smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NC3CCCCC3)c2)CC1 216873927 SYFLWVFRRUBETM-UHFFFAOYSA-N 399.944 2.339 70 40 GEIB C[C@@H](C(=O)NCc1ccc2c(c1)OCO2)N(c1ccc(F)cc1)S(C)(=O)=O 218452070 AXTBUVUQSDDHMN-LBPRGKRZSA-N 394.424 2.025 70 40 GEIB COc1ccc(-c2noc(CNC(=O)[C@H]3COc4ccccc4O3)n2)c(OC)c1 218301030 AAVSFCKJJARMDX-QGZVFWFLSA-N 397.387 2.210 70 40 GEIB Cc1nc(-c2ccc(S(=O)(=O)NCC[C@@H](O)c3cccn3C)cc2)co1 217945278 GYXQFDWJGBZQTD-GOSISDBHSA-N 375.450 2.391 70 40 GEIB COc1cc(OC)cc(OCC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1 217010639 WRWYPEVITWSJIL-UHFFFAOYSA-N 385.464 2.473 70 40 GEIB COCCN(CCOC)C(=O)Nc1ccc(S(=O)(=O)Cl)c(Cl)c1 110166963 QSUFKGWMVDCUSC-UHFFFAOYSA-N 385.269 2.394 70 40 GEIB COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1S(=O)(=O)Cc1ccccc1 217999215 CMAAWHOQKGMTEL-DOTOQJQBSA-N 393.436 2.350 70 40 GEIB CN(c1ccc(C(=O)NCc2nc(-c3cccs3)no2)cc1)S(C)(=O)=O 218338541 NACZUFRBRSZPTE-UHFFFAOYSA-N 392.462 2.124 70 40 GEIB CCS(=O)(=O)N(C)c1ccc(C(=O)NCCN(C)c2ccccc2)cc1 218440657 XMMKSDUCDIJFKF-UHFFFAOYSA-N 375.494 2.339 70 40 GEIB O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCCCc1ccccc1Cl 218325771 GMXRGGJUSXTQIB-UHFFFAOYSA-N 392.864 2.234 70 40 GEIB COc1ccc(CNC(=O)NCCn2ccnc2-c2ccccn2)cc1OC 217862974 PRTDLMLTEAGTKJ-UHFFFAOYSA-N 381.436 2.462 70 40 GEIB COc1cccc2cc(C(=O)N3CC(N4C(=O)[C@@H]5CC=CC[C@H]5C4=O)C3)oc12 217723903 XRVIOFXHTOLMEZ-HUUCEWRRSA-N 380.400 2.217 70 40 GEIB CC(C)C(NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O)C(C)C 218429445 MMODYEPHHCQGKA-UHFFFAOYSA-N 384.498 2.021 70 40 GEIB Cc1cc(OC2CN(C(=O)c3cc(-c4ccc(F)cc4)nn3C)C2)cc(=O)o1 217751203 KOLJOJDPDNGPBG-UHFFFAOYSA-N 383.379 2.391 70 40 GEIB O=C(c1cccc(C(F)(F)F)c1)N1Cc2cnc(N3CCOCC3)nc2C1 217608884 NJSDPDHRJRATHW-UHFFFAOYSA-N 378.354 2.488 70 40 GEIB CC(=O)NC(=O)C(C#N)=P(c1ccccc1)(c1ccccc1)c1ccccc1 104476358 UGDFATRRNPLMAI-UHFFFAOYSA-N 386.391 2.339 70 40 GEIB Cc1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1C 216860515 ZOUZVELDGPKNLE-UHFFFAOYSA-N 387.505 2.492 70 40 GEIB Cc1cc(O[C@H]2CCN(C(=O)c3ccc(Br)o3)C2)cc(=O)n1C 217773411 MZHJWKZRCNWRMZ-NSHDSACASA-N 381.226 2.343 70 40 GEIB COc1ccc(S(=O)(=O)NCCn2ccnc2-c2ccccn2)cc1F 217864962 KLNJDWPIHJKSNX-UHFFFAOYSA-N 376.413 2.071 70 40 GEIB O=C(NC[C@H](O)c1ccc2c(c1)CCO2)c1ccccc1S(=O)(=O)C(F)F 217583946 RXXPIYFUNTWAOT-AWEZNQCLSA-N 397.399 2.081 70 40 GEIB Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 218021102 BCDROYPVCAETND-ZWKOTPCHSA-N 393.487 2.296 70 40 GEIB Cc1cc(C)cc(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c1 218425915 GBRSBNNAQDZASN-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB Cc1nc(-n2cccc2)sc1C(=O)N1CC[C@H](N2C(=O)CSC2=O)C1 217786144 QBGDPFXEPHKJDE-NSHDSACASA-N 376.463 2.152 70 40 GEIB CSc1ccc(CCC(=O)NC2C[C@@H]3CC[C@H](C2)N3S(C)(=O)=O)cc1 217679883 GFHPYNFZEJLYQG-MQVJKMGUSA-N 382.551 2.412 70 40 GEIB Cc1ccccc1-c1noc(C[C@@H]2CCCN(C(=O)c3ccc(=O)n(C)n3)C2)n1 217826340 YOGBYTGPCKDEKV-HNNXBMFYSA-N 393.447 2.234 70 40 GEIB C[C@@H]1CCCN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCN(C)CC3)c2)C1 216872204 XRSNUIQDUCFBMG-CQSZACIVSA-N 399.944 2.148 70 40 GEIB CCc1ccc(S(=O)(=O)N[C@@H](CN2C(=O)COC2=O)c2ccccc2)s1 217981839 SZAPSAJMBMFTRF-AWEZNQCLSA-N 394.474 2.309 70 40 GEIB COc1cccc2c1ccn2CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 218049203 DJUOXAAXXWRQFU-JKSUJKDBSA-N 377.444 2.458 70 40 GEIB O=C(NCc1ccccn1)[C@H]1CC[C@H](CNS(=O)(=O)c2ccccc2)CC1 217794704 UMVBNDIOGOEUKY-CALCHBBNSA-N 387.505 2.483 70 40 GEIB Cc1nc(-c2ccc(S(=O)(=O)NCC[C@@H](O)C3CCOCC3)cc2)co1 217927602 XABIWOKNKNWDND-GOSISDBHSA-N 380.466 2.106 70 40 GEIB Cc1cc(OC2CCN(S(=O)(=O)Cc3ccccc3F)CC2)cc(=O)n1C 217779931 XLWJQCBHRNVPNZ-UHFFFAOYSA-N 394.468 2.206 70 40 GEIB CN(C)c1ccc([SiH](c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1 195757375 ZDGUKNQYVQMNSL-UHFFFAOYSA-N 389.619 2.133 70 40 GEIB C[C@](O)(CNC(=O)c1ccccc1S(=O)(=O)C(F)F)c1cccs1 217580825 GRENKWLKCVXEQC-HNNXBMFYSA-N 375.418 2.382 70 40 GEIB Cc1ccccc1NC(=O)c1ccc(CS(=O)(=O)N2CCN(C)CC2)cc1 216881320 MDYXQXXLPWGVMK-UHFFFAOYSA-N 387.505 2.325 70 40 GEIB CCn1nc(C)c(S(=O)(=O)N2CCC[C@H](Cc3nc(C4CC4)no3)C2)c1C 217824624 PVDXVEBWOSLGBK-CQSZACIVSA-N 393.513 2.424 70 40 GEIB COc1cccc2cc(C(=O)NC3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)oc12 217678674 QHVLDZNXJJZGNZ-AGUYFDCRSA-N 378.450 2.126 70 40 GEIB COc1ccc2c(c1)cc(CN1C[C@@H]3C[C@H](C1)c1cccc(=O)n1C3)c(=O)n2C 217564411 XYJAPFGBEOKPQM-DOTOQJQBSA-N 391.471 2.328 70 40 GEIB O=C(c1ccc(OC(F)(F)F)cc1)N1Cc2cnc(N3CCOCC3)nc2C1 217610054 COAKUQNSHYZEBR-UHFFFAOYSA-N 394.353 2.368 70 40 GEIB O=C1COC(=O)N1C[C@H](NS(=O)(=O)/C=C/c1ccccc1)c1ccccc1 217981475 DBZFXMGKPOWOTN-FLVLSHQESA-N 386.429 2.297 70 40 GEIB C[C@H](NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O)c1ccccc1 218425328 QGNPHMUXTXTVFK-AWEZNQCLSA-N 390.461 2.101 70 40 GEIB Cc1noc(C)c1S(=O)(=O)N(Cc1ccco1)Cc1nn(C)c2c1CCC2 217907079 NIIHVNPOAYTYTD-UHFFFAOYSA-N 390.465 2.498 70 40 GEIB Cc1cc(O[C@@H]2CCN(C(=O)c3ccc(Br)o3)C2)cc(=O)n1C 217773327 MZHJWKZRCNWRMZ-LLVKDONJSA-N 381.226 2.343 70 40 GEIB Cc1ccc(-c2noc(CNC(=O)c3cccc(NS(C)(=O)=O)c3)n2)cc1 218569833 LQTXUOUZEZRYQO-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB COCCN1C(=O)CS[C@H]1c1cn(Cc2cccc(Br)c2)nn1 216687737 JFEGGFPGBRJZEL-HNNXBMFYSA-N 397.298 2.309 70 40 GEIB Cc1cc(C(=O)NCCCN(C)C)cc2c1N(C)S(=O)(=O)c1ccccc1-2 216892158 LZXUTPGVWQEQJN-UHFFFAOYSA-N 387.505 2.482 70 40 GEIB O=C(CCCN1Cc2ccccc2C1=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217963672 PEMSZXKBXASIBQ-FUHWJXTLSA-N 391.471 2.230 70 40 GEIB COCCN1C(=O)CS[C@@H]1c1cn(Cc2cccc(Br)c2)nn1 216687688 JFEGGFPGBRJZEL-OAHLLOKOSA-N 397.298 2.309 70 40 GEIB O=C(Cc1ccc(S(=O)(=O)F)cc1)N1CCCN(c2ccncc2)CC1 1615057548 FVIKVOUQORSSAJ-UHFFFAOYSA-N 377.441 2.021 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NC(C(C)C)C(C)C 216861896 HVVQPQFGZCJNFK-UHFFFAOYSA-N 395.569 2.342 70 40 GEIB COC1CCN(C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)CC1 217791551 UVFDPNQALOTWRG-UHFFFAOYSA-N 380.510 2.153 70 40 GEIB