFFFAOYSA-N 377.375 0.515 70 20 GCID CC(C)(C)OC(=O)N1CC(O)(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1123727642 PZPAYOUOAVNHIA-UHFFFAOYSA-N 377.394 0.385 70 20 GCID CN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCN(S(C)(=O)=O)C1 1349696345 GHEUJZACGYQWSA-GFCCVEGCSA-N 378.447 0.380 70 20 GCID CN(C)[C@@H]1C[C@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777026196 AJXWXYJRIDMTBF-JGVFFNPUSA-N 384.323 0.782 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)N2CCC[C@H]2CN2CCOCC2)c1CC 160438323 YHJZSOHTOWHWLM-AWEZNQCLSA-N 377.489 0.901 70 20 GCID NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1 771832180 XWFDABJHVIPNML-UHFFFAOYSA-N 394.427 0.793 70 20 GCID Cn1cc(CN2[C@H]3CC[C@@H]2C[C@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1097863739 UUUHJFZZJHVSHK-KYOSRNDESA-N 381.433 0.942 70 20 GCID C[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1CCCN(Cc2cnn[nH]2)C1 1575649765 JEDCRBTUVPZUEW-WDEREUQCSA-N 384.437 0.822 70 20 GCID O=C(O)c1cnc(O)c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1 1602234455 UMJBMWMPUTWNKK-UHFFFAOYSA-N 376.343 0.944 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)NC[C@H](O)Cc3ccccc3)ccc21 161034150 KNWIEYQBSMUVET-CQSZACIVSA-N 375.450 0.759 70 20 GCID C[C@@H](Nc1ccc2oc(N(C)C)nc2c1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O 160044603 VGIMJAGYOUDDGS-SECBINFHSA-N 386.412 0.557 70 20 GCID NC(=O)c1ccc(CN2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)cc1 1520866593 YALXFVUNHLCFOH-UHFFFAOYSA-N 394.428 0.730 70 20 GCID Nc1c(C(=O)CN2CCO[C@@]3(CCc4ccccc43)C2)c(=O)[nH]c(=O)n1C1CC1 159419678 IGSHWCQERHQXMA-NRFANRHFSA-N 396.447 0.810 70 20 GCID C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1)n1cnc(-c2nn[nH]n2)n1 1589017922 NABHHEGMZOQFHH-ZCFIWIBFSA-N 384.328 0.455 70 20 GCID Cc1c([C@@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@@H]2C(N)=O)cnn1C 1550294981 AZMXBTRZNXPKDW-GJZGRUSLSA-N 394.428 0.728 70 20 GCID O=C(CCn1cc(Br)ccc1=O)NC[C@H](O)CN1CCCCC1 160441031 UUOWDXGQQKYYTC-AWEZNQCLSA-N 386.290 0.964 70 20 GCID CN(C)S(=O)(=O)CCCS(=O)(=O)Nc1cccc(S(=O)(=O)F)c1 290538365 PACBUDYEHMHNQW-UHFFFAOYSA-N 388.464 0.368 70 20 GCID Cn1cc(-c2nn[nH]n2)c(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 1606222501 IFCGSFWMXFGKIJ-UHFFFAOYSA-N 387.378 0.059 70 20 GCID Cc1c(C(=O)Nc2ccc3oc(=O)[nH]c3c2)cnc2c1c(=O)n(C)c(=O)n2C 160903937 LWSIUMUYTGHTTL-UHFFFAOYSA-N 381.348 0.627 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2C)CC1 1262810833 VULQPYNQKHXREQ-UHFFFAOYSA-N 378.447 0.761 70 20 GCID O=C(CN1CCN(C(=O)NCCc2nnc(-c3ccccc3)o2)CC1)NC1CC1 159901302 ONPMDYGHTCINJZ-UHFFFAOYSA-N 398.467 0.885 70 20 GCID Cc1cc(C(=O)NC[C@H](CC(C)C)N(C)C)nc2c1c(=O)n(C)c(=O)n2C 160046325 FGWPOOKGPHCYPJ-ZDUSSCGKSA-N 375.473 0.647 70 20 GCID CC[C@@H](NC(=O)Cn1ccc(=O)[nH]c1=O)[C@H]1CN(Cc2ccccc2)CCO1 159638434 HPEHBUDCCGRPNX-IAGOWNOFSA-N 386.452 0.332 70 20 GCID NCCC(=O)NC[C@@H]1CCCCN1C(F)(F)COS(=O)(=O)C(F)(F)F 852748116 JSNABXCVLCLCQN-VIFPVBQESA-N 397.366 0.765 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cn[nH]c1 1001484912 OVSCMBBZRQBTTK-XWIASGKRSA-N 381.389 0.572 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)CCn2[nH]c(=O)c3ccccc3c2=O)c1CC 160121166 UFDAJHISGZYNBV-UHFFFAOYSA-N 397.435 0.604 70 20 GCID Cn1cnnc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863339 JXWBERVVOZKZGG-XWIASGKRSA-N 382.421 0.337 70 20 GCID O=C(NC1(C(=O)O)CCS(=O)(=O)CC1)c1cccc(S(=O)(=O)F)c1 1601432688 WEVMNBARSJURAJ-UHFFFAOYSA-N 379.387 0.107 70 20 GCID COCCN(CCO)S(=O)(=O)c1cccc(I)c1 161024656 FOXURTYYIHDLEY-UHFFFAOYSA-N 385.223 0.921 70 20 GCID Cc1cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n([C@@H]2CCS(=O)(=O)C2)n1 1347808962 GDPAUIUPVVBFNQ-SECBINFHSA-N 390.418 0.790 70 20 GCID C[C@@H](O)C[C@@H](CNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1 160049714 VCKJMUOHUZYFTP-HIFRSBDPSA-N 396.447 0.917 70 20 GCID CS(=O)(=O)N1CCC[C@@H]1CNC(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1 160561904 IEACKRCJBXRDIW-CYBMUJFWSA-N 380.470 0.719 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cnco1)c1cc(S(=O)(=O)F)c[nH]1 1006342037 ZLADDLYWFIMJDS-UISBYWKRSA-N 382.373 0.836 70 20 GCID CN(C)CC(C)(C)CNC(=O)C1CCN(C(=O)c2cccc(=O)n2C)CC1 161016442 AVARNSYYGGRKRL-UHFFFAOYSA-N 376.501 0.942 70 20 GCID CC[C@H](C)N(C)CCNC(=O)CCC(=O)N1CCN(c2ncccn2)CC1 161389778 QDCUTYOCIKQDSE-INIZCTEOSA-N 376.505 0.752 70 20 GCID CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1349622205 GKOBUIJYCXBLMZ-MWLCHTKSSA-N 381.451 0.511 70 20 GCID O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)c1cc(S(=O)(=O)F)ccc1Cl 1608750288 IDRKGGJOKYALDJ-NSHDSACASA-N 392.792 0.804 70 20 GCID O=C(CN1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1)N1CCCCC1 1345450992 HWADFMOPQOMPCE-UHFFFAOYSA-N 386.449 0.443 70 20 GCID C[C@@H](C(=O)c1c(N)n(C)c(=O)n(C)c1=O)N1CCO[C@]2(CCc3ccccc32)C1 159667751 ZQZWJFOSHIMOJE-YEJXKQKISA-N 398.463 0.411 70 20 GCID CCCCn1c(=O)[nH]c(=O)c2c1nc(Cn1nc(COC)oc1=O)n2CC 160136715 KGWBVORZGFKMQL-UHFFFAOYSA-N 378.389 0.051 70 20 GCID COCCN(C)CCNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1C 161257800 GAXBNCOQNJUKNM-UHFFFAOYSA-N 377.420 0.953 70 20 GCID O=C(Nc1ncn(CC(=O)N2CCCCCC2)n1)c1cc(S(=O)(=O)F)c[nH]1 1121031654 AEZMJDOAGPHAIB-UHFFFAOYSA-N 398.420 0.919 70 20 GCID Cc1ccc(-c2nnc(NC(=O)c3ccc4c(=O)n(C)c(=O)n(C)c4n3)[nH]2)o1 160323966 YCBHEYKUQQLIGW-UHFFFAOYSA-N 381.352 0.571 70 20 GCID CN[C@@H]1CCN(C(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)C1 160708764 MRUJALAJTVJBQV-GFCCVEGCSA-N 390.303 0.890 70 20 GCID C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)N[C@@H]2CCc3ncnn3C2)CC1 161126669 JZIBXRNODGFGFT-BRWVUGGUSA-N 375.521 0.793 70 20 GCID CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@@H]1O 970390499 JVKZZGLDURKNKB-IMJCEVDSSA-N 387.433 0.411 70 20 GCID CCCNC(=O)CN1CCC(NC(=O)Cc2ccc(S(=O)(=O)F)cc2)CC1 1338140879 BTUHTVBDTTXBQH-UHFFFAOYSA-N 399.488 0.994 70 20 GCID O=C(CN1CCN(C(=O)c2cccc(S(=O)(=O)F)c2)CC1)N1CCCC1 1336405144 BJDODIIZLWLCDL-UHFFFAOYSA-N 383.445 0.725 70 20 GCID COc1cc(S(=O)(=O)F)c(Cl)cc1C(=O)N[C@]1(C(=O)O)CCOC1 1594067908 XDCSEAHOGWULAS-CYBMUJFWSA-N 381.765 0.980 70 20 GCID CN(C)C(=O)CN1CCC(NC(=O)N2CCN(Cc3ccccn3)CC2)CC1 160135760 VWTBTJJSBFTBJT-UHFFFAOYSA-N 388.516 0.461 70 20 GCID COC(=O)C1CC2(C1)CN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)C[C@H]2C(=O)O 1604292980 QZKGHKGVDDJOCU-VGWYGZTPSA-N 388.373 0.399 70 20 GCID Cc1nn(C)c2[nH]nc(NC(=O)c3cc(C)c4c(=O)n(C)c(=O)n(C)c4n3)c12 160348513 CPOSLAREVYOJOP-UHFFFAOYSA-N 382.384 0.111 70 20 GCID O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)c1ccc(S(=O)(=O)F)cc1 865208322 ZENVEEIWWAZGEG-UHFFFAOYSA-N 396.400 0.652 70 20 GCID NS(=O)(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1339473035 YTRVAFMTIMBKHD-UHFFFAOYSA-N 375.403 0.293 70 20 GCID Cc1ccc(-c2n[nH]c(NC(=O)Cn3c(=O)c4c(ncn4C)n(C)c3=O)c2C)o1 161393832 AFSYVUINPXBMAB-UHFFFAOYSA-N 397.395 0.672 70 20 GCID Cn1c(=O)n(CCC(=O)NC[C@H]2CCC[C@H]2NS(C)(=O)=O)c2ccccc21 160313689 USRPNIZYSFWKNQ-ZIAGYGMSSA-N 394.497 0.564 70 20 GCID COC(=O)C1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCS(=O)(=O)CC1 865211046 VOGCFMZUQCWHIW-UHFFFAOYSA-N 393.414 0.195 70 20 GCID CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)c1cc(S(=O)(=O)F)c[nH]1)C2 1337360879 LNCBKLSNIAQHLN-RYUDHWBXSA-N 386.449 0.486 70 20 GCID O=C(NCCN1CCN(c2ncccn2)CC1)c1cnc(C(F)(F)F)nc1 160158131 ORENYIILLWRJMQ-UHFFFAOYSA-N 381.362 0.837 70 20 GCID CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NCCn3cccc3)cc2)CC1 160163598 FTSXPVPABCFTNQ-UHFFFAOYSA-N 397.479 0.560 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCCc2nc(-c3nn[nH]n3)ccc21 1593328187 CCDLSRXFQHMVRB-UHFFFAOYSA-N 377.361 0.841 70 20 GCID Cc1cccc(NC(=O)CN2CCN(CC(=O)N3CCN(C)CC3)CC2)c1C 161254869 VTCIQYMQMSSKMZ-UHFFFAOYSA-N 387.528 0.634 70 20 GCID O=S(=O)(F)c1ccc(S(=O)(=O)N=c2nc[nH]n2-c2ccncc2)cc1 848948970 NRBOJRRHZUFZMN-UHFFFAOYSA-N 383.386 0.543 70 20 GCID CCN(CC)C(=O)CN1CCCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1347457790 NNVJDDGTRQYZCL-UHFFFAOYSA-N 388.465 0.689 70 20 GCID O=C(NCCc1cc2ccccc2[nH]1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 159582749 FNEJRQJVKGYFKF-ZBFHGGJFSA-N 389.477 0.862 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ncccn1)c1cc(S(=O)(=O)F)c[nH]1 1097863766 VXPHLTOUDPMCKP-QKCSRTOESA-N 379.417 0.998 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC[C@H]1C[C@H](O)CN1Cc1ccccc1 160769942 NGUNANUGLGORSJ-SJORKVTESA-N 386.452 0.830 70 20 GCID O=C(NCCc1cc2ccccc2[nH]1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 159582612 FNEJRQJVKGYFKF-GOEBONIOSA-N 389.477 0.862 70 20 GCID CNS(=O)(=O)[C@@H]1CCN(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)C1 160463437 JDTJPXIKQAGISA-MRXNPFEDSA-N 395.460 0.887 70 20 GCID C[C@@H](C(=O)NCCc1cccs1)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 159443547 PGWRJLQUZIYBNU-AWEZNQCLSA-N 388.493 0.942 70 20 GCID COCCCNC(=O)CN(C)Cc1nnc2n(C)c(=O)c3sccc3n12 159478859 WVXIVMWUXCDECE-UHFFFAOYSA-N 378.458 0.227 70 20 GCID C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1cccc(-n2cnnn2)c1 160949238 SUJBMCOLJFCKPX-CYBMUJFWSA-N 379.424 0.728 70 20 GCID COC(=O)c1cnn(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 848949111 XCVKEWDYUDSNQC-UHFFFAOYSA-N 377.375 0.666 70 20 GCID Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NC[C@H](O)COCC1CC1 159400398 WSTOCWMXYZPZMO-DLBZAZTESA-N 377.420 0.808 70 20 GCID Cn1cc(CN2[C@H]3CC[C@@H]2C[C@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)nn1 1097863862 ZXUPCQUKGIWSOE-QKCSRTOESA-N 382.421 0.337 70 20 GCID CC(C)c1nn(C)c(Cl)c1C(=O)N1CCN(C(=O)CN2CCOCC2)CC1 159362440 FLDCQXIZJCYAOM-UHFFFAOYSA-N 397.907 0.814 70 20 GCID CCNC(=O)CN1CCN(C(=O)c2cc(N3CCCC3=O)ccc2F)CC1 159915954 AXKBKQUQQXECOS-UHFFFAOYSA-N 376.432 0.846 70 20 GCID CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@H]3C[C@H]3C3CCCCC3)CC2)CC1 160227129 SDIJCEPYUTWNAP-ROUUACIJSA-N 398.573 0.839 70 20 GCID O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cc(S(=O)(=O)F)c[nH]1 1121032301 NVZYCNXJNNTEBO-TVQRCGJNSA-N 380.419 0.139 70 20 GCID Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](O)COCC1CC1 159415593 XZYRMKSHPSNYGS-IAGOWNOFSA-N 377.420 0.808 70 20 GCID C[C@H](O)C[C@H](CNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1 160049848 VCKJMUOHUZYFTP-DZGCQCFKSA-N 396.447 0.917 70 20 GCID C[C@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N1CCN(Cc2ccncc2)CC1 161229477 RTTRXTKBEBKWKD-WBVHZDCISA-N 380.514 0.233 70 20 GCID O=C(c1ccc(S(=O)(=O)F)cc1)N1CCC(N2CCCS2(=O)=O)CC1 865211132 JZFHRQZHLLBTSZ-UHFFFAOYSA-N 390.458 0.985 70 20 GCID Cn1nccc1[C@H]1c2[nH]cnc2CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1123829645 OFCGFMHNERBNJA-AWEZNQCLSA-N 378.389 0.917 70 20 GCID O=C1CN(Cc2cccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)c2)CCN1 1517974270 DMZBFEYLBGELIU-UHFFFAOYSA-N 380.401 0.857 70 20 GCID CN(C[C@@H](O)CN1CCOCC1)[C@H](C(N)=O)c1cccc(Br)c1 160901599 ZIRYMDYHUZVXMG-CABCVRRESA-N 386.290 0.600 70 20 GCID O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1ccc(S(=O)(=O)F)cc1 865209152 JEKRUBMYNGFKNQ-SWLSCSKDSA-N 391.442 0.811 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)[C@H]1CC[C@@H](C(=O)N2CCOCC2)O1 1552596590 MVFNGBQJCRAVBZ-KGLIPLIRSA-N 386.401 0.690 70 20 GCID CC(=O)N[C@@H](CC(=O)N1CCN(C(=O)CN(C)C)CC1)c1ccc(F)cc1F 160268260 PZCBYFHKMRSMGT-KRWDZBQOSA-N 396.438 0.765 70 20 GCID CN1C[C@H](C(=O)O)N(C(=O)c2ccc(S(=O)(=O)F)cc2Cl)CC1=O 1598563646 UKCMLAIQNQUIPW-SNVBAGLBSA-N 378.765 0.366 70 20 GCID Cc1c(C(=O)NCC(C)(C)N2CCCCC2)cnc2c1c(=O)n(C)c(=O)n2C 