smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@H]1CCc2ccccc2N1C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 216790629 DOBRIXSCYLBMQY-HNNXBMFYSA-N 412.942 5.286 70 20 HKID O=C([C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)N1CCC(OCc2ccccc2)CC1 217115828 DHGMKGSFHFEOBB-NHCUHLMSSA-N 403.444 5.017 70 20 HKID COc1ccc([C@@H](C)N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1F 218195308 XINZCXAPORZDDV-VXGBXAGGSA-N 409.383 5.315 70 20 HKID CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N(C)CCCCc2ccccc2)c1 216913883 PSZNUJDGUJOHFO-UHFFFAOYSA-N 415.965 5.307 70 20 HKID O=C(NCCc1csc(-c2ccccc2)n1)c1cc(Br)ccc1Cl 217387657 AVRHXFCXPPBGCB-UHFFFAOYSA-N 421.747 5.199 70 20 HKID Cc1ccc(-c2noc([C@@H](C)N[C@H](C)c3ccccc3Br)n2)cc1F 218274072 CORVVNWHMYUWFX-CHWSQXEVSA-N 404.283 5.358 70 20 HKID COc1ccccc1C[C@H](C)CC(=O)Nc1cccc(CSC2CCOCC2)c1 217220894 QOSCGTLLISMKIH-SFHVURJKSA-N 413.583 5.315 70 20 HKID COc1ccc([C@@H](C)NCc2csc(-c3ccc(Br)cc3)n2)cc1F 216769929 PLZWDKHXLYHMFL-GFCCVEGCSA-N 421.335 5.571 70 20 HKID C[C@H](NCC(=O)Nc1c(F)cc(F)cc1Br)c1cccc2ccccc12 217140821 NSASZLKNOXREQX-LBPRGKRZSA-N 419.269 5.170 70 20 HKID Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cccnc1SCC1CCCCC1 217204747 AMLJPVJGHREOOD-UHFFFAOYSA-N 423.582 5.207 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@@H](C)c4ccccn4)cc3)sc2c1 216833787 AESSAIPYRWBWSN-IRXDYDNUSA-N 416.550 5.345 70 20 HKID Cc1cccc(C(C)C)c1NC(=O)c1cc(Br)ccc1Br 160018104 ZEYQCXRUNNEXPA-UHFFFAOYSA-N 411.137 5.896 70 20 HKID Cc1cn2c(CN(C)C(=O)c3csc(-c4cccc(Cl)c4)n3)c(C)nc2s1 217128141 FXAOLHVDMJKKCA-UHFFFAOYSA-N 416.959 5.062 70 20 HKID CCN(C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)[C@H](C)c1cccnc1 217216211 DCVPQWSSQWWGAW-QGZVFWFLSA-N 424.545 5.384 70 20 HKID O=C(N[C@@H]1CCSc2c(F)cccc21)c1ccccc1CSC1=NCCS1 216794302 RIUJEHQUWFBYIC-QGZVFWFLSA-N 418.584 5.129 70 20 HKID O=C(c1ccc(NCc2noc3c2CCCC3)cc1)N1CCC[C@H]1c1ccccc1 217072091 XHTREHKLLIPLJM-QHCPKHFHSA-N 401.510 5.143 70 20 HKID CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3cncc4ccccc34)ccc21 216896675 AHTNBKBOJSZYOH-UHFFFAOYSA-N 403.482 5.175 70 20 HKID CC(C)n1c([C@H]2CCCN(C(=O)c3cnc(-c4ccco4)s3)C2)nc2ccccc21 217195024 ZOAJVLSMDREMQW-INIZCTEOSA-N 420.538 5.354 70 20 HKID CCN(C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)[C@@H](C)c1cccnc1 217208481 OJSRILDTSNZLFA-AWEZNQCLSA-N 419.472 5.376 70 20 HKID CC(=O)N(Cc1ccc(NC(=O)c2cc(C)n(C3CCCCC3)c2C)cc1)C(C)C 217226469 DQYWZYRDEXHYRA-UHFFFAOYSA-N 409.574 5.619 70 20 HKID CO[C@@H](CNC(=O)c1c(-c2ccccc2Cl)noc1C)c1ccccc1Cl 218324153 ROQVZXMXBJKQMV-KRWDZBQOSA-N 405.281 5.074 70 20 HKID COc1ccc(OC)c([C@H](C)N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 218194376 ZOKYWHNAXSOKPH-STQMWFEESA-N 421.419 5.184 70 20 HKID CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C[C@@H]3CCOc4ccccc43)ccc21 217230342 BUNYDOBORXLNCS-KRWDZBQOSA-N 422.525 5.269 70 20 HKID Cc1cccc(C(=O)Nc2ccc3c(c2)CCCN3C)c1NC(=O)c1ccccc1F 217071363 CFCLOSXNIPGTEL-UHFFFAOYSA-N 417.484 5.021 70 20 HKID CCOC(=O)c1c(CN[C@H](C)c2ccccn2)nc2ccccc2c1-c1ccccc1 216635052 KHLMSGAXZBLPDX-GOSISDBHSA-N 411.505 5.324 70 20 HKID COc1ccc(CNCc2cccc(C(F)(F)F)c2)cc1OCc1ccccc1 216726594 MDSLZOWXNGCWJE-UHFFFAOYSA-N 401.428 5.583 70 20 HKID CC(=O)Nc1cccc(NC(=O)[C@@H](C)Sc2nc(-c3ccc(F)cc3)cs2)c1 218623151 PGLAUPOCZBFJGD-GFCCVEGCSA-N 415.515 5.027 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)[C@H]1C[C@H]1c1c(F)cccc1F 217220250 VGCSDDFNGDWZCH-MSOLQXFVSA-N 403.494 5.119 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3nc(-c4ccc(F)c(F)c4)cs3)c12 217942806 UKOSNGDEVVXNPD-UHFFFAOYSA-N 414.437 5.309 70 20 HKID CCc1ccc(CNCc2cc(Br)cc(Br)c2OC)s1 218217559 NNVVDHFVCBNYTC-UHFFFAOYSA-N 419.182 5.134 70 20 HKID C[C@@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CC1CCOCC1 217227897 ROSJEONFQHPZRR-UZLBHIALSA-N 422.956 5.673 70 20 HKID C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 216637793 BPMHWTRJPCRIQO-KRWDZBQOSA-N 424.522 5.107 70 20 HKID COc1ccc(C)cc1NC(=O)[C@@H](N[C@H](c1ccccc1)C1CC1)c1ccccc1 217554535 BJKKXXRZVHOQKQ-RPBOFIJWSA-N 400.522 5.424 70 20 HKID CCO[C@H](C)c1nc(CC(=O)N2CCc3sccc3[C@H]2c2cccs2)cs1 217227889 AUWWPCMAEROIMX-YJYMSZOUSA-N 418.609 5.080 70 20 HKID CC(=O)Nc1cccc(NC(=O)[C@H](C)Sc2nc(-c3ccc(F)cc3)cs2)c1 218623227 PGLAUPOCZBFJGD-LBPRGKRZSA-N 415.515 5.027 70 20 HKID CCCN(Cc1nnc(-c2ccccc2Cl)o1)Cc1nc2ccccc2nc1C 216633184 RFQBPUGYBKHGNH-UHFFFAOYSA-N 407.905 5.054 70 20 HKID COc1ccc2c(CC(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)coc2c1 216720016 KMBMGNKZDDUYQX-UHFFFAOYSA-N 415.474 5.294 70 20 HKID COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218623871 DTBOABFJTNEZQX-ZIAGYGMSSA-N 416.543 5.316 70 20 HKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc(-c2ccccc2)cs1 217156999 UXPRIQGDOZPZCS-KRWDZBQOSA-N 400.594 5.500 70 20 HKID Brc1ccc(-c2nnc(CN[C@@H](Cc3ccccc3)c3ccccc3)o2)o1 216701767 OCWTVHPUOZCKLW-KRWDZBQOSA-N 424.298 5.166 70 20 HKID Cc1ccc(-c2cc(C(=O)N3CCn4c3nc3ccccc34)c3ccccc3n2)cc1 217388782 FKABPGPRSZRJJM-UHFFFAOYSA-N 404.473 5.220 70 20 HKID Cc1ccc(NC(=O)c2nnc(CN(C)Cc3cccc(Cl)c3Cl)s2)cc1 218470941 BKOSYPDCDNRJEY-UHFFFAOYSA-N 421.353 5.038 70 20 HKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCc2sccc2C1 218621779 KJVUAXGCFSHQME-LBPRGKRZSA-N 404.557 5.076 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@@H](C)c4ccccn4)cc3)sc2c1 216833754 AESSAIPYRWBWSN-DLBZAZTESA-N 416.550 5.345 70 20 HKID C[C@H](NCc1nc(-c2cccc(Br)c2)no1)c1cccc2ccccc12 216648894 GMHNBPOALNXZOO-AWEZNQCLSA-N 408.299 5.503 70 20 HKID COc1c(F)cc(NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)cc1F 216978498 UTSIUCHZGCNFJE-UHFFFAOYSA-N 416.371 5.173 70 20 HKID O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1nn(-c2ccccc2)c2c1CCC2 217617376 XBLBGJSWTLLXMI-UHFFFAOYSA-N 419.488 5.157 70 20 HKID Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1nc(-c2cc3ccccc3o2)cs1 217054466 KOHXLMQOFXQOAB-UHFFFAOYSA-N 417.494 5.443 70 20 HKID CCOc1ccc(N(C(=O)c2ccnc(C3CC3)n2)c2nc3ccccc3s2)cc1 217151615 FEVMYKBBFVXGSI-UHFFFAOYSA-N 416.506 5.341 70 20 HKID CCn1cc(CC(=O)Nc2cccc(CSC3CCOCC3)c2)c2ccccc21 217220615 BEKHAZWAHZDFLO-UHFFFAOYSA-N 408.567 5.255 70 20 HKID O=C(Cc1ccccc1C(F)(F)F)Nc1cccc(CSC2CCOCC2)c1 217221224 KPINGWYEDDUCDW-UHFFFAOYSA-N 409.473 5.299 70 20 HKID CC(C)(NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)c1nccs1 217221802 VZLOYXLPEPGORH-UHFFFAOYSA-N 407.514 5.415 70 20 HKID COc1ccc2oc(C(=O)Nc3cccc(CSC4CCOCC4)c3)c(C)c2c1 217219476 PAGIKVHJRXPOOR-UHFFFAOYSA-N 411.523 5.414 70 20 HKID O=C(NCc1ccc(F)c(Cl)c1)Nc1cccc(CSC2CCOCC2)c1 217225027 CJIVSPRZKDHPPX-UHFFFAOYSA-N 408.926 5.213 70 20 HKID CCOc1cc(F)ccc1NC(=O)c1cc(Br)ccc1Br 160356629 CGUPPEAYJQAOOX-UHFFFAOYSA-N 417.072 5.002 70 20 HKID COc1ccc([C@H]2CCCN2C(=O)Nc2cccc(Br)c2C)c(OC)c1 216653455 WJEPSPASOLTYDI-GOSISDBHSA-N 419.319 5.144 70 20 HKID O=C(Nc1nc2cc(Cl)ccc2s1)c1ccc(CNC(=O)C2CCCC2)cc1 216735679 FSRZRFJXMLXWOT-UHFFFAOYSA-N 413.930 5.008 70 20 HKID c1ccc(Cn2c(SCc3noc4c3CCCC4)nnc2-c2cccs2)cc1 217007292 DWDLNKOCGSKEHX-UHFFFAOYSA-N 408.552 5.214 70 20 HKID CCN(CC)C(=O)c1ccc(C(=O)N(Cc2c(F)cccc2F)C2CCCC2)cc1 216893022 GKNOWTRHPXRZOU-UHFFFAOYSA-N 414.496 5.032 70 20 HKID COc1ccc([C@@H](NCc2nc(-c3ccc(C(F)(F)F)cc3)no2)C2CC2)cc1 218284264 JTZWXHKYSWEECA-IBGZPJMESA-N 403.404 5.005 70 20 HKID CCN(CCSc1ccc(F)cc1)CC(=O)Nc1c(Cl)cccc1Cl 216907208 QIEDKHYQUIEOKF-UHFFFAOYSA-N 401.334 5.185 70 20 HKID Cc1cccc(C(C)C)c1NC(=O)CNC(=O)c1sc2ccccc2c1Cl 218306824 RHILPCGYAIEPIA-UHFFFAOYSA-N 400.931 5.355 70 20 HKID COc1ccc(-c2n[nH]cc2C(=O)Nc2nc(-c3ccc(SC)cc3)cs2)cc1 218096707 CEFSFVXIFORVBH-UHFFFAOYSA-N 422.535 5.183 70 20 HKID CC[C@@H](NCc1nnc(-c2ccccc2Br)o1)c1ccc(Cl)cc1 218211362 NPSFGPMEAASXON-MRXNPFEDSA-N 406.711 5.393 70 20 HKID COc1c(C)ccc(NC(=O)c2ccc(Br)cc2Br)c1C 218754413 LEQUSTPTXULLAM-UHFFFAOYSA-N 413.109 5.089 70 20 HKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1ncc(-c2ccc(F)cc2)o1 217847059 JRQQASPFWWKZTD-INIZCTEOSA-N 402.516 5.170 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)O[C@H](C)c3nc4ccccc4n3C(F)F)c12 217847917 NEQUOFVUXQQYMQ-GFCCVEGCSA-N 414.412 5.317 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cnc(-c2ccccc2)s1 217220365 ZOVRDCGPYQWZJL-UHFFFAOYSA-N 410.564 5.475 70 20 HKID COc1ccc([C@H](NCc2nc(-c3ccc(C(F)(F)F)cc3)no2)C2CC2)cc1 218284312 JTZWXHKYSWEECA-LJQANCHMSA-N 403.404 5.005 70 20 HKID O=C(Nc1ccccc1Nc1ccccc1)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 216911113 BLBWVFSCOXYCFD-LJQANCHMSA-N 417.484 5.060 70 20 HKID COc1cc(Br)cc(C)c1NC(=O)c1ccc(C)cc1Br 161082340 VAUQOSDQXJJAEG-UHFFFAOYSA-N 413.109 5.089 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@H](CC)c2ccc(OC)cc2)cs1 216782981 DMEFMFJSEOPWJN-JOCHJYFZSA-N 423.582 5.640 70 20 HKID CCOc1cccc2cc([C@@H](C)NCc3ccc(C(=O)Nc4ccccc4)cc3)oc12 216761791 WQNFPPZAGTZVEL-GOSISDBHSA-N 414.505 5.935 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cccc(Oc2ccncc2)c1 217219227 GHNLOEMDDBIQOP-UHFFFAOYSA-N 420.534 5.538 70 20 HKID O=C(c1cnc(-c2ccsc2)s1)N1CCc2sccc2[C@H]1c1cccs1 217158190 GHBKPSMZDFYZDU-KRWDZBQOSA-N 414.602 5.783 70 20 HKID CCc1ccc(-c2nc(CC(=O)NCCCCOc3ccc(F)cc3)cs2)cc1 216636780 JRWDUDOERCGAHY-UHFFFAOYSA-N 412.530 5.030 70 20 HKID c1ccc(-c2nnc(SCc3noc4c3CCCC4)nc2-c2ccccc2)cc1 217008203 DZFNATVHUQFALS-UHFFFAOYSA-N 400.507 5.365 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N(Cc1cccs1)C[C@@H]1CCCO1 217155934 AJVFLRNOMPLIJF-FQEVSTJZSA-N 409.511 5.149 70 20 HKID Cc1nc2ccccc2cc1C(=O)N1CCC(c2nc(-c3ccncc3)cs2)CC1 217133759 JTQAXKMOUNYXJB-UHFFFAOYSA-N 414.534 5.082 70 20 HKID CC[C@@H](NCC(=O)Nc1c(F)cc(F)cc1Br)c1ccc(Cl)cc1 218216627 YEQRJPMQJBJTBT-OAHLLOKOSA-N 417.681 5.060 70 20 HKID CC(C)Sc1ccccc1C(=O)Nc1cccc(CSC2CCOCC2)c1 217220787 YPABZFPKCQWCMG-UHFFFAOYSA-N 401.597 5.852 70 20 HKID CCOc1ccccc1NC(=O)[C@@H](N[C@H](c1ccccc1)C1CC1)c1ccccc1 217460961 PDBVJBUNVCJLHV-RPBOFIJWSA-N 400.522 5.506 70 20 HKID Cc1ccc(-c2noc([C@H](C)N[C@@H](C)c3ccccc3Br)n2)cc1F 218274023 CORVVNWHMYUWFX-STQMWFEESA-N 404.283 5.358 70 20 HKID Clc1ccc(Cl)c(OCCSc2nnc(C3CC3)n2Cc2ccco2)c1 216792704 DRIXUTRYKNSLID-UHFFFAOYSA-N 410.326 5.275 70 20 HKID C[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 216974060 FICIUOPUBMPDHI-CQSZACIVSA-N 406.486 5.722 70 20 HKID CCOC(=O)c1c(CN[C@@H](C)c2cccnc2)nc2ccccc2c1-c1ccccc1 216727186 UZVRIILKCUGYKR-SFHVURJKSA-N 411.505 5.324 70 20 HKID CCO[C@H](C)c1nc(CC(=O)N2CCc3sccc3[C@@H]2c2cccs2)cs1 217227885 AUWWPCMAEROIMX-BFUOFWGJSA-N 418.609 5.080 70 20 HKID COc1ccc(C)cc1NC(=O)[C@H](N[C@H](c1ccccc1)C1CC1)c1ccccc1 217554632 BJKKXXRZVHOQKQ-JWQCQUIFSA-N 400.522 5.424 70 20 HKID Cc1c(Cl)cccc1NC(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F 218605336 BNNILRTUJLNPMK-QGZVFWFLSA-N 414.836 5.037 70 20 HKID Cc1nc2c(s1)[C@H](N(C)C(=O)CSc1cccc(C(F)(F)F)c1)CCC2 217126178 ACAGVAGLPXRIJB-OAHLLOKOSA-N 400.491 5.098 70 20 HKID