COc1ccc2c(c1)CCC[C@]2(O)CNS(=O)(=O)c1ccc2c(c1)CCO2 218010054 SBDYBDSGKXWVBY-FQEVSTJZSA-N 389.473 2.133 70 40 GEIB Cc1cc(C)cc(N([C@@H](C)C(=O)Nc2ccccc2C(N)=O)S(C)(=O)=O)c1 218373741 LMTWPFQQXGAMIP-AWEZNQCLSA-N 389.477 2.196 70 40 GEIB COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1S(=O)(=O)Cc1ccccc1 217999298 CMAAWHOQKGMTEL-WBVHZDCISA-N 393.436 2.350 70 40 GEIB CN1CCN(S(=O)(=O)Cc2ccc(C(=O)N3CCCC(C)(C)C3)cc2)CC1 216887884 ALCPWOCNSSSGCA-UHFFFAOYSA-N 393.553 2.026 70 40 GEIB CN(Cc1nc(-c2ccccc2)no1)C(=O)c1ccc(NS(C)(=O)=O)cc1 218404959 KXAYASYIKDTLMR-UHFFFAOYSA-N 386.433 2.380 70 40 GEIB COCCN1C(=O)CS[C@H]1c1cn(Cc2ccccc2Br)nn1 216688848 LCZUWQAVTZICTR-HNNXBMFYSA-N 397.298 2.309 70 40 GEIB O=C(Cc1c(F)cccc1Cl)N1CC(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)C1 217731436 UUTHSYYCOBTWBU-CHWSQXEVSA-N 376.815 2.184 70 40 GEIB COc1cccc2cc(C(=O)N3CC(N4C(=O)[C@H]5CC=CC[C@H]5C4=O)C3)oc12 217723738 XRVIOFXHTOLMEZ-GASCZTMLSA-N 380.400 2.217 70 40 GEIB Cc1ccc(OCCNC(=O)[C@@H](C)N(c2ccc(F)cc2)S(C)(=O)=O)cc1 218458272 QRPANMUYUHZXNT-OAHLLOKOSA-N 394.468 2.484 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)Nc1ccc(F)cc1 216861944 OQDXOFHOSANSKF-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB COC(=O)CS[C@@H]1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)C1 217568221 HUHILPATPBTHCX-LLVKDONJSA-N 379.887 2.018 70 40 GEIB COc1ccc2c(c1)CCC[C@]2(O)CNS(=O)(=O)c1cn(C)c(C(C)C)n1 218010537 WQWMRMRZHGYOCC-IBGZPJMESA-N 393.509 2.055 70 40 GEIB C[C@@H](C(=O)NCCN(C)c1ccccc1)N(c1ccc(F)cc1)S(C)(=O)=O 218459012 UEZXYZCLWFKSIF-HNNXBMFYSA-N 393.484 2.233 70 40 GEIB O=c1[nH]c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2cc(Cl)ccc12 217565809 CBYJQMFPSVGCOL-QWHCGFSZSA-N 382.851 2.358 70 40 GEIB O=C(Nc1cccc(Cn2cccnc2=O)c1)c1cccc(S(=O)(=O)F)c1 1120865949 CLSMECHJYSTWPK-UHFFFAOYSA-N 387.392 2.202 70 40 GEIB CC(=O)Nc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1 218240160 RDNBJBZZIXYTPO-UHFFFAOYSA-N 378.454 2.069 70 40 GEIB O=C(CCc1ccccc1Br)N1CC(N2C(=O)CSC2=O)C1 217744749 HNTZWUGDKZJOPQ-UHFFFAOYSA-N 383.267 2.288 70 40 GEIB COC(=O)c1ccc(S(=O)(=O)NCCn2ccc(-c3ccsc3)n2)cc1 217893339 WBYUSLWYMAOZOD-UHFFFAOYSA-N 391.474 2.377 70 40 GEIB Cc1ccc(OCCNC(=O)[C@H](C)N(c2ccc(F)cc2)S(C)(=O)=O)cc1 218458344 QRPANMUYUHZXNT-HNNXBMFYSA-N 394.468 2.484 70 40 GEIB O=C(c1ccc(=O)[nH]n1)N1CCC[C@@H](Cc2nc(-c3ccccc3F)no2)C1 217795296 HGMZKBDQLIMBHS-LBPRGKRZSA-N 383.383 2.054 70 40 GEIB CC1CCN(C(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2Cl)CC1 216875741 AWNKWUKPNICCOL-UHFFFAOYSA-N 399.944 2.148 70 40 GEIB CC(=O)Nc1ccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)NCCC(C)C)[C@H]4C2=O)cc1 217521465 PCPSZNKSCXDFOD-OZIGNCPNSA-N 397.475 2.094 70 40 GEIB biogenic Cc1cc(S(=O)(=O)NCCC2CCN(C)CC2)ccc1N1CCCC1=O 217018732 YHCIFTZTRKJCOZ-UHFFFAOYSA-N 379.526 2.132 70 40 GEIB CS(=O)(=O)N(CC(=O)NCCC1=CCCCC1)c1ccc2c(c1)OCCO2 218430551 BSAFHMVILGFIQY-UHFFFAOYSA-N 394.493 2.231 70 40 GEIB Cc1cccc(-c2noc(CNC(=O)c3cccc(NS(C)(=O)=O)c3)n2)c1 218569288 CZJAKJAUAHXRQA-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)CC1CCN(C)CC1 216902530 BAEDIIUSWQJIGR-UHFFFAOYSA-N 395.525 2.150 70 40 GEIB Cn1nc(-c2ccc(S(=O)(=O)F)cc2)s/c1=N/NC(=O)c1ccccc1 104239866 RHKQUDXMLWPWQT-KNTRCKAVSA-N 392.437 2.053 70 40 GEIB O=C(c1ccccc1Br)N1CC(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)C1 217732394 AJLMPXZMGAUQCV-BETUJISGSA-N 389.249 2.225 70 40 GEIB Cn1ccnc1S(=O)(=O)C1CCN(C(=O)c2ccc(F)cc2Cl)CC1 217696224 WCDHRKSBQPMXFA-UHFFFAOYSA-N 385.848 2.291 70 40 GEIB COc1ccc(C(=O)N2CCC(N3CCC(OC)CC3)CC2)c(OC)c1OC 217779032 KKXQCDANGBHHNX-UHFFFAOYSA-N 392.496 2.428 70 40 GEIB COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1S(=O)(=O)c1ccccc1 217980165 MERVGKUAJYAJOH-XJKSGUPXSA-N 379.409 2.209 70 40 GEIB COc1ccccc1NC(=O)CS(=O)(=O)c1ccc2[nH]c(=O)cc(C)c2c1 217430019 QYAFAPSHGCKYLF-UHFFFAOYSA-N 386.429 2.258 70 40 GEIB Cn1cccc1[C@H](O)CCNS(=O)(=O)c1ccc(Br)s1 217943606 GOWCLXRUTRRCOT-SNVBAGLBSA-N 379.301 2.251 70 40 GEIB CC(C)CCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1 216871038 MOXCAVCUPGHDGY-UHFFFAOYSA-N 387.933 2.052 70 40 GEIB COC(=O)[C@@H]1C[C@H](Oc2ccccc2F)CN1S(=O)(=O)Cc1ccccc1 217999128 CMAAWHOQKGMTEL-RDJZCZTQSA-N 393.436 2.350 70 40 GEIB COc1ccc(OC[C@H](C)NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 218333942 CQHDDCBEXQDZQZ-AWEZNQCLSA-N 392.477 2.288 70 40 GEIB COC(=O)CS[C@H]1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)C1 217568395 PIPJDTMVZYJGOI-NSHDSACASA-N 383.413 2.375 70 40 GEIB CN1CCN(S(=O)(=O)c2cc(C(=O)NC3CCCCC3)ccc2Cl)CC1 216868779 ZHGBDDDWYRLFCT-UHFFFAOYSA-N 399.944 2.339 70 40 GEIB CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)N3CCCCCC3)c2)CC1 216875784 KTXJOEYSIWEZGZ-UHFFFAOYSA-N 399.944 2.292 70 40 GEIB O=C(Cc1c(F)cccc1Cl)N1CC(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)C1 217731360 UUTHSYYCOBTWBU-STQMWFEESA-N 376.815 2.184 70 40 GEIB COC(=O)Nc1ccc(S(=O)(=O)NC[C@](O)(c2ccccc2)C2CC2)cc1 217579701 ZUBYERVDFLWFDI-IBGZPJMESA-N 390.461 2.441 70 40 GEIB Cc1ccc(C)c(N([C@@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)c1 216943263 LDOIDKNYIGVVIB-KRWDZBQOSA-N 395.569 2.306 70 40 GEIB Cc1ccc(-c2noc(CNC(=O)c3ccccc3NS(C)(=O)=O)n2)cc1 218399045 CPDMLSKAFOHPQL-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB O=C(c1cn(C[C@H](O)c2ccccc2F)nn1)N1CCN(c2ccccc2)CC1 217475275 BWHQJKGCIMDNOU-FQEVSTJZSA-N 395.438 2.113 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCC1CCN(C)CC1 216944917 NNHQRXXYWAKVGU-UHFFFAOYSA-N 393.553 2.241 70 40 GEIB CC(C)C(NC(=O)c1ccc(CS(=O)(=O)N2CCN(C)CC2)cc1)C(C)C 216883402 VMTLLWWWNBMDER-UHFFFAOYSA-N 395.569 2.174 70 40 GEIB CS(=O)(=O)Nc1ccccc1C(=O)NCc1nc(-c2cccs2)no1 218399678 GWDXTMJPDFTPDR-UHFFFAOYSA-N 378.435 2.100 70 40 GEIB O=C(Oc1c(F)c(F)c(F)c(F)c1F)c1cnc(N2CCOCC2)nc1 100041587 SXCSIAUTNMKWKC-UHFFFAOYSA-N 375.253 2.228 70 40 GEIB COc1ccccc1CNC(=O)C(=O)NC[C@H](OC)c1ccccc1Cl 218347719 BMCARUNHTHLAGM-KRWDZBQOSA-N 376.840 2.469 70 40 GEIB COC1CCN(C2CCN(S(=O)(=O)Cc3cc(F)ccc3F)CC2)CC1 217796188 ZCLHHPGWTVWKQR-UHFFFAOYSA-N 388.480 2.370 