159535988 PAKLSDBZSOGFNN-UHFFFAOYSA-N 387.484 0.935 70 20 GCID CS(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)c1cn(Cc2cccs2)nn1 160402082 LLFBAPNLPATVDU-YPMHNXCESA-N 383.499 0.836 70 20 GCID NC(=O)Cn1cc(NC(=O)C(=O)NCC2(c3ccc(F)cc3Cl)CC2)cn1 161252934 ZWODLSOJSHHRRU-UHFFFAOYSA-N 393.806 0.947 70 20 GCID O=C(NC1CC1)[C@@H]1CCCN1C(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O 160143717 TVPSPXSNGSCDCG-RYUDHWBXSA-N 376.379 0.992 70 20 GCID O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1ccc(S(=O)(=O)F)cc1 275016477 YPBCWEINLSFNHL-UXOAXIEHSA-N 396.396 0.836 70 20 GCID C[C@H](CNC(=O)NCCNC(=O)c1c(F)cccc1F)CN1CCOCC1 159835414 XVRXFGAHMYRDCP-CYBMUJFWSA-N 384.427 0.962 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)N3CCC(Cn4ccnn4)CC3)ccc21 159466021 UHBNEKHJFCTIDE-UHFFFAOYSA-N 390.469 0.569 70 20 GCID O=C1CO[C@H]2CCN(C(=O)c3cc(S(=O)(=O)F)ccc3Cl)C[C@@H]2N1 1349718135 OQGHGWSATAHQHK-RYUDHWBXSA-N 376.793 0.728 70 20 GCID Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NC[C@@H](O)COCC1CC1 159400547 WSTOCWMXYZPZMO-SJORKVTESA-N 377.420 0.808 70 20 GCID CCn1cc([C@H]2C[S@](=O)CCN2C(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1349622292 IYYNQTAIESKDHG-YEBMWUKDSA-N 388.446 0.835 70 20 GCID O=C(NC[C@@H](O)CN1CCc2ccccc2C1)c1cc(S(=O)(=O)F)c[nH]1 1349622231 HHQFSCSJGAPLNL-CQSZACIVSA-N 381.429 0.822 70 20 GCID CN1C(=O)C[C@@H](NC(=O)c2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccnn1C 1550256642 VEGBGSCAUSKSRU-DOMZBBRYSA-N 380.401 0.780 70 20 GCID O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)c1cc(S(=O)(=O)F)c[nH]1 1123467242 CQCVHMWRHWFTEL-UHFFFAOYSA-N 386.405 0.657 70 20 GCID COc1cc(C(=O)N2CC[C@H](N3CCN(C)CC3)C2)ccc1S(=O)(=O)F 1550710230 GRMGCFKPGVSGQP-AWEZNQCLSA-N 385.461 0.815 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)NC[C@H](O)CN2CCC(C)CC2)c1CC 160407379 KBZSTEKLPGESCA-AWEZNQCLSA-N 379.505 0.787 70 20 GCID CN(C)CCN1C[C@@H](C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)CC1=O 160035733 CZNUWONGNJRXOL-INIZCTEOSA-N 398.511 0.617 70 20 GCID COC(=O)[C@H](CSC(F)(F)COS(=O)(=O)C(F)(F)F)NC(C)=O 1261596966 MKAXZNLVJUBNKN-LURJTMIESA-N 389.320 0.856 70 20 GCID COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cccc(S(=O)(=O)F)c1 1348707135 HYYIPDNTLWDIHH-YPMHNXCESA-N 387.385 0.912 70 20 GCID CS(=O)(=O)NCc1ccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1123617158 SFLMXSFWFHUHCA-UHFFFAOYSA-N 375.403 0.974 70 20 GCID Cc1cc(NC(=O)CN2CCN(C(=O)c3cccc(-n4ccnn4)c3)CC2)no1 161206929 XLMIYYOSTNSBGI-UHFFFAOYSA-N 395.423 0.960 70 20 GCID C[C@@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@H]1CCCN(Cc2cnn[nH]2)C1 1575649751 JEDCRBTUVPZUEW-MNOVXSKESA-N 384.437 0.822 70 20 GCID O=C(O)CN(CCN1CCOCC1)C(=O)Cc1ccc(S(=O)(=O)F)cc1 1602054942 QVDBEICMAHSYJZ-UHFFFAOYSA-N 388.417 0.133 70 20 GCID CN(C)[C@H]1C[C@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777026198 AJXWXYJRIDMTBF-YUMQZZPRSA-N 384.323 0.782 70 20 GCID CN[C@H]1CCN(C(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)C1 160638191 JQBXGMMELCQUTC-JTQLQIEISA-N 376.276 0.839 70 20 GCID NC(=O)c1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)cc1 1336949035 GYLZYFKLFYINBP-UHFFFAOYSA-N 380.401 0.734 70 20 GCID C[C@@H](O)C[C@@H](CNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccccc1 160190559 JQNRIEHRLZCCGH-HIFRSBDPSA-N 399.451 0.105 70 20 GCID NS(=O)(=O)c1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 771830098 RHSSFHXBJMIZMS-UHFFFAOYSA-N 394.427 0.793 70 20 GCID CCCCn1c(=O)[nH]c(=O)c2c1nc(CSCCN1CCOCC1)n2C 159972360 UKSIQBWHYUUJJF-UHFFFAOYSA-N 381.502 0.789 70 20 GCID O=C(N[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C2CC2)C[C@H]1O)c1cc(S(=O)(=O)F)c[nH]1 1025700210 ZSLNRQGLUIFZGS-OIMNJJJWSA-N 385.417 0.021 70 20 GCID COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865209717 DRECDQQKKXDGOE-YPMHNXCESA-N 387.385 0.912 70 20 GCID CN(CC(C)(C)CN1CCOCC1)C(=O)CCn1nc2ccccn2c1=O 160299342 SDNGSTGWUMOBCS-UHFFFAOYSA-N 375.473 0.703 70 20 GCID O=C(N[C@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 938369993 MTUNOXDSZLLHBO-KVMADOOQSA-N 397.428 0.427 70 20 GCID COc1cc(OC)nc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 460087891 BGQQCQBSNIKBRK-UHFFFAOYSA-N 377.375 0.953 70 20 GCID COCCN(C(=O)c1cccc(S(=O)(=O)F)c1)[C@H]1CCS(=O)(=O)C1 1337726311 XYZXSHOEBXOTDI-LBPRGKRZSA-N 379.431 0.621 70 20 GCID Cc1ccc(S(=O)(=O)NCCNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1345452439 VKPJKEJKNSDOKL-UHFFFAOYSA-N 389.430 0.690 70 20 GCID CN(C(=O)CCc1ccc(S(=O)(=O)F)cc1)[C@H]1CCN(S(C)(=O)=O)C1 1354978912 FLCWRLKTLLMSMH-ZDUSSCGKSA-N 392.474 0.770 70 20 GCID Cn1cncc1[C@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550288091 JVGHSBGKLUNUPW-DOMZBBRYSA-N 380.401 0.828 70 20 GCID NS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)cc1 780362382 BHSRIRPDEJZKJC-UHFFFAOYSA-N 394.427 0.793 70 20 GCID C[C@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(-n2cnnn2)cc1 161036354 FJCMOVVHHDDQJG-ZDUSSCGKSA-N 379.424 0.728 70 20 GCID O=S1(=O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)[C@@H](C2CC2)C1 460087809 BBCXKFYSXRMTCH-CYBMUJFWSA-N 397.471 0.543 70 20 GCID CN[C@H]1CCN(C(=O)CNS(=O)(=O)c2ccc(Br)s2)C1 160802143 AFFCNZMZOWQNEP-QMMMGPOBSA-N 382.305 0.609 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cn[nH]c1)c1cc(S(=O)(=O)F)c[nH]1 1000526140 DMBQGOBNULEHDC-CDMKHQONSA-N 381.389 0.572 70 20 GCID NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCN(Cc3ccccn3)CC2)C1 160314349 ZPPXGSFIKVPCRX-QGZVFWFLSA-N 388.516 0.496 70 20 GCID Cn1cnnc1CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1096026082 JXWBERVVOZKZGG-CDMKHQONSA-N 382.421 0.337 70 20 GCID O=C(NCCN1CCN(c2ncccn2)CC1)N1CCCN(CC(F)F)CC1 160651339 LORQPABLZMGPJJ-UHFFFAOYSA-N 397.474 0.581 70 20 GCID CC(C)[C@@H](NCC(=O)NC[C@@H](c1ccccc1)N(C)C)C(=O)N1CCOCC1 160475714 IQJCPJHLRXRLJK-AZUAARDMSA-N 390.528 0.879 70 20 GCID CCN(C(=O)CN1CCN(Cc2ccncc2)CC1)[C@@H]1CCS(=O)(=O)C1 161232980 IMSZPMICGKAYSX-QGZVFWFLSA-N 380.514 0.235 70 20 GCID Cc1nn(C)c(=O)c(C(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)c1C 161373525 OVGZQYPTNFVRNU-UHFFFAOYSA-N 383.452 0.794 70 20 GCID NS(=O)(=O)c1ccc(C(=O)NC[C@@H](O)CN2CCc3ccccc3C2)cc1 217125409 HQZREDHOWCMDHT-QGZVFWFLSA-N 389.477 0.483 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 290152908 CUEIYDGYYTYCQA-UONOGXRCSA-N 386.401 0.690 70 20 GCID CCc1ccc(CC(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)cc1 160226053 NVZXOABLNAKOOR-UHFFFAOYSA-N 394.541 0.428 70 20 GCID CNS(=O)(=O)[C@H]1CCN(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)C1 160463572 JDTJPXIKQAGISA-INIZCTEOSA-N 395.460 0.887 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)N3CC[C@@H](O)C3)c(Br)cc21 161148006 QHQGQNHPFBACFE-MRVPVSSYSA-N 390.259 0.395 70 20 GCID Cc1cc(C(=O)NCCNC2CCCCCC2)nc2c1c(=O)n(C)c(=O)n2C 159630695 DVXOLAXOZUMQKP-UHFFFAOYSA-N 387.484 0.983 70 20 GCID Cn1cc(-c2nc(C(=O)NC[C@H]3CCC[C@@H]3NS(C)(=O)=O)cs2)cn1 160301905 NNYLAUMBYAFHGN-PWSUYJOCSA-N 383.499 0.991 70 20 GCID O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cc(S(=O)(=O)F)c[nH]1 1121032299 NVZYCNXJNNTEBO-RNCFNFMXSA-N 380.419 0.139 70 20 GCID C[C@@H](C(=O)NCc1ccccc1F)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 159433123 RGRYMYABRCFMDC-AWEZNQCLSA-N 386.427 0.977 70 20 GCID COC(=O)C[C@@H]1C(=O)NCCN1Cc1cnc2ccc(Br)cn12 159790718 TYTMRXOJXABDHB-GFCCVEGCSA-N 381.230 0.960 70 20 GCID Cc1c(C(=O)N[C@@H]2CCN(c3ccccn3)C2)cnc2c1c(=O)n(C)c(=O)n2C 161247216 BKLSVVOEAOKLKA-CYBMUJFWSA-N 394.435 0.344 70 20 GCID Cc1ccc(NC(=O)[C@H](C)n2cnc(-c3nn[nH]n3)n2)cc1S(=O)(=O)F 1605868609 MQDIRPPTUBCWRG-QMMMGPOBSA-N 380.365 0.625 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCO)c1cc(S(=O)(=O)F)c[nH]1 1111032633 JRSOSUNZHSSZSF-QKCSRTOESA-N 375.422 0.017 70 20 GCID O=C(c1ccc(=O)[nH]c1)N1CCN(S(=O)(=O)Cc2cccc(F)c2)CC1 160916886 OPCWENUONBWNQN-UHFFFAOYSA-N 379.413 0.802 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2CCn1cccn1)c1cc(S(=O)(=O)F)c[nH]1 1097873666 PLSIALGUAMORBQ-KYOSRNDESA-N 381.433 0.905 70 20 GCID O=C(CN1CCC[C@@H](C(=O)O)C1=O)Nc1ccc(F)c(CS(=O)(=O)F)c1 1601310988 ABDLVHUFEQSVDX-LLVKDONJSA-N 390.364 0.887 70 20 GCID O=C(O)Cn1cc(CC[S@@](=O)Cc2ccc(S(=O)(=O)F)cc2)nn1 1608797324 ZHQFYVKTARLJHC-HSZRJFAPSA-N 375.403 0.512 70 20 GCID NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1cccc(S(=O)(=O)F)c1 768893359 YRJOVCODQBLMAB-UHFFFAOYSA-N 394.427 0.793 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CC(Nc2cccc(-c3nn[nH]n3)c2)C1 1593328588 NDUDQOOZPGTJGY-UHFFFAOYSA-N 391.388 0.790 70 20 GCID CC(C)[C@@H](NCC(=O)NC[C@H](c1ccccc1)N(C)C)C(=O)N1CCOCC1 160475993 IQJCPJHLRXRLJK-UYAOXDASSA-N 390.528 0.879 70 20 GCID O=S(=O)(N1CCOCC1)N(CCO)Cc1cc(Br)ccc1F 160735899 YCHCNMPNUOKNSM-UHFFFAOYSA-N 397.266 0.960 70 20 GCID O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1ccc(S(=O)(=O)F)cc1 274948527 HRGOSDDSWCGFRV-OXHZDVMGSA-N 382.369 0.446 70 20 GCID Cc1cc(=O)n2[nH]c(NS(=O)(=O)c3cccc(S(=O)(=O)F)c3)nc2n1 848947173 YFDSPFLQNNROFU-UHFFFAOYSA-N 387.374 0.185 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)O[C@@H](c2ccccn2)C(F)(F)F)n(C)c1=O 160381459 YDCUVDVQDQWNEH-LBPRGKRZSA-N 397.313 0.676 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC(N2CCCS2(=O)=O)CC1 1338958903 MXACPCINUDJEJX-UHFFFAOYSA-N 379.435 0.313 70 20 GCID C[C@@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 460095339 VBDWQYGMZPBWKF-YPCYXAEESA-N 396.396 0.834 70 20 GCID CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1 857674189 DZKZRQWBEAQZQW-GFCCVEGCSA-N 389.380 0.550 70 20 GCID Cc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1S(=O)(=O)F 857675399 MGBKCMBWWFLUKY-FIXIBIHLSA-N 396.396 0.754 70 20 GCID Cc1nc2c(c(C)c1CC(=O)NC[C@@H](O)CN1CCCCC1)c(=O)[nH]n2C 160300419 PEOJIVLVQFHNRA-CQSZACIVSA-N 375.473 0.384 70 20 GCID O=C1CCN(CC(=O)N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)C(=O)N1 216990828 QFXNCRSHVQBRQM-UHFFFAOYSA-N 396.806 0.705 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 160326686 DBBCUBAQGWMFPP-ZWKOTPCHSA-N 385.468 0.676 70 20 GCID Cn1cc(S(=O)(=O)N2CCC(NC(=O)CNc3ccccc3)CC2)cn1 160751536 HORMIOSPUNOXJW-UHFFFAOYSA-N 377.470 0.802 70 20 GCID CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1349622290 IYYNQTAIESKDHG-RKNYENMMSA-N 388.446 0.835 70 20 GCID Cn1ccc(N2CCC[C@@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)n1 160426144 HHBHTZKEOQVOAV-QGZVFWFLSA-N 397.483 0.838 70 20 GCID Cc1ccc(S(=O)(=O)NCCNC(=O)c2cc(S(=O)(=O)F)c[nH]2)s1 1349235114 QUVYTKOOBFVHNK-UHFFFAOYSA-N 395.459 0.751 70 20 GCID C[C@@H]1CN(c2nccnc2C#N)CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1340087612 IPSXHPUEVSAXNW-SNVBAGLBSA-N 378.389 0.685 70 20 GCID Cn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550255542 CZFGEDKDGNJZEX-SWLSCSKDSA-N 380.401 0.828 70 20 GCID CCCN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@H]1CCN(Cc2cnn[nH]2)C1 1576475769 XGDXUJBZERAVRC-LBPRGKRZSA-N 384.437 0.918 70 20 GCID C[C@]1(c2ccc(CNC(=O)c3cc(S(=O)(=O)F)c[nH]3)cc2)NC(=O)NC1=O 1123525184 WZLOVLLIUUFNHW-MRXNPFEDSA-N 394.384 0.658 70 20 GCID C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 990360964 MEUGQQMKPONBOZ-TUJOMHJISA-N 399.444 0.960 70 20 GCID Cc1ccccc1CC(=O)N1CCN(C(=O)N[C@@H]2CCc3ncnn3C2)CC1 160959822 REDRTANTXKOVRI-QGZVFWFLSA-N 382.468 0.998 70 20 GCID COC[C@H](O)CCNC(=O)C(=O)Nc1cccc(I)c1 159585782 SXGXXTIKHIAVOA-LLVKDONJSA-N 392.193 0.743 70 20 GCID Cn1cc(-c2nc(C(=O)NC[C@@H]3CCC[C@H]3NS(C)(=O)=O)cs2)cn1 160302049 NNYLAUMBYAFHGN-CMPLNLGQSA-N 383.499 0.991 70 20 GCID CC(C)N1CCO[C@H](CN2CCN(C(=O)[C@@H]3CCn4ccnc4C3)CC2)C1 161448679 