CC(C)n1ncc2c(C(=O)N3c4ccccc4CC[C@@H]3C)cc(-c3ccco3)nc21 217521661 VPAOGLYXGJZQIP-INIZCTEOSA-N 400.482 5.254 70 20 HKID Brc1ccc(-c2nnc(CN[C@H](Cc3ccccc3)c3ccccc3)o2)o1 216701819 OCWTVHPUOZCKLW-QGZVFWFLSA-N 424.298 5.166 70 20 HKID CC(C)c1noc2ncc(C(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)cc12 217787631 NPINQZGAEFSUBC-UHFFFAOYSA-N 415.478 5.270 70 20 HKID C[C@@H]1CCC[C@H](OCc2cccc(N[C@@H](C(=O)NC3CC3)c3ccc(F)cc3)c2)C1 216741352 RQMSEZOABYAIIA-GAZXMLTASA-N 410.533 5.353 70 20 HKID COc1ccccc1CC(C)(C)C(=O)Nc1cccc(CSC2CCOCC2)c1 217219938 UNXOPRHVQAKHAG-UHFFFAOYSA-N 413.583 5.315 70 20 HKID C[C@@H]1CCc2ccccc2N1C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 216790583 DOBRIXSCYLBMQY-OAHLLOKOSA-N 412.942 5.286 70 20 HKID COc1ccc([C@@H](NCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C2CC2)cc1 217106795 UTXQDRZGIVDTQL-IBGZPJMESA-N 412.839 5.047 70 20 HKID CCN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@H](C)c1cccnc1 217209116 ILVUTAMJDTWGKH-CQSZACIVSA-N 418.324 5.586 70 20 HKID COc1ccc(OC)c([C@@H](C)N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 218194443 ZOKYWHNAXSOKPH-CHWSQXEVSA-N 421.419 5.184 70 20 HKID Cc1cc(NC(=O)c2cc(C(C)C)nc3onc(C)c23)n(-c2ccc(Cl)cc2)n1 218459021 GDRXDBRRUPKAQD-UHFFFAOYSA-N 409.877 5.054 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1csc(-c2ccoc2)n1 217220901 KXMMJZQCWAFOTE-UHFFFAOYSA-N 400.525 5.068 70 20 HKID C[C@@H](NC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1cc(F)c(Cl)cc1Cl 217451276 OKTZLJPKEQOYSA-SNVBAGLBSA-N 421.246 5.637 70 20 HKID Cc1cc(OC(F)F)c(C(=O)Nc2cccc(CSC3CCOCC3)c2)s1 217220226 CWJYCMXWPBOAOV-UHFFFAOYSA-N 413.511 5.322 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc4nc(N5CCCC5)sc4c3)c12 217838738 WFJYGZUUCZYKSR-UHFFFAOYSA-N 421.526 5.117 70 20 HKID COCCCCN(Cc1ccccc1)C(=O)Nc1cccc(Oc2ccncc2)c1 217155736 VRCIWLPABWNZDN-UHFFFAOYSA-N 405.498 5.335 70 20 HKID O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(CSc2ccccc2)cc1 216691384 CIEOUPSPYCYUQJ-UHFFFAOYSA-N 418.562 5.063 70 20 HKID CC(=O)N[C@@H](CC(=O)Nc1ccc(C(C)C)cc1C(C)C)c1c(F)cccc1F 216667807 UGRZBOJKFCIBOJ-NRFANRHFSA-N 402.485 5.418 70 20 HKID CCOC(=O)c1c(CN[C@H](C)c2cccnc2)nc2ccccc2c1-c1ccccc1 216727227 UZVRIILKCUGYKR-GOSISDBHSA-N 411.505 5.324 70 20 HKID COc1ccc([C@@H](C)NCc2ccc(-n3nc(C)cc3C)cc2)cc1Br 216750336 IPPUMMOQFBZMJF-MRXNPFEDSA-N 414.347 5.111 70 20 HKID O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(c2nc3ccccc3s2)CC1 216921551 IYYSNNIOTXOZEK-UHFFFAOYSA-N 419.472 5.404 70 20 HKID CN(Cc1ccccc1N1CCCC1)C(=O)Nc1cccc(Oc2ccncc2)c1 217157045 PLDMHOKHFPXGRV-UHFFFAOYSA-N 402.498 5.138 70 20 HKID CCOc1ccccc1NC(=O)[C@H](N[C@@H](c1ccccc1)C1CC1)c1ccccc1 217460897 PDBVJBUNVCJLHV-LOSJGSFVSA-N 400.522 5.506 70 20 HKID COc1ccc([C@@H]2CCCCCN2C(=O)c2cc(C(C)C)nc3onc(C)c23)cc1 217977978 FTFMANCNBKMZMI-NRFANRHFSA-N 407.514 5.421 70 20 HKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1ncc(C(F)(F)F)cc1Cl 217137101 QDDZJTNEFUSALW-CYBMUJFWSA-N 420.909 5.443 70 20 HKID CCN(C(=O)c1ccc(SCc2cn3ccccc3n2)cc1)[C@H](C)c1cccnc1 217208770 RRSDXUBWJALCKW-GOSISDBHSA-N 416.550 5.245 70 20 HKID CCOc1cccc2cc([C@@H](C)NCC(=O)Nc3ccccc3C(F)(F)F)oc12 216756125 XIHMGVGTWPZASJ-CYBMUJFWSA-N 406.404 5.140 70 20 HKID Cc1cn2c(CN(C)C(=O)c3ccc(C4SCCCS4)cc3)c(C)nc2s1 217127684 XRWXKOPWPUWWGD-UHFFFAOYSA-N 417.625 5.154 70 20 HKID C[C@@H](NCc1nc(-c2cccc(Br)c2)no1)c1cccc2ccccc12 216648851 GMHNBPOALNXZOO-CQSZACIVSA-N 408.299 5.503 70 20 HKID C[C@@H](CC1CCCC1)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 217194918 KPRKSMZYWYBZOJ-KRWDZBQOSA-N 423.532 5.571 70 20 HKID COc1ccc(NC(=O)[C@H](N[C@H](c2ccc(OC)cc2)C2CC2)c2ccccc2)cc1 217114022 HONNAJADPCWOHP-LOSJGSFVSA-N 416.521 5.125 70 20 HKID Cc1c(CNC(=O)NCc2ccc(Oc3cccnc3)c(F)c2)oc2ccccc12 217216658 DZEPJIZNTIEJLM-UHFFFAOYSA-N 405.429 5.067 70 20 HKID Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 217229808 TZVXJAWLHJNASC-DEOSSOPVSA-N 420.484 5.319 70 20 HKID C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cccc(CSC2CCOCC2)c1 217219233 XVVONYWMQDPYPD-CQSZACIVSA-N 423.937 5.297 70 20 HKID C[C@@H](SCc1ccccc1)C(=O)Nc1cccc(CSC2CCOCC2)c1 217219764 FUTBVNFXHPCKRX-QGZVFWFLSA-N 401.597 5.359 70 20 HKID O=C(NC1CC1)[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)c1ccc(F)cc1 217764049 YUCZNQZOTCBSIJ-SFHVURJKSA-N 402.491 5.200 70 20 HKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H](c1ccccc1)c1ccco1 218129598 YUJNUXDPBOBWNA-NRFANRHFSA-N 422.481 5.282 70 20 HKID CCOc1cccc2cc([C@@H](C)NCC(=O)N(CC)c3nc4ccccc4s3)oc12 216763566 VHXSHBUWDGLJKS-OAHLLOKOSA-N 423.538 5.145 70 20 HKID Clc1ccccc1OCc1nnc(SCc2noc3c2CCCC3)n1C1CC1 217007612 CNRHXBLGACWUMZ-UHFFFAOYSA-N 416.934 5.005 70 20 HKID CCc1cccc(C)c1NC(=O)c1cccc(NS(=O)(=O)c2cc(C)ccc2C)c1 218286921 MISWEXFEBCHTEB-UHFFFAOYSA-N 422.550 5.227 70 20 HKID O=C(CCc1ccc(OC(F)F)cc1)Nc1cccc(CSC2CCOCC2)c1 217219625 FWZDZOOXCVOEDC-UHFFFAOYSA-N 421.509 5.272 70 20 HKID COC(=O)c1ccccc1N(C)C(=O)c1cc(-c2cccs2)nc2ccccc12 217590084 LWRTUJWZHQFDDD-UHFFFAOYSA-N 402.475 5.027 70 20 HKID Cc1ccccc1-c1nnc(SCc2noc3c2CCCC3)n1Cc1ccco1 217009083 WEKPOIFOSQAADH-UHFFFAOYSA-N 406.511 5.054 70 20 HKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N[C@H]1CCOc2ccccc21 218624381 SGPCGUWDJIPRLV-DYVFJYSZSA-N 414.527 5.070 70 20 HKID C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)N1CCC[C@H]1c1cccs1 218613944 NTTHAABLHAFZSU-MFKMUULPSA-N 420.909 5.660 70 20 HKID Cc1noc(Cl)c1CCC(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 216897328 QANYEFSLJHLRAG-HNNXBMFYSA-N 419.909 5.025 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)C1(c2ccc(Cl)cc2)CC1 217221106 GATJPECKSRHTTG-UHFFFAOYSA-N 401.959 5.423 70 20 HKID CCCN(C(=O)c1cc(S(=O)(=O)C(C)C)ccc1F)c1cccc2ccccc12 217118150 ZBCIDRAIELBCRI-UHFFFAOYSA-N 413.514 5.218 70 20 HKID C[C@H](N[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1cccnc1 216834817 MAGAOXBPDMOSSX-VBKZILBWSA-N 400.309 5.419 70 20 HKID COc1ccc([C@H](NCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C2CC2)cc1 217107286 DKZRIZIIOMKCFQ-GOSISDBHSA-N 413.732 5.335 70 20 HKID CN(C)C(=O)Sc1ccccc1NC(=O)c1cc(Cl)ccc1Br 217050808 XPAURXVLUIVDQU-UHFFFAOYSA-N 413.724 5.129 70 20 HKID O=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccc(S(=O)(=O)Cl)c(Cl)c1 95698300 FIRRZDHAPAMSRE-UHFFFAOYSA-N 414.097 5.218 70 20 HKID CC(=O)N[C@H](CC(=O)Nc1ccc(C(C)C)cc1C(C)C)c1c(F)cccc1F 216667855 UGRZBOJKFCIBOJ-OAQYLSRUSA-N 402.485 5.418 70 20 HKID C[C@H](C1CC1)n1nccc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 216822409 LDJRHTYHGVMXKV-CYBMUJFWSA-N 416.403 5.313 70 20 HKID Cc1cn2c(CN(C)C(=O)CC(c3ccccc3)c3ccccc3)c(C)nc2s1 217124428 JBYBQMLAWCNRCV-UHFFFAOYSA-N 403.551 5.193 70 20 HKID CC[C@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(OC)cc1 218206490 ZTOSVSYZTKHGQT-ACJLOTCBSA-N 405.420 5.566 70 20 HKID O=C(Nc1ccccc1C(=O)Nc1ccc(Cc2ccncc2)cc1)c1ccccc1 217848392 XGLIXXWHACXPIG-UHFFFAOYSA-N 407.473 5.177 70 20 HKID O=C(Nc1ccc(Cc2ccncc2)cc1)c1occc1CSc1ccccc1 217040415 TZZSESOWAWNDIZ-UHFFFAOYSA-N 400.503 5.810 70 20 HKID Cc1ccc(-c2nc(NC(=O)CCc3nc(C)no3)sc2-c2ccc(C)cc2)cc1 218321635 CNRQGRQUKZEEOE-UHFFFAOYSA-N 418.522 5.357 70 20 HKID C[C@@H]1CCC[C@@H](OCc2cccc(N[C@H](C)C(=O)NCCc3cccs3)c2)C1 217163812 KFTVRHYMYNIWHE-DBXWQHBBSA-N 400.588 5.003 70 20 HKID CCN(C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C)[C@@H](C)c1cccnc1 217208137 DXNQQFVHKCRDJS-AWEZNQCLSA-N 404.436 5.254 70 20 HKID CC(C)c1ccc(NC(=O)CSc2nnc(-c3cccs3)n2C)c(C(C)C)c1 216640284 UYJRPNKTOQTTEX-UHFFFAOYSA-N 414.600 5.521 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 217156159 VJNSODDKHDSICK-QHCPKHFHSA-N 421.472 5.226 70 20 HKID Cc1cc(C)c(NC(=O)c2cc(Br)ccc2F)c(Br)c1 159771155 KKTBKQLLTJUTPA-UHFFFAOYSA-N 401.073 5.220 70 20 HKID COc1ccc([C@@H](N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 218200253 ITPBIJIRJYVMLT-DJJJIMSYSA-N 417.431 5.566 70 20 HKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N[C@@H]1CCOc2ccccc21 218624225 SGPCGUWDJIPRLV-CXAGYDPISA-N 414.527 5.070 70 20 HKID CN(C(=O)c1ccc(NCc2noc3c2CCCC3)cc1Cl)C1CCCCC1 217019085 IYGDIWIDMNCMTN-UHFFFAOYSA-N 401.938 5.224 70 20 HKID CCCN(C(=O)CCC(=O)c1ccc(C)s1)[C@H](c1ccc(F)cc1)c1cccnc1 217131291 NEVFYSDSPBIADP-XMMPIXPASA-N 424.541 5.582 70 20 HKID Cc1cc(C)nc(Sc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)n1 218084803 ZRFAPEPUSYDPBI-UHFFFAOYSA-N 404.322 5.804 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@H](C)c4ccccn4)cc3)sc2c1 216833820 AESSAIPYRWBWSN-IAGOWNOFSA-N 416.550 5.345 70 20 HKID Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)C(=O)Nc3c(C)cccc3C)s2)cc1 216996707 JNERDZRCOMFPEX-IEBWSBKVSA-N 407.583 5.722 70 20 HKID Cc1cccc(C(=O)Nc2cccc(N(C)C(C)C)c2)c1NC(=O)c1ccccc1F 217069295 FRYNUYTZRRWGQA-UHFFFAOYSA-N 419.500 5.483 70 20 HKID CSc1ccccc1C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 217985123 UGHLYRIOWTZEBO-UHFFFAOYSA-N 420.412 5.525 70 20 HKID CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)c(O)c(OCC)c1 218629240 NPOYVRFUIDXXBH-UHFFFAOYSA-N 417.811 5.504 70 20 HKID O=C(Nc1ccnc(Oc2ccccc2)c1)N1CCC(OCc2ccccc2)CC1 217235854 PYRMDEPGBGOZCS-UHFFFAOYSA-N 403.482 5.087 70 20 HKID CO[C@H](CNC(=O)c1c(-c2ccccc2Cl)noc1C)c1ccccc1Cl 218324225 ROQVZXMXBJKQMV-QGZVFWFLSA-N 405.281 5.074 70 20 HKID CCOc1cccc2cc([C@H](C)NCc3nnc(-c4cc5c(s4)CCCC5)o3)oc12 216763294 YCIJWZUQGIILGT-AWEZNQCLSA-N 423.538 5.673 70 20 HKID O=C(Nc1ccccc1Nc1ccccc1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 216911144 BLBWVFSCOXYCFD-IBGZPJMESA-N 417.484 5.060 70 20 HKID CCN(C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)[C@H](C)c1cccnc1 217208486 OJSRILDTSNZLFA-CQSZACIVSA-N 419.472 5.376 70 20 HKID Fc1ccccc1-c1nnc(SCc2noc3c2CCCC3)n1Cc1ccccc1 217007370 VUXMDJORBVRVHU-UHFFFAOYSA-N 420.513 5.292 70 20 HKID C[C@@H]1CCC[C@@H](OCc2cccc(N[C@@H](C(=O)NC3CC3)c3ccc(F)cc3)c2)C1 216741251 RQMSEZOABYAIIA-UOKFIYJESA-N 410.533 5.353 70 20 HKID O=C(Nc1ccc(OCc2cccnc2)c(Cl)c1)c1cnc(-c2ccco2)s1 216833790 YSMNEXLUQOXAAM-UHFFFAOYSA-N 411.870 5.283 70 20 HKID CC(=O)Nc1ccc(C(=O)Nc2sc3c(c2C(=O)c2cccs2)CCCC3)cc1 218084125 ZMOVAHIJJUOUER-UHFFFAOYSA-N 424.547 5.130 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@@H](c2ccccc2)C2CC2)cs1 217558988 PTUBLLKKALYGEE-QHCPKHFHSA-N 405.567 5.631 70 20 HKID COc1ccc(NC(=O)c2cc(Br)ccc2Br)cc1Cl 159997138 SFAVKRCKKGWBAQ-UHFFFAOYSA-N 419.500 5.126 70 20 HKID O=c1c2c3c(sc2ncn1Cc1csc(-c2ccc(F)cc2)n1)CCCCC3 218060829 BENXIFYSALFFBP-UHFFFAOYSA-N 411.527 5.038 70 20 HKID CN(CCc1ccc(F)cc1)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 216978566 IUUSQHKVPRHFBA-UHFFFAOYSA-N 410.436 5.088 70 20 HKID C[C@H](C1CC1)n1nccc1NC(=O)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1 218344565 VAXQRHDRXOPYCL-CQSZACIVSA-N 421.888 5.206 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cccc(Br)c1 217220185 UXYNXFNPJKDGBN-UHFFFAOYSA-N 406.345 5.114 70 20 HKID O=C(CSc1ccc(F)c(F)c1)Nc1cccc(CSC2CCOCC2)c1 217219827 