70 40 GEIB C[C@H](C(=O)NCCN(C)c1ccccc1)N(c1ccccc1)S(C)(=O)=O 218286004 YNFQRFPFEWDQIZ-MRXNPFEDSA-N 375.494 2.094 70 40 GEIB COc1ccc(OCC(=O)NCc2nc(-c3ccc(OC)cc3OC)no2)cc1 217842522 JZYRDDDYSMQTFQ-UHFFFAOYSA-N 399.403 2.458 70 40 GEIB Cc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2C)c1 216860550 JBBZUOIKVBSYJB-UHFFFAOYSA-N 387.505 2.492 70 40 GEIB Cc1ccc(C(=O)N2CCCC(C)(C)C2)cc1S(=O)(=O)N1CCN(C)CC1 216859002 BTZXNOPINNYDGB-UHFFFAOYSA-N 393.553 2.193 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)Nc1ccccc1F 216861920 DOEAGXTWSUWDIS-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB C[C@H](NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 217352241 OGDPGNFFCJNYMO-JENIJYKNSA-N 393.487 2.452 70 40 GEIB CCCc1nnsc1C(=O)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217844164 HZHLVNSVIYKPPU-GFCCVEGCSA-N 399.480 2.426 70 40 GEIB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)CC1CCN(C)CC1 216902580 IQDYVCQJIMCWLR-UHFFFAOYSA-N 383.514 2.052 70 40 GEIB Cc1cc(C(=O)NCc2nc(-c3cccs3)no2)ccc1NS(C)(=O)=O 218599918 SBKMXJULSLMGLK-UHFFFAOYSA-N 392.462 2.408 70 40 GEIB COc1cc2nc(C)n(CC(=O)NC[C@@H]3C[C@@H]4C=C[C@@H]3C4)c(=O)c2cc1OC 218311524 ZKPYJYUMNWIYDG-KFWWJZLASA-N 383.448 2.051 70 40 GEIB COc1cccc(N2C[C@@H](C(=O)Nc3cnn(CC4CCOCC4)c3)CC2=O)c1 218216625 RLKZHTBVNFCGBQ-INIZCTEOSA-N 398.463 2.310 70 40 GEIB Cc1ccc(C)c(N([C@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)c1 216943289 LDOIDKNYIGVVIB-QGZVFWFLSA-N 395.569 2.306 70 40 GEIB C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1ccc(F)cc1)S(C)(=O)=O 218448003 QVNFYHGGHPIXMC-LLVKDONJSA-N 380.397 2.348 70 40 GEIB COc1ccccc1CCCNC(=O)c1ccc(N(C)S(C)(=O)=O)cc1 218333533 WHVUUHHYJHASTM-UHFFFAOYSA-N 376.478 2.454 70 40 GEIB O=C(c1ccc2c(c1)OCO2)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217839722 WNXSVJYIRCWBSK-CYBMUJFWSA-N 393.403 2.350 70 40 GEIB Cc1ccc(OCCNC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 218285464 MCUSIHYWMCZPJG-INIZCTEOSA-N 376.478 2.345 70 40 GEIB CC[C@H](C(=O)NCCC1CCN(C)CC1)N(c1ccc(F)cc1)S(C)(=O)=O 217016444 WJIOYXUITJHICB-GOSISDBHSA-N 399.532 2.218 70 40 GEIB Cn1cccc1[C@@H](O)CCNS(=O)(=O)c1ccc(Br)s1 217943676 GOWCLXRUTRRCOT-JTQLQIEISA-N 379.301 2.251 70 40 GEIB O=S(=O)(c1cccs1)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217851276 CXPVKKJVEGKHNE-GFCCVEGCSA-N 391.478 2.232 70 40 GEIB COc1ccc(OC[C@@H](C)NC(=O)c2ccccc2N(C)S(C)(=O)=O)cc1 218341283 JLXFETHNZJQFFQ-CQSZACIVSA-N 392.477 2.288 70 40 GEIB C[C@@H](C(=O)Nc1ccccc1C(N)=O)N(c1ccc(Cl)cc1)S(C)(=O)=O 218381976 KXTAZKKYJUTQBH-NSHDSACASA-N 395.868 2.232 70 40 GEIB COc1ccc2c(c1)CCC[C@@]2(O)CNS(=O)(=O)c1ccc(C(C)=O)cc1 218009691 QNEXMEREVYOTQZ-HXUWFJFHSA-N 389.473 2.400 70 40 GEIB Cc1ccc(C)c(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c1 218425706 YTERUUIXXJNUAN-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB Cc1ccc(N([C@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)cc1C 216939495 AAMIBAXLDIKSHD-QGZVFWFLSA-N 395.569 2.306 70 40 GEIB O=C(c1ccccc1Br)N1CC(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)C1 217732486 AJLMPXZMGAUQCV-STQMWFEESA-N 389.249 2.225 70 40 GEIB COC(=O)Nc1ccc(S(=O)(=O)NC[C@@](O)(c2ccccc2)C2CC2)cc1 217579623 ZUBYERVDFLWFDI-LJQANCHMSA-N 390.461 2.441 70 40 GEIB C[C@@](O)(CNC(=O)c1ccccc1S(=O)(=O)C(F)F)c1cccs1 217580741 GRENKWLKCVXEQC-OAHLLOKOSA-N 375.418 2.382 70 40 GEIB CN(C)S(=O)(=O)N(CC(=O)NCCCc1ccc(F)cc1)c1ccccc1 218416807 PYXMGGYCHWIPPW-UHFFFAOYSA-N 393.484 2.188 70 40 GEIB CC(C)n1nccc1[C@@H]1OCC[C@H]1NC(=O)c1ccc(S(=O)(=O)F)cc1 1550294588 CAFVNURYXBWBPR-GDBMZVCRSA-N 381.429 2.382 70 40 GEIB COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1S(=O)(=O)Cc1ccccc1 217999375 CMAAWHOQKGMTEL-NVXWUHKLSA-N 393.436 2.350 70 40 GEIB O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2c(c1)OCCCO2 217564307 ILXDFGUYCYBLSB-DOTOQJQBSA-N 380.444 2.312 70 40 GEIB Cc1ccc(-c2noc(CNC(=O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1 218404310 FWEKEKJMQACHIL-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB O=S(=O)(Cc1ccccc1)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217851658 ZZDHEMYFOBYGLI-MRXNPFEDSA-N 399.476 2.311 70 40 GEIB COc1ccc(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)c(OC)c1OC 218401284 GHSMUSLBRYMNIP-UHFFFAOYSA-N 394.449 2.014 70 40 GEIB Cn1cccc1[C@@H](O)CCNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1 217949064 IHDBVARLURHLKQ-AWEZNQCLSA-N 385.342 2.102 70 40 GEIB Cn1cc(S(=O)(=O)Nc2nc3ccccc3nc2NCc2ccco2)cn1 217974108 AOKWSSHYSVHQRT-UHFFFAOYSA-N 384.421 2.369 70 40 GEIB Cc1cc(C)c(C)c(S(=O)(=O)N2CC[C@@H](N3C(=O)CSC3=O)C2)c1C 217788201 GGSYGNFDLXKMTE-CQSZACIVSA-N 382.507 2.379 70 40 GEIB Cc1cccc(N(CC(=O)NCCCN(C)c2ccccc2)S(C)(=O)=O)c1 218232988 UGWXASACBDGKIX-UHFFFAOYSA-N 389.521 2.404 70 40 GEIB Cc1ccc(C(=O)NC(C(C)C)C(C)C)cc1S(=O)(=O)N1CCN(C)CC1 216855505 QGRZNBVUFPEDJM-UHFFFAOYSA-N 395.569 2.342 70 40 GEIB COc1ccc2c(c1)CCC[C@]2(O)CNS(=O)(=O)c1ccc(C(C)=O)cc1 218009761 QNEXMEREVYOTQZ-FQEVSTJZSA-N 389.473 2.400 70 40 GEIB CC[C@@H](C(=O)NCCC1CCN(C)CC1)N(c1ccccc1)S(C)(=O)=O 217015426 HGEVMKGXMVMFCQ-SFHVURJKSA-N 381.542 2.079 70 40 GEIB CN(Cc1nc(-c2cccs2)no1)C(=O)c1cccc(NS(C)(=O)=O)c1 218571275 KBMRUEUIXBZRDY-UHFFFAOYSA-N 392.462 2.442 70 40 GEIB COc1ccc(OC)c(-c2cc(C(=O)NCC[C@H](O)c3cccn3C)n(C)n2)c1 217938579 WAFUXIOEAUMDBZ-IBGZPJMESA-N 398.463 2.296 70 40 GEIB Cc1cccc(C)c1NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O 218425805 ZBPMJKLTNFLUMM-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB COC(=O)CS[C@@H]1CCN(C(=O)COc2cccc3c2OC(C)(C)C3)C1 217557558 ZFDJQTKHMYNUFB-CQSZACIVSA-N 379.478 2.286 70 40 GEIB CN(CCCNC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)c1ccccc1 218339722 RJAJEPXFYXLQRK-UHFFFAOYSA-N 375.494 2.339 70 40 GEIB Cc1nc(-c2ccc(S(=O)(=O)NCC[C@H](O)c3cccn3C)cc2)co1 217945191 GYXQFDWJGBZQTD-SFHVURJKSA-N 375.450 2.391 70 40 GEIB CCC(=O)Nc1ccc(S(=O)(=O)NCC[C@@H](O)c2cccn2C)c(C)c1 217943869 AHLACRBELXAQGN-MRXNPFEDSA-N 379.482 2.084 70 40 GEIB COC(=O)c1cccc(Cn2cc([C@@H]3N(C)C(=O)c4ccccc4N3C)nn2)c1 216758078 