FJUNWUTUEAUXEE-QZTJIDSGSA-N 375.517 0.699 70 20 GCID O=C(O)[C@H]1C[C@@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777605241 DDHAWEGILHQCQB-OLQVQODUSA-N 385.263 0.553 70 20 GCID Cc1ccoc1C(=O)NCCCNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 160277524 GNPIDVOQHBCWOA-UHFFFAOYSA-N 378.410 0.856 70 20 GCID COc1cc(C(=O)NCC2(C(=O)O)CCOCC2)ccc1S(=O)(=O)F 1599353998 ILEOUIKNVOXKDN-UHFFFAOYSA-N 375.374 0.965 70 20 GCID CCNC(=O)CN1CCN(C(=O)C[C@H](NC(C)=O)c2ccc(F)cc2F)CC1 159919570 SLQJTNHFHQGLTP-KRWDZBQOSA-N 396.438 0.812 70 20 GCID O=S(=O)(Cc1c(F)cccc1F)NCCN1CCN(c2ncccn2)CC1 160864388 VMUUUFSABOJPIM-UHFFFAOYSA-N 397.451 0.996 70 20 GCID O=C(Cn1nnc(-c2ccccc2)n1)N[C@H]1CCN(C(=O)c2ccccn2)C1 160169658 PXTGBCJTRBLQOC-HNNXBMFYSA-N 377.408 0.766 70 20 GCID Cc1ccc(C[C@H](C)NS(=O)(=O)c2cnc3c(c2)c(=O)[nH]c(=O)n3C)s1 159662598 BIQNXXGGKZASFV-VIFPVBQESA-N 394.478 0.901 70 20 GCID COCCCNC(=O)CN(C)Cc1nnc2n(C)c(=O)c3cc(C)ccc3n12 159479020 UYQAKMZTJIGWHL-UHFFFAOYSA-N 386.456 0.474 70 20 GCID CC(C)(N)CNC(=O)CCNS(=O)(=O)c1cccc(Br)c1 159948314 UXLZQEBWZJFBBK-UHFFFAOYSA-N 378.292 0.971 70 20 GCID CC1CCN(C2CCC(NS(=O)(=O)c3cn(C)c(=O)n(C)c3=O)CC2)CC1 160965468 NXOQNABFKPMMEV-UHFFFAOYSA-N 398.529 0.405 70 20 GCID C[C@@]1(c2ccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)cc2)NC(=O)NC1=O 1345452243 QNEIUKFBNOBYLQ-HNNXBMFYSA-N 380.357 0.980 70 20 GCID Cn1cc(S(=O)(=O)N2CCO[C@]3(CCc4ccccc43)C2)cc1C(N)=O 159767999 CUOIVAOYUSDHOK-GOSISDBHSA-N 375.450 0.987 70 20 GCID O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1cccc(S(=O)(=O)F)c1 460088311 CFUVRFBCAVJUFA-RFHZTLPTSA-N 382.369 0.446 70 20 GCID O=C(OCC(=O)N1CCN(C(=O)C2CC2)CC1)c1ccc(S(=O)(=O)F)cc1 838088401 VHHPRRNWSYOVTM-UHFFFAOYSA-N 398.412 0.582 70 20 GCID O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1ccc(S(=O)(=O)F)cc1 274948531 HRGOSDDSWCGFRV-RFHZTLPTSA-N 382.369 0.446 70 20 GCID C[C@H](CNS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C)CN1CCOCC1 160374641 WNRRIPPHUYCLRR-CYBMUJFWSA-N 382.486 0.124 70 20 GCID Cn1cc(CCCNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cn1 160932521 CPTXTEKPMGMUFT-UHFFFAOYSA-N 385.472 0.388 70 20 GCID Cc1ccc(S(=O)(=O)NCCNC(=O)N[C@@H]2CCc3[nH]ncc3C2)s1 159459015 CIAZUCLNZMNITF-GFCCVEGCSA-N 383.499 0.915 70 20 GCID Cc1nc2ccccn2c1CN1CCN(S(=O)(=O)N2CCN(C)CC2)CC1 160428351 GICHVSCKADZWEI-UHFFFAOYSA-N 392.529 0.253 70 20 GCID C[C@H](CC(=O)c1cccs1)NC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O 161005947 INJPZQKDCYNMHB-SNVBAGLBSA-N 389.437 0.273 70 20 GCID O=C(O)C1(C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)CCS(=O)(=O)CC1 1605937254 BEIGQGIUQDYOOK-UHFFFAOYSA-N 397.377 0.702 70 20 GCID Cn1cc(CN2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cn1 1096026323 UUUHJFZZJHVSHK-ZLDLUXBVSA-N 381.433 0.942 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC1 1340865958 FYMRDJBBVRZMFT-UHFFFAOYSA-N 378.447 0.381 70 20 GCID CC(C)N1C[C@@H](NC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)CC1=O 217289312 LQQSHQWRLIMUHO-HNNXBMFYSA-N 394.497 0.712 70 20 GCID NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(S(=O)(=O)F)c2)cc1 1337724740 CQXTVCDWNNNMED-UHFFFAOYSA-N 386.426 0.965 70 20 GCID CN[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)C1 160487662 YKEWPILRUBGURB-MRXNPFEDSA-N 380.514 0.267 70 20 GCID CCN(C(=O)[C@@H](C)N1CCN(Cc2ccncc2)CC1)[C@H]1CCS(=O)(=O)C1 161231135 DRPAZFCQXDBTAP-AEFFLSMTSA-N 394.541 0.623 70 20 GCID Cn1cc(N2CCC[C@H](N3CCN(c4ncccc4C(N)=O)CC3)C2=O)cn1 159821634 NWOICJRUHHZKOX-INIZCTEOSA-N 383.456 0.232 70 20 GCID NC(=O)CN(CC(N)=O)C(=O)c1ccc(Br)c(C(F)(F)F)c1 160364268 IWAFIXZATQKBMQ-UHFFFAOYSA-N 382.136 0.881 70 20 GCID C[C@@H](CC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)[C@@H]1CCCNC1 160751702 KOFQCQOTVHDDJZ-LSDHHAIUSA-N 397.545 0.715 70 20 GCID CNC(=O)COc1cccc(CC(=O)N2CCN(Cc3cc(C)on3)CC2)c1 161067359 QESPKUFOQUCJMS-UHFFFAOYSA-N 386.452 0.995 70 20 GCID COC[C@@H](C)NC(=O)NC(=O)COC(=O)c1ccc(S(=O)(=O)F)cc1 838087825 IRKGAWVSRYBNAW-SECBINFHSA-N 376.362 0.362 70 20 GCID Cc1cc(N2CC[C@H](NC(=O)c3cccc(S(=O)(=O)F)c3)C2=O)n(C)n1 1338259656 FDYWFAQQSNCHBX-ZDUSSCGKSA-N 380.401 0.922 70 20 GCID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2ccc(-n3nnnc3O)cc2)cc1 848945905 XJIIQMRYJAQOFL-UHFFFAOYSA-N 399.385 0.827 70 20 GCID COC(=O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@@H](C(=O)OC)C1 1338260903 QCPUOIZEKQLJRW-LDYMZIIASA-N 376.362 0.240 70 20 GCID CCC(N)(CC)CNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 160419403 GYXQBTHPTPRNII-UHFFFAOYSA-N 385.534 0.763 70 20 GCID Cc1ccn(-c2ccccc2CNC(=O)C2CCN(S(N)(=O)=O)CC2)n1 161388276 CZJWMSDJBNRCGC-UHFFFAOYSA-N 377.470 0.712 70 20 GCID CN(CC(=O)N(CCO)Cc1cc(Br)ccc1F)S(C)(=O)=O 160287823 DUJMYYSRADELPK-UHFFFAOYSA-N 397.266 0.801 70 20 GCID Cc1c([C@@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@H]2C(N)=O)cnn1C 865210627 AZMXBTRZNXPKDW-LSDHHAIUSA-N 394.428 0.728 70 20 GCID CNC(=O)COc1cccc(CC(=O)N2CCN(Cc3cc(C)no3)CC2)c1 161123508 PSLMCAWATBITLM-UHFFFAOYSA-N 386.452 0.995 70 20 GCID CCOC(=O)[C@H]1CN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC12COC2 1262799597 KNRICULPGOVRGB-CQSZACIVSA-N 385.413 0.925 70 20 GCID C[C@@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N1CCN(Cc2ccncc2)CC1 161229102 RTTRXTKBEBKWKD-DOTOQJQBSA-N 380.514 0.233 70 20 GCID Cn1c(N)c(C(=O)CN2CCO[C@]3(CCc4ccccc43)C2)c(=O)n(C)c1=O 159449533 WOJWXGCWDGONRG-HXUWFJFHSA-N 384.436 0.023 70 20 GCID NS(=O)(=O)c1ccc(S(=O)(=O)N[C@H]2CCN(c3ccccn3)C2)cc1 218109025 XUUXNYPAAFHFKL-LBPRGKRZSA-N 382.467 0.286 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ncccn1)c1cc(S(=O)(=O)F)c[nH]1 1096026349 VXPHLTOUDPMCKP-OSMZGAPFSA-N 379.417 0.998 70 20 GCID CS(=O)(=O)N1CCN(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)CC1 1120832277 GQOUJYKTDCAION-UHFFFAOYSA-N 384.838 0.716 70 20 GCID O=C1[C@H](N2CCN(c3ccc4nncn4n3)CC2)CCCN1CC(F)(F)F 159903309 LRCJJGLGBIJHRT-GFCCVEGCSA-N 383.378 0.800 70 20 GCID Cn1nccc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863837 YTUDDRODEWKONG-YVLXSGLVSA-N 381.433 0.942 70 20 GCID O=C(Nc1ccn(CC(F)F)n1)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 161472394 ADDQMUYBCGEWEY-LBPRGKRZSA-N 383.399 0.994 70 20 GCID CC(C)C[C@@H](CO)NC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 160736012 KUXGJMBRIVKXFS-VIFPVBQESA-N 386.250 0.416 70 20 GCID CN(CC(=O)Nc1ccc(S(=O)(=O)F)cc1)S(=O)(=O)c1cccnc1 460096613 YCUWMALXNYIKHC-UHFFFAOYSA-N 387.414 0.999 70 20 GCID C[C@@]1(c2ccc(CNC(=O)c3cc(S(=O)(=O)F)c[nH]3)cc2)NC(=O)NC1=O 1123525183 WZLOVLLIUUFNHW-INIZCTEOSA-N 394.384 0.658 70 20 GCID C[C@@]1(c2cccc(NC(=O)c3cc(S(=O)(=O)F)c[nH]3)c2)NC(=O)NC1=O 1518681045 WLTAXPPHCLQMDU-HNNXBMFYSA-N 380.357 0.980 70 20 GCID C[C@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1=O 1348034161 IXDDBKBCIDCEGT-OAHLLOKOSA-N 380.357 0.785 70 20 GCID O=C(C[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)C(=O)O)OCc1ccccc1 1574535155 WZLLXWMNLBBHEL-ZDUSSCGKSA-N 398.368 0.989 70 20 GCID O=C1[C@@H](N2CCN(c3ccc4nncn4n3)CC2)CCCN1CC(F)(F)F 159903461 LRCJJGLGBIJHRT-LBPRGKRZSA-N 383.378 0.800 70 20 GCID CN[C@H]1CCN(C(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)C1 160708893 MRUJALAJTVJBQV-LBPRGKRZSA-N 390.303 0.890 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@@H](C(=O)OC)C1 1338260898 QCPUOIZEKQLJRW-GZMMTYOYSA-N 376.362 0.240 70 20 GCID COC(=O)CCN1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)[C@H](C)C1 1338786106 CZVFYJCCZVWULY-CYBMUJFWSA-N 386.445 0.983 70 20 GCID CC(=O)N1CC[C@@H](NC(=O)c2ccc(-n3cc(Br)cn3)nn2)C1 159450787 LEDYFLDBQUDUJL-LLVKDONJSA-N 379.218 0.775 70 20 GCID Cc1sc(=O)n(CCC(=O)NC[C@@H]2CCC[C@H]2NS(C)(=O)=O)c1C 160279529 BOKBLERJCITFOC-QWHCGFSZSA-N 375.516 0.751 70 20 GCID COC(=O)[C@H]1CC[C@@H](C(=O)O)N(C(=O)Cc2ccc(S(=O)(=O)F)cc2)C1 1598771902 DJESZVGHJYWSQR-AAEUAGOBSA-N 387.385 0.752 70 20 GCID CCOCCC1(CNC(=O)CCc2nc3c([nH]2)c(=O)[nH]c(=O)n3C)CCC1 159965002 HJAYYIUQWJSLQF-UHFFFAOYSA-N 377.445 0.596 70 20 GCID CN[C@@H]1CCN(C(=O)CNS(=O)(=O)c2ccc(Br)s2)C1 160802012 AFFCNZMZOWQNEP-MRVPVSSYSA-N 382.305 0.609 70 20 GCID CNC(=O)Cn1nc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1C 460093321 LJNBUXHZXZGEGB-UHFFFAOYSA-N 390.418 0.397 70 20 GCID CN(C)S(=O)(=O)c1cccc(CN2CCC(N3CCC[C@H]3C(N)=O)CC2)c1 159397419 HOTMQIQNAYAPRU-SFHVURJKSA-N 394.541 0.851 70 20 GCID Cc1c(C(=O)N2CCN(c3ccncc3)CC2)cnc2c1c(=O)n(C)c(=O)n2C 159868867 OKJPHAZUFZTKRU-UHFFFAOYSA-N 394.435 0.298 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)N2CC[C@@H](N3CCN(CC)CC3)C2)c1CC 160392282 QDIBMWRNQVTBHG-OAHLLOKOSA-N 390.532 0.816 70 20 GCID O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc(S(=O)(=O)F)c3)cc2[nH]c1=O 768892444 SZBPEPFYRRIQIS-UHFFFAOYSA-N 399.381 0.675 70 20 GCID Cc1nn(C)c2ncc(S(=O)(=O)N3CCC(Cn4ccnn4)CC3)cc12 159484503 RCIZCEKPBYVMOX-UHFFFAOYSA-N 375.458 0.969 70 20 GCID Cc1conc1NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1 160211999 GAHSZZCRUGXDNL-UHFFFAOYSA-N 375.404 0.999 70 20 GCID 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O=C(O)CN1CCCC[C@H](NC(=O)Cc2ccc(S(=O)(=O)F)cc2)C1=O 1606257018 GSRIQUOQXFILHD-ZDUSSCGKSA-N 386.401 0.469 70 20 GCID CCN(CC)C(=O)CN1CCC(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1520008362 YWKFAPMNWYNPAM-UHFFFAOYSA-N 388.465 0.736 70 20 GCID COc1cc(C(=O)N2C[C@@H](N(C)C)[C@H](n3ccnn3)C2)ccc1S(=O)(=O)F 1550707670 KMUOBRUMCDMRRL-CHWSQXEVSA-N 397.432 0.572 70 20 GCID O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)c1cc(S(=O)(=O)F)c[nH]1 1263760747 KVRPEXHVCMVKIM-UHFFFAOYSA-N 379.435 0.359 70 20 GCID C[C@@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1CCCN(Cc2cnn[nH]2)C1 1575649749 JEDCRBTUVPZUEW-GHMZBOCLSA-N 384.437 0.822 70 20 GCID C[C@H](OC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@H](C(N)=O)C1 838087650 GTJYCFOYBHEWLV-JQWIXIFHSA-N 386.401 0.614 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cocn1)c1cc(S(=O)(=O)F)c[nH]1 1000528245 UPVQVDMIOZMBCX-DVYJOKAKSA-N 382.373 0.836 70 20 GCID O=C(CNC(=O)Cc1ccccc1)NC[C@@H](O)CN1CCc2ccccc2C1 159363673 VEOAZLJKAUWEPG-HXUWFJFHSA-N 381.476 0.881 70 20 GCID CCN(C(=O)CN1CCN(Cc2ccncc2)CC1)[C@H]1CCS(=O)(=O)C1 161233096 IMSZPMICGKAYSX-KRWDZBQOSA-N 380.514 0.235 70 20 GCID O=C(Nc1cccc(S(=O)(=O)F)c1)C1=CC=CN2CCS(=O)(=O)N=C12 460087924 BIKXKHRSNRBMEK-UHFFFAOYSA-N 385.398 0.781 70 20 GCID Cn1cc([C@@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@@H]2C(N)=O)cn1 1550255559 DHWJKENNAKMNFN-KBPBESRZSA-N 380.401 0.419 70 20 GCID CN1CCN(S(=O)(=O)c2ccc(N3CCC(n4ccnn4)CC3)nc2)CC1 160199678 HEPRAIIVBGRBCR-UHFFFAOYSA-N 391.501 0.451 70 20 GCID CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(=O)(=O)F)cc2)CC1 838087742 HWQKHIFLBVYNKF-LLVKDONJSA-N 386.401 0.581 70 20 GCID COCCCN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@@H]1CCS(=O)(=O)C1 1120866606 SRKYYZRTFLFQPJ-SNVBAGLBSA-N 382.435 0.339 70 20 GCID O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(S(=O)(=O)F)c1 1262733235 LJMKCJYKBYJVGF-LWWSYDQCSA-N 392.408 0.882 70 20 GCID O=C(NNC(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cnn(-c2ccccc2)c1 1340088935 UWXWQECOCCGAST-UHFFFAOYSA-N 377.357 0.933 70 20 GCID CN(CC(=O)N1CCN(c2ncnc3c2cnn3C)CC1)C[C@H]1CCC[C@@H]1O 159470184 KYQNGYXNUZPECJ-ZBFHGGJFSA-N 387.488 0.105 70 20 GCID O=C(NCCn1c(=O)[nH]c2ccccc21)N1CCC(N2CCCNC2=O)CC1 159493599 SDRLLUPFNBDVRU-UHFFFAOYSA-N 386.456 0.919 70 20 GCID O=C(N[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 941860038 MTUNOXDSZLLHBO-MHVRPGDESA-N 397.428 0.427 70 20 GCID O=C(c1cc(S(=O)(=O)N2CCC(Cn3ccnn3)CC2)c[nH]1)N1CCCC1 159455104 FYMIFPUBEAKXIH-UHFFFAOYSA-N 392.485 0.943 