KHKUJCDHOCFKDR-UHFFFAOYSA-N 409.523 5.108 70 20 HKID COc1ccc([C@H](N[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)C2CC2)cc1 217108911 HLYZIPRMHRCQDP-AVRWGWEMSA-N 400.522 5.430 70 20 HKID CC(C)[C@@H](NCc1cc(Br)c(O)c(Br)c1)c1ccccc1 218752704 JKAGHAJCZWDWPM-MRXNPFEDSA-N 413.153 5.404 70 20 HKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N[C@H]1CCOc2ccccc21 218624451 SGPCGUWDJIPRLV-GUYCJALGSA-N 414.527 5.070 70 20 HKID Cc1nc2ccccc2cc1C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 216773831 MKGUJJUXMOFHIJ-UHFFFAOYSA-N 412.927 5.452 70 20 HKID CCN(C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)[C@@H](C)c1cccnc1 217209110 ILVUTAMJDTWGKH-AWEZNQCLSA-N 418.324 5.586 70 20 HKID Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 217229805 TZVXJAWLHJNASC-XMMPIXPASA-N 420.484 5.319 70 20 HKID COc1ccc(NC(=O)[C@H](N[C@@H](c2ccc(OC)cc2)C2CC2)c2ccccc2)cc1 217113991 HONNAJADPCWOHP-JWQCQUIFSA-N 416.521 5.125 70 20 HKID COc1ccc([C@H]2CCCCCN2C(=O)Nc2cccc(Oc3ccncc3)c2)cc1 217156677 DTMMNGUXGHJUGX-XMMPIXPASA-N 417.509 6.032 70 20 HKID COc1ccc(OC)c([C@@H](C)N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 218194313 ZOKYWHNAXSOKPH-OLZOCXBDSA-N 421.419 5.184 70 20 HKID C[C@H](N[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 216832878 UKHRQDVHKDOWFC-VBKZILBWSA-N 400.309 5.419 70 20 HKID COc1cc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc(Cl)c1OCC(C)C 216851407 XRHIDVVKNJPLCT-UHFFFAOYSA-N 415.917 5.019 70 20 HKID C[C@@H](NC(=O)Nc1cccc(Oc2ccncc2)c1)c1nc(-c2ccccc2)cs1 217156072 AQNAUKBQOHTXRZ-MRXNPFEDSA-N 416.506 5.880 70 20 HKID O=C(Nc1ccc2c3c(cccc13)CC2)c1ccccc1CSC1=NCCS1 217064154 KLTYHKURHNXNOM-UHFFFAOYSA-N 404.560 5.527 70 20 HKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCc2sccc2C1 218621709 KJVUAXGCFSHQME-GFCCVEGCSA-N 404.557 5.076 70 20 HKID O=C(CCOc1cccc(Cl)c1)Nc1cccc(CSC2CCOCC2)c1 217219374 JWRGAXRTGJPIGI-UHFFFAOYSA-N 405.947 5.160 70 20 HKID COc1ccc(Cl)cc1CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216830357 SDFADYOTOSBKAN-UHFFFAOYSA-N 409.898 5.202 70 20 HKID Clc1ccc(Cl)c(OCCSc2nnc(NCc3ccco3)s2)c1 217403082 FMYXQUPAJBCYOC-UHFFFAOYSA-N 402.328 5.221 70 20 HKID C[C@H](c1nc2ccccc2s1)N(C)C(=O)CCc1cccc(Br)c1 216851478 NSLSNOSCIDNFFQ-CYBMUJFWSA-N 403.345 5.211 70 20 HKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1ncc(C(F)(F)F)cc1Cl 217137111 QDDZJTNEFUSALW-ZDUSSCGKSA-N 420.909 5.443 70 20 HKID Cc1cccc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)c1NC(=O)c1ccccc1F 217197619 YNBOAAGDEYOUFQ-VWLOTQADSA-N 406.501 5.349 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cc(F)ccc1Br 217220062 FFFNHWMGLJMEIU-UHFFFAOYSA-N 424.335 5.253 70 20 HKID CCO[C@@H](C)c1nc(CC(=O)NCC2(c3ccccc3C)CCCCC2)cs1 217228822 DCXRFOWRLSYUOR-SFHVURJKSA-N 400.588 5.110 70 20 HKID C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)N1CCC[C@H]1c1cccs1 218614031 NTTHAABLHAFZSU-GWCFXTLKSA-N 420.909 5.660 70 20 HKID O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)N(Cc1ccco1)Cc1ccco1 217182478 SIRNXRSZXVGECY-SFHVURJKSA-N 405.281 5.579 70 20 HKID O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cc(-c2ccco2)on1 217678593 DHCVENSCHUPRFG-UHFFFAOYSA-N 401.447 5.387 70 20 HKID CC[C@@H](NCC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)c1ccc(Cl)cc1 218214353 NEMKRXGASKCQIO-OAQYLSRUSA-N 410.949 5.130 70 20 HKID O=C(NCc1cccc(OCC(F)(F)F)c1)Nc1cccc(Oc2ccncc2)c1 217156375 JBUGHONJGHEUGL-UHFFFAOYSA-N 417.387 5.137 70 20 HKID C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CC1CCOCC1 217227895 ROSJEONFQHPZRR-OXJNMPFZSA-N 422.956 5.673 70 20 HKID CCCOc1ccccc1NC(=O)c1cc(Br)ccc1Br 160310803 YPTFWWFQLDAJQT-UHFFFAOYSA-N 413.109 5.253 70 20 HKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3c(C)cc(C)cc3C)n2)cc1 216818371 RMEOYHDZHYPXHB-UHFFFAOYSA-N 421.566 5.056 70 20 HKID Cc1ccc(-c2cc(C(=O)Nc3cccc(CSC4CCOCC4)c3)on2)cc1 217220979 OINVVYHMXNFEHI-UHFFFAOYSA-N 408.523 5.315 70 20 HKID Cc1cccc(OCCCCC(=O)Nc2cccc(CSC3CCOCC3)c2)c1 217221230 SOTSSQWHWBOKGL-UHFFFAOYSA-N 413.583 5.595 70 20 HKID CCN(C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C)[C@H](C)c1cccnc1 217208141 DXNQQFVHKCRDJS-CQSZACIVSA-N 404.436 5.254 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)O[C@@H](C)c3nc4ccccc4n3C(F)F)c12 217847837 NEQUOFVUXQQYMQ-LBPRGKRZSA-N 414.412 5.317 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1ccc(Oc2cccnc2)cc1 217220336 BFQYDDZPHMSQHK-UHFFFAOYSA-N 420.534 5.538 70 20 HKID O=C(NC1CC1)c1cc(N2CCC[C@@H]2c2nc3ccccc3s2)nc2ccccc12 216800953 LUXUCUNHYLHIHJ-HXUWFJFHSA-N 414.534 5.078 70 20 HKID C[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 216974044 FICIUOPUBMPDHI-AWEZNQCLSA-N 406.486 5.722 70 20 HKID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)C1CCOCC1 216641901 DQPDVDIYQXZYDV-SFHVURJKSA-N 417.336 5.149 70 20 HKID O=C(Nc1ccc(Cc2ccncc2)cc1)C1(c2ccc(Br)cc2)CC1 218522073 CBJOPOKQSCMXMO-UHFFFAOYSA-N 407.311 5.105 70 20 HKID COc1ccc([C@@H](N[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)C2CC2)cc1 217108894 HLYZIPRMHRCQDP-BVZFJXPGSA-N 400.522 5.430 70 20 HKID O=C(CCOc1ccc(Cl)cc1)Nc1cccc(CSC2CCOCC2)c1 217220373 JPGWSPIHRGKVJC-UHFFFAOYSA-N 405.947 5.160 70 20 HKID Cc1ccc(-c2nc(CNC3(c4ccc5c(c4)OCCO5)CCCC3)cs2)cc1 217409159 MEZSREMSQCCEBL-UHFFFAOYSA-N 406.551 5.449 70 20 HKID Cc1occc1-c1nnc(SCc2noc3c2CCCC3)n1Cc1ccccc1 217008629 AYGXNSZGSAMPQM-UHFFFAOYSA-N 406.511 5.054 70 20 HKID Cc1ccc(C(=O)C2CCN(C(=O)Nc3cccc(Oc4ccncc4)c3)CC2)cc1 217156241 QZYIDCQCQDUQMD-UHFFFAOYSA-N 415.493 5.309 70 20 HKID O=C([C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)N1CCC(OCc2ccccc2)CC1 217115841 DHGMKGSFHFEOBB-RTWAWAEBSA-N 403.444 5.017 70 20 HKID Cc1cc(F)ccc1-c1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1F 217227914 BAVNVJPCZGXBJM-UHFFFAOYSA-N 424.491 5.270 70 20 HKID CN(Cc1ccc(Br)s1)C(=O)Nc1cccc(Oc2ccncc2)c1 217155985 MKFMDBRZYALORT-UHFFFAOYSA-N 418.316 5.362 70 20 HKID CCc1ccc(-c2nc(CC(=O)N3CCC[C@H]3c3ccc(OC)cc3)cs2)cc1 216642911 VHGAKJDLSSDWKH-QFIPXVFZSA-N 406.551 5.287 70 20 HKID C[C@H](NCC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)c1cc2ccccc2o1 216692097 OGVCYRSYZRIMLY-YJBOKZPZSA-N 419.506 5.116 70 20 HKID O=C(Nc1c(F)cccc1Cl)N1CCN(C(c2ccccc2)c2ccccc2)CC1 217313056 LVRZFEWSXZTVGS-UHFFFAOYSA-N 423.919 5.418 70 20 HKID COc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(Br)c2C)c(OC)c1 216653408 WJEPSPASOLTYDI-SFHVURJKSA-N 419.319 5.144 70 20 HKID CCOc1cccc2cc([C@@H](C)NCC(=O)Nc3c(Cl)cccc3Cl)oc12 216755898 GNGODDMVTRFTSB-GFCCVEGCSA-N 407.297 5.428 70 20 HKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cc(C)cc(C)c2)o1 217159119 ZCAQHMRMRPKMQU-QGZVFWFLSA-N 413.568 5.043 70 20 HKID O=C(CCCOc1cccc(F)c1)Nc1cccc(CSC2CCOCC2)c1 217219741 SIEYOKOVIAMKJG-UHFFFAOYSA-N 403.519 5.036 70 20 HKID COc1ccc(CCC(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1F 217029049 JEMPTTQCAQBAAU-UHFFFAOYSA-N 407.470 5.077 70 20 HKID Cc1cc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)on1 216717490 JOMFJJQFBQQFIB-QINSGFPZSA-N 402.475 5.437 70 20 HKID O=C(Nc1cccc(C[S@](=O)c2ccccc2)c1)C1(c2cccc(Cl)c2)CCC1 217209663 JFOQDHAANUUDPH-LJAQVGFWSA-N 423.965 5.708 70 20 HKID CC(=O)Nc1cccc(NC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 217300651 KUIMRGZLAOQRKY-UHFFFAOYSA-N 405.298 5.327 70 20 HKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1cc(Cl)ccc1N(C)C 218135415 XQLHCYZJEJKOHV-UHFFFAOYSA-N 419.909 5.141 70 20 HKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCC[C@@H]1c1cccs1 218628586 OKGPNSGFFSVKFO-CXAGYDPISA-N 418.584 5.855 70 20 HKID COc1ccccc1[C@H]1CCCN1Cc1nnc(-c2ccc(Cl)cc2Cl)o1 216740547 BNNDOYSWGZIDNZ-QGZVFWFLSA-N 404.297 5.389 70 20 HKID Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 217229828 JEWKLDACELLUQP-XMMPIXPASA-N 420.484 5.319 70 20 HKID COc1cc(NC(=O)CSCc2ccc3ccccc3c2)c(OC)cc1Cl 218032122 OMAPQTXSBBZJRM-UHFFFAOYSA-N 401.915 5.382 70 20 HKID CN(Cc1cccc(Cl)c1Cl)C(=O)c1ccc(CNC(=O)C2CCCC2)cc1 216734998 RFIVKPWAQSCBMU-UHFFFAOYSA-N 419.352 5.072 70 20 HKID CCc1cccc(CC)c1NC(=O)c1cc(Br)ccc1Br 159997702 GBIXEKQZBKWLLV-UHFFFAOYSA-N 411.137 5.589 70 20 HKID Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)C(=O)Nc3c(C)cccc3C)s2)cc1 216996693 JNERDZRCOMFPEX-MJGOQNOKSA-N 407.583 5.722 70 20 HKID C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 217234203 GORHSSIGYQHYPP-IQWFGDOHSA-N 424.972 5.381 70 20 HKID CN(C(=O)c1ccc(CNC(=O)C2CCCC2)cc1)c1cc(Cl)cc(Cl)c1 217178292 KIYUEVORZPUMSM-UHFFFAOYSA-N 405.325 5.076 70 20 HKID Cc1nc2c(s1)[C@@H](N(C)C(=O)CSc1cccc(C(F)(F)F)c1)CCC2 217126168 ACAGVAGLPXRIJB-HNNXBMFYSA-N 400.491 5.098 70 20 HKID CCOc1ccc2cc(C(=O)Nc3cccc(CSC4CCOCC4)c3)[nH]c2c1 217222785 IJVDTYGFVSBELB-UHFFFAOYSA-N 410.539 5.231 70 20 HKID COc1ccc([C@@H](C)N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1F 218195123 XINZCXAPORZDDV-NEPJUHHUSA-N 409.383 5.315 70 20 HKID CC[C@@H](NCc1cc(Br)c(O)c(Br)c1)c1ccc(C)cc1 218399407 JCNGXTUSNCGTNC-MRXNPFEDSA-N 413.153 5.467 70 20 HKID COc1ccc(Br)c(C(=O)Nc2ccccc2-c2csc(C)n2)c1 218589464 HGFFBQJJAOIPKJ-UHFFFAOYSA-N 403.301 5.142 70 20 HKID Cc1ccc(Cn2nccc2NC(=O)c2occc2CSc2ccccc2)cc1 217056294 INAARRJMHYXTSV-UHFFFAOYSA-N 403.507 5.377 70 20 HKID Cc1ccnc(-c2ccc(NC(=O)c3cc(Cl)ccc3Br)cc2)n1 217206505 JTDSOKHOQUATTI-UHFFFAOYSA-N 402.679 5.120 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@H](C)c4cccnc4)cc3)sc2c1 216835751 BIEUUPYLSVFDMH-IAGOWNOFSA-N 416.550 5.345 70 20 HKID c1ccc(Cn2c(SCc3ccc(-n4ccnc4)cc3)nnc2-c2ccco2)cc1 216786759 KLDUSGKQFDAKSL-UHFFFAOYSA-N 413.506 5.064 70 20 HKID C[C@H](Sc1nc2cc(Cl)ccc2o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218651096 OIAZALDHOTWSIW-YFKPBYRVSA-N 422.762 5.296 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)[C@H]1C[C@@H]1c1c(F)cccc1F 217220241 VGCSDDFNGDWZCH-ROUUACIJSA-N 403.494 5.119 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)C(c1ccccc1)c1ccccc1 217219896 SDVDMNUGVYNYIR-UHFFFAOYSA-N 417.574 5.869 70 20 HKID Cc1ccccc1-c1nnc(SCc2cccc3cccnc23)n1Cc1ccco1 217503997 VXMBIIUDRBZEPA-UHFFFAOYSA-N 412.518 5.735 70 20 HKID COc1c(C)ccc(NC(=O)c2cc(Br)ccc2Br)c1C 160294867 LSUZYWFHBWANIP-UHFFFAOYSA-N 413.109 5.089 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@H](C)c4cccnc4)cc3)sc2c1 216835792 BIEUUPYLSVFDMH-SJORKVTESA-N 416.550 5.345 70 20 HKID Cc1ccc2[nH]c([C@@H]3CCCN3C(=O)[C@@H]3C[C@@H]3c3cccc(C(F)(F)F)c3)nc2c1 217118244 KEJAHWAOUNSQSK-HLIPFELVSA-N 413.443 5.357 70 20 HKID Cc1noc2nc(C3CC3)cc(C(=O)Nc3cccc(CSC4CCOCC4)c3)c12 217220424 PRUYYQKYRLRUJZ-UHFFFAOYSA-N 423.538 5.073 70 20 HKID O=C(CCc1nc2ccccc2s1)Nc1cccc(CSC2CCOCC2)c1 217221152 GCBCYJCTWSLBAC-UHFFFAOYSA-N 412.580 5.280 70 20 HKID Cc1cn2c(CN(C)C(=O)c3csc(-c4ccc(Cl)cc4)n3)c(C)nc2s1 217129046 MLVYUMOPBOJXGI-UHFFFAOYSA-N 416.959 5.062 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)[C@@H]1C[C@H]1c1c(F)cccc1F 217220245 VGCSDDFNGDWZCH-QZTJIDSGSA-N 403.494 5.119 70 20 HKID COc1ccc(C)cc1NC(=O)[C@@H](N[C@@H](c1ccccc1)C1CC1)c1ccccc1 