UQJPILHBFAKHCB-IBGZPJMESA-N 391.431 2.334 70 40 GEIB CCS(=O)(=O)Nc1ccc(C(=O)NCc2nc(-c3cccs3)no2)cc1 218643897 VNARJHYTATXXSO-UHFFFAOYSA-N 392.462 2.490 70 40 GEIB Cc1ccc(S(=O)(=O)N[C@@H](CN2C(=O)COC2=O)c2ccccc2)cc1C 217981659 IEXKNMQUMDJIDF-KRWDZBQOSA-N 388.445 2.302 70 40 GEIB Cc1ccc(N([C@H](C)C(=O)Nc2ccccc2C(N)=O)S(C)(=O)=O)cc1C 218364634 PUNCLOASROZEHD-CQSZACIVSA-N 389.477 2.196 70 40 GEIB O=C(CCS(=O)(=O)c1ccccc1)N1CC(n2cc(-c3ccccc3)nn2)C1 217671976 VQFQJRACNWXKOF-UHFFFAOYSA-N 396.472 2.192 70 40 GEIB CCN(c1ccc(C(=O)NCCN(C)c2ccccc2)cc1)S(C)(=O)=O 218779912 JHOYYHGJKWYDHA-UHFFFAOYSA-N 375.494 2.339 70 40 GEIB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@@H]34)[C@H]2C1=O)c1cccc(Br)c1 217567000 IYWDNVOMIGEONH-FYYZZUKCSA-N 387.233 2.147 70 40 GEIB COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1S(=O)(=O)c1ccccc1 217980249 MERVGKUAJYAJOH-CJNGLKHVSA-N 379.409 2.209 70 40 GEIB CN(CCCNC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccccc1 218227887 VNHCNCVKWIQYRQ-UHFFFAOYSA-N 375.494 2.095 70 40 GEIB O=C(c1noc2c1CCCC2)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217846129 JSEZINACWOGUMU-CYBMUJFWSA-N 394.435 2.488 70 40 GEIB Cc1cc(C)cc(N([C@H](C)C(=O)Nc2ccccc2C(N)=O)S(C)(=O)=O)c1 218373808 LMTWPFQQXGAMIP-CQSZACIVSA-N 389.477 2.196 70 40 GEIB O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCCCc1ccc(Cl)cc1 218325924 DZVLJDZVNTXAQJ-UHFFFAOYSA-N 392.864 2.234 70 40 GEIB Cc1cc(C(=O)NCc2nc(-c3ccccc3)no2)ccc1NS(C)(=O)=O 218599110 NEFRXVAOBSHGSM-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@@H]1C[C@@H]2C(=O)Nc3ccccc3N2C1 217594149 QQPMBPVYFZWAEL-HTFDGFGYSA-N 377.400 2.144 70 40 GEIB CN(CCCNC(=O)CN(c1ccccc1F)S(C)(=O)=O)c1ccccc1 218264239 MEQYQZXLPGNNCL-UHFFFAOYSA-N 393.484 2.234 70 40 GEIB COc1cc2nc(C)n(CC(=O)NC[C@@H]3C[C@H]4C=C[C@@H]3C4)c(=O)c2cc1OC 218311464 ZKPYJYUMNWIYDG-ZNMIVQPWSA-N 383.448 2.051 70 40 GEIB COc1ccc(S(=O)(=O)Cl)cc1CNC(=O)c1ccc([N+](=O)[O-])cc1 100027182 UPCMYJUWRJUTDW-UHFFFAOYSA-N 384.797 2.461 70 40 GEIB Cc1c(Cl)cccc1S(=O)(=O)N1[C@H]2CC[C@H]1CC(N1C(=O)CCC1=O)C2 217767681 DWNNUCHGBZEWCJ-STQMWFEESA-N 396.896 2.482 70 40 GEIB Cc1ccc(C(=O)Nc2ccc(F)cc2)cc1S(=O)(=O)N1CCN(C)CC1 216855571 VFPHEGMLWIQCPF-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB Cc1nc(-c2ccc(S(=O)(=O)NCC[C@H](O)C3CCOCC3)cc2)co1 217927530 XABIWOKNKNWDND-SFHVURJKSA-N 380.466 2.106 70 40 GEIB Cc1noc(C)c1S(=O)(=O)Nc1cnn(C[C@@H]2COc3ccccc3O2)c1 218294932 JYIVBVWBTYJUMF-CQSZACIVSA-N 390.421 2.129 70 40 GEIB COc1ccccc1-n1c(C[C@@H]2CCCN(C(=O)c3ccco3)C2)n[nH]c1=O 217856304 NGVLBSLLLWISED-AWEZNQCLSA-N 382.420 2.257 70 40 GEIB COc1cc2c(cc1OC)CN(C(=O)[C@H]1CC[C@H](Cn3cnnn3)CC1)CC2 217962523 ITYVHQAOJJAVHE-GASCZTMLSA-N 385.468 2.082 70 40 GEIB O=C(CCCc1nc(-c2ccco2)no1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217953080 RBKJRCRROAWBCZ-LSDHHAIUSA-N 394.431 2.460 70 40 GEIB CS(=O)(=O)N1[C@H]2CC[C@H]1CC(NC(=O)CCc1c(F)cccc1Cl)C2 217679692 DKPBYLCZHMQINM-STQMWFEESA-N 388.892 2.483 70 40 GEIB Cc1nc(-n2cccc2)sc1C(=O)N1CC[C@@H](N2C(=O)CSC2=O)C1 217786222 QBGDPFXEPHKJDE-LLVKDONJSA-N 376.463 2.152 70 40 GEIB Cc1nnn([C@@]23C[C@H]4C[C@@H](C2)C[C@](C(=O)NCc2ccc5c(c2)OCO5)(C4)C3)n1 217550062 XNEGYNRUWLLOPD-IFCLKOLQSA-N 395.463 2.322 70 40 GEIB COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)COc1ccccc1 216844418 HSTLBAHOEAQHOG-UHFFFAOYSA-N 383.448 2.100 70 40 GEIB COC(=O)CS[C@@H]1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)C1 217568323 PIPJDTMVZYJGOI-LLVKDONJSA-N 383.413 2.375 70 40 GEIB CN1CCN(S(=O)(=O)Cc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1 216883466 OLVFMGFRQUUWKY-UHFFFAOYSA-N 391.468 2.155 70 40 GEIB O=C(Cc1csc(-n2cccc2)n1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 218013375 NSACOTGSXSGDNQ-LSDHHAIUSA-N 380.473 2.284 70 40 GEIB COc1ccc(OC[C@H](C)NC(=O)c2ccccc2N(C)S(C)(=O)=O)cc1 218341358 JLXFETHNZJQFFQ-AWEZNQCLSA-N 392.477 2.288 70 40 GEIB O=C(CCCCCNc1ncccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217802080 FEKOMWURMCXBCM-DLBZAZTESA-N 381.480 2.257 70 40 GEIB CC(=O)N1CCc2cc(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccc21 217561913 GNLPPZAUBOWCCP-QFBILLFUSA-N 391.471 2.059 70 40 GEIB COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1S(=O)(=O)c1ccccc1 217980346 MERVGKUAJYAJOH-CZUORRHYSA-N 379.409 2.209 70 40 GEIB C[C@@H](NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O)c1ccccc1 218425261 QGNPHMUXTXTVFK-CQSZACIVSA-N 390.461 2.101 70 40 GEIB Cc1ccc(C(=O)NCCC2CCN(C)CC2)cc1S(=O)(=O)N1CCCC1 216942736 QEYPRXAJHHLQEC-UHFFFAOYSA-N 393.553 2.241 70 40 GEIB CCc1ccc(S(=O)(=O)N[C@H](CN2C(=O)COC2=O)c2ccccc2)s1 217981914 SZAPSAJMBMFTRF-CQSZACIVSA-N 394.474 2.309 70 40 GEIB C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1ccc(F)cc1)S(C)(=O)=O 218447932 QVNFYHGGHPIXMC-NSHDSACASA-N 380.397 2.348 70 40 GEIB CCCCCNC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl 216878185 OXSCSEHFINJYQM-UHFFFAOYSA-N 387.933 2.196 70 40 GEIB O=C(Cn1c(=O)oc2ccccc21)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 217812173 QJRYRDMBVFBLAB-CYBMUJFWSA-N 382.420 2.336 70 40 GEIB COc1ccc(NC(=O)N2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1OC 159388588 VSLBCIYWOBGZDT-JWTNVVGKSA-N 388.512 2.479 70 40 GEIB Cc1cc(C)cc(N([C@@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)c1 216939576 VIXRQIBGDAHISZ-KRWDZBQOSA-N 395.569 2.306 70 40 GEIB C[C@H](C(=O)NCCN(C)c1ccccc1)N(c1ccc(F)cc1)S(C)(=O)=O 218459095 UEZXYZCLWFKSIF-OAHLLOKOSA-N 393.484 2.233 70 40 GEIB CCOC(=O)c1sc(NC(=O)[C@H]2CC[C@H](Cn3cnnn3)CC2)nc1C 218110579 MKPHSUOBFTYORD-TXEJJXNPSA-N 378.458 2.060 70 40 GEIB COc1ccc(CC(=O)N2CCC(N3CCC(OC)CC3)CC2)cc1OC 217759500 WGBDEIRKOVOQJB-UHFFFAOYSA-N 376.497 2.348 70 40 GEIB COCCN1C(=O)CS[C@H]1c1cn(Cc2ccc(Br)cc2)nn1 216687947 JIBBZEDLPPQRNB-HNNXBMFYSA-N 397.298 2.309 70 40 GEIB Cc1cccc(N(CCCC(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)c1 217035752 XMVKKRBNCAJYFW-UHFFFAOYSA-N 395.569 2.389 70 40 GEIB CC(C)c1ccc(N(CC(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)cc1 216934960 FIZIYRUMTULUBZ-UHFFFAOYSA-N 