70 20 GCID Cn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550255544 CZFGEDKDGNJZEX-WFASDCNBSA-N 380.401 0.828 70 20 GCID CSCC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1000528662 ZODSPSFWWLFAKH-QRTLGDNMSA-N 375.447 0.898 70 20 GCID O=C(OCC(=O)N1CCC2(CC1)OCCO2)c1cccc(S(=O)(=O)F)c1 1334330316 OJDRFJNGFLEOTI-UHFFFAOYSA-N 387.385 0.867 70 20 GCID COc1ccccc1CCNC(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C 159622789 JKLOLBVHJIZKIB-UHFFFAOYSA-N 382.420 0.922 70 20 GCID Cn1cnc2cc(C(=O)N3CCN([C@H](C(N)=O)c4ccccc4)CC3)cnc21 160049990 DUIOXHQFXULFOG-KRWDZBQOSA-N 378.436 0.953 70 20 GCID Cc1nn(C)c(N2CCOCC2)c1CN1CCN(C(=O)[C@@H]2CCCO2)CC1 161035260 HNUXNFKGAMBHLN-KRWDZBQOSA-N 377.489 0.388 70 20 GCID COCCN(CCOC)C1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1123731519 QGDNEJKNSJMULI-UHFFFAOYSA-N 391.465 0.872 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1cc(S(=O)(=O)F)c[nH]1 1521206022 LEUQQPYDSPYCKZ-VDUILEQBSA-N 381.385 0.210 70 20 GCID COCCCNC(=O)CN(C)C(=O)c1cncc(I)c1 161294993 FHGSYJBIMFYVST-UHFFFAOYSA-N 391.209 0.911 70 20 GCID O=C(NC[C@@]1(N2CCOCC2)CCSC1)c1cc(S(=O)(=O)F)c[nH]1 1520702591 BMHRXZDFNLDFAD-AWEZNQCLSA-N 377.463 0.611 70 20 GCID Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](O)COCC1CC1 159415468 XZYRMKSHPSNYGS-SJORKVTESA-N 377.420 0.808 70 20 GCID Cc1cc(C)n(CCCNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)n1 159418230 GJVNAKXTBJTMQC-UHFFFAOYSA-N 384.440 0.574 70 20 GCID Cn1cc(N2CC[C@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)cn1 160280347 XYFLHVCRQIHIOI-KRWDZBQOSA-N 383.456 0.448 70 20 GCID O=C(c1ccc(O)nc1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346290778 LOLQBLWSTZZRJP-UHFFFAOYSA-N 382.373 0.372 70 20 GCID CN1C(=O)C[C@H](NC(=O)c2ccc(S(=O)(=O)F)cc2)[C@H]1c1ccnn1C 1550256644 VEGBGSCAUSKSRU-WFASDCNBSA-N 380.401 0.780 70 20 GCID Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1 159906437 FWACIUCIQYVFON-MRVPVSSYSA-N 378.410 0.731 70 20 GCID Cc1noc(C)c1C[C@H](C)NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1 159906578 FWACIUCIQYVFON-QMMMGPOBSA-N 378.410 0.731 70 20 GCID CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)N1CCCN(CC(F)F)CC1 161507000 WHZBSXOYVXHJOC-HNNXBMFYSA-N 389.491 0.912 70 20 GCID CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@@H]3C[C@H]3C3CCCCC3)CC2)CC1 160226994 SDIJCEPYUTWNAP-ZWKOTPCHSA-N 398.573 0.839 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)N[C@@H]1CCN(C2CCOCC2)C1=O 1121190767 HWWRJTMTGFWOGQ-OAHLLOKOSA-N 384.429 0.783 70 20 GCID CS(=O)(=O)CCCCN1CCN(Cc2cc(=O)n3ccsc3n2)CC1 161302740 ZLCVQMGCNRWZGM-UHFFFAOYSA-N 384.527 0.698 70 20 GCID C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC[C@](C)(O)CN1CCOCC1 160025542 VOHVJPNQVLJZBW-LMNJBCLMSA-N 390.528 0.889 70 20 GCID C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)N[C@@H]2CCc3ncnn3C2)CC1 161126402 JZIBXRNODGFGFT-IXDOHACOSA-N 375.521 0.793 70 20 GCID Cn1c(N)c(C(=O)CN2CCO[C@@]3(CCc4ccccc43)C2)c(=O)n(C)c1=O 159449673 WOJWXGCWDGONRG-FQEVSTJZSA-N 384.436 0.023 70 20 GCID C[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1NC(=O)[C@@]12COC[C@@H]1C2 959676578 OTTCAIWKXHAOND-QDRWXPAPSA-N 385.417 0.286 70 20 GCID CC(C)(CNC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@H]1COCC12OCCO2 1337361071 OOSYGJLHOZQUCA-GFCCVEGCSA-N 376.406 0.818 70 20 GCID Cn1c(=O)c2cc(NC(=O)c3cccc(S(=O)(=O)F)c3)cnc2n(C)c1=O 1347808983 GVBSVUPMUNRXIE-UHFFFAOYSA-N 392.368 0.543 70 20 GCID O=C([C@@H]1CSCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1)N1CCSCC1 1262732334 DBCSFFXBDDXPOL-NSHDSACASA-N 393.487 0.763 70 20 GCID COCCCNC(=O)[C@H](C)N1CCN(C(=O)[C@H]2CCn3ccnc3C2)CC1 161411148 FKUKWLXLQHHMDI-HOTGVXAUSA-N 377.489 0.131 70 20 GCID CC(=O)NCCN([C@@H](C)C(=O)O)C(F)(F)COS(=O)(=O)C(F)(F)F 852732410 TZSFHHIWDHATHF-LURJTMIESA-N 386.295 0.357 70 20 GCID C[C@H]1CN(C(=O)CCc2ccc(S(=O)(=O)F)cc2)CCN1S(C)(=O)=O 1337332593 NYRPNISGKZCFRT-LBPRGKRZSA-N 392.474 0.770 70 20 GCID CN(CCNC(=O)N1CCN(CC(F)F)CC1)S(=O)(=O)c1cccs1 159809875 NZJXCOQDUOMFMO-UHFFFAOYSA-N 396.485 0.961 70 20 GCID CC(C)NC(=O)CN1CCN(C(=O)CCc2ccc(S(=O)(=O)F)cc2)CC1 1337798626 JHKRGYPQTSNRKS-UHFFFAOYSA-N 399.488 0.946 70 20 GCID Cc1nc2n(n1)C[C@H](NC(=O)CCC(=O)N1CCN(c3ccccn3)CC1)CC2 161344841 DKCITIDCXUQNAJ-MRXNPFEDSA-N 397.483 0.542 70 20 GCID CS(=O)(=O)CCN(C(=O)CNC(=O)c1ccc(Br)o1)C1CC1 160000434 CQVQWTAEQCOZAS-UHFFFAOYSA-N 393.259 0.808 70 20 GCID O=C1CN(c2ccc(NC(=O)c3cccc(S(=O)(=O)F)c3)cn2)CCN1 1339471776 HEVMOGSPMTVDNP-UHFFFAOYSA-N 378.385 0.928 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2cccc(S(=O)(=O)F)c2)[C@@H](C(=O)OC)C1 1348707133 HYYIPDNTLWDIHH-WCQYABFASA-N 387.385 0.912 70 20 GCID Cc1cc(C(=O)NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c2c(=O)[nH]n(C)c2n1 160548155 HYFJZDQSAHYZTF-HOTGVXAUSA-N 395.463 0.935 70 20 GCID Cc1c(C(=O)NCCc2nc3ccccc3[nH]2)cnc2c1c(=O)n(C)c(=O)n2C 159951033 DZGXHJKXUXAMAE-UHFFFAOYSA-N 392.419 0.789 70 20 GCID O=C(OCC(=O)N1CCC2(CC1)OCCO2)c1ccc(S(=O)(=O)F)cc1 838088201 PSLAMXMQAHBGSY-UHFFFAOYSA-N 387.385 0.867 70 20 GCID O=C(NC[C@H](O)COc1ccc2c(c1)OCO2)c1cc(S(=O)(=O)F)c[nH]1 1263760442 CWZAQBFXVTUNBG-VIFPVBQESA-N 386.357 0.571 70 20 GCID Cc1cc(N2CC[C@H](NC(=O)c3ccc(S(=O)(=O)F)cc3)C2=O)n(C)n1 865208410 IRPLRPDOSJUXCO-ZDUSSCGKSA-N 380.401 0.922 70 20 GCID CCc1c(C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)cnn1CC(C)C 160931394 AZJQAUBMKOLRSH-UHFFFAOYSA-N 377.489 0.911 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@H]1CC[C@H](C(=O)N2CCOCC2)O1 1552595387 CUEIYDGYYTYCQA-ZIAGYGMSSA-N 386.401 0.690 70 20 GCID Cc1ccc(-n2nnc(C(=O)NC[C@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 159469029 UGCKASHJMYOUAK-CQSZACIVSA-N 377.470 0.895 70 20 GCID CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNC(=O)c1cn(Cc2cccs2)nn1 160401949 LLFBAPNLPATVDU-DGCLKSJQSA-N 383.499 0.836 70 20 GCID COC(=O)CCN1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)[C@@H](C)C1 160529655 XMAQVWQLUNJTAG-HKUYNNGSSA-N 390.528 0.975 70 20 GCID Cn1c(=O)c2cc(C(=O)Nc3cccc(S(=O)(=O)F)c3)cnc2n(C)c1=O 460092176 MIIOCMGJEOBAJV-UHFFFAOYSA-N 392.368 0.543 70 20 GCID COC(=O)Cn1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 771829510 GCVWAFMFGGGBSC-UHFFFAOYSA-N 377.375 0.515 70 20 GCID O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cc(S(=O)(=O)F)c[nH]1 1121032296 NVZYCNXJNNTEBO-NOZJJQNGSA-N 380.419 0.139 70 20 GCID C[C@@H]1CC[C@@H](C)N1CCN1CCN(S(=O)(=O)c2ccc(C(N)=O)cc2)CC1 161244199 OCPKREMSACSZEP-HZPDHXFCSA-N 394.541 0.965 70 20 GCID CN(CCOCc1ccccc1)C(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O 161482697 JGJSRVXMUNPFKB-UHFFFAOYSA-N 385.424 0.109 70 20 GCID O=S(=O)(F)c1ccc(N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)nc1 1550634426 LZIKNGPVNOKRID-ZDUSSCGKSA-N 377.463 0.439 70 20 GCID O=C(NCCc1cc2ccccc2[nH]1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 159582882 FNEJRQJVKGYFKF-HOCLYGCPSA-N 389.477 0.862 70 20 GCID CS(=O)(=O)c1ccc(OCCNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1354469184 GPKPPPOBUQWIPH-UHFFFAOYSA-N 390.414 0.885 70 20 GCID COC(=O)C1CCN(CCCNC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1263716503 DTTGSDFAICFMGI-UHFFFAOYSA-N 375.422 0.678 70 20 GCID Cc1nn(C)c(N2CCOCC2)c1CN1CCN(C(=O)[C@H]2CCCO2)CC1 161035386 HNUXNFKGAMBHLN-QGZVFWFLSA-N 377.489 0.388 70 20 GCID CS(=O)(=O)Nc1ccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1347810617 YDFCOMMMMGDIPY-UHFFFAOYSA-N 375.403 0.974 70 20 GCID C[C@@H](CC(=O)c1cccs1)NC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O 161005826 INJPZQKDCYNMHB-JTQLQIEISA-N 389.437 0.273 70 20 GCID CN1CCO[C@H]2CN(C(=O)CNC(=O)c3ccc(Br)cc3)C[C@@H]21 159721406 CWNSHVIMEJJWMZ-KBPBESRZSA-N 382.258 0.720 70 20 GCID CC(C)(C)OC(=O)CNC(=O)COC(=O)c1ccc(S(=O)(=O)F)cc1 838091768 BCIYCQLSZBHVLA-UHFFFAOYSA-N 375.374 0.960 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cc[nH]n1 1001444867 GVUIHDJESDUAGR-DYLAAIIWSA-N 381.389 0.572 70 20 GCID O=C(Cn1nc2ccccn2c1=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1 160545615 MXPXYGIUYJAYJI-SJORKVTESA-N 381.436 0.248 70 20 GCID CN1CCN(CCOc2ccc(NC(=O)C(=O)NCCn3cccc3)cc2)CC1 160084050 WEILLYHWOFZCMN-UHFFFAOYSA-N 399.495 0.869 70 20 GCID Cn1cc(S(=O)(=O)NCC(=O)NCCc2csc(C(C)(C)C)n2)cn1 160761584 JDQULZPQUIETOX-UHFFFAOYSA-N 385.515 0.811 70 20 GCID C[C@@H](NCc1ccc(C(=O)NCC(N)=O)cc1)c1ccc(-n2cnnn2)cc1 161036490 FJCMOVVHHDDQJG-CYBMUJFWSA-N 379.424 0.728 70 20 GCID O=C(NCC(=O)N1CCN(c2ccccc2)CC1)c1cc(S(=O)(=O)F)c[nH]1 1345746146 BAJYNTDWRMHGEQ-UHFFFAOYSA-N 394.428 0.752 70 20 GCID CN(C(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCNCC1=O)c1ccccc1 161263925 RQNRYHVDOJKKBG-IBGZPJMESA-N 394.475 0.809 70 20 GCID CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)c1cc(S(=O)(=O)F)c[nH]1 1346795489 FLRUCJVBQPHJJD-VIFPVBQESA-N 379.410 0.631 70 20 GCID C[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@@H]1C(=O)N1CCOCC1 1550279662 LBARNJAKFTYLFO-WFASDCNBSA-N 384.429 0.912 70 20 GCID Cc1nn(C)c(C)c1-c1cc(C(=O)NC[C@@H]2CCC[C@@H]2NS(C)(=O)=O)[nH]n1 160517744 ZDOJMEQRIOPGJT-STQMWFEESA-N 394.501 0.875 70 20 GCID CS(=O)(=O)CCn1ccc(NC(=O)c2cccc(S(=O)(=O)F)c2)n1 1121032475 QVCNRLRQBYRKBQ-UHFFFAOYSA-N 375.403 0.838 70 20 GCID COC(=O)[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)C[C@H]1C(=O)O 1606421265 KUOWVSQOTVSELY-NXEZZACHSA-N 393.776 0.944 70 20 GCID Cn1ccnc1[C@@](O)(CCNC(=O)c1cc(S(=O)(=O)F)c[nH]1)C(F)(F)F 1348385581 YWFUUUYQBMTTIS-LBPRGKRZSA-N 398.338 0.976 70 20 GCID O=C(Nc1nc2ccc(-c3nn[nH]n3)cc2[nH]1)c1cc(S(=O)(=O)F)c[nH]1 1593264701 FWMNXYZOOOFANE-UHFFFAOYSA-N 376.333 0.982 70 20 GCID O=C(O)C[C@H]1CS(=O)(=O)CCN1C(=O)c1cccc(S(=O)(=O)F)c1 1601964215 POIKCQIEPQDZGR-JTQLQIEISA-N 379.387 0.059 70 20 GCID O=S(=O)(NCCS(=O)(=O)N1CCOCC1)c1ccc(CCCl)cc1 52115918 VCRPNZCUAQYAPH-UHFFFAOYSA-N 396.918 0.408 70 20 GCID COc1cc(C(=O)N2CC[C@@H](N3CCN(C)CC3)C2)ccc1S(=O)(=O)F 1550710232 GRMGCFKPGVSGQP-CQSZACIVSA-N 385.461 0.815 70 20 GCID Cn1c(=O)[nH]c2ccc(C(=O)N3CCCC[C@H]3CCNS(C)(=O)=O)cc21 159472745 ASGNDZOKZLNLSX-ZDUSSCGKSA-N 380.470 0.801 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 1339471676 GBWPTPSIUIAGEW-UHFFFAOYSA-N 383.361 0.939 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)N1CC[C@H](OCCN2CCCCC2)C1 159560564 KTXTWYPKEBMRST-INIZCTEOSA-N 385.468 0.895 70 20 GCID Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)N[C@@H]3CCOC4(CCCCC4)C3)nc21 160710920 BQBJEXUDNOZISN-GFCCVEGCSA-N 389.456 0.881 70 20 GCID Cn1cc(S(=O)(=O)N2CCO[C@@]3(CCc4ccccc43)C2)cc1C(N)=O 159768134 CUOIVAOYUSDHOK-SFHVURJKSA-N 375.450 0.987 70 20 GCID O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Nc1cccc(S(=O)(=O)F)c1 460088296 CFUVRFBCAVJUFA-HBJVGIJOSA-N 382.369 0.446 70 20 GCID COc1cc(S(=O)(=O)F)c(Cl)cc1C(=O)N1CCOC[C@@H]1C(=O)O 1594067880 VMUWKNXPIBZFTI-SECBINFHSA-N 381.765 0.932 70 20 GCID Cc1c(C(=O)Nc2ccc(-n3cccn3)nc2)cnc2c1c(=O)n(C)c(=O)n2C 160552561 QMRYPASSMJWTNF-UHFFFAOYSA-N 391.391 0.774 70 20 GCID CN(C)C(=O)CN1CCCN(S(=O)(=O)Cc2c(F)cccc2F)CC1 160545457 OTYAYISPYSLYIE-UHFFFAOYSA-N 375.441 0.891 70 20 GCID C[C@]1(c2cccc(N3CCOC3=O)c2)NC(=O)N(CCS(=O)(=O)F)C1=O 883953339 RKZKNJNJFIYFFP-OAHLLOKOSA-N 385.373 0.710 70 20 GCID CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1518681175 YSRIFGIGHZPVNM-JTQLQIEISA-N 381.451 0.607 70 20 GCID Cc1c(NC(=O)C(=O)NCC(=O)NCC(F)(F)F)cnn1-c1ccccc1 160280501 CYOGPZGOXBMWLY-UHFFFAOYSA-N 383.330 0.914 70 20 GCID O=C(NCCNc1ccc(-c2nn[nH]n2)cn1)c1cc(S(=O)(=O)F)c[nH]1 1606782450 ZQNRJTINWQVMGU-UHFFFAOYSA-N 380.365 0.090 70 20 GCID CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@H](OC)C1 946798098 YVJJQQCVCSBWEQ-WGEPELCKSA-N 