217554373 BJKKXXRZVHOQKQ-DQEYMECFSA-N 400.522 5.424 70 20 HKID C[C@@H](N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1cccnc1 216834848 MAGAOXBPDMOSSX-VLIAUNLRSA-N 400.309 5.419 70 20 HKID O=C(NCC1(c2ccc3c(c2)OCCO3)CCCC1)c1c(Cl)cccc1Cl 218423725 FFGRCDGKFXBYRB-UHFFFAOYSA-N 406.309 5.006 70 20 HKID Cc1ccc(Cl)cc1NC(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F 218610477 SHBIPOFXSASNTA-KRWDZBQOSA-N 414.836 5.037 70 20 HKID CCOc1cccc2cc([C@@H](C)NCc3nnc(-c4cc5c(s4)CCCC5)o3)oc12 216763247 YCIJWZUQGIILGT-CQSZACIVSA-N 423.538 5.673 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N1CCC[C@@H](c2nc3ccccc3o2)C1 217157533 HROODLJUCOCMJI-QGZVFWFLSA-N 414.465 5.427 70 20 HKID O=C(NC1CC1)c1cc(N2CCC[C@H]2c2nc3ccccc3s2)nc2ccccc12 216800993 LUXUCUNHYLHIHJ-FQEVSTJZSA-N 414.534 5.078 70 20 HKID CCN(C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)[C@@H](C)c1cccnc1 217216205 DCVPQWSSQWWGAW-KRWDZBQOSA-N 424.545 5.384 70 20 HKID O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)Nc1cccc2ccccc12 218190694 VOWIMQBVRFAWBQ-FQEVSTJZSA-N 416.424 5.228 70 20 HKID O=C(NCCOc1ccc2ccccc2c1)c1occc1CSc1ccccc1 217040041 GWJLGKFZZLXODC-UHFFFAOYSA-N 403.503 5.534 70 20 HKID CC(C)(C)OC(=O)NCc1nc(C(=O)Oc2ccc(-c3ccccc3)cc2)cs1 217158098 QFVQEZRNDAOXJP-UHFFFAOYSA-N 410.495 5.054 70 20 HKID COc1ccc([C@@H](N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 218200426 ITPBIJIRJYVMLT-YJYMSZOUSA-N 417.431 5.566 70 20 HKID CC(=O)c1ccc(Cl)c(Cl)c1OCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 216719586 GCROQWFGAMNKJC-SNVBAGLBSA-N 416.251 5.073 70 20 HKID c1ccc(Cc2nnc(SCc3noc4c3CCCC4)n2-c2ccccc2)cc1 217010131 BFPZRHAIAJFRMA-UHFFFAOYSA-N 402.523 5.017 70 20 HKID COc1ccc([C@H](N[C@H](C)C(=O)Nc2ccccc2-c2ccccc2)C2CC2)cc1 217108940 HLYZIPRMHRCQDP-IQGLISFBSA-N 400.522 5.430 70 20 HKID COc1ccc([C@H](N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 218200515 ITPBIJIRJYVMLT-BFUOFWGJSA-N 417.431 5.566 70 20 HKID CC(C)n1c([C@@H]2CCCN(C(=O)c3cnc(-c4ccco4)s3)C2)nc2ccccc21 217195020 ZOAJVLSMDREMQW-MRXNPFEDSA-N 420.538 5.354 70 20 HKID CCOc1ccc(NC(=O)c2cc(Br)ccc2Br)cc1F 160656806 XSKSAFAZBWVMOD-UHFFFAOYSA-N 417.072 5.002 70 20 HKID O=C(c1ccccc1)C1CCN(C(=O)Nc2cccc(Oc3ccncc3)c2)CC1 217155924 WFPDIRJQCQKGGQ-UHFFFAOYSA-N 401.466 5.001 70 20 HKID CC[C@@H](NCc1csc(-c2cccc(OC)c2OC)n1)c1ccc(Cl)cc1 218214173 CIKWVLWAPGPIPT-GOSISDBHSA-N 402.947 5.722 70 20 HKID CC(C)c1n[nH]c(-c2ccccc2NC(=O)c2cc(Cl)ccc2Br)n1 217174233 LDLKHUHRSITLKB-UHFFFAOYSA-N 419.710 5.263 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)N3CCc4sccc4[C@H]3c3cccs3)c12 217982245 ZSHDCJRLPZLMDD-FQEVSTJZSA-N 423.563 5.566 70 20 HKID C[C@H](Nc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@@H](C)c1cc2ccccc2o1 218771110 PBWJNUFDAKDLFU-KBPBESRZSA-N 406.404 5.052 70 20 HKID Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 217229832 JEWKLDACELLUQP-DEOSSOPVSA-N 420.484 5.319 70 20 HKID C[C@@H](C1CC1)n1nccc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 216822379 LDJRHTYHGVMXKV-ZDUSSCGKSA-N 416.403 5.313 70 20 HKID O=C([C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)N1CCC(OCc2ccccc2)CC1 217115873 DHGMKGSFHFEOBB-SFTDATJTSA-N 403.444 5.017 70 20 HKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N[C@@H]1CCOc2ccccc21 218624305 SGPCGUWDJIPRLV-SUMWQHHRSA-N 414.527 5.070 70 20 HKID Cc1cc(C)c(NC(=O)c2cc(Br)ccc2Cl)c(Br)c1 159769335 RFBXBSJXVBYNOP-UHFFFAOYSA-N 417.528 5.734 70 20 HKID CCOc1cc(C(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)cc(Cl)c1O 218055754 WURYNUHQAZADTQ-UHFFFAOYSA-N 418.902 5.137 70 20 HKID O=C(Nc1cccc(S(F)(F)(F)(F)F)c1)c1ccc(S(=O)(=O)F)cc1 865209606 AIXQJJRKILPHJU-UHFFFAOYSA-N 405.341 5.255 70 20 HKID O=C(N[C@H]1CCSc2c(F)cccc21)c1ccccc1CSC1=NCCS1 216794341 RIUJEHQUWFBYIC-KRWDZBQOSA-N 418.584 5.129 70 20 HKID COc1cc(C(=O)N(C)[C@@H](C)c2sc(C)nc2C)ccc1OCc1ccccc1 216969090 BYCSQNWXXYWBJO-INIZCTEOSA-N 410.539 5.181 70 20 HKID O=C(Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccccc1C(F)(F)F 216941089 MYOYQWLFIGAWGO-UHFFFAOYSA-N 411.383 5.184 70 20 HKID O=C(Nc1ncc(Cc2ccccc2)s1)c1occc1CSc1ccccc1 217052425 SMSCLPOWGKWUGP-UHFFFAOYSA-N 406.532 5.872 70 20 HKID CC[C@H](NCC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C)c1ccc(Cl)cc1 218214434 NEMKRXGASKCQIO-NRFANRHFSA-N 410.949 5.130 70 20 HKID Cc1noc(CCC(=O)N(c2ccc(C(C)C)cc2)c2nc3ccccc3s2)n1 218320812 JYZUGLMYRCSENF-UHFFFAOYSA-N 406.511 5.409 70 20 HKID Cc1cccc(-c2nnc(SCc3noc4c3CCCC4)n2Cc2ccco2)c1 217009109 WGZSQIGXTVGHAH-UHFFFAOYSA-N 406.511 5.054 70 20 HKID C[C@H](NCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)c1cc2ccccc2o1 216700527 QQYWOHYPBIHSBK-MAUKXSAKSA-N 419.506 5.116 70 20 HKID CCO[C@@H](C)c1nc(CC(=O)N2CCc3sccc3[C@@H]2c2cccs2)cs1 217227883 AUWWPCMAEROIMX-ORAYPTAESA-N 418.609 5.080 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3c(-c4ccccc4)nc4ccccn34)c12 217961595 LHJYRUITOQNTIO-UHFFFAOYSA-N 411.465 5.222 70 20 HKID C[C@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1cccc2ccccc12 217163395 SGYDGFKBRSLCAW-HNNXBMFYSA-N 409.411 5.535 70 20 HKID CCN(C(=O)c1ccc(SCc2cn3ccccc3n2)cc1)[C@@H](C)c1cccnc1 217208763 RRSDXUBWJALCKW-SFHVURJKSA-N 416.550 5.245 70 20 HKID Brc1ccccc1-c1nnc(CSCc2ccc3ccccc3c2)o1 218032227 XBUJUURZZQRWFF-UHFFFAOYSA-N 411.324 6.086 70 20 HKID CC[C@H](NCC(=O)Nc1c(F)cc(F)cc1Br)c1ccc(Cl)cc1 218216696 YEQRJPMQJBJTBT-HNNXBMFYSA-N 417.681 5.060 70 20 HKID COc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218624051 DTBOABFJTNEZQX-KGLIPLIRSA-N 416.543 5.316 70 20 HKID CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C[C@H]3CCOc4ccccc43)ccc21 217230346 BUNYDOBORXLNCS-QGZVFWFLSA-N 422.525 5.269 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)c12 217931456 VIBBCGHMFMAPPJ-UHFFFAOYSA-N 411.465 5.450 70 20 HKID CSCC[C@H](NCc1sc2ccccc2c1Cl)c1nnc2ccccn12 217420105 XEEDQIMNWUHXIC-AWEZNQCLSA-N 402.976 5.181 70 20 HKID O=C(CNC(=O)c1sc2ccccc2c1Cl)Nc1ccccc1-c1ccccc1 218309016 NVKXWLZWCIQHEC-UHFFFAOYSA-N 420.921 5.590 70 20 HKID CCO[C@@H](C)c1nc(CC(=O)N2CCc3sccc3[C@H]2c2cccs2)cs1 217227887 AUWWPCMAEROIMX-DJJJIMSYSA-N 418.609 5.080 70 20 HKID Cc1cc(C)c(NC(=O)c2cc(Br)cnc2Cl)c(Br)c1 159638686 IDXFBXMAIWFKNG-UHFFFAOYSA-N 418.516 5.129 70 20 HKID O=C(c1ccc(F)cc1)C1CCN(C(=O)c2cccc(Oc3ccccc3)c2)CC1 217766724 HOCBJBVBUDTKMA-UHFFFAOYSA-N 403.453 5.353 70 20 HKID C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CCc1ncc(-c2ccccc2F)o1 217792617 QJQGFAFOHIABPC-AWEZNQCLSA-N 409.486 5.243 70 20 HKID CCCOc1ccccc1NC(=O)c1ccc(Br)cc1Br 218741280 DEQYMKFHHYYHAI-UHFFFAOYSA-N 413.109 5.253 70 20 HKID Clc1ccc([C@H](NCc2nc(-c3cccc(Br)c3)no2)C2CC2)cc1 216705355 NDBSSUYWRGHUAQ-GOSISDBHSA-N 418.722 5.393 70 20 HKID O=C(Nc1ccc(NC(=O)[C@@H]2CCOc3ccccc32)cc1)c1ccc(Cl)cc1 216764687 WCBHLFGONDMGCD-HXUWFJFHSA-N 406.869 5.097 70 20 HKID C[C@@H](C1CC1)n1nccc1NC(=O)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1 218344482 VAXQRHDRXOPYCL-AWEZNQCLSA-N 421.888 5.206 70 20 HKID Cc1ccc(-n2c(SCc3cnn(-c4ccccc4)c3)nnc2-c2ccncc2)cc1 217506269 AMEBGXXIHVQOCX-UHFFFAOYSA-N 424.533 5.116 70 20 HKID C[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CSC2CCOCC2)c1 217220389 GMBBSSJOLKNIQK-OAHLLOKOSA-N 405.947 5.158 70 20 HKID CCN(C(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@@H](C)c1ccc(F)cc1 216668171 LIAQILFXXWZTJZ-INIZCTEOSA-N 411.546 5.262 70 20 HKID Cc1cc(Br)cc2c1N(C(=O)c1cnc3onc(C(C)C)c3c1)CCC2 216768428 QBOGYNYDKYMXFX-UHFFFAOYSA-N 414.303 5.010 70 20 HKID CCS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(C)C)cc2C(C)C)c1 217056030 ABWXNKDPCVYKOG-UHFFFAOYSA-N 407.963 5.633 70 20 HKID COc1ccc([C@H](NCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C2CC2)cc1 217106814 UTXQDRZGIVDTQL-LJQANCHMSA-N 412.839 5.047 70 20 HKID C[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 216637834 BPMHWTRJPCRIQO-QGZVFWFLSA-N 424.522 5.107 70 20 HKID CC(=O)N1CCc2cc(NC(=O)c3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)ccc21 216687111 CQKYOLIVWHAVQO-UHFFFAOYSA-N 408.542 5.149 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1csc(-c2cccs2)n1 217221072 DPJDMUDGPFHHFV-UHFFFAOYSA-N 416.593 5.536 70 20 HKID CCN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)[C@@H](C)c1cccnc1 217208361 XFOPIZDEGUJDBI-HNNXBMFYSA-N 415.415 5.511 70 20 HKID C[C@@H](NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)c1cc2ccccc2o1 216691965 OGVCYRSYZRIMLY-CRAIPNDOSA-N 419.506 5.116 70 20 HKID O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1c(Cl)cccc1Cl 218084983 RKMLYXLTVHGRFA-UHFFFAOYSA-N 403.290 5.793 70 20 HKID COc1ccc(NC(=O)[C@H](N[C@H](C)c2cc3ccccc3o2)c2ccccc2)cc1 217116837 KCKPPZAUXHQIGK-MZNJEOGPSA-N 400.478 5.472 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cnc(-c2ccsc2)s1 217220569 ZYTTUVWXPYYUJR-UHFFFAOYSA-N 416.593 5.536 70 20 HKID O=C(CCC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccc(-c2ccccc2)cc1 216887803 IYBYYZMYEWHXCF-UHFFFAOYSA-N 411.501 5.338 70 20 HKID COc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218623961 DTBOABFJTNEZQX-UONOGXRCSA-N 416.543 5.316 70 20 HKID O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(c2c[nH]c3ccccc23)CC1 218004123 JJQJFHOROVEIMM-UHFFFAOYSA-N 401.432 5.276 70 20 HKID COc1ccc(OC)c([C@H](C)N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 218194509 ZOKYWHNAXSOKPH-QWHCGFSZSA-N 421.419 5.184 70 20 HKID O=C(N[C@H](c1ccc2c(c1)CCCC2)c1cccs1)C1C[C@@H]2CCC[C@H](C1)C2=O 216855319 RJHPRWDDDINXEN-MXHMCPQYSA-N 407.579 5.228 70 20 HKID CCO[C@H](C)c1nc(CC(=O)NCC(C)(C)c2c(Cl)cccc2Cl)cs1 217228242 VUWXNCJISSJIIM-GFCCVEGCSA-N 415.386 5.184 70 20 HKID Cc1cc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)on1 216717080 RQZSXUQWKMCSHX-SSZFMOIBSA-N 400.434 5.358 70 20 HKID O=C(c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2COc2ccccc2)CC1 217762810 IDMLWOIJQUIUEN-UHFFFAOYSA-N 417.480 5.140 70 20 HKID CC[C@H](NCc1nnc(-c2ccccc2Br)o1)c1ccc(Cl)cc1 218211458 NPSFGPMEAASXON-INIZCTEOSA-N 406.711 5.393 70 20 HKID COc1ccc([C@@H](NCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C2CC2)cc1 217107269 DKZRIZIIOMKCFQ-SFHVURJKSA-N 413.732 5.335 70 20 HKID O=C(Cc1ccc(Cl)c(Cl)c1)Nc1cccc(CSC2CCOCC2)c1 217219690 RCLOJAVXWIYWOC-UHFFFAOYSA-N 410.366 5.587 70 20 HKID CCOc1ccccc1NC(=O)[C@@H](N[C@@H](c1ccccc1)C1CC1)c1ccccc1 217460833 PDBVJBUNVCJLHV-DQEYMECFSA-N 400.522 5.506 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3CN(C)C3CCCCC3)c12 218247413 QFFUUEYTTKTUPS-UHFFFAOYSA-N 420.557 5.671 70 20 HKID CCN(CC)C(=O)c1ccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1 216871819 PRILJTONCGBUTO-UHFFFAOYSA-N 408.448 5.366 70 20 HKID C[C@@H](NC(=O)c1occc1CSc1ccccc1)c1ccc(Br)cc1 217039167 IVUVNEOEXGPWOA-CQSZACIVSA-N 416.340 5.825 70 20 HKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H](c1ccccc1)c1ccco1 218129529 YUJNUXDPBOBWNA-OAQYLSRUSA-N 422.481 5.282 70 20 HKID COCc1c(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)sc2cccc(F)c12 