395.569 2.424 70 40 GEIB Cc1ccc(C(=O)NC2CCCCCC2)cc1S(=O)(=O)N1CCN(C)CC1 216856170 VGJRZVJGDQWLDD-UHFFFAOYSA-N 393.553 2.384 70 40 GEIB Cc1cc(OC2CCN(C(=O)c3cc(=O)c4ccccc4o3)CC2)cc(=O)n1C 217776984 AZFPILWIEOWFKJ-UHFFFAOYSA-N 394.427 2.484 70 40 GEIB O=C(CNC(=O)OCc1ccccc1)NC[C@@H]1CCCN(c2nccs2)C1 218165346 DOBMMIPJHQXFLS-INIZCTEOSA-N 388.493 2.402 70 40 GEIB COc1cccc2cc(C(=O)N3Cc4cnc(N5CCOCC5)nc4C3)oc12 217609209 PTMNFXPWMQXWAO-UHFFFAOYSA-N 380.404 2.224 70 40 GEIB CN(CCCNC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)c1ccccc1 218324939 YLUHFGGLONJQKK-UHFFFAOYSA-N 393.484 2.234 70 40 GEIB O=C1OC2(CCN(C(=O)Cn3c(=O)oc4ccccc43)CC2)c2ccccc21 217517041 AFOGAMUSVZXGRI-UHFFFAOYSA-N 378.384 2.283 70 40 GEIB O=C1COC(=O)N1C[C@@H](NS(=O)(=O)/C=C/c1ccccc1)c1ccccc1 217981548 DBZFXMGKPOWOTN-FMQWLBJXSA-N 386.429 2.297 70 40 GEIB Cc1ccc(OCCNC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 218285421 MCUSIHYWMCZPJG-MRXNPFEDSA-N 376.478 2.345 70 40 GEIB COc1cccc2cc(C(=O)N3CC(N4C(=O)[C@H]5CC=CC[C@@H]5C4=O)C3)oc12 217723822 XRVIOFXHTOLMEZ-GJZGRUSLSA-N 380.400 2.217 70 40 GEIB O=S(=O)(Cl)c1cn(CCC(F)(F)F)nc1I 408717537 GNMBYSTXGBDCRM-UHFFFAOYSA-N 388.536 2.368 70 40 GEIB COC(=O)CS[C@@H]1CCN(C(=O)CCc2ccc(OC)c(OC)c2OC)C1 217560700 OCFKXHHNGKJENO-CQSZACIVSA-N 397.493 2.152 70 40 GEIB CS(=O)(=O)N(CC(=O)Nc1ccc(F)c(F)c1)c1ccc2c(c1)OCCO2 218432591 MKWOBQJKIBRXTL-UHFFFAOYSA-N 398.387 2.141 70 40 GEIB COc1ccc(Br)c(C(=O)N2CC[C@@H](N3C(=O)CSC3=O)C2)c1 217782951 HDTGQVMDOLODGR-SECBINFHSA-N 399.266 2.368 70 40 GEIB Cc1ccc(N(CC(=O)NCCCN(C)c2ccccc2)S(C)(=O)=O)cc1 218235726 YUIGVJXWBWCVOC-UHFFFAOYSA-N 389.521 2.404 70 40 GEIB CN(c1ccc(C(=O)NCc2nc(-c3ccccc3)no2)cc1)S(C)(=O)=O 218337705 OHKZWYGLZFJGAK-UHFFFAOYSA-N 386.433 2.062 70 40 GEIB Cc1cc(C)cc(N([C@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)c1 216939594 VIXRQIBGDAHISZ-QGZVFWFLSA-N 395.569 2.306 70 40 GEIB Cc1ccc(C(=O)N(C)C2CCCCC2)cc1S(=O)(=O)N1CCN(C)CC1 216859771 BTOXDWFQZCQHLF-UHFFFAOYSA-N 393.553 2.336 70 40 GEIB COC(=O)CS[C@H]1CCN(S(=O)(=O)c2ccccc2Br)C1 217568579 UZSRTMOSSZNYNC-JTQLQIEISA-N 394.312 2.118 70 40 GEIB COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@H]1CCCN(C)C1 216911584 LTZFJVMCQZKGPH-HNNXBMFYSA-N 395.525 2.150 70 40 GEIB CC(C)CCNC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl 216878296 UCUPVPNDWUCSGM-UHFFFAOYSA-N 387.933 2.052 70 40 GEIB CN1CCC(CCNC(=O)CCCN(c2ccc(F)cc2)S(C)(=O)=O)CC1 216946912 RBDYCTNRVMKREF-UHFFFAOYSA-N 399.532 2.220 70 40 GEIB CN(c1ccccc1C(=O)NCc1nc(-c2ccccc2)no1)S(C)(=O)=O 218344439 KVLCPSJQGFKLAQ-UHFFFAOYSA-N 386.433 2.062 70 40 GEIB O=S(=O)(F)c1cc(S(=O)(=O)N2CCC(C(F)(F)F)CC2)ccc1F 1776011177 GLRFRARRXKOKAT-UHFFFAOYSA-N 393.355 2.447 70 40 GEIB CC(C)(C)OC(=O)N[C@@H](CO)c1ccc(OS(=O)(=O)C(F)(F)F)cc1 138160171 OWWORAGXQBCTMD-NSHDSACASA-N 385.360 2.473 70 40 GEIB O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1c[nH]c(=O)c(Cl)c1 218283966 HXSUWBQSXIZIMZ-ZDUSSCGKSA-N 386.795 2.317 70 40 GEIB COc1nn(C)cc1C(=O)Nc1sc2c(c1-c1nc(C)no1)CCOC2 217964717 ZNOSRYBNCAPLAH-UHFFFAOYSA-N 375.410 2.174 70 40 GEIB CC(=O)Nc1ccc(CC(=O)N2CCC(Oc3cc(C)n(C)c(=O)c3)CC2)cc1 217777495 WRKHDPUWVDZPJS-UHFFFAOYSA-N 397.475 2.265 70 40 GEIB CCC[C@H](C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1 216871099 BCSOPLLUBSSYCI-ZDUSSCGKSA-N 387.933 2.195 70 40 GEIB O=C(c1ccc(-n2cccc2)cc1)N1Cc2cnc(N3CCOCC3)nc2C1 217612689 LNOLEKSIYQEHQK-UHFFFAOYSA-N 375.432 2.260 70 40 GEIB COc1ccc(F)cc1S(=O)(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 217674202 MSLJLBZHEHKLJT-UHFFFAOYSA-N 388.424 2.338 70 40 GEIB CN(Cc1nc(-c2cccs2)no1)C(=O)c1ccc(NS(C)(=O)=O)cc1 218405775 WYZUKKKUFZFBSQ-UHFFFAOYSA-N 392.462 2.442 70 40 GEIB Cc1cc(N2C[C@]34C=C[C@@H](O3)[C@@H](C(=O)NCCCc3ccccc3)[C@H]4C2=O)no1 217714562 QIMMVMVIMHVXCY-GZHDQSLTSA-N 393.443 2.018 70 40 GEIB Cc1ccc(S(=O)(=O)N[C@H](CN2C(=O)COC2=O)c2ccccc2)cc1C 217981743 IEXKNMQUMDJIDF-QGZVFWFLSA-N 388.445 2.302 70 40 GEIB COC(=O)c1ccc(Cn2cc([C@H]3N(C)C(=O)c4ccccc4N3C)nn2)cc1 216758156 DVXPEFOTXNEPTQ-LJQANCHMSA-N 391.431 2.334 70 40 GEIB Cc1ccc(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c(C)c1 218425607 VKNBTYSUHDVCBT-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB O=C(Cc1c(F)cccc1Cl)N1CC(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)C1 217731273 UUTHSYYCOBTWBU-BETUJISGSA-N 376.815 2.184 70 40 GEIB Cc1ccc(NC(=O)CC2CCN(C)CC2)cc1S(=O)(=O)N1CCCC1 216900931 BCHALLWUPGJZHN-UHFFFAOYSA-N 379.526 2.450 70 40 GEIB COc1ccc(OC[C@@H](C)NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 218566806 DRKSKVQKOCZTBP-CYBMUJFWSA-N 378.450 2.264 70 40 GEIB CCC[C@@H](C)NC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl 216878353 RQDBXYINISFHJW-CYBMUJFWSA-N 387.933 2.195 70 40 GEIB C[C@H]1CCCN(C(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2Cl)C1 216880029 RRKDDXIILNFGKL-AWEZNQCLSA-N 399.944 2.148 70 40 GEIB O=C(NCC[C@H](O)c1ccsc1)C(=O)Nc1cccc(N2CCCC2=O)c1 217543865 LDHBEQRXXBFGIW-INIZCTEOSA-N 387.461 2.053 70 40 GEIB O=C(NC[C@@H](O)c1ccc2c(c1)CCO2)c1ccccc1S(=O)(=O)C(F)F 217584030 RXXPIYFUNTWAOT-CQSZACIVSA-N 397.399 2.081 70 40 GEIB CCCCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1 216870998 HKDBCWQGHQAZEY-UHFFFAOYSA-N 387.933 2.196 70 40 GEIB Cc1ccc(NC(=O)c2ccc(CS(=O)(=O)N3CCN(C)CC3)cc2)cc1 216881380 WZQCGVNOVZFFKH-UHFFFAOYSA-N 387.505 2.325 70 40 GEIB CC[C@H](C(=O)NCCC1CCN(C)CC1)N(c1ccccc1)S(C)(=O)=O 217015472 HGEVMKGXMVMFCQ-GOSISDBHSA-N 381.542 2.079 70 40 GEIB CCc1ccc(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)cc1 218428251 VHORGNFMSYAKBX-UHFFFAOYSA-N 390.461 2.425 70 40 GEIB CCC(=O)Nc1ccc(S(=O)(=O)NCC[C@H](O)c2cccn2C)c(C)c1 217943795 AHLACRBELXAQGN-INIZCTEOSA-N 379.482 2.084 70 40 GEIB Cc1ccc(C(=O)NCc2nc(-c3ccccc3)no2)cc1NS(C)(=O)=O 218589621 SLSPHIYWVITOFR-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB Cc1ccc(N([C@@H](C)C(=O)Nc2ccccc2C(N)=O)S(C)(=O)=O)cc1C 218364543 PUNCLOASROZEHD-AWEZNQCLSA-N 389.477 2.196 70 40 GEIB O=C1CCC(=O)N1C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1ccccc1Cl 217766817 KBWMVJOCJRZJAR-FUNVUKJBSA-N 