387.433 0.675 70 20 GCID C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CN(C)[C@@H]1CCS(=O)(=O)C1 159372945 WLOMPXUJQUSYKM-NXHRZFHOSA-N 379.526 0.742 70 20 GCID N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1 771829471 DQTUWFUSJDAQPB-UHFFFAOYSA-N 383.382 0.840 70 20 GCID CC(C)(C)N1C[C@H](NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)CC1=O 217286017 LFXVJKNKADILJP-CYBMUJFWSA-N 382.486 0.575 70 20 GCID C[C@@H]1CCO[C@@H]1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1 1000558600 UGOUTVRYVJLCHQ-SLFYDOTPSA-N 399.444 0.960 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cocn1 995904431 DXNRWZPWUWJMAZ-DVYJOKAKSA-N 382.373 0.836 70 20 GCID Cn1cnc(S(=O)(=O)NCC(=O)NCCc2csc(C(C)(C)C)n2)c1 160674304 RPXJAHBYXZCHIR-UHFFFAOYSA-N 385.515 0.811 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)N3CCC[C@@H]3[C@H](O)C(F)(F)F)ccc21 161487635 OBODFAZQKHUVLH-YPMHNXCESA-N 393.387 0.953 70 20 GCID O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1ccc(S(=O)(=O)F)cc1 865209153 JEKRUBMYNGFKNQ-WFASDCNBSA-N 391.442 0.811 70 20 GCID COCCN(C(=O)c1ccc(S(=O)(=O)F)cc1C)[C@@H]1CCS(=O)(=O)C1 1337818538 CRISHJOZDANCOP-GFCCVEGCSA-N 393.458 0.929 70 20 GCID COC[C@H](O)CCNC(=O)C(=O)Nc1ccc(I)cc1 159585090 GCIFJJPFPYYMIB-LLVKDONJSA-N 392.193 0.743 70 20 GCID C[C@@H](CCNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1077622055 ONIKTLHDCRJDNW-KVMADOOQSA-N 399.444 0.721 70 20 GCID C[C@@H](CCNC(=O)c1cc(S(=O)(=O)F)c[nH]1)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 1078506479 OCSICLAHTATAOB-KVMADOOQSA-N 399.444 0.721 70 20 GCID Cc1c(C(=O)NC[C@@H]2Cc3ccccc3O2)cnc2c1c(=O)n(C)c(=O)n2C 161280830 DYLYQBJMICCRAW-ZDUSSCGKSA-N 380.404 0.674 70 20 GCID Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c(O)c1 771832117 XRYNJIZEGSNJOT-UHFFFAOYSA-N 388.398 0.982 70 20 GCID CN(C)[C@@H]1C[C@@H](C(=O)O)CN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 1777026195 AJXWXYJRIDMTBF-HTQZYQBOSA-N 384.323 0.782 70 20 GCID O=S1(=O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)[C@H](C2CC2)C1 460087812 BBCXKFYSXRMTCH-ZDUSSCGKSA-N 397.471 0.543 70 20 GCID Cc1cc(N2CC[C@@H](NC(=O)c3ccc(S(=O)(=O)F)cc3)C2=O)n(C)n1 865208409 IRPLRPDOSJUXCO-CYBMUJFWSA-N 380.401 0.922 70 20 GCID C[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@H]1C(=O)N1CCOCC1 1550279660 LBARNJAKFTYLFO-SWLSCSKDSA-N 384.429 0.912 70 20 GCID COC(=O)[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)c(OC)c2)C[C@@H]1C(=O)O 1606423930 XBYBUQNDLLAZPS-VHSXEESVSA-N 389.357 0.299 70 20 GCID C[C@H](C(=O)NC[C@H]1CC[C@H](C(N)=O)O1)N1CCN(c2ccc(F)cc2)CC1 161190692 RFFVRBLZORMSCT-KBRIMQKVSA-N 378.448 0.485 70 20 GCID Cn1c(=O)c2ccccc2n2c(Cn3c(-c4cccnc4)noc3=O)nnc12 161298672 QCRBHBBTLDEPQC-UHFFFAOYSA-N 375.348 0.841 70 20 GCID Cc1nn(C)c2ncc(S(=O)(=O)N(C)CC3CCN(C[C@@H](C)O)CC3)cc12 161465474 UTBWPENFKOYKRI-CYBMUJFWSA-N 395.529 0.990 70 20 GCID CCNS(=O)(=O)[C@@H]1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)C1 160234874 GPNJKHZFRXRVLR-SJORKVTESA-N 382.530 0.419 70 20 GCID O=C(CNS(=O)(=O)c1ccccc1F)N[C@H]1CCN(c2ccccn2)C1 218086047 AYKJNUBHWVKPCB-ZDUSSCGKSA-N 378.429 0.894 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)[C@H](C(=O)OC)C1 1338260901 QCPUOIZEKQLJRW-KWQFWETISA-N 376.362 0.240 70 20 GCID COC(=O)c1cn([C@@H]2CCN(C(=O)c3cccc(S(=O)(=O)F)c3)C2)nn1 1120948405 XUBPTCFIDIJXGU-LLVKDONJSA-N 382.373 0.810 70 20 GCID O=C(NCC1(N2CCOCC2)CCOCC1)c1cccc(S(=O)(=O)F)c1 1338961909 XZQAXBCWDAFGIM-UHFFFAOYSA-N 386.445 0.956 70 20 GCID CNC(=O)[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@H]1c1cnn(C)c1 1550256585 SLEZXBFUNFDWAA-GJZGRUSLSA-N 394.428 0.680 70 20 GCID COC(=O)Cn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cn1 771829900 NBNRQBAVFIWMNF-UHFFFAOYSA-N 377.375 0.515 70 20 GCID C[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@H]1C(=O)N1CCOCC1 865211222 LBARNJAKFTYLFO-IUODEOHRSA-N 384.429 0.912 70 20 GCID Cc1cc(=O)n2[nH]c(NS(=O)(=O)c3ccc(S(=O)(=O)F)cc3)nc2n1 848946824 BIGFIUWKYJELSX-UHFFFAOYSA-N 387.374 0.185 70 20 GCID Cn1ccnc1CN1[C@H]2CC[C@@H]1C[C@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1097863799 WPKDYGMDOGAFQB-QKCSRTOESA-N 381.433 0.942 70 20 GCID Cc1[nH]nc(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)c1-c1nn[nH]n1 1606014087 PNFUAISFQVUMFG-UHFFFAOYSA-N 387.378 0.357 70 20 GCID Cc1cc(N2CC[C@@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)n(C)n1 160452148 BUWQGIPIIMAWMZ-QGZVFWFLSA-N 397.483 0.756 70 20 GCID C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346321809 ZAJSNDHUKXDVDL-GFCCVEGCSA-N 386.449 0.442 70 20 GCID CCNC(=O)CN1CCN(C(=O)NCCc2nnc(-c3ccccc3)o2)CC1 159914738 VISQALQKQJAJNO-UHFFFAOYSA-N 386.456 0.742 70 20 GCID CC(C)[C@H](NCC(=O)NC[C@@H](c1ccccc1)N(C)C)C(=O)N1CCOCC1 160475587 IQJCPJHLRXRLJK-ICSRJNTNSA-N 390.528 0.879 70 20 GCID Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N(C)CC(C)(C)CN1CCOCC1 160150328 LUTBFWZFPFDRCA-UHFFFAOYSA-N 389.500 0.999 70 20 GCID Cc1cccc(-n2cc(C(=O)NCCN3CCN(c4ncccn4)CC3)nn2)c1 160564308 KZNBUDLHXCGQRO-UHFFFAOYSA-N 392.467 0.918 70 20 GCID Cc1cc(CN2CCN(C(=O)c3coc(S(=O)(=O)N(C)C)c3)CC2)on1 160988124 PYETUHBIZACCAK-UHFFFAOYSA-N 382.442 0.784 70 20 GCID COCCO[C@H]1COCC[C@@H]1NC(=O)Cc1ccc(S(=O)(=O)F)cc1 1338085489 USCUYEQXSFATFQ-GJZGRUSLSA-N 375.418 0.824 70 20 GCID CN(C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C)[C@H]1CCCc2c1cnn2C 160719883 XQJNYVYHQLVTCW-AWEZNQCLSA-N 397.439 0.907 70 20 GCID O=C(c1cccc(S(=O)(=O)F)c1)N1CCC[C@H](N2CCCS2(=O)=O)C1 1121094789 KWLSZXKBMMKWCK-ZDUSSCGKSA-N 390.458 0.985 70 20 GCID COCCc1nnc(SC(F)(F)COS(=O)(=O)C(F)(F)F)n1N 1328033091 OYXDPTDQKAKSQS-UHFFFAOYSA-N 386.324 0.732 70 20 GCID Cn1cc(N2CCN(C(=O)CCc3ccc(S(=O)(=O)F)cc3)CC2=O)cn1 1349425192 UEGKSQSXSDDRBY-UHFFFAOYSA-N 394.428 0.886 70 20 GCID COCCOc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 848947969 UOSNMQILXCEMPB-UHFFFAOYSA-N 391.402 0.961 70 20 GCID Cn1ncc(-c2nn[nH]n2)c1NS(=O)(=O)c1cccc(S(=O)(=O)F)c1 1606270388 BPRGAQDEAPYGHG-UHFFFAOYSA-N 387.378 0.059 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CCC[C@@H](N2CCCS2(=O)=O)C1 1520006313 HAGGEOAZYCUCCI-SNVBAGLBSA-N 379.435 0.313 70 20 GCID C[C@H](O)C[C@@H](CNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1 160049581 VCKJMUOHUZYFTP-ZFWWWQNUSA-N 396.447 0.917 70 20 GCID CS(=O)(=O)N1CCC(CNC(=O)c2ccc(S(=O)(=O)F)cc2)CC1 865209019 FJCSVZQPJGIELL-UHFFFAOYSA-N 378.447 0.746 70 20 GCID CNC(=O)[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@@H]1c1cnn(C)c1 1550256586 SLEZXBFUNFDWAA-HUUCEWRRSA-N 394.428 0.680 70 20 GCID C[C@@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 274962555 LFFYWWNVLJDQJL-YPCYXAEESA-N 396.396 0.834 70 20 GCID CCN(C(=O)[C@@H](C)N1CCN(c2ccncc2)CC1)[C@H]1CCS(=O)(=O)C1 161389244 LAVLMRNXOXJLFI-WBVHZDCISA-N 380.514 0.628 70 20 GCID Cn1cnc(-c2ccc(NC(=O)N3CCN(CC(=O)NC4CC4)CC3)cc2)n1 160824713 ATBBOPKZPXELSB-UHFFFAOYSA-N 383.456 0.910 70 20 GCID CC(=O)NCC(=O)N1CCN(CC(=O)Nc2ccc(Br)cc2)CC1 160086679 RMPDFQSPPNXVQN-UHFFFAOYSA-N 397.273 0.668 70 20 GCID Cn1cncc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550288093 JVGHSBGKLUNUPW-SWLSCSKDSA-N 380.401 0.828 70 20 GCID O=C(O)CN1CCCC[C@@H](NC(=O)Cc2ccc(S(=O)(=O)F)cc2)C1=O 1606257017 GSRIQUOQXFILHD-CYBMUJFWSA-N 386.401 0.469 70 20 GCID COC(=O)[C@H]1CN(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)C[C@@H]1C(=O)O 1606421270 KUOWVSQOTVSELY-UWVGGRQHSA-N 393.776 0.944 70 20 GCID NS(=O)(=O)c1cccc(S(=O)(=O)Nc2cccc(S(=O)(=O)F)c2)c1 768887931 XUGAJHPGEXGAGX-UHFFFAOYSA-N 394.427 0.793 70 20 GCID Cc1nnc(SC(F)(F)COS(=O)(=O)C(F)(F)F)n1CC(N)=O 1327551468 QRPUQPDJCJBRBJ-UHFFFAOYSA-N 384.308 0.623 70 20 GCID COCCN(C(=O)c1ccc(S(=O)(=O)F)cc1C)[C@H]1CCS(=O)(=O)C1 1337818541 CRISHJOZDANCOP-LBPRGKRZSA-N 393.458 0.929 70 20 GCID O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cccc(S(=O)(=O)F)c1 1120948409 XWYJOWICNCCTHS-DOMZBBRYSA-N 391.442 0.811 70 20 GCID COC(=O)CN(CCN1CCOCC1)C(=O)c1cccc(S(=O)(=O)F)c1 1262732514 KHAXVTFOKGQCND-UHFFFAOYSA-N 388.417 0.292 70 20 GCID C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 1340087580 IPSXHPUEVSAXNW-JTQLQIEISA-N 378.389 0.685 70 20 GCID Cc1cc(S(=O)(=O)CCO)ccc1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1351947344 VOQCCKFAGLAODR-UHFFFAOYSA-N 390.414 1.000 70 20 GCID COC[C@H](O)CNC(=O)c1ccc2ncc(I)n2c1 159439260 CWGXHAZYHAFPEZ-SECBINFHSA-N 375.166 0.676 70 20 GCID Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](O)CN1CCCCC1 159997549 UGYXEXZEMSLYER-QZTJIDSGSA-N 390.463 0.867 70 20 GCID Cn1cc([C@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@@H]2C(N)=O)cn1 865210403 DHWJKENNAKMNFN-KGLIPLIRSA-N 380.401 0.419 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@@H]1CC[C@@H](C(=O)N2CCOCC2)O1 1552595381 CUEIYDGYYTYCQA-KBPBESRZSA-N 386.401 0.690 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1ccc(S(=O)(=O)F)cc1 865208355 HSAHNFVBKYDKJT-JURCDPSOSA-N 392.408 0.882 70 20 GCID O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccon1)c1cc(S(=O)(=O)F)c[nH]1 1006340529 XAPUXKFPHNDCQB-DYLAAIIWSA-N 382.373 0.836 70 20 GCID Cn1c(=O)c2ccc(C(=O)Nc3cccc(S(=O)(=O)F)c3)nc2n(C)c1=O 460093204 NSUNLIULQGWFBY-UHFFFAOYSA-N 392.368 0.543 70 20 GCID Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 865210391 CZFGEDKDGNJZEX-IUODEOHRSA-N 380.401 0.828 70 20 GCID Cc1nc(S(=O)(=O)NCCC(=O)N2CCC(NCC3CC3)CC2)cn1C 159838621 MWVSIZZIKHKONM-UHFFFAOYSA-N 383.518 0.388 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2CCn1cncn1)c1cc(S(=O)(=O)F)c[nH]1 1096029493 MBSQLMJBBOOHPW-OSMZGAPFSA-N 382.421 0.300 70 20 GCID CN1CCO[C@@H]2CN(C(=O)CNC(=O)c3cccc(Br)c3)C[C@@H]21 159720348 PJVPFBUCITWPHR-UONOGXRCSA-N 382.258 0.720 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)N[C@H]2CCOC3(CCCCC3)C2)n(C)c1=O 160855125 LFVPYNSWGSASSL-ZDUSSCGKSA-N 389.456 0.432 70 20 GCID CCC[C@@H]1C[C@H]1C(=O)N1C[C@H](O)[C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 970678534 NAZWRYMOJRQFNC-IMJCEVDSSA-N 387.433 0.411 70 20 GCID O=C(N[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C2CC2)C[C@@H]1O)c1cc(S(=O)(=O)F)c[nH]1 970679154 ZSLNRQGLUIFZGS-UNJBNNCHSA-N 385.417 0.021 70 20 GCID O=C(CCC(=O)N1CC[C@H](N2CCCC2)C1)N1CCN(c2ncccn2)CC1 161332607 VVOVTVNFNRTLDG-KRWDZBQOSA-N 386.500 0.602 70 20 GCID C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1=O 1348034160 IXDDBKBCIDCEGT-HNNXBMFYSA-N 380.357 0.785 70 20 GCID CN(CCN1CCOCC1)C(=O)CCC(=O)N1CCN(c2ccccc2)CC1 161250116 LUABOWZBHKABOQ-UHFFFAOYSA-N 388.512 0.906 70 20 GCID COC(=O)CN(CCN1CCOCC1)C(=O)c1ccc(S(=O)(=O)F)cc1 865208314 YXYGTCHERGLHNG-UHFFFAOYSA-N 388.417 0.292 70 20 GCID COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(Cc3ccccn3)CC1)CC2 160705328 XVBMQJLNCOEBDJ-MRXNPFEDSA-N 385.472 0.662 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ncc[nH]1)c1cc(S(=O)(=O)F)c[nH]1 1000526582 IUEZCDIWMJWOOF-QRTLGDNMSA-N 381.389 0.572 70 20 GCID CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@H]3C[C@@H]3C3CCCCC3)CC2)CC1 160226857 SDIJCEPYUTWNAP-MSOLQXFVSA-N 398.573 0.839 70 20 GCID CN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)C1CCN(S(C)(=O)=O)CC1 1121076323 HSOKKXJWLLDYQJ-UHFFFAOYSA-N 392.474 0.770 70 20 GCID CN(CC(=O)Nc1cccc(S(=O)(=O)F)c1)S(=O)(=O)c1cccnc1 460088555 CSSXSPZISDTFTQ-UHFFFAOYSA-N 387.414 0.999 70 20 GCID Cn1c(C(=O)NCCC(=O)N2CCN(c3ccc(F)cc3)CC2)cccc1=O 160240472 PNONHZHJZARGHS-UHFFFAOYSA-N 386.427 0.993 70 20 GCID CC1CCC(NC(=O)CN2CCN(CC(=O)NC[C@@H]3CCCO3)CC2)CC1 161071041 LDRXYACDTRBYEH-ABHNRTSZSA-N 380.533 0.594 70 20 GCID CNC[C@@H]1CCCN1C(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 161229068 YGPGTRWMDQSRNT-KRWDZBQOSA-N 394.541 