217365324 XTADBEJGUQXNKY-UHFFFAOYSA-N 413.449 5.072 70 20 HKID CCc1ccc(-c2nc(CC(=O)N(Cc3ccco3)Cc3ccco3)cs2)cc1 216642282 VRKXFOOEHXHGAD-UHFFFAOYSA-N 406.507 5.330 70 20 HKID COc1cc(C(=O)N(C)[C@H](C)c2sc(C)nc2C)ccc1OCc1ccccc1 216969108 BYCSQNWXXYWBJO-MRXNPFEDSA-N 410.539 5.181 70 20 HKID Cc1nc(C(F)(F)F)ccc1C(=O)Nc1c(C)c(C(C)(C)C)nn1-c1ccccc1 216981087 GWLUQMBVZYGYPF-UHFFFAOYSA-N 416.447 5.453 70 20 HKID CC[C@@H](N[C@@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1)c1ccc(OC)cc1 217116649 LSVPIPCDZOLBQO-DNQXCXABSA-N 404.510 5.125 70 20 HKID CCc1ccc(-c2nc(CC(=O)N3CCC[C@H]3c3cccc(OC)c3)cs2)cc1 217850782 HXWNRVUSVLSNFP-QFIPXVFZSA-N 406.551 5.287 70 20 HKID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)C1CCOCC1 216641853 DQPDVDIYQXZYDV-GOSISDBHSA-N 417.336 5.149 70 20 HKID Cc1ccc(C(=O)N(C)c2ccc(Br)cc2F)cc1Oc1ccncc1 217204890 NFCLXYCMMABUAM-UHFFFAOYSA-N 415.262 5.361 70 20 HKID C[C@@H](Sc1nc2cc(Cl)ccc2o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218651001 OIAZALDHOTWSIW-RXMQYKEDSA-N 422.762 5.296 70 20 HKID CCCN(C(=O)c1cc(F)c(F)c(F)c1F)[C@@H](c1ccc(F)cc1)c1cccnc1 217131126 OMROXLXZSWARQA-NRFANRHFSA-N 420.381 5.419 70 20 HKID C[C@H](CC1CCCC1)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 217194924 KPRKSMZYWYBZOJ-QGZVFWFLSA-N 423.532 5.571 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cc(Br)ccc1F 217219458 JVXCZHCUNVMQFI-UHFFFAOYSA-N 424.335 5.253 70 20 HKID CCCN(C(=O)c1cc(F)c(F)c(F)c1F)[C@H](c1ccc(F)cc1)c1cccnc1 217131135 OMROXLXZSWARQA-OAQYLSRUSA-N 420.381 5.419 70 20 HKID CC(C)n1ncc2c(C(=O)N3c4ccccc4CC[C@H]3C)cc(-c3ccco3)nc21 217521739 VPAOGLYXGJZQIP-MRXNPFEDSA-N 400.482 5.254 70 20 HKID CCOc1ccc(NC(=O)c2ccc(Br)cc2Br)cc1F 218765181 YUEATKMDPUMYEV-UHFFFAOYSA-N 417.072 5.002 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@H](C)c4ccccn4)cc3)sc2c1 216833854 AESSAIPYRWBWSN-SJORKVTESA-N 416.550 5.345 70 20 HKID Cc1ccc(C)c(C(=O)CCC(=O)Nc2cccc(CSC3CCOCC3)c2)c1 217222632 AUPXFOBFGLNBCA-UHFFFAOYSA-N 411.567 5.317 70 20 HKID C[C@@H](Nc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H](C)c1cc2ccccc2o1 218771197 PBWJNUFDAKDLFU-ZIAGYGMSSA-N 406.404 5.052 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@H](C)c2cc3ccccc3o2)cs1 216693609 WJPYLPMAEPWTIY-MRXNPFEDSA-N 419.550 5.987 70 20 HKID Cc1ccc(Oc2ccc(NC(=O)NCC(=O)Nc3c(C)cccc3C)cc2)cc1 217425224 YKHYQDMCMLMEDM-UHFFFAOYSA-N 403.482 5.164 70 20 HKID CCOc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1OC 216721357 RIDIQYAPHDXPKN-UHFFFAOYSA-N 405.479 5.018 70 20 HKID CC(C)c1cc(C(=O)Nc2ccccc2C(=O)NCc2ccco2)c2ccccc2n1 217129716 DYIHNQBDEAOESI-UHFFFAOYSA-N 413.477 5.134 70 20 HKID Cc1noc(Cl)c1CCC(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 217180122 QAEBGWUYKUNJLJ-UHFFFAOYSA-N 407.857 5.548 70 20 HKID Cc1cc(-c2cc(C(=O)N3c4ccccc4CC[C@@H]3C)c3c(C)noc3n2)c(C)o1 218000896 YQYGFNMGEHFLAG-ZDUSSCGKSA-N 401.466 5.390 70 20 HKID C[C@@H](NCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1)c1cc2ccccc2o1 216700484 QQYWOHYPBIHSBK-CRAIPNDOSA-N 419.506 5.116 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)NC1(c2ccc(Cl)cc2)CCOCC1 217156262 NQFYHLDBCAOYGQ-UHFFFAOYSA-N 423.900 5.355 70 20 HKID CSCc1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccccc2F)cc1 216679605 AOHSILKQJLNPFU-UHFFFAOYSA-N 408.498 5.502 70 20 HKID Cc1cc(Cl)ccc1OCC(=O)Nc1cccc(CSC2CCOCC2)c1 217220201 LXACTCHVAXNVNA-UHFFFAOYSA-N 405.947 5.078 70 20 HKID COc1ccc(-c2n[nH]cc2C(=O)Nc2nc(-c3ccc(C)cc3C)cs2)cc1 218096587 CMBHBRFTXLWNDJ-UHFFFAOYSA-N 404.495 5.078 70 20 HKID COc1ccc([C@H](C)N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1F 218195203 XINZCXAPORZDDV-RYUDHWBXSA-N 409.383 5.315 70 20 HKID CCOc1cc(C)ccc1NC(=O)c1cc(Br)ccc1Br 160179191 PHGFDFJTYYAMIL-UHFFFAOYSA-N 413.109 5.171 70 20 HKID C[C@H](NC(=O)c1occc1CSc1ccccc1)c1ccc(Br)cc1 217039197 IVUVNEOEXGPWOA-AWEZNQCLSA-N 416.340 5.825 70 20 HKID O=C(OCc1noc(-c2ccc(F)cc2)n1)c1occc1CSc1ccccc1 217070750 JJUOFGVKWBXGSF-UHFFFAOYSA-N 410.426 5.118 70 20 HKID COc1cc(C2(C(=O)Nc3cccc(CSC4CCOCC4)c3)CC2)ccc1C 217219307 PIYNNAOZXRPWBI-UHFFFAOYSA-N 411.567 5.086 70 20 HKID CCSCc1ccc(C(=O)Nc2cccc(CSC3CCOCC3)c2)cc1 217220681 CSEUUDIPDSUPAA-UHFFFAOYSA-N 401.597 5.604 70 20 HKID O=C(c1cnc(-c2ccsc2)s1)N1CCc2sccc2[C@@H]1c1cccs1 217158180 GHBKPSMZDFYZDU-QGZVFWFLSA-N 414.602 5.783 70 20 HKID COc1ccc([C@@H](NCc2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 217784951 YNOLVEPILXCJBT-IBGZPJMESA-N 403.404 5.005 70 20 HKID CN(Cc1cnccn1)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 217231298 NKWRURNICKFTTB-UHFFFAOYSA-N 418.349 5.348 70 20 HKID CC[C@H](N[C@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1)c1ccc(OC)cc1 217116696 LSVPIPCDZOLBQO-ZEQRLZLVSA-N 404.510 5.125 70 20 HKID Cc1cn2c(CN(C)C(=O)CCc3ccc(-c4ccccc4F)o3)c(C)nc2s1 217128970 RLMDWWVLDRAGOP-UHFFFAOYSA-N 411.502 5.003 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Oc3ccc(NC(=O)c4ccccc4)cc3)c12 217943918 CCKBJWGTNWZPJV-UHFFFAOYSA-N 415.449 5.126 70 20 HKID Cc1ccccc1N(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)C(C)C 216923448 ZUXAGIGFEBEJGL-UHFFFAOYSA-N 401.919 5.232 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@H](c2ccccc2)C2CC2)cs1 217559071 PTUBLLKKALYGEE-HSZRJFAPSA-N 405.567 5.631 70 20 HKID Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)C(=O)Nc3c(C)cccc3C)s2)cc1 216996700 JNERDZRCOMFPEX-HKUYNNGSSA-N 407.583 5.722 70 20 HKID CC[C@H](NCc1csc(CC(=O)Nc2ccc(C)cc2)n1)c1ccc(Cl)cc1 218209149 IHHIPDNTXLHHKW-FQEVSTJZSA-N 413.974 5.527 70 20 HKID Cc1cccc(C(=O)NCC(C)(C)c2cccs2)c1NC(=O)c1ccccc1F 217197489 KJIUAQVVNCHXRH-UHFFFAOYSA-N 410.514 5.156 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)[C@@H]1C[C@@H]1c1c(F)cccc1F 217220234 VGCSDDFNGDWZCH-ZWKOTPCHSA-N 403.494 5.119 70 20 HKID C[C@@H](c1cccc(O)c1)N(C)CC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 217095210 OJBYQFDYFMOXCG-VIFPVBQESA-N 422.139 5.637 70 20 HKID CCc1cccc2c(CC(=O)Nc3cccc(CSC4CCOCC4)c3)c[nH]c12 217220218 AURCAPYLFGTSQI-UHFFFAOYSA-N 408.567 5.324 70 20 HKID O=C(OCCCc1ccncc1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 216821146 ZNTFYMCJEHAJHK-UHFFFAOYSA-N 402.372 5.077 70 20 HKID COc1ccc(Cl)cc1NC(=O)c1cc(Br)ccc1Br 160013790 QUAXICVTNJZSOT-UHFFFAOYSA-N 419.500 5.126 70 20 HKID Cc1cc(-c2cc(C(=O)N3c4ccccc4CC[C@H]3C)c3c(C)noc3n2)c(C)o1 218000995 YQYGFNMGEHFLAG-CYBMUJFWSA-N 401.466 5.390 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N(Cc1cccs1)C[C@H]1CCCO1 217155942 AJVFLRNOMPLIJF-HXUWFJFHSA-N 409.511 5.149 70 20 HKID COc1ccc2c(c1)CN(C(=O)Nc1ccc(OCc3ccccc3)cc1C)CC2 217229820 PBEAHMKQVANKKW-UHFFFAOYSA-N 402.494 5.173 70 20 HKID Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N(C)[C@@H](C)c2ccncc2)c1C 217232725 METRUJOGHAFKHZ-AWEZNQCLSA-N 418.328 5.416 70 20 HKID O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)N(Cc1ccco1)Cc1ccco1 217182472 SIRNXRSZXVGECY-GOSISDBHSA-N 405.281 5.579 70 20 HKID Oc1c(Br)cc(CN[C@@H]2CCCc3ccccc32)cc1Br 218369859 IEDXPCCSXIIRAV-MRXNPFEDSA-N 411.137 5.084 70 20 HKID COc1ccc(NC(=O)[C@@H](N[C@@H](c2ccc(OC)cc2)C2CC2)c2ccccc2)cc1 217113975 HONNAJADPCWOHP-RPBOFIJWSA-N 416.521 5.125 70 20 HKID COc1ccc([C@@H](N[C@H](C)C(=O)Nc2ccccc2-c2ccccc2)C2CC2)cc1 217108926 HLYZIPRMHRCQDP-CJAUYULYSA-N 400.522 5.430 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1ccc(-c2ccccc2F)o1 217220795 JAWSIDZHCUVTHR-UHFFFAOYSA-N 411.498 5.750 70 20 HKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2n1C(F)F 217160377 RCSWBYPQHHLCEK-CQSZACIVSA-N 407.511 5.121 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N1CCC[C@H](c2nc3ccccc3o2)C1 217157546 HROODLJUCOCMJI-KRWDZBQOSA-N 414.465 5.427 70 20 HKID Cc1onc(-c2ccccc2Cl)c1C(=O)OCc1csc(-c2ccccn2)n1 218070658 DEVVGFBNTRFLQQ-UHFFFAOYSA-N 411.870 5.179 70 20 HKID Cc1cc(C)c(NC(=O)c2ccc(Br)cc2F)c(Br)c1 159770283 BYHLBAYBARCZPT-UHFFFAOYSA-N 401.073 5.220 70 20 HKID COc1ccc(NC(=O)[C@@H](N[C@@H](C)c2cc3ccccc3o2)c2ccccc2)cc1 217116795 KCKPPZAUXHQIGK-XDHUDOTRSA-N 400.478 5.472 70 20 HKID CC(C)(C)c1nc(CC(=O)Nc2cccc(CSC3CCOCC3)c2)cs1 217219510 LRPOUJZFTDCOAK-UHFFFAOYSA-N 404.601 5.034 70 20 HKID O=C(Nc1cccc(C[S@@](=O)c2ccccc2)c1)C1(c2cccc(Cl)c2)CCC1 217209659 JFOQDHAANUUDPH-GDLZYMKVSA-N 423.965 5.708 70 20 HKID Cc1nc2ccccc2cc1C(=O)Nc1ccc(OCc2cn3ccccc3n2)cc1 216939258 NSRHCIOXQJWLBB-UHFFFAOYSA-N 408.461 5.022 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3nc(-c4cc(F)ccc4F)cs3)c12 217661817 RRGISEUHISWWMJ-UHFFFAOYSA-N 414.437 5.309 70 20 HKID Brc1cccc([C@H]2CCCN2Cc2csc(-c3ccccn3)n2)c1 217146522 NHDFQWDYRLPCDV-GOSISDBHSA-N 400.345 5.305 70 20 HKID CCOc1cccc2cc([C@H](C)NCC(=O)Nc3c(Cl)cccc3Cl)oc12 216755949 GNGODDMVTRFTSB-LBPRGKRZSA-N 407.297 5.428 70 20 HKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cc(C)cc(C)c2)o1 217159127 ZCAQHMRMRPKMQU-KRWDZBQOSA-N 413.568 5.043 70 20 HKID CCO[C@H](C)c1nc(CC(=O)NCC2(c3ccccc3C)CCCCC2)cs1 217228825 DCXRFOWRLSYUOR-GOSISDBHSA-N 400.588 5.110 70 20 HKID Cc1ccc(Cn2nccc2NC(=O)c2ccccc2SCc2cccs2)cc1 217815998 LBBVALNVMRWWAJ-UHFFFAOYSA-N 419.575 5.846 70 20 HKID C[C@H](N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 216832953 UKHRQDVHKDOWFC-XOBRGWDASA-N 400.309 5.419 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@@H](CC)c2ccc(OC)cc2)cs1 216782932 DMEFMFJSEOPWJN-QFIPXVFZSA-N 423.582 5.640 70 20 HKID CCOc1ccccc1NC(=O)[C@H](N[C@H](c1ccccc1)C1CC1)c1ccccc1 217461040 PDBVJBUNVCJLHV-JWQCQUIFSA-N 400.522 5.506 70 20 HKID Cc1c(Cl)cccc1NC(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F 218605411 BNNILRTUJLNPMK-KRWDZBQOSA-N 414.836 5.037 70 20 HKID Cc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)n(-c2ccc(F)cc2)n1 217830583 XAYHDFSDEMDGJP-UHFFFAOYSA-N 424.863 5.200 70 20 HKID Cc1cc(C(=O)Nc2c(F)cc(Br)cc2F)ccc1Br 160602886 JTTVPZMBBUTVOU-UHFFFAOYSA-N 405.036 5.051 70 20 HKID COc1cc(CNCc2ccc(NC(C)=O)cc2)ccc1OCc1ccc(Cl)cc1 218258506 YJEVOSVLSQUSMX-UHFFFAOYSA-N 424.928 5.176 70 20 HKID O=C(CSCc1noc2c1CCCC2)Nc1cc(C(F)(F)F)ccc1Cl 217033038 ZNEOSAIXYDEBKJ-UHFFFAOYSA-N 404.841 5.098 70 20 HKID FC(F)(F)c1ccc(-c2nc(CN[C@@H](c3ccccc3)c3ccco3)cs2)cc1 218281354 MQGLEGLNYAAKAX-FQEVSTJZSA-N 414.452 6.301 70 20 HKID C[C@@H](NCC(=O)N1N=C(c2cccs2)C[C@H]1c1ccco1)c1cc2ccccc2o1 216692048 OGVCYRSYZRIMLY-QAPCUYQASA-N 419.506 5.116 70 20 HKID O=S(=O)(c1ccc(CSc2ncc(C(F)(F)F)cc2Cl)cc1)C(F)F 216862791 UVKIAFZFJBIXLQ-UHFFFAOYSA-N 417.808 5.042 70 20 HKID CN(Cc1cnccn1)C(=O)c1cc(-c2cccc3ccccc23)nc2ccccc12 217232611 HYHYIACHWGNCHG-UHFFFAOYSA-N 404.473 5.117 70 20 HKID CCOc1ccc(NC(=O)c2ccc(Br)cc2Br)c(C)c1 218764284 PBSNUBUBNQOYNY-UHFFFAOYSA-N 413.109 5.171 70 20 HKID CCS[C@H]1CCCCN(C(=O)c2cccc(C)c2NC(=O)c2ccccc2F)C1 217150258 JCJAFJZWNJXYRP-KRWDZBQOSA-N 414.546 5.134 70 20 HKID CN(Cc1ccccc1Br)C(=O)Nc1cccc(Oc2ccncc2)c1 217156204 RWKKXOWDCJYPIU-UHFFFAOYSA-N 412.287 5.300 70 20 HKID O=C(c1ccc(F)cc1)C1CCN(C(=O)c2ccc(OCc3ccccc3)cc2)CC1 217744474 CLOBOOOVRDNRQN-UHFFFAOYSA-N 417.480 5.140 70 20 HKID O=C(Nc1ccccc1Nc1ccccc1)C1CCN(c2nc3ccccc3o2)CC1 