382.869 2.173 70 40 GEIB O=S(=O)(Cl)c1cnn(CCC(F)(F)F)c1I 408717735 QRMCYMPAZWRSQT-UHFFFAOYSA-N 388.536 2.368 70 40 GEIB COc1ccccc1-c1cc(C(=O)N2CC(Oc3cc(C)oc(=O)c3)C2)[nH]n1 217751896 UUCZIJIFIYQLKY-UHFFFAOYSA-N 381.388 2.250 70 40 GEIB COc1ccccc1CCCNC(=O)c1ccccc1N(C)S(C)(=O)=O 218341171 XRERSVDTGNHGHM-UHFFFAOYSA-N 376.478 2.454 70 40 GEIB O=C(NN1C(=O)[C@@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)c1ccc(Br)cc1 217358121 QRWZSMGXNJSJBA-YXJLRHLOSA-N 387.233 2.147 70 40 GEIB COc1ccc(S(=O)(=O)NC[C@H]2CCCN(c3nccs3)C2)cc1OC 218185256 WLYKWNKUZNRFQZ-CYBMUJFWSA-N 397.522 2.355 70 40 GEIB CN1CCN(S(=O)(=O)Cc2ccc(C(=O)N(C)C3CCCCC3)cc2)CC1 216889198 GLNFELSHHJJDFT-UHFFFAOYSA-N 393.553 2.169 70 40 GEIB O=C(c1ccc2c(c1)OCO2)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217839796 WNXSVJYIRCWBSK-ZDUSSCGKSA-N 393.403 2.350 70 40 GEIB Cc1cc(C)nc(NCCCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1 217706876 ZOFMXJWBMNGIHG-DLBZAZTESA-N 381.480 2.093 70 40 GEIB COc1cccc(C(=O)NCC(=O)N2CCC3(CC2)OC(=O)c2ccccc23)c1 217526326 YAGNYNPAWFCCRD-UHFFFAOYSA-N 394.427 2.113 70 40 GEIB CCOc1ncccc1C(=O)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217845907 KAYQYRKKWAQFDZ-AWEZNQCLSA-N 394.435 2.415 70 40 GEIB C[C@H]1CCCN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCN(C)CC3)c2)C1 216872251 XRSNUIQDUCFBMG-AWEZNQCLSA-N 399.944 2.148 70 40 GEIB CN1CCC(CCNC(=O)CCCN(c2ccccc2)S(C)(=O)=O)CC1 217035512 IPEDCINFMZDERJ-UHFFFAOYSA-N 381.542 2.081 70 40 GEIB O=S(=O)(Nc1cnn(CC2CCOCC2)c1)c1ccc2c(c1)OCCCO2 218247672 QOISCCIFVYRDOH-UHFFFAOYSA-N 393.465 2.272 70 40 GEIB O=S(=O)(F)c1ccc(S(=O)(=O)Nc2ccc(Br)nc2)cc1 97977117 NDUINDVYOMVTRO-UHFFFAOYSA-N 395.231 2.303 70 40 GEIB COC(=O)CS[C@@H]1CCN(S(=O)(=O)c2ccccc2Br)C1 217568497 UZSRTMOSSZNYNC-SNVBAGLBSA-N 394.312 2.118 70 40 GEIB CC(=O)Nc1ccc2c(c1)nc(CN1C[C@@H]3C[C@H](C1)c1cccc(=O)n1C3)n2C 217540516 QLENMSZXHYHAGD-JKSUJKDBSA-N 391.475 2.313 70 40 GEIB COC(=O)CS[C@H]1CCN(C(=O)CCc2ccc(OC)c(OC)c2OC)C1 217560612 OCFKXHHNGKJENO-AWEZNQCLSA-N 397.493 2.152 70 40 GEIB Cc1c(NS(C)(=O)=O)cccc1C(=O)NCc1nc(-c2cccs2)no1 218582182 XFHDQVFDWNKKML-UHFFFAOYSA-N 392.462 2.408 70 40 GEIB COc1ccc(S(=O)(=O)Cl)cc1CNC(=O)c1cccc([N+](=O)[O-])c1 100027187 GJBLIBUZOAFSRC-UHFFFAOYSA-N 384.797 2.461 70 40 GEIB O=C(c1cn(C[C@@H](O)c2ccccc2F)nn1)N1CCN(c2ccccc2)CC1 217475350 BWHQJKGCIMDNOU-HXUWFJFHSA-N 395.438 2.113 70 40 GEIB O=C(NCC[C@@H](O)c1ccsc1)C(=O)Nc1cccc(N2CCCC2=O)c1 217543939 LDHBEQRXXBFGIW-MRXNPFEDSA-N 387.461 2.053 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NC1CCCCCC1 216862373 OGVCPXSVKUMIDN-UHFFFAOYSA-N 393.553 2.384 70 40 GEIB CCS(=O)(=O)Nc1ccc(C(=O)NCc2nc(-c3ccccc3)no2)cc1 218643138 YJMMCTZABYJWTK-UHFFFAOYSA-N 386.433 2.428 70 40 GEIB CCOC(=O)CN(c1ccc(OC)c(OC)c1)S(=O)(=O)c1ccccc1 217011000 ITOYFOLPKWIUHH-UHFFFAOYSA-N 379.434 2.462 70 40 GEIB COC(=O)c1cccc(Cn2cc([C@H]3N(C)C(=O)c4ccccc4N3C)nn2)c1 216758038 UQJPILHBFAKHCB-LJQANCHMSA-N 391.431 2.334 70 40 GEIB Cc1ccc(N([C@H](C)C(=O)NCCN(C)c2ccccc2)S(C)(=O)=O)cc1 218357401 YEUHQFFMOUOJCT-QGZVFWFLSA-N 389.521 2.402 70 40 GEIB Cc1cccc(-c2noc(CNC(=O)c3ccccc3NS(C)(=O)=O)n2)c1 218398947 NTJZPYIYABMOMZ-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB COCCN1C(=O)CS[C@@H]1c1cn(Cc2ccccc2Br)nn1 216688799 LCZUWQAVTZICTR-OAHLLOKOSA-N 397.298 2.309 70 40 GEIB O=C(CSCc1ccccc1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1 217977389 UIHKZABDIQHPGY-UHFFFAOYSA-N 398.532 2.437 70 40 GEIB CCc1ccc(OCC(=O)NCCCN2CCN(C)CC2)c(Br)c1 217009738 QVTREBHLXSPFDT-UHFFFAOYSA-N 398.345 2.144 70 40 GEIB CC(=O)Nc1ccc(N2C[C@]34C=C[C@H](O3)[C@@H](C(=O)NCCC(C)C)[C@H]4C2=O)cc1 217521385 PCPSZNKSCXDFOD-WEMPKCCASA-N 397.475 2.094 70 40 GEIB biogenic CCSc1ccccc1C(=O)N1CCN(c2cc(-n3cncn3)ncn2)CC1 218634272 RXSFVPTTYONEGY-UHFFFAOYSA-N 395.492 2.132 70 40 GEIB O=C(c1n[nH]c2c1COc1ccccc1-2)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217590965 CVELBQZSVAFNTF-UONOGXRCSA-N 388.427 2.390 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)Nc1cccc(F)c1 216862299 BWPQVMIATLWFFH-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB COC(=O)c1sccc1S(=O)(=O)NCCn1ccc(-c2ccsc2)n1 217893244 LDJAXRWTAROHST-UHFFFAOYSA-N 397.503 2.438 70 40 GEIB O=C(c1cc(-c2ccccc2)on1)N1CC(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)C1 217723153 OSPBMFBEXBICTD-IYBDPMFKSA-N 377.400 2.117 70 40 GEIB O=C(Cn1c(=O)oc2ccccc21)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 217812250 QJRYRDMBVFBLAB-ZDUSSCGKSA-N 382.420 2.336 70 40 GEIB COc1cc2c(cc1OC)N(C)S(=O)(=O)C(C(=O)NCc1ccco1)=C2C 216853151 OYFAUOBDASBNGE-UHFFFAOYSA-N 392.433 2.124 70 40 GEIB COc1ccc(OC[C@H](C)NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 218566838 DRKSKVQKOCZTBP-ZDUSSCGKSA-N 378.450 2.264 70 40 GEIB COc1ccc(S(=O)(=O)N2CCC(N3CCC(OC)CC3)CC2)cc1F 217792681 CAQKEPZSVGQRNC-UHFFFAOYSA-N 386.489 2.098 70 40 GEIB CN1CCN(S(=O)(=O)Cc2ccc(C(=O)NC3CCCCCC3)cc2)CC1 216884334 CYRVDZGGNKDFQT-UHFFFAOYSA-N 393.553 2.216 70 40 GEIB C[C@H](C(=O)NCc1ccc2c(c1)OCO2)N(c1ccc(F)cc1)S(C)(=O)=O 218452150 AXTBUVUQSDDHMN-GFCCVEGCSA-N 394.424 2.025 70 40 GEIB COc1cccc(N2C[C@@H](C(=O)NC[C@@H]3CCCN4CCCC[C@H]34)CC2=O)c1 217672777 VCJAEHZANBYVDX-ABSDTBQOSA-N 385.508 2.429 70 40 GEIB C[C@H](C(=O)Nc1ccccc1C(N)=O)N(c1ccc(Cl)cc1)S(C)(=O)=O 218382054 KXTAZKKYJUTQBH-LLVKDONJSA-N 395.868 2.232 70 40 GEIB COc1ccccc1-n1c(C[C@H]2CCCN(C(=O)c3ccco3)C2)n[nH]c1=O 217856377 NGVLBSLLLWISED-CQSZACIVSA-N 382.420 2.257 70 40 GEIB Cc1ccccc1-c1noc(C[C@H]2CCCN(C(=O)c3ccc(=O)n(C)n3)C2)n1 217826435 YOGBYTGPCKDEKV-OAHLLOKOSA-N 393.447 2.234 70 40 GEIB COC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCN(c3nccs3)C2)cc1 218188065 KYTXIHVMNQAOKI-CYBMUJFWSA-N 395.506 2.125 70 40 GEIB COc1ccc2c(c1)CCC[C@@]2(O)CNS(=O)(=O)c1ccc2c(c1)CCO2 218010135 SBDYBDSGKXWVBY-HXUWFJFHSA-N 389.473 2.133 70 40 GEIB CCOc1ncccc1C(=O)N1CCC[C@H](Cc2nc(-c3cnccn3)no2)C1 217845834 KAYQYRKKWAQFDZ-CQSZACIVSA-N 394.435 2.415 70 40 GEIB CCC(C)(C)NC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl 216881124 WDIKLBMDRJQSSU-UHFFFAOYSA-N 387.933 2.195 