0.512 70 20 GCID CS(=O)(=O)N1CCC(CNC(=O)c2cccc(S(=O)(=O)F)c2)CC1 1262733516 UUPJYBAXPKTIRX-UHFFFAOYSA-N 378.447 0.746 70 20 GCID CCN(C(=O)[C@H](C)N1CCN(Cc2ccncc2)CC1)[C@@H]1CCS(=O)(=O)C1 161231233 DRPAZFCQXDBTAP-FUHWJXTLSA-N 394.541 0.623 70 20 GCID NCCNC(=O)[C@@H]1CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 852743704 IDNGGKRLGBSWHY-MRVPVSSYSA-N 383.339 0.232 70 20 GCID O=C(CN1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)CC1)N1CCCC1 865205356 CZWAIJSCEBSNCI-UHFFFAOYSA-N 383.445 0.725 70 20 GCID COC[C@H](O)CCNC(=O)Cn1cnc2ccc(Br)cc2c1=O 160845788 HJMQZEGNYFQXDM-LLVKDONJSA-N 384.230 0.673 70 20 GCID Cn1cnc2c1c(=O)n(CC(=O)N[C@@H]1CCOC3(CCCC3)C1)c(=O)n2C 160085674 CBMURPSCQTZSBH-GFCCVEGCSA-N 375.429 0.042 70 20 GCID CCn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c(C(N)=O)n1 460097418 SYDCTVUEDGPYEY-UHFFFAOYSA-N 376.391 0.461 70 20 GCID CS(=O)(=O)NC[C@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865204928 BBZPHXHLYAIINC-GFCCVEGCSA-N 378.447 0.889 70 20 GCID Cn1c(=O)oc2c(C(=O)NCCN3CCN(c4ncccn4)CC3)cccc21 160201623 IMFOZLDNTJAMPI-UHFFFAOYSA-N 382.424 0.474 70 20 GCID C[C@H]1CC[C@@H](C)N1CCN1CCN(S(=O)(=O)c2ccc(C(N)=O)cc2)CC1 161243981 OCPKREMSACSZEP-IYBDPMFKSA-N 394.541 0.965 70 20 GCID O=S(=O)(F)c1ccc(S(=O)(=O)Nc2cc(-c3nn[nH]n3)ccn2)cc1 1593429157 PTODQNGYFHVPLH-UHFFFAOYSA-N 384.374 0.721 70 20 GCID O=C(CCn1[nH]c(=O)c2ccccc2c1=O)N[C@@H]1CCN(c2ccccn2)C1 161270715 XUVXCEPNTYVQMH-CQSZACIVSA-N 379.420 0.870 70 20 GCID O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NCCn1cccn1 159689775 OATUHJRGKFBXJN-UHFFFAOYSA-N 377.879 0.876 70 20 GCID O=C(O)CNC(=O)[C@H]1CCCN1C(=O)c1cc(S(=O)(=O)F)ccc1Cl 1608750287 IDRKGGJOKYALDJ-LLVKDONJSA-N 392.792 0.804 70 20 GCID CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1346848568 JSBVEOHSJTUVOK-GHMZBOCLSA-N 377.394 0.383 70 20 GCID Cc1c(NC(=O)C(=O)NCC2CCN(CCO)CC2)cnn1-c1ccccc1 161303906 SRWMIXFPUZJIFQ-UHFFFAOYSA-N 385.468 0.940 70 20 GCID O=C(NCCC[C@H]1CCCN1Cc1cnn[nH]1)c1cc(S(=O)(=O)F)c[nH]1 1578005694 NGODEEFPUUMWDE-LBPRGKRZSA-N 384.437 0.966 70 20 GCID Cn1cncc1CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1096026311 UHYRMIWZBBWSPL-DGFSRKRXSA-N 381.433 0.942 70 20 GCID CNC(=O)CNC(=O)c1cccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1 1337492998 ZAOVBQOQZPCDHV-UHFFFAOYSA-N 382.373 0.401 70 20 GCID COC(=O)[C@H]1CN(C(=O)c2ccc(S(=O)(=O)F)c(OC)c2)C[C@H]1C(=O)O 1606423931 XBYBUQNDLLAZPS-ZJUUUORDSA-N 389.357 0.299 70 20 GCID CS(=O)(=O)NC[C@@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1 865204931 BBZPHXHLYAIINC-LBPRGKRZSA-N 378.447 0.889 70 20 GCID C[C@@H](C[C@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[nH]c1=O 159468598 WWZKGGUBZHROBR-GWCFXTLKSA-N 396.241 0.928 70 20 GCID CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCN(c3ccncc3)CC1)n2C 161371705 OAQIGDGSUPCOCV-UHFFFAOYSA-N 397.483 0.941 70 20 GCID Cn1cc(-c2nc(C(=O)NC[C@@H]3CCC[C@@H]3NS(C)(=O)=O)cs2)cn1 160301800 NNYLAUMBYAFHGN-JQWIXIFHSA-N 383.499 0.991 70 20 GCID Cc1nn(C)c2c1N(S(=O)(=O)c1ccc(S(=O)(=O)F)cc1)CCO2 460098164 VPOBSSISDRNEEC-UHFFFAOYSA-N 375.403 0.974 70 20 GCID C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)C[C@H](O)CN1CCOCC1 159991127 OVDDPORUTDFNBL-HOJAQTOUSA-N 390.528 0.841 70 20 GCID Cn1cc([C@H]2CN(C(=O)c3ccc(S(=O)(=O)F)cc3)C[C@H]2C(N)=O)cn1 1550255563 DHWJKENNAKMNFN-ZIAGYGMSSA-N 380.401 0.419 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1262673256 FVGWFQDYPJJYOH-MNOVXSKESA-N 394.446 0.481 70 20 GCID COCCN(C(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1)[C@H]1CCS(=O)(=O)C1 217285920 MQQFMIGURFXWQI-STQMWFEESA-N 375.491 0.231 70 20 GCID CN(C)CCNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 161130797 WYZGBCLRHWFRCY-QGZVFWFLSA-N 384.484 0.946 70 20 GCID CCOC(=O)N1CCN(S(=O)(=O)Nc2cccc(S(=O)(=O)F)c2)CC1 768885846 DGCGZJJQMBKYJA-UHFFFAOYSA-N 395.434 0.776 70 20 GCID O=C1CN(c2ccc(NC(=O)c3ccc(S(=O)(=O)F)cc3)cn2)CCN1 865205971 VDPGNISPFBPNER-UHFFFAOYSA-N 378.385 0.928 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2CCOC3(CCCC3)C2)n(C)c1=O 160048128 NYGNSQTWZDWUFJ-GFCCVEGCSA-N 375.429 0.042 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 160572909 XWAKTJDLDDBKLJ-SJORKVTESA-N 378.473 0.963 70 20 GCID COCCNC(=O)CN1CCN(C(=O)c2ccc(C)nc2Br)CC1 160525167 SGQWENDEHUBLFJ-UHFFFAOYSA-N 399.289 0.673 70 20 GCID C[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1NC(=O)[C@H]1OCC[C@H]1C 940367747 KFPOPWRCGFJXFH-MHWZDGSBSA-N 387.433 0.675 70 20 GCID Cc1c(C(=O)NCCN(C(C)C)C(C)C)cnc2c1c(=O)n(C)c(=O)n2C 159933686 AVNPYNRUAJNPFC-UHFFFAOYSA-N 375.473 0.789 70 20 GCID CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NCCCN)c2)CC1 160140315 MKMIRWFQLPBODZ-UHFFFAOYSA-N 388.921 0.745 70 20 GCID Cc1nn(C)c(NC(=O)Cc2ccc(S(=O)(=O)F)cc2)c1-c1nn[nH]n1 1592433974 KQTSQYLEIXTMHX-UHFFFAOYSA-N 379.377 0.748 70 20 GCID Cc1ccc(-n2nnc(C(=O)NC[C@@H]3CCN(S(C)(=O)=O)C3)c2C)cc1 159468893 UGCKASHJMYOUAK-AWEZNQCLSA-N 377.470 0.895 70 20 GCID CCN1CCN(CCNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C)CC1 160183296 MMQSMRCYLSWWAU-UHFFFAOYSA-N 384.484 0.873 70 20 GCID CC(C)N1Cc2cccc(NS(=O)(=O)c3cn(C)c(=O)n(C)c3=O)c2C1 160759722 JSXYRGPLLWMNRQ-UHFFFAOYSA-N 378.454 0.609 70 20 GCID CCCn1c(C)nnc1CN1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 161418930 ALBQNWUOOVTMCA-UHFFFAOYSA-N 381.506 0.545 70 20 GCID C[C@@H]1CN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C[C@H]1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 940341773 VKSTUJREFJCWCY-KVOBGNBSSA-N 399.444 0.817 70 20 GCID O=C(Cn1cnnn1)N1CCN(C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)CC1 160477175 OIRNSZOVNIKNTH-MSOLQXFVSA-N 397.483 0.938 70 20 GCID CN(C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C)[C@@H]1CCCc2c1cnn2C 160719751 XQJNYVYHQLVTCW-CQSZACIVSA-N 397.439 0.907 70 20 GCID O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cccc(S(=O)(=O)F)c1 1120948411 XWYJOWICNCCTHS-SWLSCSKDSA-N 391.442 0.811 70 20 GCID O=C([C@H]1CSCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1)N1CCSCC1 1262732333 DBCSFFXBDDXPOL-LLVKDONJSA-N 393.487 0.763 70 20 GCID COc1cc(S(=O)(=O)F)c(Cl)cc1C(=O)N1CCOC[C@H]1C(=O)O 1594067881 VMUWKNXPIBZFTI-VIFPVBQESA-N 381.765 0.932 70 20 GCID CN(CC(=O)N1CCN(CC(=O)N2CCOCC2)CC1)c1ccccc1F 161141821 KJDGIIJEZLUHCZ-UHFFFAOYSA-N 378.448 0.265 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)N1CC[C@@H](OCCN2CCCCC2)C1 159560702 KTXTWYPKEBMRST-MRXNPFEDSA-N 385.468 0.895 70 20 GCID Cn1c(=O)n(C)c2cc(S(=O)(=O)N3CCC[C@H]3[C@H](O)C(F)(F)F)ccc21 161487759 OBODFAZQKHUVLH-AAEUAGOBSA-N 393.387 0.953 70 20 GCID CN(C)S(=O)(=O)N1CCN(c2ccc(I)cn2)CC1 216875944 PVHCPNZDNDDQIW-UHFFFAOYSA-N 396.254 0.615 70 20 GCID C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCCc1cc2ccccc2[nH]1 159620433 AUAKPYYPAJCCFY-LBPRGKRZSA-N 375.454 0.927 70 20 GCID Cc1noc(C)c1S(=O)(=O)N[C@@H](C)C(=O)N1CCC(NCC2CC2)CC1 159776080 LRDNROPMKDXBOC-LBPRGKRZSA-N 384.502 0.949 70 20 GCID O=C1C[C@@H](C(=O)N2CCc3c(F)cccc3C2)CN1CCN1CCOCC1 161054610 MJMQKOFEEULJLD-MRXNPFEDSA-N 375.444 0.891 70 20 GCID CCC(=O)N1CC[C@H](C(=O)NCC(=O)N2CCN(Cc3ccccc3)CC2)C1 161195580 BIILNFJCZUVPCK-SFHVURJKSA-N 386.496 0.706 70 20 GCID CC(C)(NS(C)(=O)=O)C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 160047667 UFMQKGHQMBVSQS-UHFFFAOYSA-N 379.486 0.535 70 20 GCID CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)c2ccc(S(=O)(=O)F)cc2)C1=O 865208669 SAWLDZPCXJEJPS-MEDUHNTESA-N 383.401 0.795 70 20 GCID C[C@H](NC(=O)c1cc(S(=O)(=O)F)c[nH]1)[C@H]1CCCN(Cc2cnn[nH]2)C1 1575649753 JEDCRBTUVPZUEW-QWRGUYRKSA-N 384.437 0.822 70 20 GCID Cn1cnc2cc(C(=O)NCC(=O)Nc3ccc(-n4cncn4)cc3)cnc21 159657933 AUINEAZYAGKHLX-UHFFFAOYSA-N 376.380 0.918 70 20 GCID C[C@@H]1[C@@H](NC(=O)[C@@]23COC[C@@H]2C3)CCN1C(=O)c1cc(S(=O)(=O)F)c[nH]1 988458796 YSICULSCQPIBJR-IZXSPOQTSA-N 385.417 0.429 70 20 GCID CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNC(=O)c1cc(S(=O)(=O)F)c[nH]1 1349622204 GKOBUIJYCXBLMZ-KOLCDFICSA-N 381.451 0.511 70 20 GCID Cc1nn(C)c(C)c1[C@H](OC(=O)CN1CCS(=O)(=O)CC1)C(F)(F)F 160202932 JQFSAPLWBPGSQT-ZDUSSCGKSA-N 383.392 0.914 70 20 GCID O=C(NCCC(=O)N1CCOCC1)c1cc(S(=O)(=O)F)ccc1Cl 1338846525 ICUYEAGMDOPJBA-UHFFFAOYSA-N 378.809 0.977 70 20 GCID CCN1CCN(CCCNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)CC1 160441246 FJUGSEMKXHYANN-UHFFFAOYSA-N 396.557 0.883 70 20 GCID CN[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCC2)C1 160793907 UMEHMYHIFXHYHF-AWEZNQCLSA-N 380.514 0.971 70 20 GCID C[C@@H](C(=O)NC[C@@H]1CC[C@H](C(N)=O)O1)N1CCN(c2ccc(F)cc2)CC1 161190351 RFFVRBLZORMSCT-RRQGHBQHSA-N 378.448 0.485 70 20 GCID CN(C)C(=O)Cn1cc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)nn1 161307040 JHDKBUNVFCGNFI-UHFFFAOYSA-N 390.875 0.978 70 20 GCID CCN1CCN([C@@H]2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C2)CC1 216970572 KHPNYGWSHZTUOV-MRXNPFEDSA-N 384.480 0.911 70 20 GCID Cc1ccc(NC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1S(=O)(=O)F 857675400 MGBKCMBWWFLUKY-FKGLVLAHSA-N 396.396 0.754 70 20 GCID C[C@H](CNC(=O)C(=O)Nc1ccc(Br)nc1)CN1CCN(C)CC1 160394397 VEWWTHMCDMWNRD-GFCCVEGCSA-N 398.305 0.782 70 20 GCID CN1CCC(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)(N2CCOCC2)CC1 1337360361 DRZSGUYRIPIQMM-UHFFFAOYSA-N 388.465 0.199 70 20 GCID O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NC[C@@H](O)CN1CCCCC1 160067872 JCPHMRHCKGUYTF-OAHLLOKOSA-N 378.864 0.957 70 20 GCID Cc1c(C(=O)NCc2cccc(CN(C)C)c2)cnc2c1c(=O)n(C)c(=O)n2C 160538598 BFBJUWWRZSTOAC-UHFFFAOYSA-N 395.463 0.932 70 20 GCID COCCO[C@H]1COCC[C@H]1NC(=O)Cc1ccc(S(=O)(=O)F)cc1 1338085488 USCUYEQXSFATFQ-CABCVRRESA-N 375.418 0.824 70 20 GCID COCC(COC)N1CCN(C(=O)Cc2ccc(S(=O)(=O)F)cc2)CC1 1349718449 PNANTKOHCZWPHY-UHFFFAOYSA-N 388.461 0.693 70 20 GCID CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 160412566 PYYYWTQRWVIREG-UHFFFAOYSA-N 386.374 0.606 70 20 GCID O=C(NCCNC1CCCCCC1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 159703103 VKOIFELLSZANJP-QGZVFWFLSA-N 380.533 0.596 70 20 GCID O=C([C@@H]1CCS(=O)(=O)C1)N1CCN(Cc2noc(-c3cccs3)n2)CC1 159367486 VVJJRNMYICROKB-GFCCVEGCSA-N 396.494 0.877 70 20 GCID O=C(NC[C@@H]1CCN1C(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1cc(S(=O)(=O)F)c[nH]1 952163956 IKMFWQIYYCOGHE-KVMADOOQSA-N 397.428 0.427 70 20 GCID COC[C@H](O)CCNC(=O)C(=O)Nc1ccccc1I 159488722 CGERKKIXHVZQNP-SECBINFHSA-N 392.193 0.743 70 20 GCID Cc1cc(C(=O)NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c2c(=O)[nH]n(C)c2n1 160548423 HYFJZDQSAHYZTF-JKSUJKDBSA-N 395.463 0.935 70 20 GCID O=C(c1ccc(=O)[nH]c1)N1CCN(C[C@@H](O)COCc2ccccc2F)CC1 159441335 NGPHLHNOSDVDRM-QGZVFWFLSA-N 389.427 0.850 70 20 GCID Cn1c(=O)n(CCC(=O)NC[C@H]2CCC[C@@H]2NS(C)(=O)=O)c2ccccc21 160313430 USRPNIZYSFWKNQ-KGLIPLIRSA-N 394.497 0.564 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N(C)[C@H]1CCN(S(C)(=O)=O)C1 1337462948 LNAVDKDTVLMENF-NSHDSACASA-N 378.447 0.759 70 20 GCID C[C@@H]1CN(C(=O)[C@@]23COC[C@@H]2C3)C[C@H]1NC(=O)c1cc(S(=O)(=O)F)c[nH]1 940341218 FYPIKJPYLUOZNY-QDRWXPAPSA-N 385.417 0.286 70 20 GCID CN(CC(C)(C)CN1CCOCC1)C(=O)Cn1nc2n(c1=O)CCCCC2 160092751 OALPIAAWPUOJMP-UHFFFAOYSA-N 379.505 0.588 70 20 GCID O=C(NNC(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cc(Br)c[nH]1 1347189171 NXBYHVNUQIFIEL-UHFFFAOYSA-N 379.167 0.838 70 20 GCID O=C(COC(=O)c1ccc(S(=O)(=O)F)cc1)NCCCN1CCCC1=O 838088470 XJBXKFYXOKMECF-UHFFFAOYSA-N 386.401 0.630 70 20 GCID CN(C)CCn1nccc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 460099192 ZPNVPSRTLRKYOW-UHFFFAOYSA-N 376.435 0.904 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cnco1 998768229 