217802820 BISMQMLWUBIETD-UHFFFAOYSA-N 412.493 5.427 70 20 HKID CCC[C@@H](NCc1cc(Br)c(O)c(Br)c1)c1ccccc1 218419327 QTTIJPBUJFHEGR-MRXNPFEDSA-N 413.153 5.548 70 20 HKID COc1ccc2c(c1)CN(C(=O)Nc1ccc(OCc3cccc(F)c3)cc1C)CC2 216759192 BTPFBDBFQSMXRP-UHFFFAOYSA-N 420.484 5.312 70 20 HKID COCCc1ccc(Oc2ccc(NC(=O)CCc3c(C)noc3Cl)cc2)cc1 217004025 APMFIPOXENJYME-UHFFFAOYSA-N 414.889 5.189 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)N3CCc4sccc4[C@@H]3c3cccs3)c12 217982153 ZSHDCJRLPZLMDD-HXUWFJFHSA-N 423.563 5.566 70 20 HKID CN(Cc1cnccn1)C(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 217231239 CNYWLULYOXOZHJ-UHFFFAOYSA-N 415.518 5.056 70 20 HKID CCc1ccccc1N(C(C)=O)c1nc(CN[C@@H](C)c2cc3ccccc3o2)cs1 216693568 WJPYLPMAEPWTIY-INIZCTEOSA-N 419.550 5.987 70 20 HKID C[C@@H](Sc1ccc(Cl)cc1)C(=O)Oc1cccc(NC(=O)c2ccco2)c1 217205478 VIGROEQELGVJGO-CYBMUJFWSA-N 401.871 5.272 70 20 HKID CN(C(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12)c1ccccn1 217706538 DCMSSQXZKUUFMB-UHFFFAOYSA-N 418.294 5.336 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cccnc1SC(F)F 217222530 CCCCEMWRQCWVLX-UHFFFAOYSA-N 410.511 5.061 70 20 HKID CC(=O)c1ccc(Cl)c(Cl)c1OCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 216719545 GCROQWFGAMNKJC-JTQLQIEISA-N 416.251 5.073 70 20 HKID O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1ccnc2ccccc12 217604767 BVXNTNAHQUMHDZ-UHFFFAOYSA-N 424.323 5.297 70 20 HKID CN(Cc1cnccn1)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 217231470 MUGISKYAXQPDRW-UHFFFAOYSA-N 418.349 5.348 70 20 HKID CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)C1(c2ccccc2)CCCC1 216858201 ABMQAQDRLNYTBA-UHFFFAOYSA-N 419.352 5.292 70 20 HKID COc1ccccc1OCc1ccc(C(=O)N(C)c2cc(Cl)cc(Cl)c2)o1 217178373 JWLHADQSHCSALZ-UHFFFAOYSA-N 406.265 5.451 70 20 HKID O=C(Nc1ccc(NC(=O)[C@H]2CCOc3ccccc32)cc1)c1ccc(Cl)cc1 216764728 WCBHLFGONDMGCD-FQEVSTJZSA-N 406.869 5.097 70 20 HKID CCOc1ccccc1Nc1nnc(SCc2noc(-c3ccccc3)n2)s1 216804688 ZUOSJLQAWDPHHW-UHFFFAOYSA-N 411.512 5.023 70 20 HKID O=S(=O)(c1ccc(CSc2nc(-c3ccc(F)cc3)cs2)cc1)C(F)F 216863993 FADUJVWFTRFZHG-UHFFFAOYSA-N 415.483 5.238 70 20 HKID O=C(Nc1nc2c(s1)CCCCC2)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 217920274 JWIOIFCQLQLBHT-FQEVSTJZSA-N 418.518 5.119 70 20 HKID Cc1cccc(C(=O)N2CCC[C@]3(CC=CCC3)C2)c1NC(=O)c1ccccc1F 217197626 YNBOAAGDEYOUFQ-RUZDIDTESA-N 406.501 5.349 70 20 HKID Cc1nc2ccccc2cc1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 217206470 UWUZCKXZMDEVQF-UHFFFAOYSA-N 415.880 5.701 70 20 HKID COc1ccc([C@H](C)NCc2ccc(-n3nc(C)cc3C)cc2)cc1Br 216750379 IPPUMMOQFBZMJF-INIZCTEOSA-N 414.347 5.111 70 20 HKID Cc1nc2ccccc2cc1C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1 217209643 YAEHVZUVJLFYBH-LJAQVGFWSA-N 400.503 5.103 70 20 HKID Brc1ccc(-c2nc(CN(Cc3cccnc3)C3CC3)cs2)cc1 216712321 FSJDAMAESRKYKR-UHFFFAOYSA-N 400.345 5.132 70 20 HKID CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1c(Cl)cccc1Cl 216857895 GCMNATKFTBXKTE-UHFFFAOYSA-N 420.123 5.401 70 20 HKID CC(C)CCn1c(COc2ccccc2)nnc1SCc1noc2c1CCCC2 217008954 QWHGXVKKKAKJGD-UHFFFAOYSA-N 412.559 5.062 70 20 HKID CCOC(=O)c1c(CN[C@@H](C)c2ccccn2)nc2ccccc2c1-c1ccccc1 216635007 KHLMSGAXZBLPDX-SFHVURJKSA-N 411.505 5.324 70 20 HKID Cc1cc(C)n(-c2ccc(C(=O)Nc3cccc(CSC4CCOCC4)c3)cc2)n1 217219677 WBXJHZDJTLMZQX-UHFFFAOYSA-N 421.566 5.154 70 20 HKID C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1cccc2ccccc12 217163389 SGYDGFKBRSLCAW-OAHLLOKOSA-N 409.411 5.535 70 20 HKID Cc1nc(CSc2ccccc2C(=O)Nc2nc3c(s2)CCCC3)cs1 218064260 BVIRMNHTRXQXRT-UHFFFAOYSA-N 401.582 5.331 70 20 HKID CCS[C@@H]1CCCCN(C(=O)c2cccc(C)c2NC(=O)c2ccccc2F)C1 217150249 JCJAFJZWNJXYRP-QGZVFWFLSA-N 414.546 5.134 70 20 HKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1ncc(-c2ccc(F)cc2)o1 217846966 JRQQASPFWWKZTD-MRXNPFEDSA-N 402.516 5.170 70 20 HKID Cc1ccc(Cl)cc1NC(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F 218610403 SHBIPOFXSASNTA-QGZVFWFLSA-N 414.836 5.037 70 20 HKID O=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccccc1Nc1ccccc1 217803857 VMSHLYGGQRGBPO-UHFFFAOYSA-N 401.441 5.796 70 20 HKID COc1ccc([C@H](NCc2csc(-c3ccc(OC)c(OC)c3)n2)C2CC2)cc1 217110379 GTMOMWSPVFVZMV-JOCHJYFZSA-N 410.539 5.077 70 20 HKID C[C@H](c1nc2ccccc2s1)N(C)C(=O)CCc1ncc(-c2ccccc2F)o1 217792705 QJQGFAFOHIABPC-CQSZACIVSA-N 409.486 5.243 70 20 HKID C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)N1CCC[C@@H]1c1cccs1 218613870 NTTHAABLHAFZSU-GXFFZTMASA-N 420.909 5.660 70 20 HKID CCOc1ccc(CN(CCCn2ccnc2)C(=O)c2csc3ccccc23)cc1 217163566 JLJHUSHSPFLOTG-UHFFFAOYSA-N 419.550 5.229 70 20 HKID Oc1c(Br)cc(CN[C@H]2CCCc3ccccc32)cc1Br 218369941 IEDXPCCSXIIRAV-INIZCTEOSA-N 411.137 5.084 70 20 HKID Cc1cc(C)c(NC(=O)c2cc(F)ccc2Br)c(Br)c1 159772894 MVQXGAAVBOGSIP-UHFFFAOYSA-N 401.073 5.220 70 20 HKID O=C(Nc1ccc(NCc2noc3c2CCCC3)c(C(F)(F)F)c1)c1ccco1 217019142 RAOHOQFKYZWSLX-UHFFFAOYSA-N 405.376 5.030 70 20 HKID O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)Nc1cccc2ccccc12 218190632 VOWIMQBVRFAWBQ-HXUWFJFHSA-N 416.424 5.228 70 20 HKID Cc1c(C(=O)N2CC=C(c3ccc(O)cc3)CC2)oc2ccc(Br)cc12 216849854 UMIXEERHPDTLBC-UHFFFAOYSA-N 412.283 5.139 70 20 HKID Cc1ccc(C[C@H](NC(=O)Nc2cccc(Oc3ccncc3)c2)c2ccccn2)cc1 217235642 MPCYSUIYCJQZNS-VWLOTQADSA-N 424.504 5.683 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Oc3ccc(NC(=O)c4cccs4)cc3)c12 217944031 FKTROKPYCRQCJS-UHFFFAOYSA-N 421.478 5.188 70 20 HKID C[C@@H](N[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1cccnc1 216834784 MAGAOXBPDMOSSX-JLTOFOAXSA-N 400.309 5.419 70 20 HKID COc1ccc2c(c1)c(C(=O)N(C)CCc1ccccn1)c(C)n2C1CCCCC1 218583885 IQBPCESRSWOBLI-UHFFFAOYSA-N 405.542 5.173 70 20 HKID COc1ccc([C@H](NCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C2CC2)cc1 217107452 XBCJTUYYRLIOET-LJQANCHMSA-N 412.839 5.047 70 20 HKID COc1cc(CN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)C2CC2)ccc1O 217185406 RJIGQCYEJHGRRQ-KRWDZBQOSA-N 421.324 5.069 70 20 HKID COc1ccc([C@H](C)NCc2csc(-c3ccc(Br)cc3)n2)cc1F 216769971 PLZWDKHXLYHMFL-LBPRGKRZSA-N 421.335 5.571 70 20 HKID CC(C)[C@H](NCc1cc(Br)c(O)c(Br)c1)c1ccccc1 218752753 JKAGHAJCZWDWPM-INIZCTEOSA-N 413.153 5.404 70 20 HKID COc1cc(C(=O)Nc2ccc(Cl)cc2NC(C)=O)ccc1OCc1ccccc1 216937689 VUHHNVOSFMFMHD-UHFFFAOYSA-N 424.884 5.138 70 20 HKID c1ccc(-n2cc(CSc3nnc(-c4c[nH]c5ccccc45)n3C3CC3)cn2)cc1 217505428 RBZRIQHZOGGQSQ-UHFFFAOYSA-N 412.522 5.239 70 20 HKID CCN(C(=O)C1CCN(c2nc3ccccc3s2)CC1)[C@H](C)c1ccc(F)cc1 216668217 LIAQILFXXWZTJZ-MRXNPFEDSA-N 411.546 5.262 70 20 HKID CCOc1ccc(NC(=O)c2cc(Br)ccc2Br)c(C)c1 160186712 GAOLDBZTSWHYOH-UHFFFAOYSA-N 413.109 5.171 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)C1(c2cccc(Cl)c2)CC1 217220056 CXFKIERQBLWFNZ-UHFFFAOYSA-N 401.959 5.423 70 20 HKID C[C@H](c1nc2ccccc2s1)N(C)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 217471684 ABTMBRWBPLIQIG-DAXOMENPSA-N 404.457 5.638 70 20 HKID COc1ccc([C@@H](NCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C2CC2)cc1 217107437 XBCJTUYYRLIOET-IBGZPJMESA-N 412.839 5.047 70 20 HKID O=C(CCC(=O)c1ccc(Cl)cc1)Nc1cccc(CSC2CCOCC2)c1 217222807 MJNUBSULJOXYOI-UHFFFAOYSA-N 417.958 5.354 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1cc2cc(Cl)ccc2o1 217219446 NUFKDFSRYLUYAO-UHFFFAOYSA-N 401.915 5.751 70 20 HKID O=C(N[C@@H](c1ccc2c(c1)CCCC2)c1cccs1)C1C[C@@H]2CCC[C@H](C1)C2=O 216855346 RJHPRWDDDINXEN-FANLQWHUSA-N 407.579 5.228 70 20 HKID Cc1ccc(-n2c(SCc3ccc4ccccc4n3)nnc2-c2ccncc2)cc1 217069923 CBTJLYQBDVOIMN-UHFFFAOYSA-N 409.518 5.478 70 20 HKID C[C@H](NC(=O)[C@@H](C)Nc1ccc(OCC(F)(F)F)cc1)c1cc2ccccc2o1 218771025 PBWJNUFDAKDLFU-UONOGXRCSA-N 406.404 5.052 70 20 HKID O=C(Nc1ccc(NCc2noc3c2CCCC3)c(C(F)(F)F)c1)c1ccoc1 217019421 CUPSFAUFZRWGFJ-UHFFFAOYSA-N 405.376 5.030 70 20 HKID CCc1ccc(-c2nc(CC(=O)N3CCC[C@@H]3c3ccc(OC)cc3)cs2)cc1 216642861 VHGAKJDLSSDWKH-JOCHJYFZSA-N 406.551 5.287 70 20 HKID Cc1noc(Cl)c1CCC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 217212505 CLFMEQQITPPOIS-UHFFFAOYSA-N 418.280 5.113 70 20 HKID CCOc1cc(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)cc(Cl)c1O 218181356 ZPDXTUFIXNGUKG-UHFFFAOYSA-N 416.886 5.010 70 20 HKID O=C(Nc1ccc(NCc2noc3c2CCCC3)c(C(F)(F)F)c1)c1ccccc1 217019201 LNAADKKLZWFXOF-UHFFFAOYSA-N 415.415 5.437 70 20 HKID COc1ccc2cc(C(=O)Nc3nc(-c4ccccc4)c(C(C)=O)s3)c(C)nc2c1 217048873 JNBNVMFFSNTTGG-UHFFFAOYSA-N 417.490 5.130 70 20 HKID CCc1ccc(-c2nc(CC(=O)Nc3cc(Cl)c(N)c(Cl)c3)cs2)cc1 218368612 DAQWUVQOBQKZAA-UHFFFAOYSA-N 406.338 5.443 70 20 HKID O=C(Cc1cccc(C(F)(F)F)c1)Nc1cccc(CSC2CCOCC2)c1 217221136 QPQITFUMGRZRFR-UHFFFAOYSA-N 409.473 5.299 70 20 HKID COc1ccc([C@H]2CCCCCN2C(=O)c2cc(C(C)C)nc3onc(C)c23)cc1 217978050 FTFMANCNBKMZMI-OAQYLSRUSA-N 407.514 5.421 70 20 HKID Cc1cc(C)c(NC(=O)c2cc(F)cc(Br)c2)c(Br)c1 159978437 FPHCCFGTAACFFF-UHFFFAOYSA-N 401.073 5.220 70 20 HKID Cc1cc2oc(=O)cc(CNc3ccccc3C(=O)N3CCCC3)c2cc1C(C)C 216661050 YDZYIJPDBKBNEF-UHFFFAOYSA-N 404.510 5.073 70 20 HKID Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216720078 WZTMDXQZZYMXEC-UHFFFAOYSA-N 412.474 5.574 70 20 HKID Cc1cc(C(=O)N(C)c2ccc(C)c(Cl)c2)c2cnn(Cc3cccs3)c2n1 217177777 MXLAMIVVGANITG-UHFFFAOYSA-N 410.930 5.088 70 20 HKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCC[C@H]1c1cccs1 218628825 OKGPNSGFFSVKFO-GUYCJALGSA-N 418.584 5.855 70 20 HKID C[C@@H](NCC(=O)Nc1c(F)cc(F)cc1Br)c1cccc2ccccc12 217140816 NSASZLKNOXREQX-GFCCVEGCSA-N 419.269 5.170 70 20 HKID Clc1ccc(C2(NCc3nnc(-c4ccc(Cl)cc4Cl)o3)CCC2)cc1 216905771 ROZDDONMRJOQIE-UHFFFAOYSA-N 408.716 5.866 70 20 HKID CC[C@H](NCc1cc(Br)c(O)c(Br)c1)c1ccc(C)cc1 218399494 JCNGXTUSNCGTNC-INIZCTEOSA-N 413.153 5.467 70 20 HKID O=C(COc1cccc2ccccc12)Nc1nnc(SCc2cccs2)s1 216817358 ZIJMYSWSJMJJMX-UHFFFAOYSA-N 413.549 5.063 70 20 HKID CCc1ccc(C(=O)CCC(=O)Nc2cccc(CSC3CCOCC3)c2)cc1 217222551 KVQZIPGOTRATNY-UHFFFAOYSA-N 411.567 5.263 70 20 HKID CC[C@@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(OC)cc1 218206419 ZTOSVSYZTKHGQT-FZKQIMNGSA-N 405.420 5.566 70 20 HKID C[C@H](NC(C)(C)CNC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 217157760 DBIVPNCFWXMCPK-SFHVURJKSA-N 404.514 5.125 70 20 HKID CCCn1c(SCCOc2cc(Cl)ccc2Cl)nnc1-c1ccncc1 217393918 TVLHFILNMDQGRJ-UHFFFAOYSA-N 409.342 5.228 70 20 HKID O=C(NCc1ccc(OC(F)(F)F)cc1)c1occc1CSc1ccccc1 217488996 VJTLQIPBIOCBFC-UHFFFAOYSA-N 407.413 5.401 70 20 HKID COc1ccc2cc(CNC(=O)c3ccccc3CSC3=NCCS3)ccc2c1 217840846 XHDVVYBNCLXNED-UHFFFAOYSA-N 422.575 5.114 70 20 HKID CC(C)Sc1ccccc1C(=O)Nc1nnc(SCc2cccs2)s1 216817486 UCRJDZASZTWXCK-UHFFFAOYSA-N 407.611 5.645 70 20 HKID O=C(c1ccc(NCc2noc3c2CCCC3)cc1)N1CCC[C@@H]1c1ccccc1 217072066 XHTREHKLLIPLJM-HSZRJFAPSA-N 401.510 5.143 70 20 HKID Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccccc1Nc1ccccc1 217605404 ICWVNJORQRLSNI-UHFFFAOYSA-N 417.490 5.898 70 20 HKID CC(C)c1noc2ncc(C(=O)Nc3cccc(CSC4CCOCC4)c3)cc12 217220743 NBPZDYCTZHRWAJ-UHFFFAOYSA-N 411.527 5.011 70 20 