70 40 GEIB CN1CCN(C(=O)C2CCN(Cc3ccc(Br)cc3)CC2)CC1 217030464 HFBYBAQAACDWNT-UHFFFAOYSA-N 380.330 2.435 70 40 GEIB Cc1ccc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCN(C)CC3)c2)cc1 216853985 ICPPHTOVPVSODQ-UHFFFAOYSA-N 387.505 2.492 70 40 GEIB O=C(c1ccccc1Br)N1CC(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)C1 217732555 AJLMPXZMGAUQCV-CHWSQXEVSA-N 389.249 2.225 70 40 GEIB Cc1cc(C)c(C)c(S(=O)(=O)N2CC[C@H](N3C(=O)CSC3=O)C2)c1C 217788108 GGSYGNFDLXKMTE-AWEZNQCLSA-N 382.507 2.379 70 40 GEIB COc1ccc(NC(=O)[C@H]2CCCN(C)C2)cc1S(=O)(=O)N1CCCCC1 216911429 UVHWQHLKTLAQHJ-HNNXBMFYSA-N 395.525 2.150 70 40 GEIB COc1ccc(CCCNC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 218333751 GWBXTRVPLDKGSC-UHFFFAOYSA-N 376.478 2.454 70 40 GEIB COc1ccc(N2C[C@H](C(=O)NCCSC3CCOCC3)CC2=O)cc1 217702732 HVWWATOARCUCNE-CQSZACIVSA-N 378.494 2.077 70 40 GEIB COc1cccc(CCCNC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)c1 218333654 YHBQOLSWZIKLRJ-UHFFFAOYSA-N 376.478 2.454 70 40 GEIB Cc1cc(OS(=O)(=O)C(F)(F)F)c(N)cc1I 103631766 QYOTWAQIWDSDLA-UHFFFAOYSA-N 381.113 2.410 70 40 GEIB CN1CCC(NC(=O)c2ccccc2N(C)S(=O)(=O)c2ccccc2)CC1 216938823 OCVXOKKAZNYCEC-UHFFFAOYSA-N 387.505 2.336 70 40 GEIB COCCN1C(=O)CS[C@@H]1c1cn(Cc2ccc(Br)cc2)nn1 216687903 JIBBZEDLPPQRNB-OAHLLOKOSA-N 397.298 2.309 70 40 GEIB O=C(c1ccc(=O)[nH]n1)N1CCC[C@H](Cc2nc(-c3ccccc3F)no2)C1 217795373 HGMZKBDQLIMBHS-GFCCVEGCSA-N 383.383 2.054 70 40 GEIB O=C(CCn1cnc2ccccc2c1=O)Nc1cnn(CC2CCOCC2)c1 218201309 PXLIVXPAVRIOAD-UHFFFAOYSA-N 381.436 2.048 70 40 GEIB COc1ccc(CNC(=O)c2cccc(NS(C)(=O)=O)c2)c(OC)c1OC 218566034 JNEXXDXRBIYYJM-UHFFFAOYSA-N 394.449 2.014 70 40 GEIB O=c1cc(C2CCCC2)ncn1CCNS(=O)(=O)Cc1cc(F)ccc1F 217477868 LRTAYTSZNHRCLA-UHFFFAOYSA-N 397.447 2.299 70 40 GEIB Cn1cc(S(=O)(=O)Nc2nc3ccccc3nc2NCCn2cccc2)cn1 217976538 IZHOHOXFSUKJAV-UHFFFAOYSA-N 397.464 2.078 70 40 GEIB COc1ccc(N2C[C@@H](C(=O)NCCSC3CCOCC3)CC2=O)cc1 217702808 HVWWATOARCUCNE-AWEZNQCLSA-N 378.494 2.077 70 40 GEIB Cc1noc(C)c1S(=O)(=O)Nc1cnn(C[C@H]2COc3ccccc3O2)c1 218294986 JYIVBVWBTYJUMF-AWEZNQCLSA-N 390.421 2.129 70 40 GEIB C[C@@H]1CCCN(C(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2Cl)C1 216879991 RRKDDXIILNFGKL-CQSZACIVSA-N 399.944 2.148 70 40 GEIB CCNC(=O)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(NC(C)=O)c1 217566879 MDWLBWMNEQXGRG-DOTOQJQBSA-N 394.475 2.180 70 40 GEIB CS(=O)(=O)N1[C@H]2CC[C@H]1CC(NC(=O)c1ccccc1Br)C2 217683842 WRHJIBIZPPLEJM-RYUDHWBXSA-N 387.299 2.134 70 40 GEIB CN1CCC(NC(=O)CN(C2CCCCC2)S(=O)(=O)c2ccccc2)CC1 216797348 ZJKLITSTBMMRPB-UHFFFAOYSA-N 393.553 2.220 70 40 GEIB Cn1cccc1[C@H](O)CCNS(=O)(=O)c1ccccc1OC(F)(F)F 217944786 SQLJYHYTWBLNPF-GFCCVEGCSA-N 378.372 2.326 70 40 GEIB Cc1ccc(C(=O)NC2CCN(C)CC2)cc1S(=O)(=O)N1CCCCCC1 216942768 CQBPQJFJBIAGTA-UHFFFAOYSA-N 393.553 2.384 70 40 GEIB COC(=O)[C@@H]1C[C@H](Oc2ccccc2F)CN1S(=O)(=O)c1ccccc1 217980095 MERVGKUAJYAJOH-BBRMVZONSA-N 379.409 2.209 70 40 GEIB Cc1ccc(N([C@@H](C)C(=O)NCCN(C)c2ccccc2)S(C)(=O)=O)cc1 218357321 YEUHQFFMOUOJCT-KRWDZBQOSA-N 389.521 2.402 70 40 GEIB Cc1ccc(C(=O)Nc2ccccc2F)cc1S(=O)(=O)N1CCN(C)CC1 216855539 OELKLXIZAXRVEQ-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB O=C(c1cc(-c2ccccc2)on1)N1CC(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)C1 217723245 OSPBMFBEXBICTD-HOTGVXAUSA-N 377.400 2.117 70 40 GEIB CCC[C@H](C)NC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl 216878400 RQDBXYINISFHJW-ZDUSSCGKSA-N 387.933 2.195 70 40 GEIB O=C(c1ccccc1Br)N1Cc2cnc(N3CCOCC3)nc2C1 217614193 OYDBSIWXTNZUIJ-UHFFFAOYSA-N 389.253 2.232 70 40 GEIB COc1ccc(N2C[C@]34C=C[C@@H](O3)[C@@H](C(=O)Nc3nccs3)[C@H]4C2=O)cc1 217723325 BMJRDPJPRARWOX-CUYVQJCZSA-N 383.429 2.077 70 40 GEIB O=C(CSc1nc2ccccc2o1)N1Cc2cnc(N3CCOCC3)nc2C1 217613876 CQYZRPJOEFQKTL-UHFFFAOYSA-N 397.460 2.089 70 40 GEIB CN(CCCNC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1ccccc1 218266396 ZBBKMVZBWGJFIK-UHFFFAOYSA-N 393.484 2.234 70 40 GEIB CC[C@@H](C(=O)NCCC1CCN(C)CC1)N(c1ccc(F)cc1)S(C)(=O)=O 217016401 WJIOYXUITJHICB-SFHVURJKSA-N 399.532 2.218 70 40 GEIB Cc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCN(C)CC3)ccc2C)cc1 216860585 IVDSNTDKDUCAME-UHFFFAOYSA-N 387.505 2.492 70 40 GEIB COC(=O)CS[C@H]1CCN(C(=O)COc2cccc3c2OC(C)(C)C3)C1 217557456 ZFDJQTKHMYNUFB-AWEZNQCLSA-N 379.478 2.286 70 40 GEIB C[C@@H](C(=O)NCCCN(C)c1ccccc1)N(c1ccccc1)S(C)(=O)=O 218292758 WREBFMDELMYBBR-KRWDZBQOSA-N 389.521 2.484 70 40 GEIB Cc1ccc(C(=O)Nc2cccc(F)c2)cc1S(=O)(=O)N1CCN(C)CC1 216856057 ZDUNJSGOSPIGGR-UHFFFAOYSA-N 391.468 2.323 70 40 GEIB COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(c3nccs3)C2)cc1OC 218185178 WLYKWNKUZNRFQZ-ZDUSSCGKSA-N 397.522 2.355 70 40 GEIB O=S(=O)(Cc1ccccc1)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217851742 ZZDHEMYFOBYGLI-INIZCTEOSA-N 399.476 2.311 70 40 GEIB COc1ccc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)Nc3nccs3)[C@H]4C2=O)cc1 217723417 BMJRDPJPRARWOX-QZNHQWIBSA-N 383.429 2.077 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)N(C)C1CCCCC1 216865615 OSLPUHBGJOFLSP-UHFFFAOYSA-N 393.553 2.336 70 40 GEIB O=C(CNC(=O)OCc1ccccc1)NC[C@H]1CCCN(c2nccs2)C1 218165418 DOBMMIPJHQXFLS-MRXNPFEDSA-N 388.493 2.402 70 40 GEIB COC(=O)c1ccc(Cn2cc([C@@H]3N(C)C(=O)c4ccccc4N3C)nn2)cc1 216758205 DVXPEFOTXNEPTQ-IBGZPJMESA-N 391.431 2.334 70 40 GEIB O=S(=O)(F)CCN(CCS(=O)(=O)F)C1(Cc2cccc(F)c2)CCC1 1615610099 AMAPVVOXEDHADJ-UHFFFAOYSA-N 399.456 2.192 70 40 GEIB CN(Cc1nc(-c2ccccc2)no1)C(=O)c1ccccc1NS(C)(=O)=O 218399770 KSTQEPMURNCURA-UHFFFAOYSA-N 386.433 2.380 70 40 GEIB CN(Cc1nc(-c2cccs2)no1)C(=O)c1ccccc1NS(C)(=O)=O 218400562 IZSIYTHNLPCMMW-UHFFFAOYSA-N 392.462 2.442 70 40 GEIB CN1CCC(NC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)CC1 216950125 CPMKAWPGCUZUCV-UHFFFAOYSA-N 379.507 2.373 70 40 GEIB COC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCN(c3nccs3)C2)cc1 218187976 KYTXIHVMNQAOKI-ZDUSSCGKSA-N 395.506 2.125 70 40 GEIB Cc1ccc(N(CCCC(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)cc1 217035870 XTONYXZOWQKKAW-UHFFFAOYSA-N 395.569 2.389 70 40 