GKBGOESDWSVZSS-QRTLGDNMSA-N 382.373 0.836 70 20 GCID O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cccc(S(=O)(=O)F)c1 1120948410 XWYJOWICNCCTHS-IUODEOHRSA-N 391.442 0.811 70 20 GCID C[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)F)cc2)C[C@@H]1C(=O)N1CCOCC1 1550279657 LBARNJAKFTYLFO-DOMZBBRYSA-N 384.429 0.912 70 20 GCID Cc1cc(C(=O)N2CCC[C@@H](N3CCCC3)C2)nc2c1c(=O)n(C)c(=O)n2C 159402157 BMHJURLJQNFSCT-CQSZACIVSA-N 385.468 0.641 70 20 GCID CC(C)NC(=O)CN1CCN(S(=O)(=O)Cc2c(F)cccc2F)CC1 160185110 JBRBLOIISMHHIN-UHFFFAOYSA-N 375.441 0.937 70 20 GCID O=C(NCCCn1nc2n(c1=O)CCCC2)N1CCCN(CC(F)F)CC1 160611348 FHXZIRBKDDZMRW-UHFFFAOYSA-N 386.447 0.754 70 20 GCID Cc1nn(C)c(=O)c(C(=O)N2CCN(CC(=O)NCc3ccccc3)CC2)c1C 161365391 JRPUCVMECABHFM-UHFFFAOYSA-N 397.479 0.471 70 20 GCID NC(=O)c1ccc(N2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)nc1 1347339408 FFAOJOTVFZEXHY-UHFFFAOYSA-N 381.389 0.129 70 20 GCID COC(=O)[C@@H]1CC[C@@H](C(=O)O)CN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1598765428 IXQVCCVRHVAJBR-YPMHNXCESA-N 387.385 0.752 70 20 GCID CN1CCN(c2ccc(CNC(=O)c3ccc(CS(C)(=O)=O)o3)cn2)CC1 159437190 PXYMFSZQCWGSTL-UHFFFAOYSA-N 392.481 0.901 70 20 GCID C[C@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CCN1c1nccn2cnnc12 1340087215 GAPYDWJGYMHMNG-JTQLQIEISA-N 393.404 0.462 70 20 GCID O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cc(S(=O)(=O)F)c[nH]1 1521206027 LEUQQPYDSPYCKZ-WTTBSCSTSA-N 381.385 0.210 70 20 GCID O=S(=O)(F)c1ccc(S(=O)(=O)N[C@@H]2CCO[C@H]2c2cc[nH]n2)cc1 1887579012 GJADMEZONBLMLN-OLZOCXBDSA-N 375.403 0.876 70 20 GCID O=S(=O)(F)c1cccc(S(=O)(=O)Nc2ccc(-n3nnnc3O)cc2)c1 799926733 XPCRHEOIYQUHSL-UHFFFAOYSA-N 399.385 0.827 70 20 GCID C[C@H](O)C[C@H](CNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccccc1 160190673 JQNRIEHRLZCCGH-DZGCQCFKSA-N 399.451 0.105 70 20 GCID Cn1c(C(=O)N2CCCN(S(=O)(=O)c3ccccc3)CC2)cccc1=O 160963082 VHTYTJMBYIFGTO-UHFFFAOYSA-N 375.450 0.922 70 20 GCID CC1CCC(NC(=O)CN2CCN(CC(=O)NC[C@H]3CCCO3)CC2)CC1 161071159 LDRXYACDTRBYEH-DAWZGUTISA-N 380.533 0.594 70 20 GCID Cc1nn(C)c2ncc(S(=O)(=O)N(C)CC3CCN(C[C@H](C)O)CC3)cc12 161465608 UTBWPENFKOYKRI-ZDUSSCGKSA-N 395.529 0.990 70 20 GCID COCc1noc(CN2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)n1 1263760796 LYFWDLJMAIBGII-UHFFFAOYSA-N 387.393 0.160 70 20 GCID COC(=O)[C@@H]1CC[C@H](C(=O)O)CN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1598765422 IXQVCCVRHVAJBR-AAEUAGOBSA-N 387.385 0.752 70 20 GCID Cn1ncc2c(N3CCN(C(=O)N[C@@H]4CCN(CC5CC5)C4)CC3)ncnc21 160659310 RJWDHVPLTPCCHU-OAHLLOKOSA-N 384.488 0.679 70 20 GCID CN1C(=O)C[C@@H](NC(=O)c2ccc(S(=O)(=O)F)cc2)[C@@H]1c1ccnn1C 865211035 VEGBGSCAUSKSRU-IUODEOHRSA-N 380.401 0.780 70 20 GCID C[C@H](C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1)n1cnc(-c2nn[nH]n2)n1 1573756194 NNCVLBLZGAVYSY-SSDOTTSWSA-N 398.355 0.596 70 20 GCID C[C@@H](O)C[C@H](CNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1 160049984 VCKJMUOHUZYFTP-UKRRQHHQSA-N 396.447 0.917 70 20 GCID C[C@@H](CO)CNS(=O)(=O)c1cc2c(cc1Br)n(C)c(=O)n2C 159706267 NFFNQMFYXAYVRR-MRVPVSSYSA-N 392.275 0.546 70 20 GCID O=C(N[C@@H]1CN(C(=O)[C@@]23CCC[C@@H]2C3)C[C@H]1O)c1cc(S(=O)(=O)F)c[nH]1 1025698604 WVOBCRUIKLWCFT-RVXWVPLUSA-N 385.417 0.165 70 20 GCID CS(=O)(=O)CCn1cccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1=O 1516702285 UZHGMVYDDGPFPT-UHFFFAOYSA-N 391.402 0.132 70 20 GCID O=C(NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cc(S(=O)(=O)F)c[nH]1 1263760441 CWZAQBFXVTUNBG-SECBINFHSA-N 386.357 0.571 70 20 GCID C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346321810 ZAJSNDHUKXDVDL-LBPRGKRZSA-N 386.449 0.442 70 20 GCID CCOC1CC(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)(N2CCOCC2)C1 1521437661 JNCWHSSQGVPUBM-UHFFFAOYSA-N 389.449 0.673 70 20 GCID O=C(Nc1ccc(S(=O)(=O)F)cc1)[C@H]1CC[C@@H](C(=O)N2CCOCC2)O1 1552595384 CUEIYDGYYTYCQA-KGLIPLIRSA-N 386.401 0.690 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1ncn(-c2ccccc2)n1 159418939 PNFLNMOPCXVYJD-SDADXPQNSA-N 377.404 0.804 70 20 GCID O=C(N[C@@H]1CCCN(CCN2CCOCC2)C1)c1cc(S(=O)(=O)F)c[nH]1 1350388931 QGRKIULOPRWMTK-CYBMUJFWSA-N 388.465 0.199 70 20 GCID CN(C)CCN(CC(=O)N(C)C)C(=O)CCc1ccc(S(=O)(=O)F)cc1 1338965686 WTMRQLUYJXWEAV-UHFFFAOYSA-N 387.477 0.756 70 20 GCID CCNC(=O)CN1CCN(C(=O)C[C@@H](NC(C)=O)c2ccc(F)cc2F)CC1 159919693 SLQJTNHFHQGLTP-QGZVFWFLSA-N 396.438 0.812 70 20 GCID CCc1c(C(=O)N2CC[C@H]3[C@H](CCCN3C)C2)cnc2c1c(=O)n(C)c(=O)n2C 160091563 HYGQWDSPRCIOMB-CJNGLKHVSA-N 399.495 0.751 70 20 GCID CCOC(=O)c1n[nH]c(C2CCN(C(=O)c3cc(S(=O)(=O)F)c[nH]3)CC2)n1 1349622929 SERDAFFJMCWJGD-UHFFFAOYSA-N 399.404 0.988 70 20 GCID O=C1CNCCN1[C@H]1CCCN(C(F)(F)COS(=O)(=O)C(F)(F)F)C1 852746165 FIGVUEXHQVYWIS-VIFPVBQESA-N 395.350 0.342 70 20 GCID CCc1c(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cnc2c1c(=O)n(C)c(=O)n2C 160812232 HLCISRVXUHMNFI-DOTOQJQBSA-N 394.431 0.583 70 20 GCID CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)c2ccc(S(=O)(=O)F)cc2)C1=O 865208670 SAWLDZPCXJEJPS-ZBEGNZNMSA-N 383.401 0.795 70 20 GCID Cn1cnc2c1c(=O)n(CC(=O)N[C@H]1CCOC3(CCCC3)C1)c(=O)n2C 160085802 CBMURPSCQTZSBH-LBPRGKRZSA-N 375.429 0.042 70 20 GCID O=C(CCn1cc(Br)ccc1=O)NC[C@@H](O)CN1CCCCC1 160441156 UUOWDXGQQKYYTC-CQSZACIVSA-N 386.290 0.964 70 20 GCID O=C(COc1ccccc1-c1nn[nH]n1)Nc1ncc(S(=O)(=O)F)s1 1592898417 SCNXNAUMNGXDOF-UHFFFAOYSA-N 384.374 0.999 70 20 GCID COc1cc(C(=O)N2C[C@H](N(C)C)[C@@H](n3ccnn3)C2)ccc1S(=O)(=O)F 1550707679 KMUOBRUMCDMRRL-STQMWFEESA-N 397.432 0.572 70 20 GCID CN(c1ccc(-c2nn[nH]n2)nc1)S(=O)(=O)c1ccc(S(=O)(=O)F)cc1 1591155209 JUDASATUUAJBTG-UHFFFAOYSA-N 398.401 0.745 70 20 GCID Cc1onc(-c2ccccn2)c1C(=O)NC[C@@H](O)CN1CCCCC1 160198149 ZSZUBJIAZMUODV-SNVBAGLBSA-N 344.415 1.622 70 20 GCID Cn1c(C(=O)N2CCN(CC(=O)N3CCc4ccccc43)CC2)cccc1=O 159934318 SYLPJSRXTJITBS-UHFFFAOYSA-N 380.448 0.732 70 20 GCID Cn1cnc2c1c(=O)n(CC(=O)N[C@@H]1CCOC3(CCCCC3)C1)c(=O)n2C 160885174 LOVRJGXGYRIVRW-CYBMUJFWSA-N 389.456 0.432 70 20 GCID O=C(N[C@H]1CCN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)C1)c1cc(S(=O)(=O)F)c[nH]1 938844591 HCYQGHSNCARKIW-KVMADOOQSA-N 397.428 0.427 70 20 GCID O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1cnc2c(c1)c(=O)[nH]c(=O)n2C1CC1 159787923 WBXSCXPVUSSFPN-HOTGVXAUSA-N 378.388 0.808 70 20 GCID C[C@@H]1CC[C@@H](C)N1CCN1CCN(S(=O)(=O)c2cc(C(N)=O)n(C)c2)CC1 161244969 XCYPYYQVBVDCHI-HUUCEWRRSA-N 397.545 0.303 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)C#CC1CC1)c1cc(S(=O)(=O)F)c[nH]1 1000527623 QPGNXGQTIYFUTJ-ZLDLUXBVSA-N 379.413 0.948 70 20 GCID COC[C@@H](O)CCNC(=O)C(=O)Nc1ccc(I)cc1 159585204 GCIFJJPFPYYMIB-NSHDSACASA-N 392.193 0.743 70 20 GCID C[C@H](CC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)[C@@H]1CCCNC1 160751782 KOFQCQOTVHDDJZ-HUUCEWRRSA-N 397.545 0.715 70 20 GCID CCS(=O)(=O)N1CCN(C(=O)c2cccc(S(=O)(=O)F)c2)[C@H](C)C1 1338959634 NYPRSGOZJWFQMC-LLVKDONJSA-N 378.447 0.841 70 20 GCID COC(=O)[C@@H]1CCN(C(=O)c2ccc(S(=O)(=O)F)cc2)[C@@H](C(=O)OC)C1 865209715 DRECDQQKKXDGOE-DGCLKSJQSA-N 387.385 0.912 70 20 GCID O=C(N[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@H]1O)[C@@H]1C[C@H]1C1CC1 1023926043 UIAVOWCBPGZDSK-OIMNJJJWSA-N 385.417 0.021 70 20 GCID CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)c2cccc(S(=O)(=O)F)c2)C1=O 1348707608 NXOKAPLNSIIUSY-BDJLRTHQSA-N 383.401 0.795 70 20 GCID CC[C@H](NC(=O)Cn1ccc(=O)[nH]c1=O)[C@H]1CN(Cc2ccccc2)CCO1 159638310 HPEHBUDCCGRPNX-DLBZAZTESA-N 386.452 0.332 70 20 GCID CCCN[C@H](C1=CCCCO1)[C@@H](OCC)C(C)(C)C 160178413 SALAKRPYUFRMEO-CYBMUJFWSA-N 269.429 3.500 70 20 GCID Cc1cc(C(=O)NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c2c(=O)[nH]n(C)c2n1 160548272 HYFJZDQSAHYZTF-CVEARBPZSA-N 395.463 0.935 70 20 GCID COc1cc(C)nc(NNS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)n1 771839785 KJFFKTNCJFRJPE-UHFFFAOYSA-N 376.391 0.757 70 20 GCID COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 771830053 PGVNFRPNRDFRCD-UHFFFAOYSA-N 388.398 0.977 70 20 GCID Cn1cnc2c1c(=O)n(CC(=O)O[C@H](c1ccccn1)C(F)(F)F)c(=O)n2C 159961778 DGXWKFQKYVXMCG-GFCCVEGCSA-N 397.313 0.676 70 20 GCID O=C(Cn1nc2ccccn2c1=O)NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 160545485 MXPXYGIUYJAYJI-IAGOWNOFSA-N 381.436 0.248 70 20 GCID C[C@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 460095338 VBDWQYGMZPBWKF-OJGWYHNPSA-N 396.396 0.834 70 20 GCID CS(=O)(=O)CCCCN1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 161313117 HUJBGZLWNCCAIA-UHFFFAOYSA-N 378.498 0.866 70 20 GCID O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Nc1cccc(S(=O)(=O)F)c1 460090895 JGIPLLUWDZTFBI-UXOAXIEHSA-N 396.396 0.836 70 20 GCID C[C@@H]1C[C@H](NC(=O)N2CCN(S(C)(=O)=O)CC2)CN1Cc1ccccc1 160040776 JNYWHRJPDHRYSA-WBVHZDCISA-N 380.514 0.936 70 20 GCID CN(C)C(=O)c1nn(C)cc1NS(=O)(=O)c1ccc(S(=O)(=O)F)cc1 460088396 BZCRFDAAHJTDCS-UHFFFAOYSA-N 390.418 0.581 70 20 GCID CN(CCOCc1ccccc1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 161424109 ZNVYOFACFWCMLF-UHFFFAOYSA-N 385.424 0.109 70 20 GCID CS(=O)(=O)[C@H]1CSCCN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1349436404 PHXMAXFESUWRRX-ZDUSSCGKSA-N 381.472 0.833 70 20 GCID COC(=O)CNC(=O)Cc1ccc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)cc1 1518680975 VCWRSILBOWFJBJ-UHFFFAOYSA-N 397.384 0.757 70 20 GCID Cn1ccc(CN2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n1 1096026125 MFJFEKWIZXAUSJ-ZLDLUXBVSA-N 381.433 0.942 70 20 GCID C[C@H](C[C@H](O)c1ccccc1)NC(=O)Cn1cc(Br)c(=O)[nH]c1=O 159468740 WWZKGGUBZHROBR-MFKMUULPSA-N 396.241 0.928 70 20 GCID Nc1c(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)[nH]c(=O)[nH]c1=O 160360427 SLYHGNZHYANELD-UHFFFAOYSA-N 383.330 0.627 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)N2CCC[C@@H]2CN2CCOCC2)c1CC 160438212 YHJZSOHTOWHWLM-CQSZACIVSA-N 377.489 0.901 70 20 GCID O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)F)c[nH]1 1338401581 XLEFMTWIUPLTMB-MRVPVSSYSA-N 376.391 0.481 70 20 GCID NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1518676649 AASVHYDMSQERPN-HNNXBMFYSA-N 394.428 0.657 70 20 GCID Cc1cccc([C@@H](C)C(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)c1 159656760 JCBXNYXQWVNCDI-QGZVFWFLSA-N 394.541 0.735 70 20 GCID C[C@H]1C[C@H](NC(=O)N(C)C[C@H](O)CN2CCOCC2)CN1Cc1ccccc1 160280025 PDNKTELJTGCAFE-IHPCNDPISA-N 390.528 0.984 70 20 GCID COCCN(C(=O)c1ccc(S(=O)(=O)F)cc1)[C@@H]1CCS(=O)(=O)C1 865206980 DQNFEBKINRXOJZ-GFCCVEGCSA-N 379.431 0.621 70 20 GCID CN(C)N(C(=O)Cc1ccc(S(=O)(=O)F)cc1)[C@@H]1CCS(=O)(=O)C1 1120824497 STAPFXDXHJTWGJ-GFCCVEGCSA-N 378.447 0.380 70 20 GCID Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NC[C@H](O)COCC1CC1 159415342 XZYRMKSHPSNYGS-DLBZAZTESA-N 377.420 0.808 70 20 GCID CN(C)CCN1C[C@H](C(=O)NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)CC1=O 160507266 UCRMRJFBHXBPTN-QYZOEREBSA-N 388.512 0.148 70 20 GCID Cn1cnc2c1c(=O)n(CC(=O)O[C@@H](c1ccccn1)C(F)(F)F)c(=O)n2C 159961633 DGXWKFQKYVXMCG-LBPRGKRZSA-N 397.313 0.676 70 20 GCID O=C(CCC(=O)N1CC[C@@H](N2CCCC2)C1)N1CCN(c2ncccn2)CC1 161332731 VVOVTVNFNRTLDG-QGZVFWFLSA-N 386.500 0.602 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(Cc3ccccn3)CC1)CC2 160705441 XVBMQJLNCOEBDJ-INIZCTEOSA-N 385.472 0.662 70 20 GCID CC(C)C[C@H](CO)NC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 160736139 KUXGJMBRIVKXFS-SECBINFHSA-N 386.250 0.416 70 20 GCID O=C(NC1(C(=O)O)CCS(=O)(=O)CC1)c1ccc(S(=O)(=O)F)cc1 1601432418 ITZVUOXBGRUBGY-UHFFFAOYSA-N 379.387 0.107 70 20 GCID CCCCNC(=O)Cc1noc(-c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)n1 160850749 DSJNCYUNOFNJAK-UHFFFAOYSA-N 386.412 0.449 70 20 