HKID O=C(NCC1(c2ccccc2)CCCC1)c1ccccc1CSC1=NCCS1 218082848 HVCMAMHYCAMWRT-UHFFFAOYSA-N 410.608 5.264 70 20 HKID C[C@@H](N[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 216832846 UKHRQDVHKDOWFC-JLTOFOAXSA-N 400.309 5.419 70 20 HKID COc1ccc([C@H](NCc2csc(-c3cccc(OC)c3OC)n2)C2CC2)cc1 217112431 UBDJZUHLHIDGBL-OAQYLSRUSA-N 410.539 5.077 70 20 HKID C[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(CSC2CCOCC2)c1 217220395 GMBBSSJOLKNIQK-HNNXBMFYSA-N 405.947 5.158 70 20 HKID CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N[C@H]2CCSc3ccccc32)c1 216914195 AOGMTXQWSSCVHN-KRWDZBQOSA-N 417.962 5.179 70 20 HKID COc1ccccc1[C@@H]1CCCN1Cc1nnc(-c2ccc(Cl)cc2Cl)o1 216740504 BNNDOYSWGZIDNZ-KRWDZBQOSA-N 404.297 5.389 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)N[C@@H](C)c4cccnc4)cc3)sc2c1 216835722 BIEUUPYLSVFDMH-IRXDYDNUSA-N 416.550 5.345 70 20 HKID C[C@H](N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1cccnc1 216834879 MAGAOXBPDMOSSX-XOBRGWDASA-N 400.309 5.419 70 20 HKID Cc1cc(-c2cc(C(=O)OCCc3scnc3C)c3c(C)noc3n2)c(C)s1 217936837 UGRBTCFODACKLV-UHFFFAOYSA-N 413.524 5.041 70 20 HKID O=C(NC1CC1)[C@H](Sc1nc(-c2ccc(F)cc2)cs1)c1ccc(F)cc1 217764122 YUCZNQZOTCBSIJ-GOSISDBHSA-N 402.491 5.200 70 20 HKID CC[C@@H](N[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(OC)cc1 218206243 ZTOSVSYZTKHGQT-SCLBCKFNSA-N 405.420 5.566 70 20 HKID C[C@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)c1ccc(Br)cc1 216977027 FJSRTXVWMYYIJV-AWEZNQCLSA-N 422.750 5.028 70 20 HKID C[C@@H](NC(C)(C)CNC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 217157750 DBIVPNCFWXMCPK-GOSISDBHSA-N 404.514 5.125 70 20 HKID O=C(Nc1ccc(Cc2ccncc2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F 217849297 MIXKMSOIGUUKCJ-UHFFFAOYSA-N 422.410 5.129 70 20 HKID CCOc1cccc2cc([C@H](C)NCC(=O)Nc3c(C)cc(C)cc3Cl)oc12 216762786 QOXNCOOALDMAPB-HNNXBMFYSA-N 400.906 5.391 70 20 HKID CCN(C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C)[C@@H](C)c1cccnc1 217208778 JHAFKRWMIXAGOO-INIZCTEOSA-N 419.554 5.359 70 20 HKID CC(=O)c1sc(NC(=O)c2cc(C(C)C)nc3onc(C)c23)nc1-c1ccccc1 217944500 HAKIKRKWSWRPFF-UHFFFAOYSA-N 420.494 5.233 70 20 HKID CCCC(=O)Nc1ccc(Cl)c(NCc2nc(-c3ccc(Cl)cc3)no2)c1 216664720 VTCJVIBMAPNKJD-UHFFFAOYSA-N 405.285 5.394 70 20 HKID COc1ccc([C@@H](NCc2csc(-c3cccc(OC)c3OC)n2)C2CC2)cc1 217112418 UBDJZUHLHIDGBL-NRFANRHFSA-N 410.539 5.077 70 20 HKID Cc1c(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)[nH]c2c1C(=O)CC(C)(C)C2 217130379 GCGAVSXJRFWYAQ-UHFFFAOYSA-N 408.498 5.162 70 20 HKID O=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccc(Cc2ccncc2)cc1 217806075 IZEPTYZIFJEGOY-UHFFFAOYSA-N 401.441 5.038 70 20 HKID CC[C@H](NCc1nc(-c2ccc(OC(F)F)c(OC)c2)no1)c1ccc(Cl)cc1 218210116 FNQGWJZMMISMTE-HNNXBMFYSA-N 423.847 5.241 70 20 HKID C[C@H](NCC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)c1cc2ccccc2o1 216700620 QQYWOHYPBIHSBK-YJBOKZPZSA-N 419.506 5.116 70 20 HKID CCN(C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C)[C@H](C)c1cccnc1 217208783 JHAFKRWMIXAGOO-MRXNPFEDSA-N 419.554 5.359 70 20 HKID Brc1cccc([C@@H]2CCCN2Cc2csc(-c3ccccn3)n2)c1 217146509 NHDFQWDYRLPCDV-SFHVURJKSA-N 400.345 5.305 70 20 HKID O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1cccc(CSC2CCOCC2)c1 217220928 QXKUZUCZPOSUOX-UHFFFAOYSA-N 414.958 5.415 70 20 HKID CCOc1ccc(C(=O)N2CCC(Nc3ccnc4cc(Cl)ccc34)CC2)cc1 217115184 SKNJXSQCZMZRBP-UHFFFAOYSA-N 409.917 5.004 70 20 HKID Cc1cc(C)n(-c2ccc(Cl)c(C(=O)Nc3ccccc3Cc3ccccc3)n2)n1 217142593 RACRKLMKTHRDLE-UHFFFAOYSA-N 416.912 5.381 70 20 HKID CCCc1nc(C)c(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)s1 217206421 IWMPMRKTVNNPBQ-UHFFFAOYSA-N 413.930 5.562 70 20 HKID C[C@H](Nc1ccc(OCC(F)(F)F)cc1)C(=O)N[C@H](C)c1cc2ccccc2o1 218771284 PBWJNUFDAKDLFU-KGLIPLIRSA-N 406.404 5.052 70 20 HKID Cc1ccccc1-c1cc(C(=O)NC(C)(C)c2nccs2)c2cnn(C(C)C)c2n1 217222076 IHJAXEGVCMENDX-UHFFFAOYSA-N 419.554 5.109 70 20 HKID CCN(CC)CCN(Cc1cccs1)C(=O)Nc1cccc(Oc2ccncc2)c1 217157982 JAXOQWKHUQGMQF-UHFFFAOYSA-N 424.570 5.311 70 20 HKID COc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218624122 DTBOABFJTNEZQX-KBPBESRZSA-N 416.543 5.316 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N1CCO[C@@H](c2ccccc2Cl)C1 217156616 STDPVIFQXAUWIP-OAQYLSRUSA-N 409.873 5.133 70 20 HKID COc1cc2c(cc1NC(=O)c1cc(C(C)C)nc3onc(C)c13)oc1ccccc12 217935372 TUPBUJSTYOEBSA-UHFFFAOYSA-N 415.449 5.815 70 20 HKID O=C(CCSc1ccc(F)cc1)Nc1cccc(CSC2CCOCC2)c1 217219669 MZNHHTSBRZVVKY-UHFFFAOYSA-N 405.560 5.359 70 20 HKID COc1ccccc1C[C@@H](C)CC(=O)Nc1cccc(CSC2CCOCC2)c1 217220887 QOSCGTLLISMKIH-GOSISDBHSA-N 413.583 5.315 70 20 HKID Cc1cc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)n(-c2ccc(F)cc2)n1 217830466 VASZMQKVMHSFRP-UHFFFAOYSA-N 424.863 5.200 70 20 HKID Cc1cccc(OCc2nnc(SCCOc3cc(Cl)ccc3Cl)o2)c1 216792013 KULJQMOWHOTSKM-UHFFFAOYSA-N 411.310 5.435 70 20 HKID Clc1ccc(-n2c(SCc3noc4c3CCCC4)nnc2-c2ccncc2)cc1 217008230 AADKGEQKILQSDX-UHFFFAOYSA-N 423.929 5.142 70 20 HKID Cc1cc(Br)ccc1C(=O)Nc1cccc(CSC2CCOCC2)c1 217219782 KJXWXUTZNBXPLI-UHFFFAOYSA-N 420.372 5.422 70 20 HKID COc1ccc(Br)c(C(=O)Nc2c(C)cc(C)cc2Br)c1 159773493 VCMFADGESRSFAY-UHFFFAOYSA-N 413.109 5.089 70 20 HKID O=C(CSCc1noc2c1CCCC2)Nc1ccc(Cl)c(C(F)(F)F)c1 217033365 XHFUIIVPPJGUGQ-UHFFFAOYSA-N 404.841 5.098 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N1CCO[C@H](c2ccccc2Cl)C1 217156626 STDPVIFQXAUWIP-NRFANRHFSA-N 409.873 5.133 70 20 HKID CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)N[C@@H]2CCSc3ccccc32)c1 216914166 AOGMTXQWSSCVHN-QGZVFWFLSA-N 417.962 5.179 70 20 HKID O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1cccc(Oc2ccncc2)c1 217156927 UKKZABXMIHNYEU-UHFFFAOYSA-N 405.351 5.354 70 20 HKID O=C(c1ccc(F)cc1)C1CCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1 217743798 GIUBSTCNYOQUDX-UHFFFAOYSA-N 403.453 5.353 70 20 HKID CC(C)(NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1nccs1 217221678 DNBLWQQWLLXXFG-UHFFFAOYSA-N 407.417 5.014 70 20 HKID Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(OCc2cn3ccccc3n2)cc1 216940876 YURHLSGNWGHNPH-UHFFFAOYSA-N 424.460 5.129 70 20 HKID CC[C@@H](N[C@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1)c1ccc(OC)cc1 217116679 LSVPIPCDZOLBQO-RPWUZVMVSA-N 404.510 5.125 70 20 HKID Cc1ccc2[nH]c([C@@H]3CCCN3C(=O)[C@H]3C[C@@H]3c3cccc(C(F)(F)F)c3)nc2c1 217118276 KEJAHWAOUNSQSK-UWVAXJGDSA-N 413.443 5.357 70 20 HKID CCOc1cc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)cc(Cl)c1O 218750939 SGXOWDAGLPRDHE-UHFFFAOYSA-N 407.857 5.240 70 20 HKID CCOc1cccc2cc([C@H](C)NCC(=O)Nc3ccccc3C(F)(F)F)oc12 216756171 XIHMGVGTWPZASJ-ZDUSSCGKSA-N 406.404 5.140 70 20 HKID CCc1ccc(-c2nc(CC(=O)N3CCC[C@@H]3c3cccc(OC)c3)cs2)cc1 217850703 HXWNRVUSVLSNFP-JOCHJYFZSA-N 406.551 5.287 70 20 HKID CCOc1ccccc1-c1nnc(SCCOc2cc(Cl)ccc2Cl)o1 216797282 PXACTTHUCLIQHI-UHFFFAOYSA-N 411.310 5.613 70 20 HKID O=C(Cc1csc2nc(-c3ccccc3)cn12)Nc1ccc(Cc2ccncc2)cc1 217072759 WHYKFTCFNHVNPX-UHFFFAOYSA-N 424.529 5.230 70 20 HKID Cc1ccc(NC(=O)Nc2cccc3c2CCN(Cc2noc4c2CCCC4)C3)cc1 217060146 HQOASIHFWJHAAS-UHFFFAOYSA-N 416.525 5.064 70 20 HKID COc1ccc([C@@H]2CCCCCN2C(=O)Nc2cccc(Oc3ccncc3)c2)cc1 217156671 DTMMNGUXGHJUGX-DEOSSOPVSA-N 417.509 6.032 70 20 HKID Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N(C)[C@H](C)c2ccncc2)c1C 217232727 METRUJOGHAFKHZ-CQSZACIVSA-N 418.328 5.416 70 20 HKID CCC[C@H](NCc1cc(Br)c(O)c(Br)c1)c1ccccc1 218419410 QTTIJPBUJFHEGR-INIZCTEOSA-N 413.153 5.548 70 20 HKID Cc1noc(Cl)c1CCC(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 216897291 QANYEFSLJHLRAG-OAHLLOKOSA-N 419.909 5.025 70 20 HKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2n1C(F)F 217160389 RCSWBYPQHHLCEK-AWEZNQCLSA-N 407.511 5.121 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1occc1COc1ccccc1 217219638 CGRNTXIDKWHJCM-UHFFFAOYSA-N 423.534 5.523 70 20 HKID Cc1cc(NC(=O)COc2ccccc2-c2ccccc2)n(-c2ccc(F)cc2)n1 217343747 LSQKFNWFGNCOHS-UHFFFAOYSA-N 401.441 5.004 70 20 HKID Cc1cc(OCC(=O)Nc2cccc(CSC3CCOCC3)c2)ccc1Cl 217219697 UFAKPLNFQYMPPI-UHFFFAOYSA-N 405.947 5.078 70 20 HKID CCOc1ccccc1CSCc1nnc(-c2ccccc2Br)o1 218032532 FFWGFSNCXCUAQA-UHFFFAOYSA-N 405.317 5.331 70 20 HKID COc1ccc([C@H](C)N[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1F 218195390 XINZCXAPORZDDV-NWDGAFQWSA-N 409.383 5.315 70 20 HKID COc1cc(CN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)C2CC2)ccc1O 217185398 RJIGQCYEJHGRRQ-QGZVFWFLSA-N 421.324 5.069 70 20 HKID COc1ccc(-c2noc(CCC(=O)Nc3ccccc3Nc3ccccc3)n2)cc1 217803963 HKRDDFIWTSFCAG-UHFFFAOYSA-N 414.465 5.060 70 20 HKID CC(C)Oc1ccccc1NC(=O)c1cc(Br)ccc1Br 160295154 NXQNMPRPJSHADL-UHFFFAOYSA-N 413.109 5.251 70 20 HKID Cc1ccc(-n2c(SCc3noc4c3CCCC4)nnc2-c2ccncc2)cc1C 217007689 PBHJXBWQZBVVOC-UHFFFAOYSA-N 417.538 5.105 70 20 HKID C[C@H](c1cccc(O)c1)N(C)CC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 217095233 OJBYQFDYFMOXCG-SECBINFHSA-N 422.139 5.637 70 20 HKID CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C(C)(C)c3cccs3)ccc21 217205351 YDEPBEZOGWTCNB-UHFFFAOYSA-N 400.544 5.352 70 20 HKID COc1ccc([C@H](N[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 218200342 ITPBIJIRJYVMLT-ORAYPTAESA-N 417.431 5.566 70 20 HKID CSc1ccc(Cl)c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)c1 216713991 QEXGUERDNVGIPV-UHFFFAOYSA-N 411.939 5.986 70 20 HKID Cc1cc(NC(=O)COC(c2ccccc2)c2ccccc2)n(-c2ccc(F)cc2)n1 217359368 JIDMGYJSHUQGAO-UHFFFAOYSA-N 415.468 5.065 70 20 HKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCC[C@H]1c1cccs1 218628743 OKGPNSGFFSVKFO-DYVFJYSZSA-N 418.584 5.855 70 20 HKID CC[C@@H](NCc1nc(-c2ccc(OC(F)F)c(OC)c2)no1)c1ccc(Cl)cc1 218210035 FNQGWJZMMISMTE-OAHLLOKOSA-N 423.847 5.241 70 20 HKID Cc1ccc(NC(=O)Cc2nc(CN[C@H](C)c3cc4ccccc4o3)cs2)cc1 216691556 JKYYAVUHVBEHFU-MRXNPFEDSA-N 405.523 5.230 70 20 HKID CC[C@H](N[C@@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1)c1ccc(OC)cc1 217116665 LSVPIPCDZOLBQO-BJKOFHAPSA-N 404.510 5.125 70 20 HKID O=C1CCCc2nc(NC(=O)c3sc(-c4ccco4)nc3-c3ccccc3)sc21 216725312 IBRKOSVPTAULQN-UHFFFAOYSA-N 421.503 5.298 70 20 HKID COc1ccc(Cl)c(NC(=O)c2cc(Br)ccc2Br)c1 160502837 KJALIBNYACXFDA-UHFFFAOYSA-N 419.500 5.126 70 20 HKID CCCC(=O)Nc1ccc(Cl)c(NCC(=O)Nc2cc(C)c(Cl)cc2OC)c1 216661923 KZQMXUGJZHNUBB-UHFFFAOYSA-N 424.328 5.100 70 20 HKID COc1ccc(NC(=O)[C@H](N[C@@H](C)c2cc3ccccc3o2)c2ccccc2)cc1 217116812 KCKPPZAUXHQIGK-BXKMTCNYSA-N 400.478 5.472 70 20 HKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc(-c2ccccc2)cs1 217156991 UXPRIQGDOZPZCS-QGZVFWFLSA-N 400.594 5.500 70 20 HKID Cc1cn2c(CN(C)C(=O)c3ccc(-c4nc5ccccc5s4)o3)c(C)nc2s1 217126462 OQQOWEYBIQAFKO-UHFFFAOYSA-N 422.535 5.155 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)OCc3ncc(-c4cccc(Cl)c4)o3)c12 217643649 ZSTYTJWOTHQFJM-UHFFFAOYSA-N 411.845 5.320 70 20 HKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)N1CCC[C@@H]1c1cccs1 218628675 OKGPNSGFFSVKFO-SUMWQHHRSA-N 