GEIB COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@@H]1CCCN(C)C1 216911555 LTZFJVMCQZKGPH-OAHLLOKOSA-N 395.525 2.150 70 40 GEIB CCC[C@@H](C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1 216871073 BCSOPLLUBSSYCI-CYBMUJFWSA-N 387.933 2.195 70 40 GEIB O=C(C[C@@H]1NC(=O)N(Cc2ccccc2Cl)C1=O)NC[C@H]1C[C@@H]2C=C[C@H]1C2 218391511 ZJDGJCKOONIMED-CXUGXGMPSA-N 387.867 2.479 70 40 GEIB COc1ccccc1CNC(=O)C(=O)NC[C@@H](OC)c1ccccc1Cl 218347798 BMCARUNHTHLAGM-QGZVFWFLSA-N 376.840 2.469 70 40 GEIB Cc1cc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)NCCCc3ccccc3)[C@H]4C2=O)no1 217714635 QIMMVMVIMHVXCY-ONZODILHSA-N 393.443 2.018 70 40 GEIB COc1ccc(-c2noc(CNC(=O)[C@@H]3COc4ccccc4O3)n2)c(OC)c1 218300973 AAVSFCKJJARMDX-KRWDZBQOSA-N 397.387 2.210 70 40 GEIB COc1ccc(CN(C)C(=O)CN(c2cccc(OC)c2)S(C)(=O)=O)cc1 218253554 HLAODYQVCVGDQB-UHFFFAOYSA-N 392.477 2.128 70 40 GEIB C[C@@H](C(=O)NCCN(C)c1ccccc1)N(c1ccccc1)S(C)(=O)=O 218285971 YNFQRFPFEWDQIZ-INIZCTEOSA-N 375.494 2.094 70 40 GEIB COc1ccc(OC[C@@H](C)NC(=O)c2ccccc2NS(C)(=O)=O)cc1 218396035 NKYJHWVDCOKCAS-CYBMUJFWSA-N 378.450 2.264 70 40 GEIB CS(=O)(=O)N(CC(=O)NC1CCCCCCC1)c1ccc2c(c1)OCCO2 218433555 WUWJRUTWOHMXJO-UHFFFAOYSA-N 396.509 2.453 70 40 GEIB O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cc2cc(=O)n3cc(Cl)ccc3n2)C1 217563226 NCIJXIRMWSDSKD-UONOGXRCSA-N 382.851 2.129 70 40 GEIB CC(=O)Nc1ccc(S(=O)(=O)NCCn2ccnc2-c2ccccn2)c(C)c1 217865186 AWBRXMCKCKHGDY-UHFFFAOYSA-N 399.476 2.190 70 40 GEIB COc1ccc2c(c1)CCC[C@@]2(O)CNS(=O)(=O)c1cn(C)c(C(C)C)n1 218010446 WQWMRMRZHGYOCC-LJQANCHMSA-N 393.509 2.055 70 40 GEIB COc1ccc(OC)c(-c2cc(C(=O)NCC[C@@H](O)c3cccn3C)n(C)n2)c1 217938497 WAFUXIOEAUMDBZ-LJQANCHMSA-N 398.463 2.296 70 40 GEIB Cn1cccc1[C@@H](O)CCNS(=O)(=O)c1ccccc1OC(F)(F)F 217944869 SQLJYHYTWBLNPF-LBPRGKRZSA-N 378.372 2.326 70 40 GEIB C[C@H](C(=O)NCCCN(C)c1ccccc1)N(c1ccccc1)S(C)(=O)=O 218292816 WREBFMDELMYBBR-QGZVFWFLSA-N 389.521 2.484 70 40 GEIB Cn1cccc1[C@H](O)CCNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1 217948994 IHDBVARLURHLKQ-CQSZACIVSA-N 385.342 2.102 70 40 GEIB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@@H]1C[C@H]2C(=O)Nc3ccccc3N2C1 217594239 QQPMBPVYFZWAEL-BKSCXVJVSA-N 377.400 2.144 70 40 GEIB O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1c[nH]c(=O)c(Cl)c1 218284031 HXSUWBQSXIZIMZ-CYBMUJFWSA-N 386.795 2.317 70 40 GEIB CCC(C)(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCN(C)CC2)c1 216873312 OWTHHEHTIPWUCH-UHFFFAOYSA-N 387.933 2.195 70 40 GEIB CCc1ccccc1NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O 218426131 FZTCTPOXFHHSEI-UHFFFAOYSA-N 390.461 2.425 70 40 GEIB Cc1c(NS(C)(=O)=O)cccc1C(=O)NCc1nc(-c2ccccc2)no1 218581410 URTHBLUITKOMQD-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB COc1ccc(NC(=O)[C@@H]2CCCN(C)C2)cc1S(=O)(=O)N1CCCCC1 216911400 UVHWQHLKTLAQHJ-OAHLLOKOSA-N 395.525 2.150 70 40 GEIB Cc1ccc(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)cc1C 218426023 JLNINGSQZUQXNB-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB COc1ccc2c(c1OC)C(=O)O[C@H]2N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217535523 KORQDLHTDHYSPR-MRRFBWAASA-N 382.416 2.154 70 40 GEIB COc1ccc(OC[C@@H](C)NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 218333862 CQHDDCBEXQDZQZ-CQSZACIVSA-N 392.477 2.288 70 40 GEIB Cc1cc(OC2CN(C(=O)c3cc(-c4ccc(F)cc4)nn3C)C2)cc(=O)n1C 217755817 SHPYUAJRHVOWEI-UHFFFAOYSA-N 396.422 2.137 70 40 GEIB COc1ccc(-c2noc(CNC(=O)COc3ccccc3OC)n2)c(OC)c1 217948383 FTEQFRZEGWLKAS-UHFFFAOYSA-N 399.403 2.458 70 40 GEIB COc1cccc(N2C[C@H](C(=O)Nc3cnn(CC4CCOCC4)c3)CC2=O)c1 218216560 RLKZHTBVNFCGBQ-MRXNPFEDSA-N 398.463 2.310 70 40 GEIB COc1cc2nc(C)n(CC(=O)NC[C@@H]3C[C@@H]4C=C[C@H]3C4)c(=O)c2cc1OC 218311404 ZKPYJYUMNWIYDG-ILXRZTDVSA-N 383.448 2.051 70 40 GEIB COC(=O)CS[C@H]1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)C1 217568144 HUHILPATPBTHCX-NSHDSACASA-N 379.887 2.018 70 40 GEIB COc1ccc(CN(C)C(=O)CN(c2ccc(F)c(F)c2)S(C)(=O)=O)cc1 218434412 JZWOZIMHCSGEOK-UHFFFAOYSA-N 398.431 2.398 70 40 GEIB COc1ccc(Br)c(C(=O)N2CC[C@H](N3C(=O)CSC3=O)C2)c1 217782857 HDTGQVMDOLODGR-VIFPVBQESA-N 399.266 2.368 70 40 GEIB O=C1CCC(=O)N1C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1cccc2cccnc12 217769518 JAPNKVHVQSNCBK-XYPWUTKMSA-N 399.472 2.068 70 40 GEIB Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)N1CCCC(C)(C)C1 216864884 PWQQLKASTVLCKW-UHFFFAOYSA-N 393.553 2.193 70 40 GEIB COc1ccc2c(c1OC)C(=O)O[C@@H]2N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 217535440 KORQDLHTDHYSPR-RDXCRGQUSA-N 382.416 2.154 70 40 GEIB O=C(c1cc(-c2ccccc2)on1)N1CC(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)C1 217723326 OSPBMFBEXBICTD-HZPDHXFCSA-N 377.400 2.117 70 40 GEIB COc1cc(NC(=O)[C@H]2CC[C@H](Cn3cnnn3)CC2)cc(OC)c1OC 218118209 UGVBSQWKSWMRIB-BETUJISGSA-N 375.429 2.144 70 40 GEIB Cc1cccc(-c2noc(CNC(=O)c3ccc(NS(C)(=O)=O)cc3)n2)c1 218404238 GSDJYKOUNWTKJN-UHFFFAOYSA-N 386.433 2.347 70 40 GEIB Cc1ccc(N([C@@H](C)C(=O)NCCC2CCN(C)CC2)S(C)(=O)=O)cc1C 216939478 AAMIBAXLDIKSHD-KRWDZBQOSA-N 395.569 2.306 70 40 GEIB CCn1nc(C)c(S(=O)(=O)N2CCC[C@@H](Cc3nc(C4CC4)no3)C2)c1C 217824716 PVDXVEBWOSLGBK-AWEZNQCLSA-N 393.513 2.424 70 40 GEIB Cc1cccc(NC(=O)CN(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c1C 218428165 IRBBGPZNNMTOBH-UHFFFAOYSA-N 390.461 2.479 70 40 GEIB COc1ccc(OC[C@H](C)NC(=O)c2ccccc2NS(C)(=O)=O)cc1 218396113 NKYJHWVDCOKCAS-ZDUSSCGKSA-N 378.450 2.264 70 40 GEIB O=C(c1noc2c1CCCC2)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217846041 JSEZINACWOGUMU-ZDUSSCGKSA-N 394.435 2.488 70 40 GEIB CN(Cc1nc(-c2ccccc2)no1)C(=O)c1cccc(NS(C)(=O)=O)c1 218570486 UXBOAMFPIIOMAL-UHFFFAOYSA-N 386.433 2.380 70 40 GEIB O=S(=O)(c1cccs1)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217851359 CXPVKKJVEGKHNE-LBPRGKRZSA-N 391.478 2.232 70 40 GEIB CCCc1nnsc1C(=O)N1CCC[C@@H](Cc2nc(-c3cnccn3)no2)C1 217844199 HZHLVNSVIYKPPU-LBPRGKRZSA-N 399.480 2.426 70 40 GEIB Cc1cc(OC2CCN(C(=O)c3cc4ccccc4oc3=O)CC2)cc(=O)n1C 217777117 FJXULFQHHXGBQQ-UHFFFAOYSA-N 394.427 2.484 70 40 GEIB