GCID CN(C(=O)c1ccc(S(=O)(=O)F)cc1)C1CCN(S(C)(=O)=O)CC1 865209500 WZBYDPJXRVDVBR-UHFFFAOYSA-N 378.447 0.841 70 20 GCID CC(C)CS(=O)(=O)N1CCC(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1348034144 ILSURVIKFYUVHO-UHFFFAOYSA-N 395.478 0.853 70 20 GCID O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(S(=O)(=O)F)cc1 865208416 JGVOKYVHZTUENN-UHFFFAOYSA-N 376.369 0.996 70 20 GCID CN1CCN(c2cc(CNC(=O)c3ccc(CS(C)(=O)=O)o3)ccn2)CC1 160345348 VMBQTIGESNQERR-UHFFFAOYSA-N 392.481 0.901 70 20 GCID NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1 218109105 XUUXNYPAAFHFKL-GFCCVEGCSA-N 382.467 0.286 70 20 GCID Cn1cc(N2CCN(C(=O)Cc3ccc(S(=O)(=O)F)cc3)CC2=O)cn1 1338746614 KFGMWIQNLUIHSK-UHFFFAOYSA-N 380.401 0.496 70 20 GCID O=C1NC[C@@H]2CN([C@@H]3CCN(c4ccc(Cl)c(F)c4)C3=O)CCN2C1=O 161378452 BJTXZOUVLFFYRZ-BXUZGUMPSA-N 380.807 0.227 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1cn[nH]c1 995824860 OVSCMBBZRQBTTK-CDMKHQONSA-N 381.389 0.572 70 20 GCID Cc1nc(C)c(CCNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)s1 159504604 CFXPOSGFHQGRAF-UHFFFAOYSA-N 387.465 0.986 70 20 GCID O=C(Cn1cnnn1)N1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1 160477275 OIRNSZOVNIKNTH-ZWKOTPCHSA-N 397.483 0.938 70 20 GCID CCC(=O)N1CC[C@@H](C(=O)NCC(=O)N2CCN(Cc3ccccc3)CC2)C1 161195701 BIILNFJCZUVPCK-GOSISDBHSA-N 386.496 0.706 70 20 GCID CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NCCn3cccc3)cc21 160088734 CNCLSJNZSGCSDE-UHFFFAOYSA-N 385.424 0.713 70 20 GCID Cc1cc(NC(=O)c2cc(S(=O)(=O)F)c[nH]2)n([C@H]2CCS(=O)(=O)C2)n1 1347808963 GDPAUIUPVVBFNQ-VIFPVBQESA-N 390.418 0.790 70 20 GCID Cn1cc(N2CCC[C@@H](N3CCN(C(=O)c4ccc(=O)[nH]c4)CC3)C2=O)cn1 159455024 ZDAJRLYGZQKXJZ-MRXNPFEDSA-N 384.440 0.062 70 20 GCID Cn1cc(CN2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2cc(S(=O)(=O)F)c[nH]2)nn1 1096026417 ZXUPCQUKGIWSOE-OSMZGAPFSA-N 382.421 0.337 70 20 GCID O=C([C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1CCc2c(F)cccc2C1 160894916 UKIRMKLMZVQJMW-KGLIPLIRSA-N 380.441 0.746 70 20 GCID COc1ccc(N(C)C(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)cc1Cl 160123613 AEWYIBKNJJFYHB-UHFFFAOYSA-N 391.815 0.759 70 20 GCID O=C(Cn1nnc2ccccc2c1=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 160326378 DBBCUBAQGWMFPP-MSOLQXFVSA-N 385.468 0.676 70 20 GCID O=C(N[C@@H]1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C[C@@H]1O)[C@@H]1C[C@H]1C1CC1 964331383 UIAVOWCBPGZDSK-UNJBNNCHSA-N 385.417 0.021 70 20 GCID O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1ccc(S(=O)(=O)F)cc1 865209151 JEKRUBMYNGFKNQ-IUODEOHRSA-N 391.442 0.811 70 20 GCID Cn1ccnc1CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1096026358 WPKDYGMDOGAFQB-OSMZGAPFSA-N 381.433 0.942 70 20 GCID CC(C)(C)n1ncn(CC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c1=O 159610629 XJEYOZOZYFSAIH-AWEZNQCLSA-N 384.502 0.758 70 20 GCID O=C(NCCNC1CCCCCC1)[C@H]1CC(=O)N(CCN2CCOCC2)C1 159703238 VKOIFELLSZANJP-KRWDZBQOSA-N 380.533 0.596 70 20 GCID CN(C)CCN1C[C@H](C(=O)NC[C@H]2C[C@H](O)CN2Cc2ccccc2)CC1=O 160507494 UCRMRJFBHXBPTN-QRVBRYPASA-N 388.512 0.148 70 20 GCID NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NCCn2cccc2)CC1 160183247 WHQRHZMYTOLPGN-UHFFFAOYSA-N 383.452 0.945 70 20 GCID O=C(c1ccc(O)cc1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1346641873 MOFKHUWKQVXNCK-UHFFFAOYSA-N 381.385 0.977 70 20 GCID O=C(COc1ccc(-c2nn[nH]n2)cc1)Nc1ncc(S(=O)(=O)F)s1 1592889446 OOOWMBXGCTWMOJ-UHFFFAOYSA-N 384.374 0.999 70 20 GCID CS(=O)(=O)NC[C@@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)F)c1 1337666827 IREUGZTXCKPVNZ-LBPRGKRZSA-N 378.447 0.889 70 20 GCID O=C(CCc1ccc(S(=O)(=O)F)cc1)N=c1cc[nH]cc1-c1nn[nH]n1 1592851912 PNGSMBMNRNRCOF-UHFFFAOYSA-N 376.373 0.913 70 20 GCID CC(=O)N[C@H](CC(=O)N1CCN(C(=O)CN(C)C)CC1)c1ccc(F)cc1F 160268429 PZCBYFHKMRSMGT-QGZVFWFLSA-N 396.438 0.765 70 20 GCID Cn1c(=O)[nH]c2ccc(C(=O)N3CCCC[C@@H]3CCNS(C)(=O)=O)cc21 159472612 ASGNDZOKZLNLSX-CYBMUJFWSA-N 380.470 0.801 70 20 GCID COC(=O)[C@H]1CCN(C(=O)c2cccc(S(=O)(=O)F)c2)[C@H](C(=O)OC)C1 1348707128 HYYIPDNTLWDIHH-AAEUAGOBSA-N 387.385 0.912 70 20 GCID O=C(NC1CN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 997037785 AUNVXWKJFYUJCI-QXJJFIIZSA-N 383.401 0.037 70 20 GCID Cc1nn(C)c(=O)c(C(=O)N2CCN(CC(=O)N3CCCC[C@@H]3C)CC2)c1C 161460446 RRASBDNSIMYBAQ-AWEZNQCLSA-N 389.500 0.556 70 20 GCID Cn1cc(-c2nn[nH]n2)c(NS(=O)(=O)c2cccc(S(=O)(=O)F)c2)n1 1592559729 BUFOFZKYPCKLCE-UHFFFAOYSA-N 387.378 0.059 70 20 GCID Cc1cc(S(=O)(=O)F)ccc1C(=O)N[C@H]1CCCCN(CC(=O)O)C1=O 1594328039 GVKPATQFLPCEEU-ZDUSSCGKSA-N 386.401 0.849 70 20 GCID CCNC(=O)CN1CCN(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)CC1 159662317 OOFYWTRUIOPMQO-AWEZNQCLSA-N 394.907 0.777 70 20 GCID O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(S(=O)(=O)F)c[nH]1 1348708057 VPHMJKFQPPMZSW-UHFFFAOYSA-N 396.404 0.141 70 20 GCID COC(=O)CCN1CCN(CC(=O)NC[C@@H](c2ccccc2)N(C)C)[C@H](C)C1 160529538 XMAQVWQLUNJTAG-MJGOQNOKSA-N 390.528 0.975 70 20 GCID O=C(Cc1ccc(S(=O)(=O)F)cc1)N1CCN(CC(=O)N2CCCC2)CC1 1120821817 NYXWHHDCGNPMBK-UHFFFAOYSA-N 397.472 0.654 70 20 GCID Cn1nncc1CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1cc(S(=O)(=O)F)c[nH]1 1096026179 OJPCHDBQMAJVFX-LQJRIPTKSA-N 382.421 0.337 70 20 GCID CN(C)CCNC(=O)c1cccc(CNC(=O)c2cc(S(=O)(=O)F)c[nH]2)c1 1516702003 ROQDFJFVBXJBGC-UHFFFAOYSA-N 396.444 0.894 70 20 GCID Cc1nn(C)c(=O)c(C(=O)N2CCN(CC(=O)N3CCCC[C@H]3C)CC2)c1C 161460556 RRASBDNSIMYBAQ-CQSZACIVSA-N 389.500 0.556 70 20 GCID N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1 771829858 MANBDMNZDRKLNO-UHFFFAOYSA-N 383.382 0.840 70 20 GCID CS(=O)(=O)CCn1ccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)n1 865208693 SYOPRLNQAXWLNF-UHFFFAOYSA-N 375.403 0.838 70 20 GCID CS(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)c1cn(Cc2cccs2)nn1 160402355 LLFBAPNLPATVDU-AAEUAGOBSA-N 383.499 0.836 70 20 GCID CS(=O)(=O)[C@@H]1CSCCN1C(=O)Cc1ccc(S(=O)(=O)F)cc1 1349436400 PHXMAXFESUWRRX-CYBMUJFWSA-N 381.472 0.833 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 160573267 XWAKTJDLDDBKLJ-DLBZAZTESA-N 378.473 0.963 70 20 GCID O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccc(S(=O)(=O)F)cc1 865208356 HSAHNFVBKYDKJT-NZBPQXDJSA-N 392.408 0.882 70 20 GCID CCc1c(C(=O)N2CCN(CC(=O)N3CCCCC3)CC2)[nH]c(C)c1C(N)=O 160117172 OHNAWCOUQJROAZ-UHFFFAOYSA-N 389.500 0.755 70 20 GCID COC(=O)[C@@]12C[C@@H](N)C[C@@H]1CN(C(=O)Cc1ccc(S(=O)(=O)F)cc1)C2 1578841518 HLACGOXACXVFJG-IIYDPXPESA-N 384.429 0.626 70 20 GCID Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)NCCc3cc4ccccc4[nH]3)nc21 159576647 OUJBTUPZYBQZPB-UHFFFAOYSA-N 380.408 0.723 70 20 GCID CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNC(=O)c1cn(Cc2ccccc2)nn1 160372649 NQMZHJZFTZJAOU-HUUCEWRRSA-N 377.470 0.774 70 20 GCID CC(C)N1C[C@H](NC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)CC1=O 217289311 LQQSHQWRLIMUHO-OAHLLOKOSA-N 394.497 0.712 70 20 GCID CN(C)c1ccc(Br)c(S(=O)(=O)N[C@@H]2CCS(=O)(=O)C2)c1 159952155 DDXQLPJDGKJMLM-SECBINFHSA-N 397.316 0.981 70 20 GCID C[C@H]1C[C@@H](NC(=O)N2CCN(S(C)(=O)=O)CC2)CN1Cc1ccccc1 160041176 JNYWHRJPDHRYSA-DOTOQJQBSA-N 380.514 0.936 70 20 GCID O=C(Nc1ccc(S(=O)(=O)CCO)cc1)c1cc(S(=O)(=O)F)c[nH]1 1123741533 AGEWTWQCTBPDOH-UHFFFAOYSA-N 376.387 0.691 70 20 GCID O=C(NCCCN1CCN(c2ncccn2)CC1)c1cc(S(=O)(=O)F)c[nH]1 1350747197 HRGICFYJDNNZJX-UHFFFAOYSA-N 396.448 0.405 70 20 GCID Cc1nn(C)c(C)c1CN1CCN(C(=O)NC[C@@H]2CCCS2(=O)=O)CC1 160248626 SQWCREDPINMPKU-HNNXBMFYSA-N 383.518 0.441 70 20 GCID CN(C)c1cccc(CNC(=O)NCCCCN2CCN(CCO)CC2)n1 161248615 PNTMIRJHNSHLJW-UHFFFAOYSA-N 378.521 0.337 70 20 GCID COC(=O)C1CC2(C1)CN(C(=O)c1cc(S(=O)(=O)F)c[nH]1)C[C@@H]2C(=O)O 1604292972 QZKGHKGVDDJOCU-IXZKOCCXSA-N 388.373 0.399 70 20 GCID Cc1c(C(=O)NC[C@@H](c2ccco2)N(C)C)cnc2c1c(=O)n(C)c(=O)n2C 159461940 KEAFTSFMQDSZCY-ZDUSSCGKSA-N 385.424 0.566 70 20 GCID Cc1c(C(=O)NCCc2cn3ccccc3n2)cnc2c1c(=O)n(C)c(=O)n2C 160290968 NBHBWKXUXYYFAB-UHFFFAOYSA-N 392.419 0.561 70 20 GCID O=C(CNC(=O)NCc1ccco1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 160573019 XWAKTJDLDDBKLJ-IRXDYDNUSA-N 378.473 0.963 70 20 GCID C[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 274962545 LFFYWWNVLJDQJL-LXOGICJWSA-N 396.396 0.834 70 20 GCID COC(=O)[C@H]1CN(C(=O)c2cc(S(=O)(=O)F)ccc2Cl)C[C@H]1C(=O)O 1606421275 KUOWVSQOTVSELY-ZJUUUORDSA-N 393.776 0.944 70 20 GCID CN(C(=O)NCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCS(=O)(=O)C1 217306182 WMNKYHGLCVXUED-LBPRGKRZSA-N 379.438 0.501 70 20 GCID C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)N[C@H]2CCc3ncnn3C2)CC1 160979622 CDFYCQBMOIVDNE-HOTGVXAUSA-N 389.504 0.321 70 20 GCID CCS(=O)(=O)N(C)C1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1347458760 YRMQCPMXAPVCRY-UHFFFAOYSA-N 381.451 0.559 70 20 GCID Cn1cc(N2CCC[C@@H](N3CCN(c4ncccc4C(N)=O)CC3)C2=O)cn1 159821770 NWOICJRUHHZKOX-MRXNPFEDSA-N 383.456 0.232 70 20 GCID C[C@@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N1CCN(Cc2ccncc2)CC1 161229359 RTTRXTKBEBKWKD-RDJZCZTQSA-N 380.514 0.233 70 20 GCID NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1 1518676651 AASVHYDMSQERPN-OAHLLOKOSA-N 394.428 0.657 70 20 GCID O=C(CCC(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1)N1CCOCC1 160071032 MUMHSTPJCAVXRZ-UHFFFAOYSA-N 385.468 0.846 70 20 GCID Cn1c(=O)c2c(ncn2CC(=O)N[C@H]2CCOC3(CCCC3)C2)n(C)c1=O 160048266 NYGNSQTWZDWUFJ-LBPRGKRZSA-N 375.429 0.042 70 20 GCID C[C@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N1CCN(Cc2ccncc2)CC1 161229233 RTTRXTKBEBKWKD-NVXWUHKLSA-N 380.514 0.233 70 20 GCID Nc1c(C(=O)CN2CCO[C@]3(CCc4ccccc43)C2)c(=O)[nH]c(=O)n1C1CC1 159419542 IGSHWCQERHQXMA-OAQYLSRUSA-N 396.447 0.810 70 20 GCID O=C(NC1CCN(C(=O)c2cc(S(=O)(=O)F)c[nH]2)CC1)N1CCOCC1 1348406748 WVDJMNYOAJJVMG-UHFFFAOYSA-N 388.421 0.319 70 20 GCID O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(S(=O)(=O)F)c1 1262733236 LJMKCJYKBYJVGF-UOVKNHIHSA-N 392.408 0.882 70 20 GCID CCNC(=O)CN1CCN(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CC1 159662183 OOFYWTRUIOPMQO-CQSZACIVSA-N 394.907 0.777 70 20 GCID O=C(c1cc(S(=O)(=O)F)c[nH]1)N1CC(Oc2ccc(-c3nn[nH]n3)cc2)C1 1593328230 FZVBZBBAUFRHAD-UHFFFAOYSA-N 392.372 0.756 70 20 GCID C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(CCO)CCN1CCOCC1 160014668 MQWBTPNGVSFQLM-QUCCMNQESA-N 390.528 0.843 70 20 GCID CCc1n[nH]c(=O)c(CNC(=O)N2CCN(C3CCOCC3)CC2)c1CC 160390110 UDTBNGCPOWMEOG-UHFFFAOYSA-N 377.489 0.901 70 20 GCID CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)c2ccc(S(=O)(=O)F)cc2)C1=O 865208667 SAWLDZPCXJEJPS-BDJLRTHQSA-N 383.401 0.795 70 20 GCID O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(S(=O)(=O)F)c[nH]1)c1ncc[nH]1 996256403 BDDGGZVBXKZFIK-QRTLGDNMSA-N 381.389 0.572 70 20 GCID COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(S(=O)(=O)F)c[nH]2)C1 1263697104 LWGNAJUPWNSLPG-GHMZBOCLSA-N 375.422 0.676 70 20 GCID CN(CCNC(=O)N[C@H]1CCc2[nH]ncc2C1)S(=O)(=O)c1cccs1 159457743 RREYIKNPAJEERX-LBPRGKRZSA-N 383.499 0.948 70 20 GCID COCCO[C@@H]1COCC[C@H]1NC(=O)Cc1ccc(S(=O)(=O)F)cc1 1338085490 USCUYEQXSFATFQ-HUUCEWRRSA-N 375.418 0.824 70 20 GCID Cn1ccc(N2CCC[C@H](NC(=O)N3CCN(Cc4ccccn4)CC3)C2=O)n1 160425975 HHBHTZKEOQVOAV-KRWDZBQOSA-N 397.483 0.838 70 20 GCID COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(Cc3cc(C)no3)CC1)CC2 161081385 BWUGMYYMXUHDFG-AWEZNQCLSA-N 389.460 0.563 70 20 GCID C[C@H](CO)CNS(=O)(=O)c1cc2c(cc1Br)n(C)c(=O)n2C 159706131 NFFNQMFYXAYVRR-QMMMGPOBSA-N 392.275 0.546 70 20 GCID NC(=O)c1cnn2c(C(=O)N3CCN(Cc4ccc(Cl)nc4)CC3)ccnc12 160272598 YRIPDWXKADELCF-UHFFFAOYSA-N 399.842 0.835 70 20 GCID