418.584 5.855 70 20 HKID Cc1cc(C)c(NC(=O)c2ccc(Br)cc2Cl)c(Br)c1 159984261 YYIIUBFPJNWRJW-UHFFFAOYSA-N 417.528 5.734 70 20 HKID COc1cc(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc(OC)c1OC 217268210 ZOSHAJOIVWNEGA-UHFFFAOYSA-N 404.772 5.029 70 20 HKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(Br)cc3Cl)c12 217948127 ZRRXEAHZQQJXRV-UHFFFAOYSA-N 408.683 5.323 70 20 HKID CC[C@@H](NCc1csc(-c2ccc(OC)c(OC)c2)n1)c1ccc(Cl)cc1 218209473 CMBCIMYWQWSSRL-GOSISDBHSA-N 402.947 5.722 70 20 HKID O=C(OCc1noc(-c2ccc(F)cc2)n1)c1ccc(C2SCCCS2)cc1 216813957 RHHLNNPAJBYDNN-UHFFFAOYSA-N 416.499 5.101 70 20 HKID COc1ccc(NC(=O)[C@@H](N[C@H](C)c2cc3ccccc3o2)c2ccccc2)cc1 217116826 KCKPPZAUXHQIGK-OSPHWJPCSA-N 400.478 5.472 70 20 HKID COc1ccc([C@H](NCc2nc(-c3cccc(C(F)(F)F)c3)no2)C2CC2)cc1 217785030 YNOLVEPILXCJBT-LJQANCHMSA-N 403.404 5.005 70 20 HKID Clc1ccc(Cl)c(OCCSc2nncn2CCc2cccs2)c1 217507955 DXNYIIOOCKZBFM-UHFFFAOYSA-N 400.356 5.060 70 20 HKID CCOc1cc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc(Cl)c1O 217142284 QUKRPDIYKFVLJM-UHFFFAOYSA-N 414.914 5.384 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N1CCC(COc2ccccc2)CC1 217157286 LUFMVEKOHKWGFA-UHFFFAOYSA-N 403.482 5.197 70 20 HKID Cc1nc(CSc2ccccc2C(=O)Nc2nc3c(s2)CCCCC3)cs1 218085316 VFASGRBTVJYCOU-UHFFFAOYSA-N 415.609 5.722 70 20 HKID CCOc1cccc2cc([C@H](C)NCc3ccc(C(=O)Nc4ccccc4)cc3)oc12 216761835 WQNFPPZAGTZVEL-SFHVURJKSA-N 414.505 5.935 70 20 HKID CSc1ccc(Cl)c(C(=O)Nc2cccc(CSC3CCOCC3)c2)c1 217219903 RXUXHJYTLZAPPU-UHFFFAOYSA-N 407.988 5.726 70 20 HKID COc1ccc(NC(=O)c2ccc(Br)cc2Br)cc1Cl 218722762 XTBOYKOSHBACRY-UHFFFAOYSA-N 419.500 5.126 70 20 HKID COc1ccc(C)cc1NC(=O)[C@H](N[C@@H](c1ccccc1)C1CC1)c1ccccc1 217554457 BJKKXXRZVHOQKQ-LOSJGSFVSA-N 400.522 5.424 70 20 HKID O=C([C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)N1CCC(OCc2ccccc2)CC1 217115857 DHGMKGSFHFEOBB-LEWJYISDSA-N 403.444 5.017 70 20 HKID Fc1ccc(-c2nnc(SCc3noc4c3CCCC4)n2Cc2ccccc2)cc1 217008599 WIQBOVFVGLIRER-UHFFFAOYSA-N 420.513 5.292 70 20 HKID C[C@H](Sc1ccc(Cl)cc1)C(=O)Oc1cccc(NC(=O)c2ccco2)c1 217205484 VIGROEQELGVJGO-ZDUSSCGKSA-N 401.871 5.272 70 20 HKID Cc1nc2ccccc2cc1C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 217209638 YAEHVZUVJLFYBH-GDLZYMKVSA-N 400.503 5.103 70 20 HKID O=C(Nc1nc2c(s1)CCCCC2)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 217920357 JWIOIFCQLQLBHT-HXUWFJFHSA-N 418.518 5.119 70 20 HKID Cc1cccc(C(=O)Nc2nc(-c3ccco3)cs2)c1NC(=O)c1ccccc1F 216652911 UHSQXZAWVSVCOR-UHFFFAOYSA-N 421.453 5.355 70 20 HKID Clc1ccccc1-c1nnc(SCc2noc3c2CCCC3)n1C1CCCC1 217007316 GWPJVYDEWRPAJD-UHFFFAOYSA-N 414.962 5.873 70 20 HKID FC(F)(F)c1ccc(-c2nc(CN[C@H](c3ccccc3)c3ccco3)cs2)cc1 218281309 MQGLEGLNYAAKAX-HXUWFJFHSA-N 414.452 6.301 70 20 HKID CCN(C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)[C@H](C)c1cccnc1 217208308 PXAHIMZGWVHHDZ-CYBMUJFWSA-N 420.365 5.664 70 20 HKID CCCOc1c(Cl)cc(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc1OC 217356205 MXXUKOYOKURXJA-UHFFFAOYSA-N 417.868 5.023 70 20 HKID COc1cc(CNC(=O)c2c(Cl)cccc2Cl)ccc1OCc1ccccc1 216815899 QGDXLNFOMGOCLC-UHFFFAOYSA-N 416.304 5.511 70 20 HKID O=C(NCCc1csc2ccccc12)N(Cc1ccccc1)CC1CCOCC1 217148498 SKRZLUXORSTRBH-UHFFFAOYSA-N 408.567 5.082 70 20 HKID C[C@H](NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1)c1cc2ccccc2o1 216692008 OGVCYRSYZRIMLY-MAUKXSAKSA-N 419.506 5.116 70 20 HKID Cc1cc(NC(=O)c2ccc(C3SCCCS3)cc2)n(-c2ccc(F)cc2)n1 217363507 MBIGPQOHHWDQLZ-UHFFFAOYSA-N 413.543 5.441 70 20 HKID Cc1cc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)n(-c2ccccn2)n1 216741502 DIAPDQGJKNUCEI-UHFFFAOYSA-N 424.460 5.153 70 20 HKID CCN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)[C@H](C)c1cccnc1 217208368 XFOPIZDEGUJDBI-OAHLLOKOSA-N 415.415 5.511 70 20 HKID Clc1ccc2nc(CNCc3cn(-c4ccccc4)nc3-c3ccccc3)cn2c1 216716175 KPQBOYBIJBDADT-UHFFFAOYSA-N 413.912 5.130 70 20 HKID CCOc1cccc2cc([C@@H](C)NCC(=O)Nc3c(C)cc(C)cc3Cl)oc12 216762747 QOXNCOOALDMAPB-OAHLLOKOSA-N 400.906 5.391 70 20 HKID CCOc1cccc2cc([C@H](C)NCC(=O)N(CC)c3nc4ccccc4s3)oc12 216763615 VHXSHBUWDGLJKS-HNNXBMFYSA-N 423.538 5.145 70 20 HKID Cc1ccc(-n2c(SCc3noc4c3CCCC4)nnc2-c2ccccn2)c(C)c1 217010699 SNENCNOVVNLLSL-UHFFFAOYSA-N 417.538 5.105 70 20 HKID CCCN(C(=O)CCC(=O)c1ccc(C)s1)[C@@H](c1ccc(F)cc1)c1cccnc1 217131281 NEVFYSDSPBIADP-DEOSSOPVSA-N 424.541 5.582 70 20 HKID O=C(Nc1cccc(Oc2ccncc2)c1)N(Cc1cccc(F)c1)C[C@H]1CCCO1 217156166 VJNSODDKHDSICK-HSZRJFAPSA-N 421.472 5.226 70 20 HKID CC[C@H](NCc1csc(-c2cccc(OC)c2OC)n1)c1ccc(Cl)cc1 218214247 CIKWVLWAPGPIPT-SFHVURJKSA-N 402.947 5.722 70 20 HKID Cc1cc(C)c(NC(=O)c2ccc(F)cc2Br)c(Br)c1 159769729 JYLBHSDPXAIDMZ-UHFFFAOYSA-N 401.073 5.220 70 20 HKID CCN(C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)[C@@H](C)c1cccnc1 217208304 PXAHIMZGWVHHDZ-ZDUSSCGKSA-N 420.365 5.664 70 20 HKID C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)N1CCC[C@@H]1c1cccs1 218613797 NTTHAABLHAFZSU-ZWNOBZJWSA-N 420.909 5.660 70 20 HKID Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)N[C@@H](C)c4cccnc4)cc3)sc2c1 216835685 BIEUUPYLSVFDMH-DLBZAZTESA-N 416.550 5.345 70 20 HKID Cc1cc(NC(=O)c2oc3ccccc3c2COc2ccccc2)n(-c2ccccn2)n1 216741313 CZGMTHMEUSFWCH-UHFFFAOYSA-N 424.460 5.153 70 20 HKID CC[C@H](NCc1csc(-c2ccc(OC)c(OC)c2)n1)c1ccc(Cl)cc1 218209558 CMBCIMYWQWSSRL-SFHVURJKSA-N 402.947 5.722 70 20 HKID C[C@H](c1nc2ccccc2s1)N(C)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 217471840 ABTMBRWBPLIQIG-WQVCFCJDSA-N 404.457 5.638 70 20 HKID CSCC[C@@H](NCc1sc2ccccc2c1Cl)c1nnc2ccccn12 217420027 XEEDQIMNWUHXIC-CQSZACIVSA-N 402.976 5.181 70 20 HKID Cc1ccc(NC(=O)Cc2nc(CN[C@@H](C)c3cc4ccccc4o3)cs2)cc1 216691513 JKYYAVUHVBEHFU-INIZCTEOSA-N 405.523 5.230 70 20 HKID CC[C@H](N[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(OC)cc1 218206343 ZTOSVSYZTKHGQT-UGSOOPFHSA-N 405.420 5.566 70 20 HKID CCO[C@@H](C)c1nc(CC(=O)NCC(C)(C)c2c(Cl)cccc2Cl)cs1 217228240 VUWXNCJISSJIIM-LBPRGKRZSA-N 415.386 5.184 70 20 HKID C[C@@H](N[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 216832916 UKHRQDVHKDOWFC-VLIAUNLRSA-N 400.309 5.419 70 20 HKID CCOc1cc(C(=O)Nc2nc(-c3ccccc3)c(C(C)=O)s2)cc(Cl)c1O 218055984 WYOHNKVANBRRSO-UHFFFAOYSA-N 416.886 5.023 70 20 HKID Cc1nc2cc(F)ccc2cc1C(=O)Nc1cccc(CSC2CCOCC2)c1 217221034 GYHYGECSKOZVTD-UHFFFAOYSA-N 410.514 5.347 70 20 HKID CC(=O)N(Cc1ccc(NC(=O)c2cc(Cl)ccc2Br)cc1)C(C)C 217226101 UFYAPROATHHFCC-UHFFFAOYSA-N 423.738 5.112 70 20 HKID Cc1ccc(C(=O)Nc2c(F)cc(Br)cc2F)c(Br)c1 161063519 BYUCFYBTWXSCCZ-UHFFFAOYSA-N 405.036 5.051 70 20 HKID O=C(Nc1cccc(CSC2CCOCC2)c1)c1sc2ccccc2c1Cl 217220541 VWQXPTZOUMZDHI-UHFFFAOYSA-N 417.983 6.219 70 20 HKID Cc1ccc(-n2nc(C)c(NC(=O)CNc3ccc4c5c(cccc35)CC4)c2C)cc1 217106650 PRYWPNIBBFOQDM-UHFFFAOYSA-N 410.521 5.100 70 20 HKID C[C@H](NC(=O)Nc1cccc(Oc2ccncc2)c1)c1nc(-c2ccccc2)cs1 217156078 AQNAUKBQOHTXRZ-INIZCTEOSA-N 416.506 5.880 70 20 HKID O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCn2c1nc1ccccc12 217388693 BRHPMJIPXZVHAF-UHFFFAOYSA-N 424.891 5.565 70 20 HKID Cc1nc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n(C2CCCCC2)c1C 217508637 ZCWGDSPVRPTRSR-UHFFFAOYSA-N 414.543 5.294 70 20 HKID COC(=O)c1c(CBr)c(-c2cccc(C(F)(F)F)c2)nc2ccccc12 118749795 ONMSDVHYWXJKEH-UHFFFAOYSA-N 424.216 5.602 70 20 HKID C[C@@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CC1CCOCC1 217227893 ROSJEONFQHPZRR-OXQOHEQNSA-N 422.956 5.673 70 20 HKID COc1ccc(NC(=O)[C@@H](N[C@H](c2ccc(OC)cc2)C2CC2)c2ccccc2)cc1 217114007 HONNAJADPCWOHP-DQEYMECFSA-N 416.521 5.125 70 20 HKID O=C(Nc1ccc(S(=O)(=O)F)cc1)c1ccc(S(F)(F)(F)(F)F)cc1 865204663 CYBATDMAZYDCEJ-UHFFFAOYSA-N 405.341 5.255 70 20 HKID C[C@H](SCc1ccccc1)C(=O)Nc1cccc(CSC2CCOCC2)c1 217219769 FUTBVNFXHPCKRX-KRWDZBQOSA-N 401.597 5.359 70 20 HKID C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cccc(CSC2CCOCC2)c1 217219239 XVVONYWMQDPYPD-AWEZNQCLSA-N 423.937 5.297 70 20 HKID COc1ccc([C@@H](NCc2csc(-c3ccc(OC)c(OC)c3)n2)C2CC2)cc1 217110361 GTMOMWSPVFVZMV-QFIPXVFZSA-N 410.539 5.077 70 20 HKID Cc1nc(CSc2ccccc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)cs1 218164688 MMGGWJCRNXUQBD-UHFFFAOYSA-N 422.575 5.379 70 20 HKID CC[C@@H](NCc1csc(CC(=O)Nc2ccc(C)cc2)n1)c1ccc(Cl)cc1 218209078 IHHIPDNTXLHHKW-HXUWFJFHSA-N 413.974 5.527 70 20 HKID CCCc1c(C(=O)Nc2cccc(CSC3CCOCC3)c2)[nH]c(C)c1C(C)=O 217219319 QPTVVUNJJUGMRT-UHFFFAOYSA-N 414.571 5.143 70 20 HKID Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 217143615 YXHGUXDUVQDNNY-UHFFFAOYSA-N 414.465 5.606 70 20 HKID Cc1cc(OC(F)F)c(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(N)=O)s1 217193677 NMBOYVGKTXHUHX-UHFFFAOYSA-N 422.478 5.046 70 20 HKID O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ccc(S(=O)(=O)Cl)c(Cl)c1 95698301 MVOQKJRKYIKDFF-UHFFFAOYSA-N 414.097 5.218 70 20 HKID Cc1ccc(-c2noc([C@H](C)N[C@H](C)c3ccccc3Br)n2)cc1F 218274116 CORVVNWHMYUWFX-OLZOCXBDSA-N 404.283 5.358 70 20 HKID C[C@H](NC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1cc(F)c(Cl)cc1Cl 217451347 OKTZLJPKEQOYSA-JTQLQIEISA-N 421.246 5.637 70 20 HKID CC(=O)N[C@@H](CC(=O)Nc1ccccc1Nc1ccccc1)c1ccc(Cl)cc1 217803506 KCUFIMYTKDQANK-QFIPXVFZSA-N 407.901 5.290 70 20 HKID CC(=O)N[C@H](CC(=O)Nc1ccccc1Nc1ccccc1)c1ccc(Cl)cc1 217803588 KCUFIMYTKDQANK-JOCHJYFZSA-N 407.901 5.290 70 20 HKID Cc1ccc(C[C@@H](NC(=O)Nc2cccc(Oc3ccncc3)c2)c2ccccn2)cc1 217235640 MPCYSUIYCJQZNS-RUZDIDTESA-N 424.504 5.683 70 20 HKID COc1ccc2nc(C(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)ccc2c1 217599619 AETGIOVEFMUMLP-UHFFFAOYSA-N 412.474 5.167 70 20 HKID C[C@@H]1CCC[C@H](OCc2cccc(N[C@H](C)C(=O)NCCc3cccs3)c2)C1 217163830 KFTVRHYMYNIWHE-OPYAIIAOSA-N 400.588 5.003 70 20 HKID C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CC1CCOCC1 217227899 ROSJEONFQHPZRR-JXFKEZNVSA-N 422.956 5.673 70 20 HKID CCN(CC)[C@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 217222771 LLXKEJKXZLMSNN-QHCPKHFHSA-N 412.599 5.120 70 20 HKID Clc1ccc([C@@H](NCc2nc(-c3cccc(Br)c3)no2)C2CC2)cc1 216705310 NDBSSUYWRGHUAQ-SFHVURJKSA-N 418.722 5.393 70 20 HKID Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)C(=O)Nc3c(C)cccc3C)s2)cc1 216996713 JNERDZRCOMFPEX-PKOBYXMFSA-N 407.583 5.722 70 20 HKID COc1cc2c(cc1NC(=O)CSCc1noc3c1CCCC3)oc1ccccc12 217033303 YKXDQKFZTOROEJ-UHFFFAOYSA-N 422.506 5.333 70 20 HKID Cc1ccc(-c2noc([C@@H](C)N[C@@H](C)c3ccccc3Br)n2)cc1F 218273970 CORVVNWHMYUWFX-QWHCGFSZSA-N 404.283 5.358 70 20 HKID C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CCc1cccc(Br)c1 216851454 NSLSNOSCIDNFFQ-ZDUSSCGKSA-N 403.345 5.211 70 20 HKID C[C@@H](NCC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1)c1cc2ccccc2o1 216700571 QQYWOHYPBIHSBK-QAPCUYQASA-N 419.506 5.116 70 20 HKID C[C@@H](NC(=O)C1(c2ccccc2Cl)CCOCC1)c1ccc(Br)cc1 216977010 FJSRTXVWMYYIJV-CQSZACIVSA-N 422.750 5.028 70 20 HKID CCN(CC)[C@@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 217222766 LLXKEJKXZLMSNN-HSZRJFAPSA-N 412.599 5.120 70 20 HKID